← сравнение complex #564 3D Viewer

Complex #564 — Ru(2)

GT: {"O": 1, "N": 3} · Δ = +0.00
{"O": 1, "N": 3}
Ground Truth
0.000
Single-lig
0.000
Sequential
+0.000
Δ Sequential
Single-ligand (v1) — 144 candidates
Pred: {"N": 1}
#2 Cn1cc[n](->[Ru+2])c1 1.000
#2 Cn1cc[n](->[Ru+2])c1 1.000
#2 Cn1cc[n](->[Ru+2])c1 1.000
#2 Cn1cc[n](->[Ru+2])c1 1.000
#2 Cn1cc[n](->[Ru+2])c1 1.000
#2 Cn1cc[n](->[Ru+2])c1 1.000
#2 Cn1cc[n](->[Ru+2])c1 1.000
#2 Cn1cc[n](->[Ru+2])c1 1.000
#2 Cn1cc[n](->[Ru+2])c1 1.000
#3 Cc1c2[O][Ru+]<-[S]=c2ccn1C 0.938
#3 Cc1c2[O][Ru+]<-[S]=c2ccn1C 0.938
#3 Cc1c2[O][Ru+]<-[S]=c2ccn1C 0.938
#3 Cc1c2[O][Ru+]<-[S]=c2ccn1C 0.938
#3 Cc1c2[O][Ru+]<-[S]=c2ccn1C 0.938
#3 Cc1c2[O][Ru+]<-[S]=c2ccn1C 0.938
#3 Cc1c2[O][Ru+]<-[S]=c2ccn1C 0.938
#3 Cc1c2[O][Ru+]<-[S]=c2ccn1C 0.938
#3 Cc1c2[O][Ru+]<-[S]=c2ccn1C 0.938
#4 CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62 0.318
#4 CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62 0.318
#4 CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62 0.318
#4 CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62 0.318
#4 CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62 0.318
#4 CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62 0.318
#4 CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62 0.318
#4 CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62 0.318
#4 CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62 0.318
#5 Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12 0.056
#5 Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12 0.056
#5 Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12 0.056
#5 Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12 0.056
#5 Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12 0.056
#5 Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12 0.056
#5 Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12 0.056
#5 Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12 0.056
#5 Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12 0.056
#6 Cc1c([O][Ru+])c(=S)ccn1C 0.009
#6 Cc1c([O][Ru+])c(=S)ccn1C 0.009
#6 Cc1c([O][Ru+])c(=S)ccn1C 0.009
#6 Cc1c([O][Ru+])c(=S)ccn1C 0.009
#6 Cc1c([O][Ru+])c(=S)ccn1C 0.009
#6 Cc1c([O][Ru+])c(=S)ccn1C 0.009
#6 Cc1c([O][Ru+])c(=S)ccn1C 0.009
#6 Cc1c([O][Ru+])c(=S)ccn1C 0.009
#6 Cc1c([O][Ru+])c(=S)ccn1C 0.009
#7 Cc1c([O][Ru+]<-[n]2ccn(C)c2)c(=S)ccn1C 0.004
#7 Cc1c([O][Ru+]<-[n]2ccn(C)c2)c(=S)ccn1C 0.004
#7 Cc1c([O][Ru+]<-[n]2ccn(C)c2)c(=S)ccn1C 0.004
#7 Cc1c([O][Ru+]<-[n]2ccn(C)c2)c(=S)ccn1C 0.004
