0  B19R2.1022145  CC(C)NCC(O)COc1cccc2C=CCc12 Amb22167592 [0,0,0,0,0,0|1,0,1]=2
1  B19R2.1022145  CC(C)NCC(O)COc1cccc2CCCc12 Amb24063880 [0,0,0,0,0,0|1,0,2]=3
2  B19R2.1022145  CC(C)NCC(O)COc1cccc2CCNc21 Amb24082157 [0,0,0,0,0,0|2,0,1]=3
3  B19R2.1022145  CC(C)NCC(O)COc1cccc2ccoc21 Amb24064467 [0,0,0,0,0,0|2,0,0]=2
4  B19R2.1022145  CC(C)NC[C@H](O)COc1cccc2[nH]ccc12 Amb22350168 [0,0,0,0,0,0|0,0,0]=0
5  B20R2.152960  Cc1cc2c(cccc2OCC(O)CNC(C)C)[nH]1 Amb22055675 [0,1,0,0,0,0|0,0,0]=1
6  B18R1.4935  CC(C)NCC(C)COc1ccccc1CC=C Amb23952246 [0,0,1,0,0,0|2,0,1]=4
7  B18R1.4935  CC(C)NCC(O)COc1ccccc1CC=C Amb22049840 [0,0,1,0,0,0|1,0,1]=3
8  B18R1.23137  CC(C)NCC(O)COc1cc(COC)ccc1 Amb23978315 [0,0,1,0,0,0|2,0,1]=4
9  B18R2.560567  CC(NC(=O)CCc1cccc2c1cc[nH]2)C Amb16283048 [0,0,0,0,1,0|1,0,2]=4
10  B20R2.10963774  CC(C)NC[C@@H](O)COc1cccc2ccccc12 Amb23437866 [0,0,0,0,0,1|1,0,0]=2
11  B17R1.1421  CC(C)NCC(O)COc1ccccc1SC Amb22731002 [1,0,1,0,0,0|1,0,1]=4
12  B17R1.1421  CC(C)NC[C@@H](O)COc1ccccc1OC Amb22746427 [1,0,1,0,0,0|1,0,1]=4
13  B17R1.1421  COc1ccccc1OCC(O)CNC(C)C Amb17760690 [1,0,1,0,0,0|1,0,1]=4
14  B17R1.28454  CC(C)NCC(O)COc1cccc(c1)C#N Amb24085698 [1,0,1,0,0,0|1,0,1]=4
15  B19R1.10443  C=CCOc1ccccc1OCC(CNC(C)C)O Amb17619037 [0,1,1,0,0,0|1,0,1]=4
16  B19R2.234411  CN(CCNCc1cccc2[nH]ccc12)C(C)C Amb24801916 [1,1,0,0,0,0|2,0,0]=4
17  B19R2.1115713  CC(C)CC(CO)NCc1cccc2[nH]ccc21 Amb24801907 [0,1,0,0,1,0|2,0,0]=4
18  B21R2.210872  CC(C)NCC(O)COC1=CC(=O)Oc2ccccc12 Amb21997879 [0,1,0,0,0,1|2,0,0]=4
19  B21R2.3237171  OC(COc1cccc2c1cc(O)cc2)CNC(C)C Amb17615794 [0,1,0,0,0,1|1,0,0]=3
20  B21R2.4389558  OC(COc1cccc2c1cccc2O)CNC(C)C Amb17615788 [0,1,0,0,0,1|1,0,0]=3
21  B21R2.4494802  CC(C)NC[C@@H](O)COc1ccc(O)c2ccccc21 Amb24100970 [0,1,0,0,0,1|1,0,0]=3
22  B21R2.4494802  O[C@@H](COc1ccc(c2c1cccc2)O)CNC(C)C Amb17615784 [0,1,0,0,0,1|1,0,0]=3
23  B21R2.221517  CC(C)(C)NCC(O)COc1cccc2NC(=O)Nc21 Amb22352450 [0,2,0,0,0,0|1,0,0]=3
24  B21R2.221517  OC(COc1cccc2c1cc([nH]2)C)CNC(C)(C)C Amb2412921 [0,2,0,0,0,0|0,0,0]=2
25  B21R2.457419  CC(C)NCC(O)COc1cccc2cc(CC)oc21 Amb24080328 [0,2,0,0,0,0|2,0,0]=4
26  B21R2.14121573  OC(COc1cccc2c1c(C)c[nH]2)CNC(C)(C)C Amb10809092 [0,2,0,0,0,0|0,0,0]=2
27  B19R2.199  CC(C)NCC(O)COc1c[s]c2ccccc12 Amb24064471 [0,0,1,1,0,0|2,0,0]=4
28  B19R3.19245  C1C=Cc2cccc(OCC3CNCCO3)c21 Amb18661158 [1,0,0,1,0,0|1,0,1]=4
29  B19R3.19245  C1C=Cc2cccc(OCC3CNCCO3)c21 Amb22167560 [1,0,0,1,0,0|1,0,1]=4
30  B19R3.19245  C1C=Cc2cccc(OC[C@@H]3CNCCO3)c21 Amb24083799 [1,0,0,1,0,0|1,0,1]=4
31  B17R2.44757  CC(CCNCc1cccc2c1cc[nH]2)C Amb2182644 [1,0,0,0,1,0|2,0,0]=4
32  B19R2.164105  CC(C)OCCCNCc1cccc2[nH]ccc12 Amb24801908 [1,0,0,0,0,1|2,0,0]=4
33  B19R2.6063385  CN(C)CC(O)COc1cccc2ccccc21 Amb21876033 [0,0,0,0,1,1|2,0,0]=4