Metal,Smiles_Linker,Predicted_PLD Mn,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,3.8164993791031776 Mn,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,3.8164993791031776 Mn,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,6.049685776798816 Mn,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.2290327712702522 Mn,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],3.976816174045703 Mn,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],4.167314307712249 Mn,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.563674296247725 Mn,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.991062938281954 Mn,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.991062938281954 Mn,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.7574813135085967 Mn,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.7574813135085967 Mn,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.07015427088646 Mn,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.07015427088646 Mn,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],4.92428618376621 Mn,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.8163630095590957 Mn,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.8163630095590957 Mn,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.875524303140739 Mn,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.875524303140739 Mn,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.843569583311686 Mn,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.843569583311686 Mn,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.201546466317839 Mn,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],5.484151911928982 Mn,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.031329812602382 Mn,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.216754821515056 Mn,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.4603612632214755 Mn,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],4.0594254760039705 Mn,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.745082175064055 Mn,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.666204251088459 Mn,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.666204251088459 Ti,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.600799734914437 Ti,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.600799734914437 Ti,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,6.634401613833357 Ti,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.6736923094440477 Ti,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],4.780948514930812 Ti,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],5.025832271374332 Ti,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.952722475499113 Ti,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],5.026428986642523 Ti,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],5.026428986642523 Ti,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.353665124973669 Ti,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.353665124973669 Ti,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.595431276296331 Ti,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.595431276296331 Ti,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],6.028373961314946 Ti,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.407184494230738 Ti,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.407184494230738 Ti,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],8.149420022046822 Ti,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],8.149420022046822 Ti,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],8.043827802463309 Ti,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],8.043827802463309 Ti,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.3009226209913765 Ti,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],6.739512062679356 Ti,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.6386522416869593 Ti,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],5.069376222755261 Ti,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],5.185816610185956 Ti,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],4.940677631112766 Ti,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],3.2453252629525164 Ti,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,4.450384251898131 Ti,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,4.450384251898131 Ag,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.158779879323907 Ag,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.158779879323907 Ag,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,5.660449256003943 Ag,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.018005998997469 Ag,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],3.9684531697807763 Ag,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],3.9192608772999455 Ag,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.176584876370023 Ag,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.199513482819195 Ag,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.199513482819195 Ag,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.9451158518915026 Ag,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.9451158518915026 Ag,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.9803806020825325 Ag,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.9803806020825325 Ag,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],4.8107558640459525 Ag,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.489420681181843 Ag,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.489420681181843 Ag,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.184027652215334 Ag,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.184027652215334 Ag,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.589180853406804 Ag,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.589180853406804 Ag,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.68999076214415 Ag,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],5.385185093282836 Ag,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.0845527210834973 Ag,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.129973937048457 Ag,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.302225667914593 Ag,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],3.906532944172082 Ag,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.8618957619060454 Ag,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.476314843157112 Ag,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.476314843157112 Fe,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.1540661049329115 Fe,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.1540661049329115 Fe,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,6.321333234702089 Fe,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.49337154170767 Fe,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],4.014787086178971 Fe,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],4.465364808553807 Fe,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.81085098358028 Fe,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.341089428377396 Fe,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.341089428377396 Fe,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.070108120915817 Fe,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.070108120915817 Fe,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.304403872572198 Fe,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.304403872572198 Fe,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],5.116669333268996 Fe,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.020277703045338 Fe,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.020277703045338 Fe,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.5585339683194395 Fe,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.5585339683194395 Fe,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.915002806223196 Fe,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.915002806223196 Fe,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.689551527284167 Fe,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],5.722471382955479 Fe,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.2134908413191727 Fe,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.4885899121975505 Fe,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.779354496585722 Fe,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],4.428477328538054 Fe,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.9188617431017017 Fe,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.891983359341298 Fe,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.891983359341298 Ni,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.357084090700193 Ni,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.357084090700193 Ni,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,6.271257395470391 Ni,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.66068239443851 Ni,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],4.321269476070862 Ni,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],4.522105258870427 Ni,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.6961249894131623 Ni,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.483776863504451 Ni,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.483776863504451 Ni,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.330535506035206 Ni,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.330535506035206 Ni,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.391286841252164 Ni,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.391286841252164 Ni,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],5.520408674755645 Ni,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.341272087440519 Ni,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.341272087440519 Ni,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.954271119017827 Ni,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.954271119017827 Ni,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.348713152516699 Ni,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.348713152516699 Ni,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.008260926446826 Ni,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],5.696292116773039 Ni,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.551926974842589 Ni,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.462455969260252 Ni,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.852154402527127 Ni,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],4.377490058591545 Ni,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],3.1186797276088276 Ni,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,4.394571338633423 Ni,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,4.394571338633423 U,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.37949952064484 U,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.37949952064484 U,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,5.547264570963445 U,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.290156727582376 U,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],4.185936922772205 U,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],3.9588803327236755 U,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.606709841847419 U,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.130190981589877 U,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.130190981589877 U,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.946583675018867 U,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.946583675018867 U,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.0632439296963394 U,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.0632439296963394 U,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],5.164179474254876 U,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.592004831078981 U,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.592004831078981 U,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.694157059553187 U,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.694157059553187 U,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.894175098823549 U,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.894175098823549 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Dy,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,5.489582801446771 Dy,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.102198541443361 Dy,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],3.7374231656875914 Dy,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],3.807000556254425 Dy,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.40570780284402 Dy,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.9889218067514345 Dy,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.9889218067514345 Dy,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.7313509048801583 Dy,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.7313509048801583 Dy,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.0843610073285594 Dy,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.0843610073285594 Dy,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],4.766038411154273 Dy,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.5397303919180363 Dy,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.5397303919180363 Dy,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.4693892834157065 Dy,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.4693892834157065 Dy,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.793593566344111 Dy,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.793593566344111 Dy,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.281027972528458 Dy,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],5.093265042829278 Dy,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.0542233241329657 Dy,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.101323291430285 Dy,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.3146896038648626 Dy,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],4.104557371704487 Dy,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.8616830067613384 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Gd,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.413355893650261 Gd,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.01642593598419 Gd,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.01642593598419 Gd,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.674712587866051 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Be,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.4702945755461325 Be,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],5.497141976978539 Be,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],5.085527100280964 Be,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],3.4388840155350495 Be,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,4.953411555934887 Be,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,4.953411555934887 Nd,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.019249443785432 Nd,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.019249443785432 Nd,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,5.2271420712529055 Nd,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],2.898076067066433 Nd,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],3.7099089341687828 Nd,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],3.7275747259722993 Nd,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.3236182257599935 Nd,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.949269277833768 Nd,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.949269277833768 Nd,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.7182989092297634 Nd,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.7182989092297634 Nd,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.0032232844310616 Nd,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.0032232844310616 Nd,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],4.8402077640247985 Nd,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.574715003630766 Nd,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.574715003630766 Nd,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.434950763541957 Nd,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.434950763541957 Nd,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.643915478101589 Nd,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.643915478101589 Nd,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.305026934351957 Nd,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],5.2123592815736774 Nd,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.0611860250870055 Nd,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.1318326762065105 Nd,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.162288647032118 Nd,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],4.002044177106786 Nd,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.891549687441903 Nd,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.4137888239766006 Nd,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.4137888239766006 Yb,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.00572173175289 Yb,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.00572173175289 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Ru,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.309805025858497 Ru,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],6.2114595621042605 Ru,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.4241223470651647 Ru,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.569308064819943 Ru,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.657590973627293 Ru,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],4.329305705668775 Ru,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.9994543416382973 Ru,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.9259609646724263 Ru,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.9259609646724263 Ho,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,3.919068524015211 Ho,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,3.919068524015211 Ho,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,5.527432482744734 Ho,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.111442888907928 Ho,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],3.7078817843907412 Ho,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],3.8928127428805475 Ho,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.4072842503620904 Ho,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.9919121289818085 Ho,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.9919121289818085 Ho,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.6138644080507643 Ho,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.6138644080507643 Ho,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.079639897639242 Ho,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.079639897639242 Ho,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],4.768301374005715 Ho,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.548095644375003 Ho,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.548095644375003 Ho,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.4837337682978635 Ho,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.4837337682978635 Ho,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.7950376942559885 Ho,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.7950376942559885 Ho,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.293342054384756 Ho,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],5.097733127553846 Ho,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.0677649955408905 Ho,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.088707753776681 Ho,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.299193344393128 Ho,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],4.10395254202344 Ho,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.8612171185911635 Ho,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.290522009870414 Ho,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.290522009870414 Sc,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.558845645431186 Sc,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.558845645431186 Sc,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,6.521232705798638 Sc,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.6615760693659603 Sc,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],4.757200387351533 Sc,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],5.047247114720477 Sc,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],4.023077267911453 Sc,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],5.026339722902717 Sc,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],5.026339722902717 Sc,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.291899838781597 Sc,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.291899838781597 Sc,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.6183133146513313 Sc,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.6183133146513313 Sc,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],6.077761968502191 Sc,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.402867732990471 Sc,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.402867732990471 Sc,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],8.228475099064937 Sc,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],8.228475099064937 Sc,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],8.034666670950363 Sc,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],8.034666670950363 Sc,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.228649408590894 Sc,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],6.5768468852628805 Sc,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.5816465324224014 Sc,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],5.068610870257526 Sc,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],5.189760174570638 Sc,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],5.012627009116474 Sc,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],3.1717645436362143 Sc,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,4.466176467787108 Sc,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,4.466176467787108 Na,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,2.651159833185928 Na,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,2.651159833185928 Na,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,4.681836138598216 Na,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],2.390519353879451 Na,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],3.017906460481516 Na,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],2.7155304994378753 Na,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],2.7837178475445175 Na,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.1006286750448773 Na,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.1006286750448773 Na,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,2.98536339027396 Na,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,2.98536339027396 Na,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.4443152865935955 Na,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.4443152865935955 Na,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],3.3473715466411758 Na,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],2.941366453713084 Na,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],2.941366453713084 Na,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],4.967357412501601 Na,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],4.967357412501601 Na,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.067249285323356 Na,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.067249285323356 Na,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],4.354163612876498 Na,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],3.6796197221158566 Na,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],2.240393263923194 Na,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],3.140459512829046 Na,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],3.36959000255849 Na,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],3.02242140291736 Na,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.5155554799979236 Na,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,2.7341367411082547 Na,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,2.7341367411082547 Ga,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.482022860258388 Ga,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.482022860258388 Ga,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,6.335821425841194 Ga,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],4.011661691896996 Ga,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],4.294003164902469 Ga,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],4.676544268752778 Ga,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.904272675090517 Ga,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.786823927912519 Ga,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.786823927912519 Ga,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.160280464398417 Ga,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.160280464398417 Ga,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.5559775212835474 