← сравнение complex #542 3D Viewer

Complex #542 — Ru(2)

GT: {"N": 3} · Δ = +0.00
{"N": 3}
Ground Truth
0.000
Single-lig
0.000
Sequential
+0.000
Δ Sequential
Single-ligand (v1) — 144 candidates
Pred: C:6(eta)
#2 C[c]12->[Ru+2]3456<-[c]1(C)[c]->3(C)[c]->4(C)[c]->5(C)[c]->62C 0.743
#2 C[c]12->[Ru+2]3456<-[c]1(C)[c]->3(C)[c]->4(C)[c]->5(C)[c]->62C 0.743
#2 C[c]12->[Ru+2]3456<-[c]1(C)[c]->3(C)[c]->4(C)[c]->5(C)[c]->62C 0.743
#2 C[c]12->[Ru+2]3456<-[c]1(C)[c]->3(C)[c]->4(C)[c]->5(C)[c]->62C 0.743
#2 C[c]12->[Ru+2]3456<-[c]1(C)[c]->3(C)[c]->4(C)[c]->5(C)[c]->62C 0.743
#2 C[c]12->[Ru+2]3456<-[c]1(C)[c]->3(C)[c]->4(C)[c]->5(C)[c]->62C 0.743
#2 C[c]12->[Ru+2]3456<-[c]1(C)[c]->3(C)[c]->4(C)[c]->5(C)[c]->62C 0.743
#2 C[c]12->[Ru+2]3456<-[c]1(C)[c]->3(C)[c]->4(C)[c]->5(C)[c]->62C 0.743
#2 C[c]12->[Ru+2]3456<-[c]1(C)[c]->3(C)[c]->4(C)[c]->5(C)[c]->62C 0.743
#3 Cc1c(C)[c]2(C)->[Ru+]3<-[c](C)(c1C)[c]->32C 0.546
#3 Cc1c(C)[c]2(C)->[Ru+]3<-[c](C)(c1C)[c]->32C 0.546
#3 Cc1c(C)[c]2(C)->[Ru+]3<-[c](C)(c1C)[c]->32C 0.546
#3 Cc1c(C)[c]2(C)->[Ru+]3<-[c](C)(c1C)[c]->32C 0.546
#3 Cc1c(C)[c]2(C)->[Ru+]3<-[c](C)(c1C)[c]->32C 0.546
#3 Cc1c(C)[c]2(C)->[Ru+]3<-[c](C)(c1C)[c]->32C 0.546
#3 Cc1c(C)[c]2(C)->[Ru+]3<-[c](C)(c1C)[c]->32C 0.546
#3 Cc1c(C)[c]2(C)->[Ru+]3<-[c](C)(c1C)[c]->32C 0.546
#3 Cc1c(C)[c]2(C)->[Ru+]3<-[c](C)(c1C)[c]->32C 0.546
#4 Cc1c(C(=O)C(F)(F)F)c(=O)n2-c3cccc[n]3->[Ru+2]<-[n-]12 0.049
#4 Cc1c(C(=O)C(F)(F)F)c(=O)n2-c3cccc[n]3->[Ru+2]<-[n-]12 0.049
#4 Cc1c(C(=O)C(F)(F)F)c(=O)n2-c3cccc[n]3->[Ru+2]<-[n-]12 0.049
#4 Cc1c(C(=O)C(F)(F)F)c(=O)n2-c3cccc[n]3->[Ru+2]<-[n-]12 0.049
#4 Cc1c(C(=O)C(F)(F)F)c(=O)n2-c3cccc[n]3->[Ru+2]<-[n-]12 0.049
#4 Cc1c(C(=O)C(F)(F)F)c(=O)n2-c3cccc[n]3->[Ru+2]<-[n-]12 0.049
#4 Cc1c(C(=O)C(F)(F)F)c(=O)n2-c3cccc[n]3->[Ru+2]<-[n-]12 0.049
#4 Cc1c(C(=O)C(F)(F)F)c(=O)n2-c3cccc[n]3->[Ru+2]<-[n-]12 0.049
#4 Cc1c(C(=O)C(F)(F)F)c(=O)n2-c3cccc[n]3->[Ru+2]<-[n-]12 0.049
#5 Cc1c(C(=O)C(F)(F)F)c(=O)n(-c2ccccn2)[n]1[Ru+] 0.013
#5 Cc1c(C(=O)C(F)(F)F)c(=O)n(-c2ccccn2)[n]1[Ru+] 0.013
#5 Cc1c(C(=O)C(F)(F)F)c(=O)n(-c2ccccn2)[n]1[Ru+] 0.013
#5 Cc1c(C(=O)C(F)(F)F)c(=O)n(-c2ccccn2)[n]1[Ru+] 0.013
#5 Cc1c(C(=O)C(F)(F)F)c(=O)n(-c2ccccn2)[n]1[Ru+] 0.013
#5 Cc1c(C(=O)C(F)(F)F)c(=O)n(-c2ccccn2)[n]1[Ru+] 0.013
#5 Cc1c(C(=O)C(F)(F)F)c(=O)n(-c2ccccn2)[n]1[Ru+] 0.013
#5 Cc1c(C(=O)C(F)(F)F)c(=O)n(-c2ccccn2)[n]1[Ru+] 0.013
#5 Cc1c(C(=O)C(F)(F)F)c(=O)n(-c2ccccn2)[n]1[Ru+] 0.013
#6 Cc1[n-]n(-c2ccccn2)c2=[O]->[Ru+2]<-[O]=C(c12)C(F)(F)F 0.000
#6 Cc1[n-]n(-c2ccccn2)c2=[O]->[Ru+2]<-[O]=C(c12)C(F)(F)F 0.000
