0  B7R1.2  CC1COC(=O)N1 4H56-1-0P2 [0,0,0,0,0,0|3,0,1]=4
1  B7R1.2  NC1CNC(=O)C1 4H48-1-6A [0,0,0,0,0,0|3,0,1]=4
2  B7R1.2  N[C@@H]1CNC(=O)C1 4H48-5-S0 [0,0,0,0,0,0|3,0,1]=4
3  B6R1.2  ClC1=CC=CO1 2H10-5-0M [1,0,0,0,0,0|1,0,2]=4
4  B6R1.2  IC1=NC=CO1 4H56-H-42 [1,0,0,0,0,0|2,0,1]=4
5  B6R1.2  O=C1CCNN1 4H48-5-FV [1,0,0,0,0,0|2,0,0]=3
6  B8R1.1  NC[C@@H]1CCC(=O)N1 4H48-1-S0 [0,1,0,0,0,0|2,0,1]=4
7  B8R1.18  C[C@@H]1NC(=O)OC1=O 4H56-1-S0C [0,1,0,0,0,0|1,0,0]=2
8  B8R1.51  O=C1CCS(=O)(=O)C1 6H63-1-09 [0,1,0,0,0,0|2,0,0]=3
9  B6R0.2  CC(=O)OC(C)Cl 2123-5-21 [0,0,1,0,0,0|1,0,1]=3
10  B6R1.5  CN1CC(=O)C1 4H17-5-2E [0,0,0,0,1,0|3,0,0]=4
11  B6R1.5  O=C1CC(Br)C1 2217-9-03 [0,0,0,0,1,0|2,0,1]=4
12  B6R1.5  O=C1CC(F)C1 2217-3-0D [0,0,0,0,1,0|2,0,1]=4
13  B6R1.5  O=C1CC(O)C1 2220-1-00 [0,0,0,0,1,0|1,0,2]=4
14  B8R1.3  N[C@H]1CCC(=O)NC1 4H48-5-SH [0,0,0,0,0,1|2,0,1]=4
15  B8R1.3  O=C1CCC(Br)CC1 2217-9-01 [0,0,0,0,0,1|2,0,1]=4
16  B8R1.3  O=C1CCC(F)CC1 2217-3-06 [0,0,0,0,0,1|2,0,1]=4
17  B8R1.4  O=C1CCCC(Br)C1 2217-9-0B [0,0,0,0,0,1|2,0,1]=4
18  B8R1.4  O=C1CCCC(Cl)C1 2217-5-08 [0,0,0,0,0,1|2,0,1]=4
19  B8R1.4  O=C1CSCC(=O)C1 6H18-1-01 [0,0,0,0,0,1|1,0,0]=2
20  B5R0.1  NCCC(N)=O 4148-5-0C [1,0,1,0,0,0|2,0,0]=4
21  B5R0.1  O=C(O)\C=C\Br 2321-9-E0 [1,0,1,0,0,0|1,0,1]=4
22  B7R0.2  O=C(O)CC(=O)CCl 2129-5-0F [0,1,1,0,0,0|2,0,0]=4
23  B7R0.4  O=C(O)CCCCO 2120-1-00 [0,1,1,0,0,0|0,0,2]=4
24  B7R1.4  O=C1CCCC1Br 2215-9-00 [1,1,0,0,0,0|1,0,1]=4
25  B7R1.4  O=C1OCC[C@@H]1O 2H29-1-S0 [1,1,0,0,0,0|0,0,1]=3
26  B7R1.8  O=C1CCC1CO 2220-1-06 [0,1,0,0,1,0|0,0,2]=4
27  B7R1.17  CC1(C)CCC1=O 2217-1-0L [0,1,0,0,1,0|1,0,1]=4
28  B9R1.2  CSC1=NC(=O)CCN1 8H66-1-8S [0,1,0,0,0,1|1,1,0]=4
29  B9R1.35  O=C1CCC(C(=O)Cl)N1 4H48-5-DJ [0,2,0,0,0,0|1,0,1]=4
30  B9R1.35  O=C1CC[C@@H](C(=O)O)C1 2229-1-R2 [0,2,0,0,0,0|1,0,1]=4
31  B9R1.35  O=C1CC[C@H](C(=O)O)C1 2229-1-S2 [0,2,0,0,0,0|1,0,1]=4
32  B7R1.18  O=C(O)C1CCO1 2H21-1-68 [0,0,1,1,0,0|0,0,2]=4
33  B7R1.18  O=C(O)C1CSC1 6H66-1-63 [0,0,1,1,0,0|2,0,0]=4