Ga,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.5559775212835474 Ga,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],5.525604742484509 Ga,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.503681193109697 Ga,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.503681193109697 Ga,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.556120126681973 Ga,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.556120126681973 Ga,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.272758111739713 Ga,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.272758111739713 Ga,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.021146146901254 Ga,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],5.882660227735473 Ga,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.6039429796304923 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Sm,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,5.520967273887454 Sm,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],2.9328875389862112 Sm,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],3.672134227639304 Sm,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],3.632321017591483 Sm,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.203028994719478 Sm,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.84920534008653 Sm,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.84920534008653 Sm,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.5296460569289794 Sm,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.5296460569289794 Sm,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.0171590023948984 Sm,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.0171590023948984 Sm,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],4.575691746084201 Sm,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.5246081454988634 Sm,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.5246081454988634 Sm,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.046057546360526 Sm,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.046057546360526 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Tb,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,5.438699727296074 Tb,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.053408018307688 Tb,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],3.8020205551304516 Tb,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],3.7879725457486124 Tb,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.408253222402247 Tb,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.004492403945486 Tb,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.004492403945486 Tb,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.853309457103177 Tb,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.853309457103177 Tb,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.0398087283446626 Tb,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.0398087283446626 Tb,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],4.917013773759874 Tb,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.594618567441564 Tb,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.594618567441564 Tb,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.594609554088908 Tb,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.594609554088908 Tb,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.944852051671605 Tb,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.944852051671605 Tb,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.354766063759681 Tb,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],5.277135597754588 Tb,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.118008155116308 Tb,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.166493650340852 Tb,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.2870611610667755 Tb,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],4.127637569067124 Tb,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.9696827973065942 Tb,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.4342482347335928 Tb,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.4342482347335928 Mg,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.9496402583208825 Mg,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.9496402583208825 Mg,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,6.689368262539888 Mg,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],4.597950559910479 Mg,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],5.05816200618132 Mg,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],4.751875394614066 Mg,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],4.399948020737593 Mg,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],6.248376511714446 Mg,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],6.248376511714446 Mg,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.956501395365717 Mg,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.956501395365717 Mg,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.6993848882419202 Mg,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.6993848882419202 Mg,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],6.83423885894452 Mg,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.709807794109141 Mg,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.709807794109141 Mg,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],8.623882514664547 Mg,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],8.623882514664547 Mg,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],8.20262826224215 Mg,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],8.20262826224215 Mg,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.884406422642362 Mg,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],7.094619512051539 Mg,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],4.000516574946223 Mg,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.856046311505274 Mg,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],6.0795791021258685 Mg,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],5.849634635515123 Mg,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],3.753367747262442 Mg,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,5.515039193442927 Mg,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,5.515039193442927 Th,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,3.993477021165223 Th,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,3.993477021165223 Th,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,5.153662016660557 Th,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.185360216867875 Th,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],3.889009507070801 Th,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],3.9089657958396433 Th,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.5242558867650047 Th,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.002680911100249 Th,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.002680911100249 Th,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.833178654492154 Th,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.833178654492154 Th,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.92090753843575 Th,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.92090753843575 Th,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],5.123930206133702 Th,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.4811389018072525 Th,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.4811389018072525 Th,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.500435650251086 Th,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.500435650251086 Th,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.730424019320822 Th,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.730424019320822 Th,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.470480508156271 Th,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],5.066827278420268 Th,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.1933855783949543 Th,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.086524978628163 Th,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.21243934136271 Th,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],4.086894396915283 Th,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],3.0610092540998135 Th,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.483682230640424 Th,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.483682230640424 Rb,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,2.4151809034605103 Rb,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,2.4151809034605103 Rb,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,3.9692827312938954 Rb,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],2.110202180269377 Rb,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],2.219428257057313 Rb,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],2.330542987936413 Rb,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],2.31470668477254 Rb,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],2.833197585079515 Rb,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],2.833197585079515 Rb,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,2.5744954375882583 Rb,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,2.5744954375882583 Rb,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.0361208409479796 Rb,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.0361208409479796 Rb,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],2.674381722715033 Rb,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],2.675536875362276 Rb,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],2.675536875362276 Rb,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],3.6774975568383965 Rb,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],3.6774975568383965 Rb,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],3.771815548272824 Rb,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],3.771815548272824 Rb,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],3.5364830420175855 Rb,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],2.9015863621803746 Rb,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],2.1761193401665357 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Cd,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,5.587912877210409 Cd,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.061304153680926 Cd,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],3.8654496477356366 Cd,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],4.1125722459916805 Cd,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.203993163718982 Cd,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.014430850744755 Cd,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.014430850744755 Cd,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.6500517296374833 Cd,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.6500517296374833 Cd,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.9345655385765888 Cd,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.9345655385765888 Cd,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],4.748578587624093 Cd,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.665626154354132 Cd,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.665626154354132 Cd,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.9337313928841695 Cd,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.9337313928841695 Cd,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.4688982479889745 Cd,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.4688982479889745 Cd,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.451054111342317 Cd,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],5.22476882133656 Cd,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],2.929403797781434 Cd,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],3.9624228327712356 Cd,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.0721124675087275 Cd,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],3.707572549758848 Cd,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.843160970514554 Cd,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.309077132832532 Cd,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.309077132832532 Pr,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,3.9366277345170033 Pr,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,3.9366277345170033 Pr,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,5.446394241021809 Pr,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],2.947165210364584 Pr,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],3.6342824059422916 Pr,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],3.5060872846289035 Pr,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.1263238110075253 Pr,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.8250128138015933 Pr,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.8250128138015933 Pr,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.790038461976612 Pr,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.790038461976612 Pr,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.9126926715188506 Pr,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.9126926715188506 Pr,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],4.669429482715403 Pr,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.458787075455935 Pr,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.458787075455935 Pr,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.129261771983877 Pr,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.129261771983877 Pr,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.5139863293392715 Pr,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.5139863293392715 Pr,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],4.82088502366557 Pr,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],4.967992746117295 Pr,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.0368103472774672 Pr,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],3.9931027821199105 Pr,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.0890163999703315 Pr,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],3.917973046444919 Pr,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.7803687568242204 Pr,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.197319593743643 Pr,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.197319593743643 Eu,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.1116056773437855 Eu,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.1116056773437855 Eu,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,5.543633371730307 Eu,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.047938077388176 Eu,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],3.7663972838248765 Eu,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],3.7508236448571237 Eu,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.410942322322227 Eu,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.028419540948631 Eu,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.028419540948631 Eu,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.813278590499727 Eu,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.813278590499727 Eu,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.028860115356951 Eu,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.028860115356951 Eu,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],4.8633442325742475 Eu,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.5726489616706667 Eu,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.5726489616706667 Eu,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.565780084329808 Eu,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.565780084329808 Eu,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.926673769401541 Eu,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.926673769401541 Eu,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.304466362415916 Eu,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],5.285228268549236 Eu,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.055864935380235 Eu,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.1311993126933055 Eu,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.258023830320153 Eu,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],4.075185560918904 Eu,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.9149914476834544 Eu,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.3750769619800836 Eu,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.3750769619800836 Er,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,3.9952535531667817 Er,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,3.9952535531667817 Er,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,5.603683369812234 Er,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.081752666393693 Er,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],3.8137452419506594 Er,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],4.00837792525334 Er,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.4274860448932696 Er,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.014573086905649 Er,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.014573086905649 Er,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.688026400423814 Er,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.688026400423814 Er,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.113543428713538 Er,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.113543428713538 Er,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],4.886688602892589 Er,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.6159763313125257 Er,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.6159763313125257 Er,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.573133903074848 Er,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.573133903074848 Er,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.896027950665306 Er,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.896027950665306 Er,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.355263863431949 Er,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],5.068532056462478 Er,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.0531096391502226 Er,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.086690117442117 Er,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.462562407855469 Er,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],4.277810751647902 Er,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.8439449758764273 Er,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.4533146652091773 Er,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.4533146652091773 Pb,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,3.852966942214498 Pb,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,3.852966942214498 Pb,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,5.400453426509912 Pb,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.072851203263813 Pb,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],3.585520492365017 Pb,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],3.946228078924482 Pb,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.1215254521199887 Pb,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.9343624103553623 Pb,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.9343624103553623 Pb,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.3773189994601274 Pb,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.3773189994601274 Pb,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.9860758283350783 Pb,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.9860758283350783 Pb,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],4.6952129848867195 Pb,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.264853470639515 Pb,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.264853470639515 Pb,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.747986167605536 Pb,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.747986167605536 Pb,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.990711187646022 Pb,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.990711187646022 Pb,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.5276043939139345 Pb,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],4.870830591645269 Pb,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],2.8402650051993987 Pb,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.001922440911299 Pb,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.105324837573038 Pb,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],3.882277834778501 Pb,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.8036517607253004 Pb,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.401974446054349 Pb,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.401974446054349 Y,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.119904189348632 Y,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.119904189348632 Y,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,5.983842634286619 Y,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.258942768812598 Y,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],4.1815095877262305 Y,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],4.544073938696057 Y,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.623918396725748 Y,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.287673336960697 Y,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.287673336960697 Y,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.856976805999265 Y,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.856976805999265 Y,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.3657210317589468 Y,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.3657210317589468 Y,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],4.882177512292382 Y,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.927335799614192 Y,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.927335799614192 Y,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.680693454160109 Y,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.680693454160109 Y,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.505824413169659 Y,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.505824413169659 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Mo,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.697929593599378 Mo,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],5.027025645332667 Mo,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],4.747013987751231 Mo,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.946117593261838 Mo,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,4.336849076930832 Mo,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,4.336849076930832 Sn,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.166102521849779 Sn,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.166102521849779 Sn,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,6.123191479147011 Sn,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.654013617890418 Sn,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],4.054137566192491 Sn,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],4.238472349808241 Sn,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.366652599112289 Sn,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.372267570378897 Sn,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.372267570378897 Sn,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.9388846237633333 Sn,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.9388846237633333 Sn,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.187816061900044 Sn,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.187816061900044 Sn,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],5.3774861674935925 Sn,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.131571095831719 Sn,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.131571095831719 Sn,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.003532361190449 Sn,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.003532361190449 Sn,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.136972220215559 Sn,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.136972220215559 Sn,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.3670865607423 Sn,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],5.610496274636661 Sn,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.2990867141955205 Sn,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.213895053825963 Sn,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.6722912001780905 Sn,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],4.30928400041811 Sn,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],3.0680102024653353 Sn,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,4.203897211898612 Sn,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,4.203897211898612 Al,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.820424511775028 Al,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.820424511775028 Al,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,6.786783650138227 Al,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],4.408761264467828 Al,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],4.708060921837324 Al,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],4.902537104986159 Al,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],4.459004809659956 