#6 Cc1[n-]n(-c2ccccn2)c2=[O]->[Ru+2]<-[O]=C(c12)C(F)(F)F 0.000
#6 Cc1[n-]n(-c2ccccn2)c2=[O]->[Ru+2]<-[O]=C(c12)C(F)(F)F 0.000
#6 Cc1[n-]n(-c2ccccn2)c2=[O]->[Ru+2]<-[O]=C(c12)C(F)(F)F 0.000
#6 Cc1[n-]n(-c2ccccn2)c2=[O]->[Ru+2]<-[O]=C(c12)C(F)(F)F 0.000
#6 Cc1[n-]n(-c2ccccn2)c2=[O]->[Ru+2]<-[O]=C(c12)C(F)(F)F 0.000
#6 Cc1[n-]n(-c2ccccn2)c2=[O]->[Ru+2]<-[O]=C(c12)C(F)(F)F 0.000
#6 Cc1[n-]n(-c2ccccn2)c2=[O]->[Ru+2]<-[O]=C(c12)C(F)(F)F 0.000
#7 Cc1[n-]n(-c2ccccn2)c(=O)c1[C]1(C(F)(F)F)[O][Ru+2]1 0.000
#7 Cc1[n-]n(-c2ccccn2)c(=O)c1[C]1(C(F)(F)F)[O][Ru+2]1 0.000
#7 Cc1[n-]n(-c2ccccn2)c(=O)c1[C]1(C(F)(F)F)[O][Ru+2]1 0.000
#7 Cc1[n-]n(-c2ccccn2)c(=O)c1[C]1(C(F)(F)F)[O][Ru+2]1 0.000
#7 Cc1[n-]n(-c2ccccn2)c(=O)c1[C]1(C(F)(F)F)[O][Ru+2]1 0.000
#7 Cc1[n-]n(-c2ccccn2)c(=O)c1[C]1(C(F)(F)F)[O][Ru+2]1 0.000
#7 Cc1[n-]n(-c2ccccn2)c(=O)c1[C]1(C(F)(F)F)[O][Ru+2]1 0.000
#7 Cc1[n-]n(-c2ccccn2)c(=O)c1[C]1(C(F)(F)F)[O][Ru+2]1 0.000
#7 Cc1[n-]n(-c2ccccn2)c(=O)c1[C]1(C(F)(F)F)[O][Ru+2]1 0.000
#8 Cc1[n-]n(-c2cccc[n]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#8 Cc1[n-]n(-c2cccc[n]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#8 Cc1[n-]n(-c2cccc[n]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#8 Cc1[n-]n(-c2cccc[n]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#8 Cc1[n-]n(-c2cccc[n]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#8 Cc1[n-]n(-c2cccc[n]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#8 Cc1[n-]n(-c2cccc[n]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#8 Cc1[n-]n(-c2cccc[n]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#8 Cc1[n-]n(-c2cccc[n]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#9 Cc1[n-]n(-c2ccccn2)c(=[O]->[Ru+2])c1C(=O)C(F)(F)F 0.000
#9 Cc1[n-]n(-c2ccccn2)c(=[O]->[Ru+2])c1C(=O)C(F)(F)F 0.000
#9 Cc1[n-]n(-c2ccccn2)c(=[O]->[Ru+2])c1C(=O)C(F)(F)F 0.000
#9 Cc1[n-]n(-c2ccccn2)c(=[O]->[Ru+2])c1C(=O)C(F)(F)F 0.000
#9 Cc1[n-]n(-c2ccccn2)c(=[O]->[Ru+2])c1C(=O)C(F)(F)F 0.000
#9 Cc1[n-]n(-c2ccccn2)c(=[O]->[Ru+2])c1C(=O)C(F)(F)F 0.000
#9 Cc1[n-]n(-c2ccccn2)c(=[O]->[Ru+2])c1C(=O)C(F)(F)F 0.000
#9 Cc1[n-]n(-c2ccccn2)c(=[O]->[Ru+2])c1C(=O)C(F)(F)F 0.000
#9 Cc1[n-]n(-c2ccccn2)c(=[O]->[Ru+2])c1C(=O)C(F)(F)F 0.000
#10 Cc1[n-]n(-c2ccccn2)c(=O)c1C(=[O]->[Ru+2])C(F)(F)F 0.000
#10 Cc1[n-]n(-c2ccccn2)c(=O)c1C(=[O]->[Ru+2])C(F)(F)F 0.000
#10 Cc1[n-]n(-c2ccccn2)c(=O)c1C(=[O]->[Ru+2])C(F)(F)F 0.000
#10 Cc1[n-]n(-c2ccccn2)c(=O)c1C(=[O]->[Ru+2])C(F)(F)F 0.000
#10 Cc1[n-]n(-c2ccccn2)c(=O)c1C(=[O]->[Ru+2])C(F)(F)F 0.000