#7 Cc1c([O][Ru+]<-[n]2ccn(C)c2)c(=S)ccn1C 0.004
#7 Cc1c([O][Ru+]<-[n]2ccn(C)c2)c(=S)ccn1C 0.004
#7 Cc1c([O][Ru+]<-[n]2ccn(C)c2)c(=S)ccn1C 0.004
#7 Cc1c([O][Ru+]<-[n]2ccn(C)c2)c(=S)ccn1C 0.004
#7 Cc1c([O][Ru+]<-[n]2ccn(C)c2)c(=S)ccn1C 0.004
#8 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]12)<-[n]1ccn(C)c1 0.003
#8 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]12)<-[n]1ccn(C)c1 0.003
#8 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]12)<-[n]1ccn(C)c1 0.003
#8 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]12)<-[n]1ccn(C)c1 0.003
#8 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]12)<-[n]1ccn(C)c1 0.003
#8 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]12)<-[n]1ccn(C)c1 0.003
#8 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]12)<-[n]1ccn(C)c1 0.003
#8 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]12)<-[n]1ccn(C)c1 0.003
#8 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]12)<-[n]1ccn(C)c1 0.003
#9 Cc1c([O-])c(=[S]->[Ru+2])ccn1C 0.001
#9 Cc1c([O-])c(=[S]->[Ru+2])ccn1C 0.001
#9 Cc1c([O-])c(=[S]->[Ru+2])ccn1C 0.001
#9 Cc1c([O-])c(=[S]->[Ru+2])ccn1C 0.001
#9 Cc1c([O-])c(=[S]->[Ru+2])ccn1C 0.001
#9 Cc1c([O-])c(=[S]->[Ru+2])ccn1C 0.001
#9 Cc1c([O-])c(=[S]->[Ru+2])ccn1C 0.001
#9 Cc1c([O-])c(=[S]->[Ru+2])ccn1C 0.001
#9 Cc1c([O-])c(=[S]->[Ru+2])ccn1C 0.001
#10 Cc1c2[O][Ru+]<-[cH](cn1C)c2=S 0.001
#10 Cc1c2[O][Ru+]<-[cH](cn1C)c2=S 0.001
#10 Cc1c2[O][Ru+]<-[cH](cn1C)c2=S 0.001
#10 Cc1c2[O][Ru+]<-[cH](cn1C)c2=S 0.001
#10 Cc1c2[O][Ru+]<-[cH](cn1C)c2=S 0.001
#10 Cc1c2[O][Ru+]<-[cH](cn1C)c2=S 0.001
#10 Cc1c2[O][Ru+]<-[cH](cn1C)c2=S 0.001
#10 Cc1c2[O][Ru+]<-[cH](cn1C)c2=S 0.001
#10 Cc1c2[O][Ru+]<-[cH](cn1C)c2=S 0.001
#11 Cc1ccc(C(C)C)[cH](->[Ru+][O]c2c(C)n(C)ccc2=S)c1 0.000
#11 Cc1ccc(C(C)C)[cH](->[Ru+][O]c2c(C)n(C)ccc2=S)c1 0.000
#11 Cc1ccc(C(C)C)[cH](->[Ru+][O]c2c(C)n(C)ccc2=S)c1 0.000
#11 Cc1ccc(C(C)C)[cH](->[Ru+][O]c2c(C)n(C)ccc2=S)c1 0.000
#11 Cc1ccc(C(C)C)[cH](->[Ru+][O]c2c(C)n(C)ccc2=S)c1 0.000
#11 Cc1ccc(C(C)C)[cH](->[Ru+][O]c2c(C)n(C)ccc2=S)c1 0.000
#11 Cc1ccc(C(C)C)[cH](->[Ru+][O]c2c(C)n(C)ccc2=S)c1 0.000
#11 Cc1ccc(C(C)C)[cH](->[Ru+][O]c2c(C)n(C)ccc2=S)c1 0.000
#11 Cc1ccc(C(C)C)[cH](->[Ru+][O]c2c(C)n(C)ccc2=S)c1 0.000
#12 Cc1ccc(C(C)C)c[cH]1->[Ru+][O]c1c(C)n(C)ccc1=S 0.000
#12 Cc1ccc(C(C)C)c[cH]1->[Ru+][O]c1c(C)n(C)ccc1=S 0.000
#12 Cc1ccc(C(C)C)c[cH]1->[Ru+][O]c1c(C)n(C)ccc1=S 0.000
#12 Cc1ccc(C(C)C)c[cH]1->[Ru+][O]c1c(C)n(C)ccc1=S 0.000