Al,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],5.19465245300655 Al,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],5.19465245300655 Al,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,5.102184299983982 Al,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,5.102184299983982 Al,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.8771627813907497 Al,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.8771627813907497 Al,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],5.7769100661926025 Al,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.8456829340895835 Al,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.8456829340895835 Al,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],8.148906533676183 Al,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],8.148906533676183 Al,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.992547376117329 Al,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.992547376117329 Al,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.326657870904025 Al,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],6.4855097788790985 Al,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],4.252203209232573 Al,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.616033975171499 Al,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],5.617110437612633 Al,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],5.1619228732134905 Al,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],3.5377861528169077 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Co,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.6938970350971063 Co,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.287608469514277 Co,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.287608469514277 Co,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.264035871176576 Co,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.264035871176576 Co,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.414911794475454 Co,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.414911794475454 Co,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],4.913128266499497 Co,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.9271486021791735 Co,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.9271486021791735 Co,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.49382516874758 Co,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.49382516874758 Co,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.985118289476106 Co,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.985118289476106 Co,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.5769533341250845 Co,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],5.501406268620071 Co,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.2923041825439263 Co,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.344348344145063 Co,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.731603293060044 Co,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],4.241742151037514 Co,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.8927217259569873 Co,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.68732264359437 Co,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.68732264359437 Zn,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.327477250589355 Zn,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.327477250589355 Zn,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,6.367626455704045 Zn,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.707568127654336 Zn,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],4.306994177507592 Zn,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],4.507172262185996 Zn,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.627200005237797 Zn,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.533267852647385 Zn,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.533267852647385 Zn,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.000287769046838 Zn,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.000287769046838 Zn,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.465494278481283 Zn,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.465494278481283 Zn,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],5.649755111874103 Zn,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.41894907797683 Zn,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.41894907797683 Zn,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.516403220168537 Zn,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],7.516403220168537 Zn,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.958862688750942 Zn,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.958862688750942 Zn,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.710354316010821 Zn,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],5.844549297436984 Zn,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.6438000530526793 Zn,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.4964506602336884 Zn,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.620968076862652 Zn,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],4.241378929692811 Zn,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],3.0018620977268045 Zn,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,4.562758959467155 Zn,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,4.562758959467155 Ba,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,2.4813939398015465 Ba,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,2.4813939398015465 Ba,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,3.9973331846632973 Ba,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],1.9918474903852337 Ba,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],2.2715665775578993 Ba,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],2.516361864646241 Ba,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],2.3598356115400643 Ba,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],2.8400002859546367 Ba,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],2.8400002859546367 Ba,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,2.481027019544405 Ba,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,2.481027019544405 Ba,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],1.8610806271728364 Ba,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],1.8610806271728364 Ba,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],2.707375980226485 Ba,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],2.74729181155865 Ba,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],2.74729181155865 Ba,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],3.4063150473443216 Ba,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],3.4063150473443216 Ba,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],3.7284911954659234 Ba,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],3.7284911954659234 Ba,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],3.4609938056078033 Ba,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],3.0518766736432013 Ba,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],2.040656624538138 Ba,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],2.7830939598545434 Ba,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],2.884885851475386 Ba,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],2.5423225189438385 Ba,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.036056302128151 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K,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],2.4101040625875214 K,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],2.9138473636190283 K,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],2.9138473636190283 K,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,2.7680724321696495 K,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,2.7680724321696495 K,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.0910867221793157 K,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.0910867221793157 K,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],3.049248467230351 K,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],2.772701567944443 K,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],2.772701567944443 K,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],3.979013172939821 K,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],3.979013172939821 K,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],4.26629925822357 K,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],4.26629925822357 K,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],3.529180724305147 K,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],2.9502630796272356 K,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],2.002557631609875 K,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],2.7603266267909365 K,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],3.0205130614218376 K,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],2.60882777911169 K,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.3240688527399116 K,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,2.3469387137782785 K,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,2.3469387137782785 Cu,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.448029953211785 Cu,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.448029953211785 Cu,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,6.487758015741606 Cu,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.718848082365686 Cu,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],4.633423835078007 Cu,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],4.643180180647913 Cu,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.747863134525107 Cu,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.605546692502374 Cu,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.605546692502374 Cu,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.209729876120453 Cu,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.209729876120453 Cu,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.4831152268231937 Cu,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.4831152268231937 Cu,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],5.7574919748175395 Cu,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.4398926711845395 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Tm,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,5.528390872578785 Tm,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.054328322945268 Tm,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],3.863981127000962 Tm,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],3.9964605115857426 Tm,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.519325449252541 Tm,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.127151533354228 Tm,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.127151533354228 Tm,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.993790325966173 Tm,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.993790325966173 Tm,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.0855360078789698 Tm,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.0855360078789698 Tm,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],5.067046942157511 Tm,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.6890043902425997 Tm,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.6890043902425997 Tm,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.783207770121852 Tm,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.783207770121852 Tm,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.109541312319219 Tm,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.109541312319219 Tm,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.511462246346609 Tm,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],5.281371259003189 Tm,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.105473255636748 Tm,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.2047706339645075 Tm,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.471650680955066 Tm,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],4.275316594106771 Tm,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],3.015811083993278 Tm,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.637182767735307 Tm,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.637182767735307 Sr,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,2.4317865747340974 Sr,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,2.4317865747340974 Sr,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,4.551638954649399 Sr,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],2.238947591725993 Sr,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],2.793387405392033 Sr,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],2.9368627421838727 Sr,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],2.8084336973315587 Sr,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],2.9062208213545113 Sr,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],2.9062208213545113 Sr,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,2.7126498467582145 Sr,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,2.7126498467582145 Sr,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.3346935007549496 Sr,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.3346935007549496 Sr,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],2.6788476530695577 Sr,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],2.9036881560829144 Sr,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],2.9036881560829144 Sr,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],4.2347408315402175 Sr,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],4.2347408315402175 Sr,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],4.277160132432137 Sr,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],4.277160132432137 Sr,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],4.229648430726392 Sr,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],3.5044115377978975 Sr,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],2.3652398630875844 Sr,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],3.2316799835065795 Sr,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],3.2991506797895207 Sr,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],2.8971863805547757 Sr,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.275744136918638 Sr,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,2.5009699709949063 Sr,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,2.5009699709949063 Tl,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.005069380514588 Tl,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.005069380514588 Tl,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,5.286573606417099 Tl,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.199611834402661 Tl,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],3.523046322294859 Tl,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],3.8407477013074818 Tl,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.2902911494158014 Tl,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.9371276891240576 Tl,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.9371276891240576 Tl,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.6523888857248235 Tl,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.6523888857248235 Tl,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.0009022957209224 Tl,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.0009022957209224 Tl,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],4.681983921808142 Tl,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.309768675119266 Tl,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.309768675119266 Tl,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.579723339812634 Tl,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.579723339812634 Tl,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.7957712147715625 Tl,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.7957712147715625 Tl,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.419332095516491 Tl,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],4.93138267572642 Tl,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],2.864454091979094 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Ce,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.772362377351164 Ce,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.027838172798769 Ce,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.027838172798769 Ce,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],4.834941051471185 Ce,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.5453765277829143 Ce,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.5453765277829143 Ce,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.503891812597741 Ce,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.503891812597741 Ce,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.709284289773981 Ce,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.709284289773981 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Ca,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],4.57695924507833 Ca,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],3.724276174449478 Ca,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],2.3520843795838475 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In,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.9654197976382033 In,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.700044077677593 In,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.700044077677593 In,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.2266217139891555 In,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,4.2266217139891555 In,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.458210527592401 In,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.458210527592401 In,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],5.320162124184256 In,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.209876879767023 In,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],4.209876879767023 In,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.581081847202581 In,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.581081847202581 In,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.859742403034888 In,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.859742403034888 In,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.280390850515726 In,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],6.232668177664622 In,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.3799908489133 In,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.655764659436409 In,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.8174215329334995 In,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],4.609525898060724 In,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],3.183573174237384 In,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,4.020175805050169 In,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,4.020175805050169 Lu,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.024896710175167 Lu,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,4.024896710175167 Lu,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,5.548074891731055 Lu,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],3.0849039379279777 Lu,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],3.8619722867334607 Lu,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],4.062057740526409 Lu,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.4547542938790494 Lu,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.065578004924825 Lu,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],4.065578004924825 Lu,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.6972488335563325 Lu,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.6972488335563325 Lu,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.079089544139526 Lu,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],3.079089544139526 Lu,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],4.938168613974094 Lu,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.6024631233082802 Lu,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.6024631233082802 Lu,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.641675001204872 Lu,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.641675001204872 Lu,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.956205345020246 Lu,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.956205345020246 Lu,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.427998058531095 Lu,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],5.188506286774684 Lu,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],3.0488196029614563 Lu,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],4.114488527225165 Lu,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],4.518834603774291 Lu,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],4.296392030720879 Lu,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.885147404217631 Lu,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.50322578439125 Lu,[H]C1=C(C(=NN=C(c2[n-]c3c([H])c([H])c([H])c([H])c3[n+](=O)c2[H])C([H])([H])C([H])([H])[H])C([H])([H])C([H])([H])[H])N=c2c(c([H])c([H])c([H])c2=[B-]2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[N+]1=O,3.50322578439125 Li,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,3.3562865427982698 Li,[H]OC(=O)c1c([H])c(-c2nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c3c(C(=O)O[H])c2[H])nc2c([H])c([H])c([H])c([H])c12,3.3562865427982698 Li,O=C(O)c1cc([N][N]c2ccc(OCc3cc(COc4ccc(/N=N/c5cc(C(=O)O)cc(C(=O)O)c5)c(c4)B4[C@@H]5CCC[C@H]4CCC5)c(COc4ccc([N][N]c5cc(C(=O)O)cc(C(=O)O)c5)cc4)cc3COc3ccc([N][N]c4cc(C(=O)O)cc(C(=O)O)c4)cc3)cc2)cc(C(=O)O)c1,5.4173255821406645 Li,[H]c1nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c2c(C([H])(c2c([H])c([H])c([H])n2[H])c2c([H])c([H])c([H])n2[H])c1[H],2.8441741201187645 Li,[H]OC(=O)c1c([H])c(N=Nc2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c([H])c(C(=O)O[H])c1[H],3.6337914476917863 Li,[H]OC(=O)c1c([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])C([H])([H])C([H])([H])C2([H])[H])c([H])c1[H],3.644836613589687 Li,[H]c1nc(N([H])C([H])([H])c2c([H])c([H])c(C([H])([H])N([H])c3nc([H])c([H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c2[H])c([H])c([H])c1[H],3.259609679495491 Li,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.6480821919090216 Li,[H]c1nc2c([H])c([H])c([H])c([H])c2c(-c2c(C(=O)OC([H])([H])C([H])([H])[H])c([H])nc3c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c([H])c([H])c([H])c23)c1C(=O)OC([H])([H])C([H])([H])[H],3.6480821919090216 Li,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.533923919088636 Li,[H]OC(=O)c1c2c([H])c([H])c([H])c([H])c2nc2c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])c([H])c([H])c12,3.533923919088636 Li,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.899839272758404 Li,[H]c1nc([H])c([H])c(-c2nnc3c4c(B5C6([H])C([H])([H])C([H])([H])C([H])([H])C5([H])C([H])([H])C([H])([H])C6([H])[H])c([H])nc([H])c4n([H])n23)c1[H],2.899839272758404 Li,[H]OC(=O)c1c([H])c(N([H])c2c([H])c([H])c([H])c([H])c2B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])c(C(=O)O[H])c([H])c1N([H])c1c([H])c([H])c([H])c([H])c1[H],4.600888741544244 Li,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.458240299196243 Li,[H]C(=Nc1c([H])c([H])c(-c2c([H])c([H])c(N=C([H])c3c([H])c([H])nc([H])c3[H])c(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c2[H])c([H])c1[H])c1c([H])c([H])nc([H])c1[H],3.458240299196243 Li,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.205347493355465 Li,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C([H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.205347493355465 Li,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.084571406575176 Li,[H]OC(=O)c1c([H])c([H])c(C([H])=Nc2c([H])c([H])c(C(O[H])(c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N=C([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],6.084571406575176 Li,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N([H])c2c([H])c([H])c(C([H])(c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N([H])C([H])([H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c3[H])c([H])c2[H])c([H])c1[H],5.4098527302637525 Li,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])n2)c([H])c1[H],4.321101102722622 Li,[H]OC(=O)c1c([H])c([H])c(N([H])[H])c(N=C([H])c2c([H])c([H])nc([H])c2[H])c1B1C2([H])C([H])([H])C([H])([H])C([H])([H])C1([H])C([H])([H])C([H])([H])C2([H])[H],2.692622565888378 Li,[H]c1nc([H])c(C(=NN=C(C(=NN=C(c2nc(B3C4([H])C([H])([H])C([H])([H])C([H])([H])C3([H])C([H])([H])C([H])([H])C4([H])[H])c([H])nc2[H])C([H])([H])[H])c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])nc1[H],3.659744952477069 Li,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C(C([H])([H])[H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3([H])C([H])([H])[H],3.8984999994607836 Li,[H]c1c2nc3c(nc2c([H])c2c1nnn2[H])C([H])(C([H])([H])[H])c1nc2c([H])c4nnn([H])c4c(B4C5([H])C([H])([H])C([H])([H])C([H])([H])C4([H])C([H])([H])C([H])([H])C5([H])[H])c2nc1C3(C([H])([H])[H])C([H])([H])[H],3.534056288544888 Li,[H][C+]1[N-][C+]([H])[C-](B2C3([H])C([H])([H])C([H])([H])C([H])([H])C2([H])C([H])([H])C([H])([H])C3([H])[H])[C+]([N-]C([H])([H])C([H])([H])[N-][C-]2[C+]([H])[C-]([H])[N-][C-]([H])[C+]2[H])[C+]1[H],2.936934505558476 