0  B27R3.173497075  c1cc(c(cc1Cl)Cl)COC(Cn2ccnc2)c3ccc(cc3Cl)Cl CHEBI:82892 [0,0,0,0,0,0|0,0,0]=0
1  B27R3.173497075  c1cc(c(cc1Cl)Cl)CO[C@@H](Cn2ccnc2)c3ccc(cc3Cl)Cl CHEBI:82886 [0,0,0,0,0,0|0,0,0]=0
2  B27R3.173497075  c1cc(c(cc1Cl)Cl)CO[C@@H](Cn2ccnc2)c3ccc(cc3Cl)Cl CHEBI:82894 [0,0,0,0,0,0|0,0,0]=0
3  B27R3.173497075  c1cc(c(cc1Cl)Cl)CO[C@H](Cn2ccnc2)c3ccc(cc3Cl)Cl CHEBI:82888 [0,0,0,0,0,0|0,0,0]=0
4  B27R3.173497075  c1cc(c(cc1Cl)Cl)CO[C@H](Cn2ccnc2)c3ccc(cc3Cl)Cl CHEBI:82897 [0,0,0,0,0,0|0,0,0]=0
5  B26R3.53803127  c1cc(ccc1COC(Cn2ccnc2)c3ccc(cc3Cl)Cl)Cl CHEBI:82873 [1,0,0,0,0,0|0,0,0]=1
6  B26R3.53803127  c1cc(ccc1CO[C@@H](Cn2ccnc2)c3ccc(cc3Cl)Cl)Cl CHEBI:82870 [1,0,0,0,0,0|0,0,0]=1
7  B26R3.53803127  c1cc(ccc1CO[C@@H](Cn2ccnc2)c3ccc(cc3Cl)Cl)Cl CHEBI:82877 [1,0,0,0,0,0|0,0,0]=1
8  B26R3.53803127  c1cc(ccc1CO[C@H](Cn2ccnc2)c3ccc(cc3Cl)Cl)Cl CHEBI:82871 [1,0,0,0,0,0|0,0,0]=1
9  B26R3.53803127  c1cc(ccc1CO[C@H](Cn2ccnc2)c3ccc(cc3Cl)Cl)Cl CHEBI:82872 [1,0,0,0,0,0|0,0,0]=1
10  B26R3.53803127  c1cc(ccc1CSC(Cn2ccnc2)c3ccc(cc3Cl)Cl)Cl CHEBI:77776 [1,0,0,0,0,0|0,1,0]=2
11  B28R3.255671332  c1cc(c(cc1Cl)Cl)CO\N=C(/Cn2cc[nH+]c2)\c3ccc(cc3Cl)Cl CHEBI:77698 [0,0,0,0,0,1|0,0,2]=3
12  B28R3.255671332  c1cc(c(cc1Cl)Cl)CO\N=C(/Cn2ccnc2)\c3ccc(cc3Cl)Cl CHEBI:7825 [0,0,0,0,0,1|0,0,1]=2
13  B28R3.255671332  c1cc(c(cc1Cl)Cl)CO\N=C(/Cn2ccnc2)\c3ccc(cc3Cl)Cl CHEBI:7826 [0,0,0,0,0,1|0,0,1]=2
14  B27R3.172865222  c1cc(c(c(c1)Cl)COC(Cn2ccnc2)c3ccc(cc3Cl)Cl)Cl CHEBI:83667 [1,1,0,0,0,0|0,0,0]=2
15  B27R3.172865222  c1cc(c(c(c1)Cl)CO[C@@H](Cn2ccnc2)c3ccc(cc3Cl)Cl)Cl CHEBI:83666 [1,1,0,0,0,0|0,0,0]=2
16  B27R3.172865222  c1cc(c(c(c1)Cl)CO[C@@H](Cn2ccnc2)c3ccc(cc3Cl)Cl)Cl CHEBI:83669 [1,1,0,0,0,0|0,0,0]=2
17  B27R3.172865222  c1cc(c(c(c1)Cl)CO[C@@H](Cn2ccnc2)c3ccc(cc3Cl)Cl)Cl CHEBI:83674 [1,1,0,0,0,0|0,0,0]=2
18  B27R3.172865222  c1cc(c(c(c1)Cl)CO[C@H](Cn2ccnc2)c3ccc(cc3Cl)Cl)Cl CHEBI:83668 [1,1,0,0,0,0|0,0,0]=2
19  B27R3.172865222  c1cc(c(c(c1)Cl)CO[C@H](Cn2ccnc2)c3ccc(cc3Cl)Cl)Cl CHEBI:83671 [1,1,0,0,0,0|0,0,0]=2
20  B27R3.172865222  c1cc(c(c(c1)Cl)CO[C@H](Cn2ccnc2)c3ccc(cc3Cl)Cl)Cl CHEBI:83673 [1,1,0,0,0,0|0,0,0]=2
21  B25R3.14498788  c1cc(c(cc1Cl)Cl)C(Cn2ccnc2)OCc3ccsc3Cl CHEBI:77898 [1,0,0,0,1,0|1,0,0]=3
22  B25R3.14498788  c1cc(c(cc1Cl)Cl)[C@@H](Cn2ccnc2)OCc3ccsc3Cl CHEBI:77903 [1,0,0,0,1,0|1,0,0]=3
23  B25R3.14498788  c1cc(c(cc1Cl)Cl)[C@H](Cn2ccnc2)OCc3ccsc3Cl CHEBI:77905 [1,0,0,0,1,0|1,0,0]=3