#10 Cc1[n-]n(-c2ccccn2)c(=O)c1C(=[O]->[Ru+2])C(F)(F)F 0.000
#10 Cc1[n-]n(-c2ccccn2)c(=O)c1C(=[O]->[Ru+2])C(F)(F)F 0.000
#10 Cc1[n-]n(-c2ccccn2)c(=O)c1C(=[O]->[Ru+2])C(F)(F)F 0.000
#10 Cc1[n-]n(-c2ccccn2)c(=O)c1C(=[O]->[Ru+2])C(F)(F)F 0.000
#11 Cc1[n-]n(-c2ncc[cH]3->[Ru+2]<-[cH]23)c(=O)c1C(=O)C(F)(F)F 0.000
#11 Cc1[n-]n(-c2ncc[cH]3->[Ru+2]<-[cH]23)c(=O)c1C(=O)C(F)(F)F 0.000
#11 Cc1[n-]n(-c2ncc[cH]3->[Ru+2]<-[cH]23)c(=O)c1C(=O)C(F)(F)F 0.000
#11 Cc1[n-]n(-c2ncc[cH]3->[Ru+2]<-[cH]23)c(=O)c1C(=O)C(F)(F)F 0.000
#11 Cc1[n-]n(-c2ncc[cH]3->[Ru+2]<-[cH]23)c(=O)c1C(=O)C(F)(F)F 0.000
#11 Cc1[n-]n(-c2ncc[cH]3->[Ru+2]<-[cH]23)c(=O)c1C(=O)C(F)(F)F 0.000
#11 Cc1[n-]n(-c2ncc[cH]3->[Ru+2]<-[cH]23)c(=O)c1C(=O)C(F)(F)F 0.000
#11 Cc1[n-]n(-c2ncc[cH]3->[Ru+2]<-[cH]23)c(=O)c1C(=O)C(F)(F)F 0.000
#11 Cc1[n-]n(-c2ncc[cH]3->[Ru+2]<-[cH]23)c(=O)c1C(=O)C(F)(F)F 0.000
#12 Cc1[n-]n(-c2c[cH]3->[Ru+2]<-[cH]3cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#12 Cc1[n-]n(-c2c[cH]3->[Ru+2]<-[cH]3cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#12 Cc1[n-]n(-c2c[cH]3->[Ru+2]<-[cH]3cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#12 Cc1[n-]n(-c2c[cH]3->[Ru+2]<-[cH]3cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#12 Cc1[n-]n(-c2c[cH]3->[Ru+2]<-[cH]3cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#12 Cc1[n-]n(-c2c[cH]3->[Ru+2]<-[cH]3cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#12 Cc1[n-]n(-c2c[cH]3->[Ru+2]<-[cH]3cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#12 Cc1[n-]n(-c2c[cH]3->[Ru+2]<-[cH]3cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#12 Cc1[n-]n(-c2c[cH]3->[Ru+2]<-[cH]3cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#13 Cc1[n-]n(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)c(=O)c1C(=O)C(F)(F)F 0.000
#13 Cc1[n-]n(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)c(=O)c1C(=O)C(F)(F)F 0.000
#13 Cc1[n-]n(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)c(=O)c1C(=O)C(F)(F)F 0.000
#13 Cc1[n-]n(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)c(=O)c1C(=O)C(F)(F)F 0.000
#13 Cc1[n-]n(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)c(=O)c1C(=O)C(F)(F)F 0.000
#13 Cc1[n-]n(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)c(=O)c1C(=O)C(F)(F)F 0.000
#13 Cc1[n-]n(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)c(=O)c1C(=O)C(F)(F)F 0.000
#13 Cc1[n-]n(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)c(=O)c1C(=O)C(F)(F)F 0.000
#13 Cc1[n-]n(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)c(=O)c1C(=O)C(F)(F)F 0.000