#12 Cc1ccc(C(C)C)c[cH]1->[Ru+][O]c1c(C)n(C)ccc1=S 0.000
#12 Cc1ccc(C(C)C)c[cH]1->[Ru+][O]c1c(C)n(C)ccc1=S 0.000
#12 Cc1ccc(C(C)C)c[cH]1->[Ru+][O]c1c(C)n(C)ccc1=S 0.000
#12 Cc1ccc(C(C)C)c[cH]1->[Ru+][O]c1c(C)n(C)ccc1=S 0.000
#12 Cc1ccc(C(C)C)c[cH]1->[Ru+][O]c1c(C)n(C)ccc1=S 0.000
#13 Cc1c([O-]->[Ru+2])c(=S)ccn1C 0.000
#13 Cc1c([O-]->[Ru+2])c(=S)ccn1C 0.000
#13 Cc1c([O-]->[Ru+2])c(=S)ccn1C 0.000
#13 Cc1c([O-]->[Ru+2])c(=S)ccn1C 0.000
#13 Cc1c([O-]->[Ru+2])c(=S)ccn1C 0.000
#13 Cc1c([O-]->[Ru+2])c(=S)ccn1C 0.000
#13 Cc1c([O-]->[Ru+2])c(=S)ccn1C 0.000
#13 Cc1c([O-]->[Ru+2])c(=S)ccn1C 0.000
#13 Cc1c([O-]->[Ru+2])c(=S)ccn1C 0.000
#14 Cc1ccc(C(C)C)[cH](->[Ru+2])c1 0.000
#14 Cc1ccc(C(C)C)[cH](->[Ru+2])c1 0.000
#14 Cc1ccc(C(C)C)[cH](->[Ru+2])c1 0.000
#14 Cc1ccc(C(C)C)[cH](->[Ru+2])c1 0.000
#14 Cc1ccc(C(C)C)[cH](->[Ru+2])c1 0.000
#14 Cc1ccc(C(C)C)[cH](->[Ru+2])c1 0.000
#14 Cc1ccc(C(C)C)[cH](->[Ru+2])c1 0.000
#14 Cc1ccc(C(C)C)[cH](->[Ru+2])c1 0.000
#14 Cc1ccc(C(C)C)[cH](->[Ru+2])c1 0.000
#15 Cc1ccc(C(C)C)c[cH]1->[Ru+2] 0.000
#15 Cc1ccc(C(C)C)c[cH]1->[Ru+2] 0.000
#15 Cc1ccc(C(C)C)c[cH]1->[Ru+2] 0.000
#15 Cc1ccc(C(C)C)c[cH]1->[Ru+2] 0.000
#15 Cc1ccc(C(C)C)c[cH]1->[Ru+2] 0.000
#15 Cc1ccc(C(C)C)c[cH]1->[Ru+2] 0.000
#15 Cc1ccc(C(C)C)c[cH]1->[Ru+2] 0.000
#15 Cc1ccc(C(C)C)c[cH]1->[Ru+2] 0.000
#15 Cc1ccc(C(C)C)c[cH]1->[Ru+2] 0.000
#16 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]3cn(C)c(C)c([O-])c3=S)<-[cH]12 0.000
#16 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]3cn(C)c(C)c([O-])c3=S)<-[cH]12 0.000
#16 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]3cn(C)c(C)c([O-])c3=S)<-[cH]12 0.000
#16 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]3cn(C)c(C)c([O-])c3=S)<-[cH]12 0.000
#16 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]3cn(C)c(C)c([O-])c3=S)<-[cH]12 0.000
#16 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]3cn(C)c(C)c([O-])c3=S)<-[cH]12 0.000
#16 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]3cn(C)c(C)c([O-])c3=S)<-[cH]12 0.000
#16 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]3cn(C)c(C)c([O-])c3=S)<-[cH]12 0.000
#16 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]3cn(C)c(C)c([O-])c3=S)<-[cH]12 0.000
#17 Cc1c([O-])c(=S)[cH](->[Ru+2])cn1C 0.000
#17 Cc1c([O-])c(=S)[cH](->[Ru+2])cn1C 0.000
#17 Cc1c([O-])c(=S)[cH](->[Ru+2])cn1C 0.000
#17 Cc1c([O-])c(=S)[cH](->[Ru+2])cn1C 0.000
#17 Cc1c([O-])c(=S)[cH](->[Ru+2])cn1C 0.000
#17 Cc1c([O-])c(=S)[cH](->[Ru+2])cn1C 0.000
#17 Cc1c([O-])c(=S)[cH](->[Ru+2])cn1C 0.000