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Mn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.1536719616877535 Mn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.1536719616877535 Mn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.449343566216141 Mn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.449343566216141 Mn,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.3776155813254407 Mn,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.3776155813254407 Mn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.449343566216141 Mn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.449343566216141 Mn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.449343566216141 Mn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.449343566216141 Mn,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],3.54437023743167 Mn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.839963638334858 Mn,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],4.3061490648323355 Mn,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.954978098149754 Mn,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.954978098149754 Mn,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.954978098149754 Mn,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.954978098149754 Mn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],4.4853645026396265 Mn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.168273144174442 Mn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.168273144174442 Mn,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.142517978447321 Mn,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.142517978447321 Mn,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],4.168892427281193 Mn,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.32093398979667 Mn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.852712125232481 Mn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.852712125232481 Mn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.852712125232481 Mn,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.264330559993255 Mn,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.264330559993255 Mn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.047985633185488 Mn,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],5.8860381611136665 Mn,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.366225588195424 Mn,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],3.557654155618157 Mn,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.5371574327066595 Mn,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.5371574327066595 Mn,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],6.988672372445543 Mn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],5.513707546615588 Mn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],5.513707546615588 Mn,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.014729416817358 Mn,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.014729416817358 Mn,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.134668561383194 Mn,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.134668561383194 Mn,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.134668561383194 Mn,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.0969623956247148 Ti,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.409850100692349 Ti,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.409850100692349 Ti,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.2458350844725805 Ti,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.730559018814244 Ti,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.730559018814244 Ti,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.947083082641937 Ti,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.947083082641937 Ti,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.698091874842584 Ti,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.017879845396594 Ti,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.017879845396594 Ti,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.017879845396594 Ti,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],6.540069661846192 Ti,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.316325017733211 Ti,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.316325017733211 Ti,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.1811026250639465 Ti,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.1811026250639465 Ti,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],5.004805699041123 Ti,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],5.004805699041123 Ti,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.6425671127689823 Ti,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.6425671127689823 Ti,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],5.004805699041123 Ti,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],5.004805699041123 Ti,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],5.004805699041123 Ti,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],5.004805699041123 Ti,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],4.262382593168375 Ti,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.899125973997793 Ti,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],4.8677338037096884 Ti,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.306969508694079 Ti,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.306969508694079 Ti,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.306969508694079 Ti,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.306969508694079 Ti,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],5.4842891600238435 Ti,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.409850100692349 Ti,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.409850100692349 Ti,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.730559018814244 Ti,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.730559018814244 Ti,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],4.683211928849987 Ti,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.8712294573019665 Ti,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.2458350844725805 Ti,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.2458350844725805 Ti,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.2458350844725805 Ti,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.935982058204079 Ti,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.935982058204079 Ti,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.928879756156104 Ti,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],6.791120872533951 Ti,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.578180652069508 Ti,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],4.421245814051771 Ti,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.929962682478643 Ti,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.929962682478643 Ti,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],7.6224746277383595 Ti,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],6.653130191603528 Ti,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],6.653130191603528 Ti,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.735178708409535 Ti,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.735178708409535 Ti,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.716556794179002 Ti,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.716556794179002 Ti,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.716556794179002 Ti,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.6570942598000533 Ag,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.06239338121499 Ag,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.06239338121499 Ag,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.336318447618366 Ag,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.032119605226707 Ag,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.032119605226707 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Ag,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.563040720001702 Ag,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.563040720001702 Ag,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],5.189652635338696 Ag,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.717753751916121 Ag,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.717753751916121 Ag,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.209167045633221 Ag,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.209167045633221 Ag,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.216652724777346 Ag,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.216652724777346 Ag,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.1741454041944275 Ag,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.1741454041944275 Ag,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.216652724777346 Ag,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.216652724777346 Ag,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.216652724777346 Ag,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.216652724777346 Ag,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],3.407818105560196 Ag,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.856387538487289 Ag,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],3.9798812880481 Ag,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.37359895078758 Ag,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.37359895078758 Ag,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.37359895078758 Ag,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.37359895078758 Ag,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],4.160884727048935 Ag,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.06239338121499 Ag,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.06239338121499 Ag,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.032119605226707 Ag,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.032119605226707 Ag,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],4.211502427685096 Ag,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.321131632576813 Ag,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.336318447618366 Ag,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.336318447618366 Ag,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.336318447618366 Ag,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.427393469620547 Ag,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.427393469620547 Ag,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.9544575646677735 Ag,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],5.167257010204933 Ag,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.6322236898376135 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Ni,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.40454912253017 Ni,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.145225562763457 Ni,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.266670558444429 Ni,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.266670558444429 Ni,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.589882443950483 Ni,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.589882443950483 Ni,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.495090363593651 Ni,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.626322800564002 Ni,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.626322800564002 Ni,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.626322800564002 Ni,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],6.292528260007538 Ni,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.2722208916256275 Ni,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.2722208916256275 Ni,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.989019803617259 Ni,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.989019803617259 Ni,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.660854900251223 Ni,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.660854900251223 Ni,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.687532632671208 Ni,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.687532632671208 Ni,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.660854900251223 Ni,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.660854900251223 Ni,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.660854900251223 Ni,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.660854900251223 Ni,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],4.1677106300500295 Ni,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.655971572452821 Ni,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],4.20165560372931 Ni,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.333985746383743 Ni,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.333985746383743 Ni,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.333985746383743 Ni,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.333985746383743 Ni,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],4.87114583791441 Ni,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.40454912253017 Ni,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.40454912253017 Ni,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.266670558444429 Ni,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.266670558444429 Ni,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],4.3249097937409235 Ni,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.606786238219156 Ni,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.145225562763457 Ni,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.145225562763457 Ni,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.145225562763457 Ni,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],5.161722555933528 Ni,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],5.161722555933528 Ni,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.490461949671981 Ni,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],5.8419073619396595 Ni,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.8884777055963955 Ni,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],4.0062583264578215 Ni,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.456179204074153 Ni,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.456179204074153 Ni,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],6.934631515244402 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Ni,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.782284230584974 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Ni,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],10.194194761353005 Ni,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],10.194194761353005 Ni,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.457348403123014 U,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.077991379839428 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U,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.682769049341141 U,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.682769049341141 U,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.675632189461132 U,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.156932036519988 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Dy,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.607744827859776 Dy,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.674534487070984 Dy,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.674534487070984 Dy,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.146943641607214 Dy,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.146943641607214 Dy,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.0771603740981863 Dy,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.0771603740981863 Dy,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.146943641607214 Dy,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.146943641607214 Dy,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.146943641607214 Dy,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.146943641607214 Dy,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],3.207814217881171 Dy,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.063106886976437 Dy,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],3.837523287616507 Dy,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.981615246933216 Dy,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.981615246933216 Dy,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.981615246933216 Dy,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.981615246933216 Dy,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],4.492825691147534 Dy,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.773834578326799 Dy,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.773834578326799 Dy,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.956343227407208 Dy,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.956343227407208 Dy,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],3.8818676303129873 Dy,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.90278260285445 Dy,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.403337010362009 Dy,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.403337010362009 Dy,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.403337010362009 Dy,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.068229446778156 Dy,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.068229446778156 Dy,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.496794228884118 Dy,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],4.797671962874503 Dy,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.172402189241954 Dy,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],3.296249936496597 Dy,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.309657928022405 Dy,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.309657928022405 Dy,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],5.0325435660340165 Dy,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.752858632899942 Dy,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.752858632899942 Dy,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.2831671879335245 Dy,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.2831671879335245 Dy,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.164437262301611 Dy,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.164437262301611 Dy,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.164437262301611 Dy,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.703311107244483 Gd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.673820488237393 Gd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.673820488237393 Gd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.482081639816645 Gd,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.0390613782163065 Gd,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.0390613782163065 Gd,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.633266120592278 Gd,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.633266120592278 Gd,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.6895170893130476 Gd,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.24908046567698 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Gd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.6255925773657203 Gd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.516088785508602 Gd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.516088785508602 Gd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.171979602127115 Gd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.171979602127115 Gd,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.1575403175419616 Gd,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.1575403175419616 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Bi,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.165222710404898 Bi,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.165222710404898 Bi,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.3326906152426705 Bi,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.3326906152426705 Bi,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.165222710404898 Bi,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.165222710404898 Bi,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.165222710404898 Bi,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.165222710404898 Bi,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],3.5855741633685074 Bi,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.045213471841171 Bi,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],3.727270252637228 Bi,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.539188785453814 Bi,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.539188785453814 Bi,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.539188785453814 Bi,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.539188785453814 Bi,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],4.194251679555219 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Bi,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],3.954785134999661 Bi,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.072545378860703 Bi,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.653230723001126 Bi,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.653230723001126 Bi,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.653230723001126 Bi,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.322917257743729 Bi,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.322917257743729 Bi,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.283799741669642 Bi,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],5.0562309137275205 Bi,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.514723699412615 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Nd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.4675500457745425 Nd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.314941067347743 Nd,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.912672038082163 Nd,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.912672038082163 Nd,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.4627189725505225 Nd,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.4627189725505225 Nd,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.562095890575187 Nd,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.07668238326858 Nd,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.07668238326858 Nd,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.07668238326858 Nd,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],4.712806389548238 Nd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.6600890798517445 Nd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.6600890798517445 Nd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.478509433770846 Nd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.478509433770846 Nd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.163144357503734 Nd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.163144357503734 Nd,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.040362296167295 Nd,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.040362296167295 Nd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.163144357503734 Nd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.163144357503734 Nd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.163144357503734 Nd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.163144357503734 Nd,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],3.1722601886889272 Nd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.1790240676522075 Nd,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],3.878445430506405 Nd,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.8752383512167015 Nd,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.8752383512167015 Nd,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.8752383512167015 Nd,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.8752383512167015 Nd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],4.1092318668865 Nd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.4675500457745425 Nd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.4675500457745425 Nd,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.912672038082163 Nd,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.912672038082163 Nd,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],3.8293668013102726 Nd,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.8936184866918366 Nd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.314941067347743 Nd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.314941067347743 Nd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.314941067347743 Nd,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.091781836648114 Nd,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.091781836648114 Nd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.662015194890008 Nd,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],4.702133583384654 Nd,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.152086815435758 Nd,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],3.2840053443276815 Nd,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.4093432481460733 