#14 Cc1[n-]n(C2=C[CH]3[Ru+2][CH]3C=N2)c(=O)c1C(=O)C(F)(F)F 0.000
#14 Cc1[n-]n(C2=C[CH]3[Ru+2][CH]3C=N2)c(=O)c1C(=O)C(F)(F)F 0.000
#14 Cc1[n-]n(C2=C[CH]3[Ru+2][CH]3C=N2)c(=O)c1C(=O)C(F)(F)F 0.000
#14 Cc1[n-]n(C2=C[CH]3[Ru+2][CH]3C=N2)c(=O)c1C(=O)C(F)(F)F 0.000
#14 Cc1[n-]n(C2=C[CH]3[Ru+2][CH]3C=N2)c(=O)c1C(=O)C(F)(F)F 0.000
#14 Cc1[n-]n(C2=C[CH]3[Ru+2][CH]3C=N2)c(=O)c1C(=O)C(F)(F)F 0.000
#14 Cc1[n-]n(C2=C[CH]3[Ru+2][CH]3C=N2)c(=O)c1C(=O)C(F)(F)F 0.000
#14 Cc1[n-]n(C2=C[CH]3[Ru+2][CH]3C=N2)c(=O)c1C(=O)C(F)(F)F 0.000
#14 Cc1[n-]n(C2=C[CH]3[Ru+2][CH]3C=N2)c(=O)c1C(=O)C(F)(F)F 0.000
#15 Cc1[n-]n(-c2cc[cH](->[Ru+2])cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#15 Cc1[n-]n(-c2cc[cH](->[Ru+2])cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#15 Cc1[n-]n(-c2cc[cH](->[Ru+2])cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#15 Cc1[n-]n(-c2cc[cH](->[Ru+2])cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#15 Cc1[n-]n(-c2cc[cH](->[Ru+2])cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#15 Cc1[n-]n(-c2cc[cH](->[Ru+2])cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#15 Cc1[n-]n(-c2cc[cH](->[Ru+2])cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#15 Cc1[n-]n(-c2cc[cH](->[Ru+2])cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#15 Cc1[n-]n(-c2cc[cH](->[Ru+2])cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#16 Cc1[n-]n(-c2nccc[cH]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#16 Cc1[n-]n(-c2nccc[cH]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#16 Cc1[n-]n(-c2nccc[cH]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#16 Cc1[n-]n(-c2nccc[cH]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#16 Cc1[n-]n(-c2nccc[cH]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#16 Cc1[n-]n(-c2nccc[cH]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#16 Cc1[n-]n(-c2nccc[cH]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#16 Cc1[n-]n(-c2nccc[cH]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#16 Cc1[n-]n(-c2nccc[cH]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#17 Cc1[n-]n(-c2c[cH](->[Ru+2])ccn2)c(=O)c1C(=O)C(F)(F)F 0.000
#17 Cc1[n-]n(-c2c[cH](->[Ru+2])ccn2)c(=O)c1C(=O)C(F)(F)F 0.000
#17 Cc1[n-]n(-c2c[cH](->[Ru+2])ccn2)c(=O)c1C(=O)C(F)(F)F 0.000
#17 Cc1[n-]n(-c2c[cH](->[Ru+2])ccn2)c(=O)c1C(=O)C(F)(F)F 0.000
#17 Cc1[n-]n(-c2c[cH](->[Ru+2])ccn2)c(=O)c1C(=O)C(F)(F)F 0.000
#17 Cc1[n-]n(-c2c[cH](->[Ru+2])ccn2)c(=O)c1C(=O)C(F)(F)F 0.000
#17 Cc1[n-]n(-c2c[cH](->[Ru+2])ccn2)c(=O)c1C(=O)C(F)(F)F 0.000