#17 Cc1c([O-])c(=S)[cH](->[Ru+2])cn1C 0.000
#17 Cc1c([O-])c(=S)[cH](->[Ru+2])cn1C 0.000
Sequential multi-lig (v2) — 144 candidates
Pred: {"O": 3, "S": 3, "N": 1}
#2 Cn1cc[n](->[Ru+2])c1 1.000
#2 Cn1cc[n](->[Ru+2])c1 1.000
#2 Cn1cc[n](->[Ru+2])c1 1.000
#2 Cn1cc[n](->[Ru+2])c1 1.000
#2 Cn1cc[n](->[Ru+2])c1 1.000
#2 Cn1cc[n](->[Ru+2])c1 1.000
#2 Cn1cc[n](->[Ru+2])c1 1.000
#2 Cn1cc[n](->[Ru+2])c1 1.000
#2 Cn1cc[n](->[Ru+2])c1 1.000
#3 Cc1c2[O][Ru+]<-[S]=c2ccn1C 0.938
#3 Cc1c2[O][Ru+]<-[S]=c2ccn1C 0.938
#3 Cc1c2[O][Ru+]<-[S]=c2ccn1C 0.938
#3 Cc1c2[O][Ru+]<-[S]=c2ccn1C 0.938
#3 Cc1c2[O][Ru+]<-[S]=c2ccn1C 0.938
#3 Cc1c2[O][Ru+]<-[S]=c2ccn1C 0.938
#3 Cc1c2[O][Ru+]<-[S]=c2ccn1C 0.938
#3 Cc1c2[O][Ru+]<-[S]=c2ccn1C 0.938
#3 Cc1c2[O][Ru+]<-[S]=c2ccn1C 0.938
#4 CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62 0.318
#4 CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62 0.318
#4 CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62 0.318
#4 CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62 0.318
#4 CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62 0.318
#4 CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62 0.318
#4 CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62 0.318
#4 CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62 0.318
#4 CC(C)[c]12->[Ru+2]3456<-[cH]([cH]->31)[c]->4(C)[cH]->5[cH]->62 0.318
#5 Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12 0.056
#5 Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12 0.056
#5 Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12 0.056
#5 Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12 0.056
#5 Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12 0.056
#5 Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12 0.056
#5 Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12 0.056
#5 Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12 0.056
#5 Cc1ccc(C(C)C)[cH]2->[Ru+2]<-[cH]12 0.056
#6 Cc1c([O][Ru+])c(=S)ccn1C 0.009
#6 Cc1c([O][Ru+])c(=S)ccn1C 0.009
#6 Cc1c([O][Ru+])c(=S)ccn1C 0.009
#6 Cc1c([O][Ru+])c(=S)ccn1C 0.009
#6 Cc1c([O][Ru+])c(=S)ccn1C 0.009
#6 Cc1c([O][Ru+])c(=S)ccn1C 0.009
#6 Cc1c([O][Ru+])c(=S)ccn1C 0.009
#6 Cc1c([O][Ru+])c(=S)ccn1C 0.009
#6 Cc1c([O][Ru+])c(=S)ccn1C 0.009
#7 Cc1c([O][Ru+]<-[n]2ccn(C)c2)c(=S)ccn1C 0.004
#7 Cc1c([O][Ru+]<-[n]2ccn(C)c2)c(=S)ccn1C 0.004
#7 Cc1c([O][Ru+]<-[n]2ccn(C)c2)c(=S)ccn1C 0.004
#7 Cc1c([O][Ru+]<-[n]2ccn(C)c2)c(=S)ccn1C 0.004
#7 Cc1c([O][Ru+]<-[n]2ccn(C)c2)c(=S)ccn1C 0.004