Nd,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.4093432481460733 Nd,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],4.740785419501487 Nd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.624008789296754 Nd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.624008789296754 Nd,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.2463446750149965 Nd,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.2463446750149965 Nd,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.157785757453166 Nd,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.157785757453166 Nd,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.157785757453166 Nd,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.716012588196855 Yb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.9301761005206295 Yb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.9301761005206295 Yb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.53967831349892 Yb,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.07150178260708 Yb,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.07150178260708 Yb,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.943594267673409 Yb,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.943594267673409 Yb,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.7680311548331646 Yb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.527532052083538 Yb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.527532052083538 Yb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.527532052083538 Yb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],4.955565068890996 Yb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.6547986382289332 Yb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.6547986382289332 Yb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.746295248201122 Yb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.746295248201122 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Ru,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.565197552332594 Ru,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.916126399032761 Ru,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.916126399032761 Ru,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.6128043147164925 Ru,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],6.0389679002339065 Ru,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.17456123204207 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Ru,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],6.132794835902985 Ru,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],6.132794835902985 Ru,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],8.815518389612166 Ru,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],8.815518389612166 Ru,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],8.999827419347252 Ru,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],8.999827419347252 Ru,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],8.999827419347252 Ru,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.1342144617687673 Ho,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.748581384896452 Ho,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.748581384896452 Ho,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.4106148645520085 Ho,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.9502294270745013 Ho,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.9502294270745013 Ho,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.543128206419215 Ho,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.543128206419215 Ho,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.684998822417349 Ho,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.254007218305828 Ho,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.254007218305828 Ho,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.254007218305828 Ho,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],4.791065695589292 Ho,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.652833990501235 Ho,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.652833990501235 Ho,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.609655757352999 Ho,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.609655757352999 Ho,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.130485602608687 Ho,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.130485602608687 Ho,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.1395125087848372 Ho,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.1395125087848372 Ho,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.130485602608687 Ho,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.130485602608687 Ho,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.130485602608687 Ho,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.130485602608687 Ho,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],3.2522118900250376 Ho,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],4.996649480603949 Ho,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],3.8034239784677752 Ho,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.991600170146035 Ho,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.991600170146035 Ho,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.991600170146035 Ho,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.991600170146035 Ho,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],4.586919653144307 Ho,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.748581384896452 Ho,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.748581384896452 Ho,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.9502294270745013 Ho,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.9502294270745013 Ho,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],3.8876535829046954 Ho,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.9185220192161245 Ho,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.4106148645520085 Ho,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.4106148645520085 Ho,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.4106148645520085 Ho,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.079525246277044 Ho,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.079525246277044 Ho,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.45352331181301 Ho,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],4.800641812286426 Ho,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.2128623370636875 Ho,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],3.305324138145022 Ho,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.361936826495423 Ho,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.361936826495423 Ho,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],5.033606080449051 Ho,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.702743588032186 Ho,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.702743588032186 Ho,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.296654658581408 Ho,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.296654658581408 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Sc,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],4.312444870202999 Sc,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.847484552573937 Sc,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],4.772353767407898 Sc,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.943470331304114 Sc,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.943470331304114 Sc,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.943470331304114 Sc,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.943470331304114 Sc,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],5.489991176572205 Sc,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.479438901280716 Sc,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.479438901280716 Sc,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.651899848919397 Sc,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.651899848919397 Sc,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],4.581140642840996 Sc,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.791522591031652 Sc,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.259422070855464 Sc,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.259422070855464 Sc,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.259422070855464 Sc,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],5.166761192022713 Sc,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],5.166761192022713 Sc,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.992674681657173 Sc,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],6.646357293104525 Sc,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.445619369501454 Sc,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],4.319965514873273 Sc,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.773259717700255 Sc,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.773259717700255 Sc,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],7.465475004035621 Sc,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],6.421129486577318 Sc,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],6.421129486577318 Sc,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.844640757371467 Sc,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.844640757371467 Sc,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.815888223776817 Sc,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.815888223776817 Sc,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.815888223776817 Sc,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.6844944613275032 Na,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.574823253685264 Na,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.574823253685264 Na,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.2066443357506786 Na,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.3940505926687368 Na,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.3940505926687368 Na,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.623955144917998 Na,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.623955144917998 Na,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.354877970388272 Na,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],4.072055875913704 Na,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],4.072055875913704 Na,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],4.072055875913704 Na,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],3.9159777059315415 Na,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],2.415073947119889 Na,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],2.415073947119889 Na,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],4.072060120217003 Na,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],4.072060120217003 Na,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.7349479684496663 Na,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.7349479684496663 Na,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],2.5611651828722524 Na,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],2.5611651828722524 Na,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.7349479684496663 Na,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.7349479684496663 Na,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.7349479684496663 Na,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.7349479684496663 Na,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],2.203519447719683 Na,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],3.85864163824222 Na,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],2.656665315518717 Na,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],2.8266833787762953 Na,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],2.8266833787762953 Na,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],2.8266833787762953 Na,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],2.8266833787762953 Na,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],2.9131178825827853 Na,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.574823253685264 Na,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.574823253685264 Na,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.3940505926687368 Na,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.3940505926687368 Na,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],2.5809722402702513 Na,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.698596858334929 Na,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.2066443357506786 Na,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.2066443357506786 Na,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.2066443357506786 Na,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],2.897875554156937 Na,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],2.897875554156937 Na,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.509869338721681 Na,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],3.8434368056025416 Na,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.734985827809597 Na,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],2.3639992580678415 Na,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],2.200122147819912 Na,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],2.200122147819912 Na,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],4.189924679418644 Na,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],3.503210930272255 Na,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],3.503210930272255 Na,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.037396942529592 Na,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.037396942529592 Na,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.074838433868374 Na,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.074838433868374 Na,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.074838433868374 Na,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.3081306593129804 Ga,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.665882800631387 Ga,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.665882800631387 Ga,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.154357280371121 Ga,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.317282055176302 Ga,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.317282055176302 Ga,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.638306625739104 Ga,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.638306625739104 Ga,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.379259531707129 Ga,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.533086812839382 Ga,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.533086812839382 Ga,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.533086812839382 Ga,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],6.256758037889975 Ga,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.290172014167069 Ga,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.290172014167069 Ga,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.195524682296422 Ga,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.195524682296422 Ga,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.897702133675242 Ga,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.897702133675242 Ga,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.825942253156497 Ga,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.825942253156497 Ga,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.897702133675242 Ga,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.897702133675242 Ga,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.897702133675242 Ga,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.897702133675242 Ga,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],4.218167104672736 Ga,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.719616470066497 Ga,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],4.313042913635112 Ga,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.076374230611101 Ga,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.076374230611101 Ga,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.076374230611101 Ga,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.076374230611101 Ga,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],5.1985402647330625 Ga,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.665882800631387 Ga,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.665882800631387 Ga,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.317282055176302 Ga,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.317282055176302 Ga,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],4.2260110132044755 Ga,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.564112397939722 Ga,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.154357280371121 Ga,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.154357280371121 Ga,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.154357280371121 Ga,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],5.2280155779826 Ga,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],5.2280155779826 Ga,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],8.164137131571973 Ga,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],5.993287021391534 Ga,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.004887532755546 Ga,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],4.11652118323927 Ga,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.453635744101954 Ga,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.453635744101954 Ga,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],7.010124939352393 Ga,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],6.311532602496617 Ga,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],6.311532602496617 Ga,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.742333819473384 Ga,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.742333819473384 Ga,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.746606115600184 Ga,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.746606115600184 Ga,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.746606115600184 Ga,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.4415870345478776 Sm,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.5497224547007225 Sm,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.5497224547007225 Sm,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.398100568660987 Sm,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.940654878388636 Sm,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.940654878388636 Sm,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.551481815544498 Sm,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.551481815544498 Sm,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.527447259613896 Sm,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.1114765220943905 Sm,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.1114765220943905 Sm,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.1114765220943905 Sm,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],4.634369294228682 Sm,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.565610031507921 Sm,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.565610031507921 Sm,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.3122776599723025 Sm,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.3122776599723025 Sm,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.0396484478880685 Sm,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.0396484478880685 Sm,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.093393885881344 Sm,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.093393885881344 Sm,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.0396484478880685 Sm,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.0396484478880685 Sm,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.0396484478880685 Sm,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.0396484478880685 Sm,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],3.135903365571121 Sm,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],4.687859046459202 Sm,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],3.8194269586372895 Sm,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.9408549130775015 Sm,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.9408549130775015 Sm,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.9408549130775015 Sm,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.9408549130775015 Sm,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],4.466620559669284 Sm,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.5497224547007225 Sm,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.5497224547007225 Sm,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.940654878388636 Sm,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.940654878388636 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Tb,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.524970484211088 Tb,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.524970484211088 Tb,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.549512971806166 Tb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.174423086109963 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Tb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.6431796932701768 Tb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.421460540325981 Tb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.421460540325981 Tb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.130097852822881 Tb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.130097852822881 Tb,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.092574803679714 Tb,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.092574803679714 Tb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.130097852822881 Tb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.130097852822881 Tb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.130097852822881 Tb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.130097852822881 Tb,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],3.2429241541090112 Tb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.076005779705336 Tb,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],3.7926258212148127 Tb,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.7863388720654303 Tb,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.7863388720654303 Tb,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.7863388720654303 Tb,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.7863388720654303 Tb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],4.26449157093583 Tb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.6197412842601775 Tb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.6197412842601775 Tb,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.869964804271137 Tb,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.869964804271137 Tb,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],3.7539291038675993 Tb,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.8251520528603673 Tb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.375849774955344 Tb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.375849774955344 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Tb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.653865384302207 Tb,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],4.776564735048078 Tb,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.1973679438439895 Tb,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],3.2603164593929383 Tb,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.440155219299604 Tb,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.440155219299604 Tb,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],4.757897892601791 Tb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.638335290331121 Tb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.638335290331121 Tb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.231970497571518 Tb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.231970497571518 Tb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.1607610454771695 Tb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.1607610454771695 Tb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.1607610454771695 Tb,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.7081269207696943 Mg,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.137648312167745 Mg,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.137648312167745 Mg,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],6.256038406080866 Mg,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],5.046607734861187 Mg,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],5.046607734861187 Mg,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.128122863182869 Mg,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.128122863182869 Mg,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],5.693887586282921 Mg,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.109063459110861 Mg,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.109063459110861 Mg,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.109063459110861 Mg,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],6.857952927258656 Mg,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.903695492725843 Mg,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.903695492725843 