#17 Cc1[n-]n(-c2c[cH](->[Ru+2])ccn2)c(=O)c1C(=O)C(F)(F)F 0.000
#17 Cc1[n-]n(-c2c[cH](->[Ru+2])ccn2)c(=O)c1C(=O)C(F)(F)F 0.000
Sequential multi-lig (v2) — 144 candidates
Pred: {"N": 4}
#2 C[c]12->[Ru+2]3456<-[c]1(C)[c]->3(C)[c]->4(C)[c]->5(C)[c]->62C 0.743
#2 C[c]12->[Ru+2]3456<-[c]1(C)[c]->3(C)[c]->4(C)[c]->5(C)[c]->62C 0.743
#2 C[c]12->[Ru+2]3456<-[c]1(C)[c]->3(C)[c]->4(C)[c]->5(C)[c]->62C 0.743
#2 C[c]12->[Ru+2]3456<-[c]1(C)[c]->3(C)[c]->4(C)[c]->5(C)[c]->62C 0.743
#2 C[c]12->[Ru+2]3456<-[c]1(C)[c]->3(C)[c]->4(C)[c]->5(C)[c]->62C 0.743
#2 C[c]12->[Ru+2]3456<-[c]1(C)[c]->3(C)[c]->4(C)[c]->5(C)[c]->62C 0.743
#2 C[c]12->[Ru+2]3456<-[c]1(C)[c]->3(C)[c]->4(C)[c]->5(C)[c]->62C 0.743
#2 C[c]12->[Ru+2]3456<-[c]1(C)[c]->3(C)[c]->4(C)[c]->5(C)[c]->62C 0.743
#2 C[c]12->[Ru+2]3456<-[c]1(C)[c]->3(C)[c]->4(C)[c]->5(C)[c]->62C 0.743
#3 Cc1c(C)[c]2(C)->[Ru+]3<-[c](C)(c1C)[c]->32C 0.546
#3 Cc1c(C)[c]2(C)->[Ru+]3<-[c](C)(c1C)[c]->32C 0.546
#3 Cc1c(C)[c]2(C)->[Ru+]3<-[c](C)(c1C)[c]->32C 0.546
#3 Cc1c(C)[c]2(C)->[Ru+]3<-[c](C)(c1C)[c]->32C 0.546
#3 Cc1c(C)[c]2(C)->[Ru+]3<-[c](C)(c1C)[c]->32C 0.546
#3 Cc1c(C)[c]2(C)->[Ru+]3<-[c](C)(c1C)[c]->32C 0.546
#3 Cc1c(C)[c]2(C)->[Ru+]3<-[c](C)(c1C)[c]->32C 0.546
#3 Cc1c(C)[c]2(C)->[Ru+]3<-[c](C)(c1C)[c]->32C 0.546
#3 Cc1c(C)[c]2(C)->[Ru+]3<-[c](C)(c1C)[c]->32C 0.546
#4 Cc1c(C(=O)C(F)(F)F)c(=O)n2-c3cccc[n]3->[Ru+2]<-[n-]12 0.049
#4 Cc1c(C(=O)C(F)(F)F)c(=O)n2-c3cccc[n]3->[Ru+2]<-[n-]12 0.049
#4 Cc1c(C(=O)C(F)(F)F)c(=O)n2-c3cccc[n]3->[Ru+2]<-[n-]12 0.049
#4 Cc1c(C(=O)C(F)(F)F)c(=O)n2-c3cccc[n]3->[Ru+2]<-[n-]12 0.049
#4 Cc1c(C(=O)C(F)(F)F)c(=O)n2-c3cccc[n]3->[Ru+2]<-[n-]12 0.049
#4 Cc1c(C(=O)C(F)(F)F)c(=O)n2-c3cccc[n]3->[Ru+2]<-[n-]12 0.049
#4 Cc1c(C(=O)C(F)(F)F)c(=O)n2-c3cccc[n]3->[Ru+2]<-[n-]12 0.049
#4 Cc1c(C(=O)C(F)(F)F)c(=O)n2-c3cccc[n]3->[Ru+2]<-[n-]12 0.049
#4 Cc1c(C(=O)C(F)(F)F)c(=O)n2-c3cccc[n]3->[Ru+2]<-[n-]12 0.049
#5 Cc1c(C(=O)C(F)(F)F)c(=O)n(-c2ccccn2)[n]1[Ru+] 0.013
#5 Cc1c(C(=O)C(F)(F)F)c(=O)n(-c2ccccn2)[n]1[Ru+] 0.013
#5 Cc1c(C(=O)C(F)(F)F)c(=O)n(-c2ccccn2)[n]1[Ru+] 0.013
#5 Cc1c(C(=O)C(F)(F)F)c(=O)n(-c2ccccn2)[n]1[Ru+] 0.013
#5 Cc1c(C(=O)C(F)(F)F)c(=O)n(-c2ccccn2)[n]1[Ru+] 0.013
#5 Cc1c(C(=O)C(F)(F)F)c(=O)n(-c2ccccn2)[n]1[Ru+] 0.013
#5 Cc1c(C(=O)C(F)(F)F)c(=O)n(-c2ccccn2)[n]1[Ru+] 0.013
#5 Cc1c(C(=O)C(F)(F)F)c(=O)n(-c2ccccn2)[n]1[Ru+] 0.013
#5 Cc1c(C(=O)C(F)(F)F)c(=O)n(-c2ccccn2)[n]1[Ru+] 0.013
#6 Cc1[n-]n(-c2ccccn2)c2=[O]->[Ru+2]<-[O]=C(c12)C(F)(F)F 0.000
#6 Cc1[n-]n(-c2ccccn2)c2=[O]->[Ru+2]<-[O]=C(c12)C(F)(F)F 0.000
#6 Cc1[n-]n(-c2ccccn2)c2=[O]->[Ru+2]<-[O]=C(c12)C(F)(F)F 0.000