#7 Cc1c([O][Ru+]<-[n]2ccn(C)c2)c(=S)ccn1C 0.004
#7 Cc1c([O][Ru+]<-[n]2ccn(C)c2)c(=S)ccn1C 0.004
#7 Cc1c([O][Ru+]<-[n]2ccn(C)c2)c(=S)ccn1C 0.004
#7 Cc1c([O][Ru+]<-[n]2ccn(C)c2)c(=S)ccn1C 0.004
#8 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]12)<-[n]1ccn(C)c1 0.003
#8 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]12)<-[n]1ccn(C)c1 0.003
#8 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]12)<-[n]1ccn(C)c1 0.003
#8 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]12)<-[n]1ccn(C)c1 0.003
#8 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]12)<-[n]1ccn(C)c1 0.003
#8 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]12)<-[n]1ccn(C)c1 0.003
#8 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]12)<-[n]1ccn(C)c1 0.003
#8 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]12)<-[n]1ccn(C)c1 0.003
#8 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]12)<-[n]1ccn(C)c1 0.003
#9 Cc1c([O-])c(=[S]->[Ru+2])ccn1C 0.001
#9 Cc1c([O-])c(=[S]->[Ru+2])ccn1C 0.001
#9 Cc1c([O-])c(=[S]->[Ru+2])ccn1C 0.001
#9 Cc1c([O-])c(=[S]->[Ru+2])ccn1C 0.001
#9 Cc1c([O-])c(=[S]->[Ru+2])ccn1C 0.001
#9 Cc1c([O-])c(=[S]->[Ru+2])ccn1C 0.001
#9 Cc1c([O-])c(=[S]->[Ru+2])ccn1C 0.001
#9 Cc1c([O-])c(=[S]->[Ru+2])ccn1C 0.001
#9 Cc1c([O-])c(=[S]->[Ru+2])ccn1C 0.001
#10 Cc1c2[O][Ru+]<-[cH](cn1C)c2=S 0.001
#10 Cc1c2[O][Ru+]<-[cH](cn1C)c2=S 0.001
#10 Cc1c2[O][Ru+]<-[cH](cn1C)c2=S 0.001
#10 Cc1c2[O][Ru+]<-[cH](cn1C)c2=S 0.001
#10 Cc1c2[O][Ru+]<-[cH](cn1C)c2=S 0.001
#10 Cc1c2[O][Ru+]<-[cH](cn1C)c2=S 0.001
#10 Cc1c2[O][Ru+]<-[cH](cn1C)c2=S 0.001
#10 Cc1c2[O][Ru+]<-[cH](cn1C)c2=S 0.001
#10 Cc1c2[O][Ru+]<-[cH](cn1C)c2=S 0.001
#11 Cc1ccc(C(C)C)[cH](->[Ru+][O]c2c(C)n(C)ccc2=S)c1 0.000
#11 Cc1ccc(C(C)C)[cH](->[Ru+][O]c2c(C)n(C)ccc2=S)c1 0.000
#11 Cc1ccc(C(C)C)[cH](->[Ru+][O]c2c(C)n(C)ccc2=S)c1 0.000
#11 Cc1ccc(C(C)C)[cH](->[Ru+][O]c2c(C)n(C)ccc2=S)c1 0.000
#11 Cc1ccc(C(C)C)[cH](->[Ru+][O]c2c(C)n(C)ccc2=S)c1 0.000
#11 Cc1ccc(C(C)C)[cH](->[Ru+][O]c2c(C)n(C)ccc2=S)c1 0.000
#11 Cc1ccc(C(C)C)[cH](->[Ru+][O]c2c(C)n(C)ccc2=S)c1 0.000
#11 Cc1ccc(C(C)C)[cH](->[Ru+][O]c2c(C)n(C)ccc2=S)c1 0.000
#11 Cc1ccc(C(C)C)[cH](->[Ru+][O]c2c(C)n(C)ccc2=S)c1 0.000
#12 Cc1ccc(C(C)C)c[cH]1->[Ru+][O]c1c(C)n(C)ccc1=S 0.000
#12 Cc1ccc(C(C)C)c[cH]1->[Ru+][O]c1c(C)n(C)ccc1=S 0.000
#12 Cc1ccc(C(C)C)c[cH]1->[Ru+][O]c1c(C)n(C)ccc1=S 0.000
#12 Cc1ccc(C(C)C)c[cH]1->[Ru+][O]c1c(C)n(C)ccc1=S 0.000
#12 Cc1ccc(C(C)C)c[cH]1->[Ru+][O]c1c(C)n(C)ccc1=S 0.000
#12 Cc1ccc(C(C)C)c[cH]1->[Ru+][O]c1c(C)n(C)ccc1=S 0.000