Mg,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.88761665404157 Mg,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.88761665404157 Mg,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],5.321649592633195 Mg,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],5.321649592633195 Mg,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.9249406471675456 Mg,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.9249406471675456 Mg,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],5.321649592633195 Mg,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],5.321649592633195 Mg,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],5.321649592633195 Mg,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],5.321649592633195 Mg,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],5.323916874879941 Mg,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.289300289497751 Mg,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],5.1168032438836875 Mg,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],6.640482265724854 Mg,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],6.640482265724854 Mg,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],6.640482265724854 Mg,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],6.640482265724854 Mg,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],5.36701496312485 Mg,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.137648312167745 Mg,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.137648312167745 Mg,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],5.046607734861187 Mg,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],5.046607734861187 Mg,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],4.995288582943536 Mg,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],5.3327021291947965 Mg,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],6.256038406080866 Mg,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],6.256038406080866 Mg,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],6.256038406080866 Mg,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],5.453451597594244 Mg,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],5.453451597594244 Mg,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],8.579526434094078 Mg,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],7.098090718710337 Mg,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.216888209830333 Mg,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],4.680313098836338 Mg,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],4.172973695767698 Mg,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],4.172973695767698 Mg,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],10.220324860631512 Mg,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],7.180356209080567 Mg,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],7.180356209080567 Mg,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],10.689923118128597 Mg,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],10.689923118128597 Mg,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],11.178282611205036 Mg,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],11.178282611205036 Mg,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],11.178282611205036 Mg,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.067321030292584 Th,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.7497583486105555 Th,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.7497583486105555 Th,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.4213775866211815 Th,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.692329888683202 Th,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.692329888683202 Th,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.462198017025628 Th,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.462198017025628 Th,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.5019543434771876 Th,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.02797478570699 Th,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.02797478570699 Th,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.02797478570699 Th,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],4.73032565174972 Th,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.720553111219651 Th,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.720553111219651 Th,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.63598586212416 Th,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.63598586212416 Th,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.140956304407036 Th,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.140956304407036 Th,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],2.9891370914523607 Th,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],2.9891370914523607 Th,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.140956304407036 Th,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.140956304407036 Th,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.140956304407036 Th,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.140956304407036 Th,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],3.236779268689051 Th,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.3041465124891936 Th,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],3.709353217270559 Th,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.7402482159971977 Th,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.7402482159971977 Th,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.7402482159971977 Th,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.7402482159971977 Th,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],4.163821550460696 Th,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.7497583486105555 Th,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.7497583486105555 Th,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.692329888683202 Th,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.692329888683202 Th,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],3.751272461820922 Th,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.7721606428390055 Th,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.4213775866211815 Th,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.4213775866211815 Th,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.4213775866211815 Th,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.121839049528033 Th,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.121839049528033 Th,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.9947409756159304 Th,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],4.686149685600926 Th,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.202436698362719 Th,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],3.257059342909372 Th,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.3132104616276057 Th,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.3132104616276057 Th,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],4.756657539572842 Th,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.821843694746038 Th,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.821843694746038 Th,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.030297183276601 Th,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.030297183276601 Th,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.996421292974689 Th,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.996421292974689 Th,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.996421292974689 Th,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.7388248031872857 Rb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.0257217390749744 Rb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.0257217390749744 Rb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],2.82331864083139 Rb,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.3119077858729717 Rb,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.3119077858729717 Rb,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.710643803097418 Rb,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.710643803097418 Rb,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],1.880049934662922 Rb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],3.3008000287333976 Rb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],3.3008000287333976 Rb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],3.3008000287333976 Rb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],3.098694534694527 Rb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],2.10229510322961 Rb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],2.10229510322961 Rb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],3.4026781336918748 Rb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],3.4026781336918748 Rb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.419229824840755 Rb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.419229824840755 Rb,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],2.127429726484068 Rb,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],2.127429726484068 Rb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.419229824840755 Rb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.419229824840755 Rb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.419229824840755 Rb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.419229824840755 Rb,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],1.9139301810253193 Rb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],3.110894270425341 Rb,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],2.3871511814080058 Rb,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],2.3341071234049555 Rb,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],2.3341071234049555 Rb,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],2.3341071234049555 Rb,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],2.3341071234049555 Rb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],2.6011544004525935 Rb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.0257217390749744 Rb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.0257217390749744 Rb,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.3119077858729717 Rb,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.3119077858729717 Rb,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],2.39825972829567 Rb,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.398611265726466 Rb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],2.82331864083139 Rb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],2.82331864083139 Rb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],2.82331864083139 Rb,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],2.408098224286049 Rb,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],2.408098224286049 Rb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],4.2339213944758125 Rb,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],3.1437976335238424 Rb,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.2229282363772267 Rb,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],2.008907713736292 Rb,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],2.09649126417567 Rb,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],2.09649126417567 Rb,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],3.30960665604284 Rb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],2.7681737735891723 Rb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],2.7681737735891723 Rb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.481902983460001 Rb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.481902983460001 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Cd,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.385996886749271 Cd,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.385996886749271 Cd,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],4.979665680794781 Cd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.7206893736451123 Cd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.7206893736451123 Cd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.65651986287003 Cd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.65651986287003 Cd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.344804709246137 Cd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.344804709246137 Cd,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.3448752124396677 Cd,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.3448752124396677 Cd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.344804709246137 Cd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.344804709246137 Cd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.344804709246137 Cd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.344804709246137 Cd,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],3.287071963786995 Cd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.309842569747005 Cd,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],4.289467236929998 Cd,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.536916159087081 Cd,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.536916159087081 Cd,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.536916159087081 Cd,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.536916159087081 Cd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],4.4449110599374215 Cd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.8472306100688725 Cd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.8472306100688725 Cd,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.238224776793112 Cd,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.238224776793112 Cd,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],4.3595558753072865 Cd,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.358314383710431 Cd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.7616093966276525 Cd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.7616093966276525 Cd,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.7616093966276525 Cd,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.148854229500385 Cd,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.148854229500385 Cd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.003152657790867 Cd,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],5.448981839798151 Cd,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.490300420851477 Cd,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],3.474422824071419 Cd,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.291899030457558 Cd,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.291899030457558 Cd,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],5.774157331118836 Cd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],5.078280740802008 Cd,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],5.078280740802008 Cd,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.534303161280662 Cd,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.534303161280662 Cd,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.551080450872667 Cd,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.551080450872667 Cd,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.551080450872667 Cd,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.900583427309022 Pr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.37158411393067 Pr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.37158411393067 Pr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.225875145802448 Pr,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.8627448982559462 Pr,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.8627448982559462 Pr,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.415447975456948 Pr,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.415447975456948 Pr,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.3508653987455137 Pr,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],4.954082545655053 Pr,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],4.954082545655053 Pr,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],4.954082545655053 Pr,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],4.5871037473949325 Pr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.4714659561833208 Pr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.4714659561833208 Pr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.324867481692067 Pr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.324867481692067 Pr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.00907824283353 Pr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.00907824283353 Pr,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],2.970607765777142 Pr,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],2.970607765777142 Pr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.00907824283353 Pr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.00907824283353 Pr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.00907824283353 Pr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.00907824283353 Pr,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],3.0955279942226244 Pr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],4.930608522307384 Pr,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],3.7336150132109154 Pr,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.704758867471126 Pr,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.704758867471126 Pr,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.704758867471126 Pr,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.704758867471126 Pr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],4.091157091133344 Pr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.37158411393067 Pr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.37158411393067 Pr,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.8627448982559462 Pr,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.8627448982559462 Pr,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],3.759534900694579 Pr,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.7191740405631317 Pr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.225875145802448 Pr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.225875145802448 Pr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.225875145802448 Pr,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],3.9574799422884546 Pr,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],3.9574799422884546 Pr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.378782318367821 Pr,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],4.5214131055522095 Pr,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.947479409489341 Pr,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],3.241265396914635 Pr,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.2930510121137715 Pr,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.2930510121137715 Pr,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],4.6357794964501124 Pr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.417245366900238 Pr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.417245366900238 Pr,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.077728859144559 Pr,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.077728859144559 Pr,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.001388695380775 Pr,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.001388695380775 Pr,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.001388695380775 Pr,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.645775076756575 Eu,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.594124730850412 Eu,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.594124730850412 Eu,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.339721506949385 Eu,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.8741933700298015 Eu,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.8741933700298015 Eu,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.507612072983141 Eu,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.507612072983141 Eu,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.593258461272122 Eu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.130272349952243 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Eu,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.659057934804702 Eu,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.659057934804702 Eu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.298918603814523 Eu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.298918603814523 Eu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.213497536212326 Eu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.213497536212326 Eu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.213497536212326 Eu,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.690828290383956 Er,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.860084602198105 Er,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.860084602198105 Er,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.457501015812621 Er,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.9728589136184054 Er,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.9728589136184054 Er,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.62882317630353 Er,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.62882317630353 Er,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.70914612430853 Er,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.467405857554667 Er,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.467405857554667 Er,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.467405857554667 Er,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],4.904772167392035 Er,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.5953869925916235 Er,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.5953869925916235 Er,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.74557797834551 Er,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.74557797834551 Er,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.164725196726922 Er,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.164725196726922 Er,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.1518281340383654 Er,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.1518281340383654 Er,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.164725196726922 Er,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.164725196726922 Er,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.164725196726922 Er,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.164725196726922 Er,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],3.286757410687165 Er,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.1526231866884835 Er,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],3.8001915426624877 Er,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.012080636761364 Er,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.012080636761364 Er,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.012080636761364 Er,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.012080636761364 Er,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],4.626538605421711 Er,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.860084602198105 Er,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.860084602198105 Er,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.9728589136184054 Er,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.9728589136184054 Er,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],3.953140327354509 Er,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.9591310811595366 Er,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.457501015812621 Er,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.457501015812621 Er,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.457501015812621 Er,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.094205892784364 Er,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.094205892784364 Er,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.583459745894103 Er,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],4.876740182640945 Er,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.308207049903334 Er,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],3.303541493321533 Er,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.334350820225493 Er,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.334350820225493 Er,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],5.077301249854948 Er,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.881160060868135 Er,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.881160060868135 Er,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.434715392155346 Er,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.434715392155346 Er,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.323466988542998 Er,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.323466988542998 Er,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.323466988542998 Er,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.7311099899470053 Pb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.7460285425924855 Pb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.7460285425924855 Pb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.682567942744901 Pb,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.873650509768172 