#6 Cc1[n-]n(-c2ccccn2)c2=[O]->[Ru+2]<-[O]=C(c12)C(F)(F)F 0.000
#6 Cc1[n-]n(-c2ccccn2)c2=[O]->[Ru+2]<-[O]=C(c12)C(F)(F)F 0.000
#6 Cc1[n-]n(-c2ccccn2)c2=[O]->[Ru+2]<-[O]=C(c12)C(F)(F)F 0.000
#6 Cc1[n-]n(-c2ccccn2)c2=[O]->[Ru+2]<-[O]=C(c12)C(F)(F)F 0.000
#6 Cc1[n-]n(-c2ccccn2)c2=[O]->[Ru+2]<-[O]=C(c12)C(F)(F)F 0.000
#6 Cc1[n-]n(-c2ccccn2)c2=[O]->[Ru+2]<-[O]=C(c12)C(F)(F)F 0.000
#7 Cc1[n-]n(-c2ccccn2)c(=O)c1[C]1(C(F)(F)F)[O][Ru+2]1 0.000
#7 Cc1[n-]n(-c2ccccn2)c(=O)c1[C]1(C(F)(F)F)[O][Ru+2]1 0.000
#7 Cc1[n-]n(-c2ccccn2)c(=O)c1[C]1(C(F)(F)F)[O][Ru+2]1 0.000
#7 Cc1[n-]n(-c2ccccn2)c(=O)c1[C]1(C(F)(F)F)[O][Ru+2]1 0.000
#7 Cc1[n-]n(-c2ccccn2)c(=O)c1[C]1(C(F)(F)F)[O][Ru+2]1 0.000
#7 Cc1[n-]n(-c2ccccn2)c(=O)c1[C]1(C(F)(F)F)[O][Ru+2]1 0.000
#7 Cc1[n-]n(-c2ccccn2)c(=O)c1[C]1(C(F)(F)F)[O][Ru+2]1 0.000
#7 Cc1[n-]n(-c2ccccn2)c(=O)c1[C]1(C(F)(F)F)[O][Ru+2]1 0.000
#7 Cc1[n-]n(-c2ccccn2)c(=O)c1[C]1(C(F)(F)F)[O][Ru+2]1 0.000
#8 Cc1[n-]n(-c2cccc[n]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#8 Cc1[n-]n(-c2cccc[n]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#8 Cc1[n-]n(-c2cccc[n]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#8 Cc1[n-]n(-c2cccc[n]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#8 Cc1[n-]n(-c2cccc[n]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#8 Cc1[n-]n(-c2cccc[n]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#8 Cc1[n-]n(-c2cccc[n]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#8 Cc1[n-]n(-c2cccc[n]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#8 Cc1[n-]n(-c2cccc[n]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#9 Cc1[n-]n(-c2ccccn2)c(=[O]->[Ru+2])c1C(=O)C(F)(F)F 0.000
#9 Cc1[n-]n(-c2ccccn2)c(=[O]->[Ru+2])c1C(=O)C(F)(F)F 0.000
#9 Cc1[n-]n(-c2ccccn2)c(=[O]->[Ru+2])c1C(=O)C(F)(F)F 0.000
#9 Cc1[n-]n(-c2ccccn2)c(=[O]->[Ru+2])c1C(=O)C(F)(F)F 0.000
#9 Cc1[n-]n(-c2ccccn2)c(=[O]->[Ru+2])c1C(=O)C(F)(F)F 0.000
#9 Cc1[n-]n(-c2ccccn2)c(=[O]->[Ru+2])c1C(=O)C(F)(F)F 0.000
#9 Cc1[n-]n(-c2ccccn2)c(=[O]->[Ru+2])c1C(=O)C(F)(F)F 0.000
#9 Cc1[n-]n(-c2ccccn2)c(=[O]->[Ru+2])c1C(=O)C(F)(F)F 0.000
#9 Cc1[n-]n(-c2ccccn2)c(=[O]->[Ru+2])c1C(=O)C(F)(F)F 0.000
#10 Cc1[n-]n(-c2ccccn2)c(=O)c1C(=[O]->[Ru+2])C(F)(F)F 0.000
#10 Cc1[n-]n(-c2ccccn2)c(=O)c1C(=[O]->[Ru+2])C(F)(F)F 0.000
#10 Cc1[n-]n(-c2ccccn2)c(=O)c1C(=[O]->[Ru+2])C(F)(F)F 0.000
#10 Cc1[n-]n(-c2ccccn2)c(=O)c1C(=[O]->[Ru+2])C(F)(F)F 0.000
#10 Cc1[n-]n(-c2ccccn2)c(=O)c1C(=[O]->[Ru+2])C(F)(F)F 0.000
#10 Cc1[n-]n(-c2ccccn2)c(=O)c1C(=[O]->[Ru+2])C(F)(F)F 0.000