#12 Cc1ccc(C(C)C)c[cH]1->[Ru+][O]c1c(C)n(C)ccc1=S 0.000
#12 Cc1ccc(C(C)C)c[cH]1->[Ru+][O]c1c(C)n(C)ccc1=S 0.000
#12 Cc1ccc(C(C)C)c[cH]1->[Ru+][O]c1c(C)n(C)ccc1=S 0.000
#13 Cc1c([O-]->[Ru+2])c(=S)ccn1C 0.000
#13 Cc1c([O-]->[Ru+2])c(=S)ccn1C 0.000
#13 Cc1c([O-]->[Ru+2])c(=S)ccn1C 0.000
#13 Cc1c([O-]->[Ru+2])c(=S)ccn1C 0.000
#13 Cc1c([O-]->[Ru+2])c(=S)ccn1C 0.000
#13 Cc1c([O-]->[Ru+2])c(=S)ccn1C 0.000
#13 Cc1c([O-]->[Ru+2])c(=S)ccn1C 0.000
#13 Cc1c([O-]->[Ru+2])c(=S)ccn1C 0.000
#13 Cc1c([O-]->[Ru+2])c(=S)ccn1C 0.000
#14 Cc1ccc(C(C)C)[cH](->[Ru+2])c1 0.000
#14 Cc1ccc(C(C)C)[cH](->[Ru+2])c1 0.000
#14 Cc1ccc(C(C)C)[cH](->[Ru+2])c1 0.000
#14 Cc1ccc(C(C)C)[cH](->[Ru+2])c1 0.000
#14 Cc1ccc(C(C)C)[cH](->[Ru+2])c1 0.000
#14 Cc1ccc(C(C)C)[cH](->[Ru+2])c1 0.000
#14 Cc1ccc(C(C)C)[cH](->[Ru+2])c1 0.000
#14 Cc1ccc(C(C)C)[cH](->[Ru+2])c1 0.000
#14 Cc1ccc(C(C)C)[cH](->[Ru+2])c1 0.000
#15 Cc1ccc(C(C)C)c[cH]1->[Ru+2] 0.000
#15 Cc1ccc(C(C)C)c[cH]1->[Ru+2] 0.000
#15 Cc1ccc(C(C)C)c[cH]1->[Ru+2] 0.000
#15 Cc1ccc(C(C)C)c[cH]1->[Ru+2] 0.000
#15 Cc1ccc(C(C)C)c[cH]1->[Ru+2] 0.000
#15 Cc1ccc(C(C)C)c[cH]1->[Ru+2] 0.000
#15 Cc1ccc(C(C)C)c[cH]1->[Ru+2] 0.000
#15 Cc1ccc(C(C)C)c[cH]1->[Ru+2] 0.000
#15 Cc1ccc(C(C)C)c[cH]1->[Ru+2] 0.000
#16 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]3cn(C)c(C)c([O-])c3=S)<-[cH]12 0.000
#16 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]3cn(C)c(C)c([O-])c3=S)<-[cH]12 0.000
#16 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]3cn(C)c(C)c([O-])c3=S)<-[cH]12 0.000
#16 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]3cn(C)c(C)c([O-])c3=S)<-[cH]12 0.000
#16 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]3cn(C)c(C)c([O-])c3=S)<-[cH]12 0.000
#16 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]3cn(C)c(C)c([O-])c3=S)<-[cH]12 0.000
#16 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]3cn(C)c(C)c([O-])c3=S)<-[cH]12 0.000
#16 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]3cn(C)c(C)c([O-])c3=S)<-[cH]12 0.000
#16 Cc1ccc(C(C)C)[cH]2->[Ru+2](<-[cH]3cn(C)c(C)c([O-])c3=S)<-[cH]12 0.000
#17 Cc1c([O-])c(=S)[cH](->[Ru+2])cn1C 0.000
#17 Cc1c([O-])c(=S)[cH](->[Ru+2])cn1C 0.000
#17 Cc1c([O-])c(=S)[cH](->[Ru+2])cn1C 0.000
#17 Cc1c([O-])c(=S)[cH](->[Ru+2])cn1C 0.000
#17 Cc1c([O-])c(=S)[cH](->[Ru+2])cn1C 0.000
#17 Cc1c([O-])c(=S)[cH](->[Ru+2])cn1C 0.000
#17 Cc1c([O-])c(=S)[cH](->[Ru+2])cn1C 0.000
#17 Cc1c([O-])c(=S)[cH](->[Ru+2])cn1C 0.000
#17 Cc1c([O-])c(=S)[cH](->[Ru+2])cn1C 0.000