Pb,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.873650509768172 Pb,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.437176639967094 Pb,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.437176639967094 Pb,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.7687458279372086 Pb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],4.900600403823679 Pb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],4.900600403823679 Pb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],4.900600403823679 Pb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],4.467047674315896 Pb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.6285911768619785 Pb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.6285911768619785 Pb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.779657255238397 Pb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.779657255238397 Pb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.1681315691463245 Pb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.1681315691463245 Pb,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.0295939825271763 Pb,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.0295939825271763 Pb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.1681315691463245 Pb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.1681315691463245 Pb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.1681315691463245 Pb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.1681315691463245 Pb,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],3.1348873842678078 Pb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.508870014869858 Pb,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],3.794371447610106 Pb,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.255962120478051 Pb,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.255962120478051 Pb,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.255962120478051 Pb,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.255962120478051 Pb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],4.098741759247453 Pb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.7460285425924855 Pb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.7460285425924855 Pb,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.873650509768172 Pb,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.873650509768172 Pb,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],3.873664970159 Pb,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.9876483701775554 Pb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.682567942744901 Pb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.682567942744901 Pb,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.682567942744901 Pb,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],3.9157086079651204 Pb,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],3.9157086079651204 Pb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.88575891494613 Pb,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],4.887923013753493 Pb,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.073860890887409 Pb,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],3.2378647649755687 Pb,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.151774916415951 Pb,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.151774916415951 Pb,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],5.0763972299948215 Pb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],5.1369212814807845 Pb,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],5.1369212814807845 Pb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.142970186923305 Pb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.142970186923305 Pb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.093625265608411 Pb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.093625265608411 Pb,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.093625265608411 Pb,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.829633175927131 Y,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.604078908326688 Y,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.604078908326688 Y,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.796931748633966 Y,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.3051601005786555 Y,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.3051601005786555 Y,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.198809680404478 Y,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.198809680404478 Y,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.032078262840557 Y,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.317157301902325 Y,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.317157301902325 Y,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.317157301902325 Y,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],5.756602323585609 Y,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.9512499805466357 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Mo,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.928039964411408 Mo,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],5.138380778191716 Mo,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],5.138380778191716 Mo,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],8.211925824118133 Mo,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],6.384334996756382 Mo,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.448426784470739 Mo,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],4.412001607816247 Mo,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.465155066451874 Mo,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.465155066451874 Mo,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],6.198283768288766 Mo,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],6.28635105411008 Mo,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],6.28635105411008 Mo,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.02600032956903 Mo,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.02600032956903 Mo,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],8.976527541440833 Mo,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],8.976527541440833 Mo,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],8.976527541440833 Mo,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.3461685306522515 Sn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.266052836998836 Sn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.266052836998836 Sn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.83393256811347 Sn,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.178172042757543 Sn,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.178172042757543 Sn,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.2255413190943205 Sn,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.2255413190943205 Sn,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.299783716217606 Sn,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.089893603676428 Sn,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.089893603676428 Sn,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.089893603676428 Sn,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],5.584283594215365 Sn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.966549883520579 Sn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.966549883520579 Sn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.7327456558439716 Sn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.7327456558439716 Sn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.492549111889243 Sn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.492549111889243 Sn,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.441461064464878 Sn,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.441461064464878 Sn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.492549111889243 Sn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.492549111889243 Sn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.492549111889243 Sn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.492549111889243 Sn,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],3.823950544650546 Sn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.261185425628561 Sn,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],4.102757252104908 Sn,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.861854238650373 Sn,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.861854238650373 Sn,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.861854238650373 Sn,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.861854238650373 Sn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],4.767442685701447 Sn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.266052836998836 Sn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.266052836998836 Sn,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.178172042757543 Sn,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.178172042757543 Sn,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],4.228429032148535 Sn,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.38671228847512 Sn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.83393256811347 Sn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.83393256811347 Sn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.83393256811347 Sn,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.836565343610001 Sn,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.836565343610001 Sn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.761175805015349 Sn,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],5.486244711151218 Sn,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.718677712436177 Sn,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],3.6645930917791807 Sn,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.2274710559049247 Sn,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.2274710559049247 Sn,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],6.183722094074575 Sn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],5.80090788730995 Sn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],5.80090788730995 Sn,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],8.788882905247226 Sn,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],8.788882905247226 Sn,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],8.945186385073185 Sn,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],8.945186385073185 Sn,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],8.945186385073185 Sn,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.970108330227095 Al,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.225567395055374 Al,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.225567395055374 Al,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.7858050585531675 Al,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.2164318576926485 Al,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.2164318576926485 Al,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.1517092839088185 Al,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.1517092839088185 Al,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],5.3463359800130394 Al,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.1358801574059845 Al,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.1358801574059845 Al,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.1358801574059845 Al,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],7.283074223348914 Al,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.930161906745921 Al,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.930161906745921 Al,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.72356482645157 Al,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.72356482645157 Al,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],5.163685803292164 Al,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],5.163685803292164 Al,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],4.207786141433254 Al,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],4.207786141433254 Al,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],5.163685803292164 Al,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],5.163685803292164 Al,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],5.163685803292164 Al,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],5.163685803292164 Al,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],4.969087549996325 Al,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.243312601565221 Al,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],4.3129102017201415 Al,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],6.254915224025416 Al,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],6.254915224025416 Al,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],6.254915224025416 Al,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],6.254915224025416 Al,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],5.483189267259459 Al,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.225567395055374 Al,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.225567395055374 Al,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.2164318576926485 Al,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.2164318576926485 Al,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],4.235045996965782 Al,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.648639870466337 Al,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.7858050585531675 Al,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.7858050585531675 Al,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.7858050585531675 Al,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],5.4885104154405315 Al,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],5.4885104154405315 Al,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],9.22681467446277 Al,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],6.416307940569664 Al,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.357624634965452 Al,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],4.518422670175507 Al,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.98115061670584 Al,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.98115061670584 Al,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],7.944169590252287 Al,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],6.871899364023405 Al,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],6.871899364023405 Al,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],10.714717300045747 Al,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],10.714717300045747 Al,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],10.971061771934895 Al,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],10.971061771934895 Al,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],10.971061771934895 Al,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.999295527775849 Co,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.300721013216228 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Zn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.964056232077006 Zn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.964056232077006 Zn,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.896224528483142 Zn,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.896224528483142 Zn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.964056232077006 Zn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.964056232077006 Zn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.964056232077006 Zn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.964056232077006 Zn,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],3.979260106142069 Zn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.49325579558866 Zn,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],4.575070491506218 Zn,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.561782643012403 Zn,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.561782643012403 Zn,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.561782643012403 Zn,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.561782643012403 Zn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],5.184496749620648 Zn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.606316717847134 Zn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.606316717847134 Zn,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.808940002029643 Zn,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.808940002029643 Zn,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],4.575512594617635 Zn,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.826810451382322 Zn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.066384903138748 Zn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.066384903138748 Zn,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.066384903138748 Zn,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],5.001723454938813 Zn,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],5.001723454938813 Zn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.964389245034513 Zn,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],6.268860164194811 Zn,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.870096625687184 Zn,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],4.095769892838733 Zn,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.4992731311026875 Zn,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.4992731311026875 Zn,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],7.487346058805369 Zn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],6.261431227657262 Zn,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],6.261431227657262 Zn,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.2749951575471 Zn,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.2749951575471 Zn,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.49458432430973 Zn,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.49458432430973 Zn,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],9.49458432430973 Zn,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.3100815120691536 Ba,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.025698340361969 Ba,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.025698340361969 Ba,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],2.919405353438408 Ba,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.6323847969943315 Ba,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.6323847969943315 Ba,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.8749445468830657 Ba,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.8749445468830657 Ba,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.22199003520202 Ba,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],3.4533720338249454 Ba,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],3.4533720338249454 Ba,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],3.4533720338249454 Ba,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],3.02098062945846 Ba,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],2.2146084667533774 Ba,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],2.2146084667533774 Ba,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],3.4851613928454896 Ba,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],3.4851613928454896 Ba,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.455648501608223 Ba,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.455648501608223 Ba,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],2.2151790321140803 Ba,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],2.2151790321140803 Ba,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.455648501608223 Ba,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.455648501608223 Ba,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.455648501608223 Ba,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.455648501608223 Ba,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],1.9940597647198477 Ba,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],2.7433898349140473 Ba,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],2.453054614669899 Ba,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],2.582145840301706 Ba,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],2.582145840301706 Ba,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],2.582145840301706 Ba,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],2.582145840301706 Ba,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],2.9462489175597515 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K,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.190957704662766 K,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.190957704662766 K,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.190957704662766 K,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.0759202651888713 Cu,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.732404845061216 Cu,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.732404845061216 Cu,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.000826025107702 Cu,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.119203300693369 Cu,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.119203300693369 Cu,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.789845473488141 Cu,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.789845473488141 Cu,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.420990575454924 Cu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.061421106930937 Cu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.061421106930937 Cu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.061421106930937 Cu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],6.664924934259935 Cu,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.219261403296288 Cu,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.219261403296288 Cu,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.542028307239397 Cu,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.542028307239397 Cu,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.67063937093822 Cu,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.67063937093822 Cu,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.853846973384805 Cu,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.853846973384805 Cu,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.67063937093822 Cu,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.67063937093822 Cu,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.67063937093822 Cu,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.67063937093822 Cu,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],4.047603982002726 Cu,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.0715843298395304 Cu,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],4.054565666411317 Cu,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.394263059275202 Cu,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.394263059275202 Cu,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.394263059275202 Cu,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],5.394263059275202 Cu,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],5.089728831308007 Cu,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.732404845061216 Cu,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.732404845061216 Cu,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.119203300693369 Cu,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.119203300693369 Cu,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],4.132799722555223 Cu,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.388766622951948 Cu,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.000826025107702 Cu,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.000826025107702 Cu,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.000826025107702 Cu,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],5.359963159493255 Cu,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],5.359963159493255 Cu,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],8.085000357217858 Cu,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],6.2295103625978445 Cu,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.157049716732874 Cu,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],4.183388196022477 Cu,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.368614380217336 Cu,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.368614380217336 Cu,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],7.259946095007461 Cu,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],6.604698578918805 Cu,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],6.604698578918805 Cu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],10.429931147132601 Cu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],10.429931147132601 Cu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],10.81296472183988 Cu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],10.81296472183988 Cu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],10.81296472183988 Cu,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.3575486488382023 W,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.744465144462177 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Tm,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],3.3568529180882414 Tm,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.291492713756265 