#10 Cc1[n-]n(-c2ccccn2)c(=O)c1C(=[O]->[Ru+2])C(F)(F)F 0.000
#10 Cc1[n-]n(-c2ccccn2)c(=O)c1C(=[O]->[Ru+2])C(F)(F)F 0.000
#10 Cc1[n-]n(-c2ccccn2)c(=O)c1C(=[O]->[Ru+2])C(F)(F)F 0.000
#11 Cc1[n-]n(-c2ncc[cH]3->[Ru+2]<-[cH]23)c(=O)c1C(=O)C(F)(F)F 0.000
#11 Cc1[n-]n(-c2ncc[cH]3->[Ru+2]<-[cH]23)c(=O)c1C(=O)C(F)(F)F 0.000
#11 Cc1[n-]n(-c2ncc[cH]3->[Ru+2]<-[cH]23)c(=O)c1C(=O)C(F)(F)F 0.000
#11 Cc1[n-]n(-c2ncc[cH]3->[Ru+2]<-[cH]23)c(=O)c1C(=O)C(F)(F)F 0.000
#11 Cc1[n-]n(-c2ncc[cH]3->[Ru+2]<-[cH]23)c(=O)c1C(=O)C(F)(F)F 0.000
#11 Cc1[n-]n(-c2ncc[cH]3->[Ru+2]<-[cH]23)c(=O)c1C(=O)C(F)(F)F 0.000
#11 Cc1[n-]n(-c2ncc[cH]3->[Ru+2]<-[cH]23)c(=O)c1C(=O)C(F)(F)F 0.000
#11 Cc1[n-]n(-c2ncc[cH]3->[Ru+2]<-[cH]23)c(=O)c1C(=O)C(F)(F)F 0.000
#11 Cc1[n-]n(-c2ncc[cH]3->[Ru+2]<-[cH]23)c(=O)c1C(=O)C(F)(F)F 0.000
#12 Cc1[n-]n(-c2c[cH]3->[Ru+2]<-[cH]3cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#12 Cc1[n-]n(-c2c[cH]3->[Ru+2]<-[cH]3cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#12 Cc1[n-]n(-c2c[cH]3->[Ru+2]<-[cH]3cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#12 Cc1[n-]n(-c2c[cH]3->[Ru+2]<-[cH]3cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#12 Cc1[n-]n(-c2c[cH]3->[Ru+2]<-[cH]3cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#12 Cc1[n-]n(-c2c[cH]3->[Ru+2]<-[cH]3cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#12 Cc1[n-]n(-c2c[cH]3->[Ru+2]<-[cH]3cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#12 Cc1[n-]n(-c2c[cH]3->[Ru+2]<-[cH]3cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#12 Cc1[n-]n(-c2c[cH]3->[Ru+2]<-[cH]3cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#13 Cc1[n-]n(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)c(=O)c1C(=O)C(F)(F)F 0.000
#13 Cc1[n-]n(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)c(=O)c1C(=O)C(F)(F)F 0.000
#13 Cc1[n-]n(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)c(=O)c1C(=O)C(F)(F)F 0.000
#13 Cc1[n-]n(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)c(=O)c1C(=O)C(F)(F)F 0.000
#13 Cc1[n-]n(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)c(=O)c1C(=O)C(F)(F)F 0.000
#13 Cc1[n-]n(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)c(=O)c1C(=O)C(F)(F)F 0.000
#13 Cc1[n-]n(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)c(=O)c1C(=O)C(F)(F)F 0.000
#13 Cc1[n-]n(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)c(=O)c1C(=O)C(F)(F)F 0.000
#13 Cc1[n-]n(-c2nc[cH]3->[Ru+]4<-[cH]2[cH]->43)c(=O)c1C(=O)C(F)(F)F 0.000
#14 Cc1[n-]n(C2=C[CH]3[Ru+2][CH]3C=N2)c(=O)c1C(=O)C(F)(F)F 0.000