Tm,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],3.866025301955203 Tm,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.8821567826168972 Tm,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.8821567826168972 Tm,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.8821567826168972 Tm,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.8821567826168972 Tm,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],4.416657556642714 Tm,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.863768145679364 Tm,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.863768145679364 Tm,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.935402579007191 Tm,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.935402579007191 Tm,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],3.9149909327493284 Tm,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.9416431040751814 Tm,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.403913767309909 Tm,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.403913767309909 Tm,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.403913767309909 Tm,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.281985680983066 Tm,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.281985680983066 Tm,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.805696175093847 Tm,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],4.9610388301526624 Tm,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.405892051392371 Tm,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],3.405906939678558 Tm,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.3406073079125895 Tm,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.3406073079125895 Tm,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],4.910687554947939 Tm,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.837812695449639 Tm,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.837812695449639 Tm,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.455898559562882 Tm,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.455898559562882 Tm,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.393610854664584 Tm,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.393610854664584 Tm,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.393610854664584 Tm,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.7124675174665493 Sr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.4532478206296995 Sr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.4532478206296995 Sr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.108721380542999 Sr,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.6604964002771934 Sr,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.6604964002771934 Sr,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.2795203069497014 Sr,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.2795203069497014 Sr,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.4220388256539245 Sr,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],3.8748904656490426 Sr,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],3.8748904656490426 Sr,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],3.8748904656490426 Sr,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],3.4198227773404755 Sr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],2.401824701141545 Sr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],2.401824701141545 Sr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],3.9472260048048784 Sr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],3.9472260048048784 Sr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.735352355356481 Sr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.735352355356481 Sr,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],2.7108249347502484 Sr,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],2.7108249347502484 Sr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.735352355356481 Sr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.735352355356481 Sr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.735352355356481 Sr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],2.735352355356481 Sr,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],2.1691269675289035 Sr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],3.286647934542798 Sr,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],2.7621549156507 Sr,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],2.833277588921321 Sr,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],2.833277588921321 Sr,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],2.833277588921321 Sr,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],2.833277588921321 Sr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],3.249909941956875 Sr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.4532478206296995 Sr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.4532478206296995 Sr,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.6604964002771934 Sr,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.6604964002771934 Sr,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],2.749177208595153 Sr,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],2.7502145372902036 Sr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.108721380542999 Sr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.108721380542999 Sr,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.108721380542999 Sr,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],2.651750506151399 Sr,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],2.651750506151399 Sr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],4.1075121659362654 Sr,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],3.8907182244915552 Sr,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.6634488010395754 Sr,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],2.2187719954127276 Sr,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],2.3597665901624953 Sr,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],2.3597665901624953 Sr,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],3.9799774978286226 Sr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],3.215466536664005 Sr,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],3.215466536664005 Sr,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.5719661788878625 Sr,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.5719661788878625 Sr,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.370331667510534 Sr,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.370331667510534 Sr,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.370331667510534 Sr,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.2888028682030814 Tl,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.809331670487874 Tl,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.809331670487874 Tl,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.705940125728929 Tl,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.701862089073268 Tl,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.701862089073268 Tl,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.506444173526891 Tl,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.506444173526891 Tl,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.6562959011480167 Tl,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],4.911424599795407 Tl,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],4.911424599795407 Tl,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],4.911424599795407 Tl,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],4.636857185477766 Tl,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.6786391847734174 Tl,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.6786391847734174 Tl,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.799912719542104 Tl,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.799912719542104 Tl,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.2263239064103715 Tl,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.2263239064103715 Tl,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],2.915252647771784 Tl,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],2.915252647771784 Tl,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.2263239064103715 Tl,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.2263239064103715 Tl,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.2263239064103715 Tl,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.2263239064103715 Tl,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],3.1762132467830355 Tl,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.399523575323213 Tl,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],3.6587531977275933 Tl,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.111265391046224 Tl,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.111265391046224 Tl,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.111265391046224 Tl,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.111265391046224 Tl,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],4.0748217419519746 Tl,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.809331670487874 Tl,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.809331670487874 Tl,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.701862089073268 Tl,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.701862089073268 Tl,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],3.7713729381899856 Tl,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.8767091567415672 Tl,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.705940125728929 Tl,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.705940125728929 Tl,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.705940125728929 Tl,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],3.9329309710269857 Tl,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],3.9329309710269857 Tl,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.047575113419818 Tl,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],4.747641862266111 Tl,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.088234408517646 Tl,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],3.1492328420685847 Tl,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.168491554785919 Tl,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.168491554785919 Tl,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],4.989983295173164 Tl,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],5.127472895728841 Tl,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],5.127472895728841 Tl,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.134348737143446 Tl,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.134348737143446 Tl,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.098661440685122 Tl,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.098661440685122 Tl,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.098661440685122 Tl,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.759579202934719 Ce,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.55728018667962 Ce,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.55728018667962 Ce,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.3379488108826525 Ce,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.87914180856247 Ce,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.87914180856247 Ce,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.542482477317488 Ce,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.542482477317488 Ce,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.55279419609583 Ce,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.126471959024682 Ce,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.126471959024682 Ce,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.126471959024682 Ce,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],4.761996789039976 Ce,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.715028289514148 Ce,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.715028289514148 Ce,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.540602261203565 Ce,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.540602261203565 Ce,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.1151652818007225 Ce,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.1151652818007225 Ce,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.134593107218591 Ce,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.134593107218591 Ce,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.1151652818007225 Ce,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.1151652818007225 Ce,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.1151652818007225 Ce,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.1151652818007225 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In,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.7156123064519715 In,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.15760862144622 In,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.437773341334061 In,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.437773341334061 In,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.515618521587091 In,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.515618521587091 In,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.263686676612182 In,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.305445737752749 In,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.305445737752749 In,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],6.305445737752749 In,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],6.033415021442846 In,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.300972752062819 In,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.300972752062819 In,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.661927666516968 In,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.661927666516968 In,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.949925965973753 In,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.949925965973753 In,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.650511758807297 In,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.650511758807297 In,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.949925965973753 In,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.949925965973753 In,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.949925965973753 In,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.949925965973753 In,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],3.8875605367600836 In,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.253426551393841 In,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],4.502048849222053 In,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.69928109939951 In,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.69928109939951 In,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.69928109939951 In,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],4.69928109939951 In,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],5.28942830024882 In,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.7156123064519715 In,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],5.7156123064519715 In,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.437773341334061 In,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.437773341334061 In,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],4.43259531703929 In,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.575307321927814 In,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.15760862144622 In,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.15760862144622 In,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],5.15760862144622 In,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.893795942738208 In,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],4.893795942738208 In,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],7.223925015337455 In,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],6.078844003983725 In,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],6.0001373350126865 In,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],3.9636446119166076 In,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.8218320143713287 In,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],3.8218320143713287 In,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],6.085530462395385 In,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],6.004715803717922 In,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],6.004715803717922 In,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],8.591475376441739 In,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],8.591475376441739 In,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],8.62563047991269 In,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],8.62563047991269 In,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],8.62563047991269 In,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],3.3915758840991828 Lu,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.968023263237685 Lu,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.968023263237685 Lu,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],4.484357266316689 Lu,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.0099248168395825 Lu,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],4.0099248168395825 Lu,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.730938320819506 Lu,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.730938320819506 Lu,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.7137303251813933 Lu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.551592678007642 Lu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.551592678007642 Lu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.551592678007642 Lu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],5.008722318834213 Lu,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.6657978104492646 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Lu,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.205888596032857 Lu,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],4.205888596032857 Lu,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.157422429951313 Lu,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],3.157422429951313 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Lu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.382473985825808 Lu,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6B(c6c([H])c([H])c([H])c([H])c6[H])c6c([H])c([H])c([H])c([H])c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],7.382473985825808 Lu,[H]c1nc([H])c(C([H])([H])N([H])c2c([H])nc([H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],2.7215568126373513 Li,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.373587501514316 Li,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.373587501514316 Li,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.891960036937562 Li,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.106578993183753 Li,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.106578993183753 Li,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.672602545453232 Li,[H]OC(=O)c1c([H])c([H])c(C([H])([H])N(c2c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.672602545453232 Li,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])nc([H])c3[H])c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.1468683351021727 Li,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.0508118325484475 Li,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.0508118325484475 Li,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c(B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],5.0508118325484475 Li,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c([H])c2c1[H],4.923991989467108 Li,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.0759640705806945 Li,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(C([H])([H])[N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.0759640705806945 Li,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.231681342801752 Li,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(-c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.231681342801752 Li,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],3.532104693206133 Li,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],3.532104693206133 Li,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],2.950833869133289 Li,[H]C(=Nn1c([H])nnc1B(c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c([H])c([H])c1[H])c1c([H])c([H])c(Cl)c([H])c1[H],2.950833869133289 Li,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],3.532104693206133 Li,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],3.532104693206133 Li,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],3.532104693206133 Li,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c([H])c2N(c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c2c([H])c([H])c([N+]3=NC4([H])[N-]C34[H])c([H])c2[H])c([H])c1[H],3.532104693206133 Li,[H]c1nc2c3nc([H])c([H])c([H])c3c3c(nc([H])n3[H])c2c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c1[H],2.78179157448179 Li,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1[H],5.0107561278448935 Li,[H]C1=NC([H])(c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])C([H])([H])N1[H],3.272175979685837 Li,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.7348632714037615 Li,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.7348632714037615 Li,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.7348632714037615 Li,[H]c1nc([H])c([H])c(N(c2c([H])c([H])nc([H])c2[H])c2c([H])c([H])c(C#CC#Cc3c([H])c([H])c(N(c4c([H])c([H])nc([H])c4[H])c4c([H])c([H])nc([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c1[H],3.7348632714037615 Li,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])C([H])([H])[H])c([H])c1[H],3.621618423170517 Li,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.373587501514316 Li,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.373587501514316 Li,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.106578993183753 Li,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.106578993183753 Li,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c(B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c1[H],3.191990904206441 Li,[H]c1nc([H])n(-c2c([H])c([H])c(N(c3c([H])c([H])c(-n4c([H])nc([H])c4C([H])([H])[H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c1[H],3.3509338423078354 Li,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.891960036937562 Li,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.891960036937562 Li,[H]c1c([H])c([H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c(-c3c([H])c([H])c(C([H])([H])[N+]4=NC5([H])[N-]C45[H])c([H])c3[H])c([H])c([H])c2C([H])([H])[N+]2=NC3([H])[N-]C23[H])c([H])c1[H],3.891960036937562 Li,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],3.7969644463534262 Li,[H]OC(=O)c1c([H])c(C(=O)O[H])c([H])c(N2C([H])=C([H])N(c3c([H])c(C(=O)O[H])c([H])c(C(=O)O[H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C2([H])[H])c1[H],3.7969644463534262 Li,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c(N(c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c([H])c3[H])c3c([H])c([H])c(N(c4c([H])c([H])c(C(=O)O[H])c([H])c4[H])c4c([H])c([H])c(C(=O)O[H])c([H])c4B(c4c([H])c([H])c([H])c([H])c4[H])c4c([H])c([H])c([H])c([H])c4[H])c([H])c3[H])c([H])c2[H])c([H])c1[H],6.548074067492072 Li,[H]OC(=O)c1c([H])c([H])c(Oc2nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3[H])nc(Oc3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])n2)c([H])c1[H],4.531201303374122 Li,[H]OC(=O)c1c([H])c([H])c(N(C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])C([H])([H])c2c([H])c([H])c(C(=O)O[H])c([H])c2B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c([H])c1[H],4.6457907965871215 Li,[H]OC(=O)c1c([H])c(C(=O)O[H])c(B(c2c([H])c([H])c([H])c([H])c2[H])c2c([H])c([H])c([H])c([H])c2[H])c(N2C([H])=C([H])N(C([H])([H])[H])C2([H])[H])c1[H],3.1826840939133616 Li,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],2.763397734248401 Li,[H]c1nc([H])c([H])c(N2C([H])([H])C([H])([H])N(c3c([H])c([H])nc([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])C([H])([H])C2([H])[H])c1[H],2.763397734248401 Li,[H]OC(=O)c1c([H])c([H])c(-c2c([H])c([H])c(N(c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3[H])c3c([H])c([H])c(-c4c([H])c([H])c(C(=O)O[H])c(OC([H])([H])[H])c4[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c([H])c2[H])c([H])c1OC([H])([H])[H],5.035350082473218 Li,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.592283451248598 Li,[H]OC(=O)c1c([H])c([H])c(N(c2c([H])c([H])c(C(=O)O[H])c([H])c2[H])c2c([H])c([H])c([H])c(N(c3c([H])c([H])c(C(=O)O[H])c([H])c3[H])c3c([H])c([H])c(C(=O)O[H])c([H])c3B(c3c([H])c([H])c([H])c([H])c3[H])c3c([H])c([H])c([H])c([H])c3[H])c2[H])c([H])c1[H],4.592283451248598 Li,[H]OC(=O)c1c([H])c([H])c2c([H])c(N(c3c([H])c([H])c(-c4c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c([H])c(-c5c([H])c([H])c(N(c6c([H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c6c(B(c7c([H])c([H])c([H])c([H])c7[H])c7c([H])c([H])c([H])c([H])c7[H])c([H])c7c([H])c(C(=O)O[H])c([H])c([H])c7c6[H])c([H])c5[H])c4[H])c([H])c3[H])c3c([H])c([H])c4c([H])c(C(=O)O[H])c([H])c([H])c4c3[H])c([H])c([H])c2c1[H],8.120455802304107 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