#14 Cc1[n-]n(C2=C[CH]3[Ru+2][CH]3C=N2)c(=O)c1C(=O)C(F)(F)F 0.000
#14 Cc1[n-]n(C2=C[CH]3[Ru+2][CH]3C=N2)c(=O)c1C(=O)C(F)(F)F 0.000
#14 Cc1[n-]n(C2=C[CH]3[Ru+2][CH]3C=N2)c(=O)c1C(=O)C(F)(F)F 0.000
#14 Cc1[n-]n(C2=C[CH]3[Ru+2][CH]3C=N2)c(=O)c1C(=O)C(F)(F)F 0.000
#14 Cc1[n-]n(C2=C[CH]3[Ru+2][CH]3C=N2)c(=O)c1C(=O)C(F)(F)F 0.000
#14 Cc1[n-]n(C2=C[CH]3[Ru+2][CH]3C=N2)c(=O)c1C(=O)C(F)(F)F 0.000
#14 Cc1[n-]n(C2=C[CH]3[Ru+2][CH]3C=N2)c(=O)c1C(=O)C(F)(F)F 0.000
#14 Cc1[n-]n(C2=C[CH]3[Ru+2][CH]3C=N2)c(=O)c1C(=O)C(F)(F)F 0.000
#15 Cc1[n-]n(-c2cc[cH](->[Ru+2])cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#15 Cc1[n-]n(-c2cc[cH](->[Ru+2])cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#15 Cc1[n-]n(-c2cc[cH](->[Ru+2])cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#15 Cc1[n-]n(-c2cc[cH](->[Ru+2])cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#15 Cc1[n-]n(-c2cc[cH](->[Ru+2])cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#15 Cc1[n-]n(-c2cc[cH](->[Ru+2])cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#15 Cc1[n-]n(-c2cc[cH](->[Ru+2])cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#15 Cc1[n-]n(-c2cc[cH](->[Ru+2])cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#15 Cc1[n-]n(-c2cc[cH](->[Ru+2])cn2)c(=O)c1C(=O)C(F)(F)F 0.000
#16 Cc1[n-]n(-c2nccc[cH]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#16 Cc1[n-]n(-c2nccc[cH]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#16 Cc1[n-]n(-c2nccc[cH]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#16 Cc1[n-]n(-c2nccc[cH]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#16 Cc1[n-]n(-c2nccc[cH]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#16 Cc1[n-]n(-c2nccc[cH]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#16 Cc1[n-]n(-c2nccc[cH]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#16 Cc1[n-]n(-c2nccc[cH]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#16 Cc1[n-]n(-c2nccc[cH]2->[Ru+2])c(=O)c1C(=O)C(F)(F)F 0.000
#17 Cc1[n-]n(-c2c[cH](->[Ru+2])ccn2)c(=O)c1C(=O)C(F)(F)F 0.000
#17 Cc1[n-]n(-c2c[cH](->[Ru+2])ccn2)c(=O)c1C(=O)C(F)(F)F 0.000
#17 Cc1[n-]n(-c2c[cH](->[Ru+2])ccn2)c(=O)c1C(=O)C(F)(F)F 0.000
#17 Cc1[n-]n(-c2c[cH](->[Ru+2])ccn2)c(=O)c1C(=O)C(F)(F)F 0.000
#17 Cc1[n-]n(-c2c[cH](->[Ru+2])ccn2)c(=O)c1C(=O)C(F)(F)F 0.000
#17 Cc1[n-]n(-c2c[cH](->[Ru+2])ccn2)c(=O)c1C(=O)C(F)(F)F 0.000
#17 Cc1[n-]n(-c2c[cH](->[Ru+2])ccn2)c(=O)c1C(=O)C(F)(F)F 0.000
#17 Cc1[n-]n(-c2c[cH](->[Ru+2])ccn2)c(=O)c1C(=O)C(F)(F)F 0.000
#17 Cc1[n-]n(-c2c[cH](->[Ru+2])ccn2)c(=O)c1C(=O)C(F)(F)F 0.000