0  B7R1.3  CC1CCNCC1 RL-2003 [0,0,0,0,0,0|2,0,1]=3
1  B6R1.1  C1CCNCC1 SOL-010 [1,0,0,0,0,0|1,0,0]=2
2  B6R0.1  CCOC(=O)CN HAA6590 [0,0,1,0,0,0|2,0,0]=3
3  B6R0.1  CNCC(=O)OC HAA7240 [0,0,1,0,0,0|2,0,0]=3
4  B6R0.1  COC(=O)CCN HAA5560 [0,0,1,0,0,0|2,0,0]=3
5  B6R0.4  C(CC(=O)O)CN HAA1061 [0,0,1,0,0,0|2,0,0]=3
6  B6R0.6  C(CCN)CCO FAL1003 [0,0,1,0,0,0|1,0,2]=4
7  B5R0.1  C(CN)C(=O)N HAA5550 [1,0,1,0,0,0|2,0,0]=4
8  B5R0.1  C(CN)C(=O)O HAA1003 [1,0,1,0,0,0|2,0,0]=4
9  B5R0.1  C(CS)C(=O)O RL-1000 [1,0,1,0,0,0|2,0,0]=4
10  B5R0.1  CNCC(=O)N HAA1581 [1,0,1,0,0,0|2,0,0]=4
11  B5R0.1  CNCC(=O)O HAA1192 [1,0,1,0,0,0|2,0,0]=4
12  B5R0.2  C(CCN)CN HNN1070 [1,0,1,0,0,0|2,0,0]=4
13  B5R0.2  C(CCN)CN HNN1080 [1,0,1,0,0,0|2,0,0]=4
14  B5R0.3  CNC(=O)CN HAA6580 [1,0,1,0,0,0|2,0,0]=4
15  B5R0.3  COC(=O)CN HAA5530 [1,0,1,0,0,0|2,0,0]=4
16  B7R0.5  CCOC(=O)[C@H](C)N HAA5630 [0,1,1,0,0,0|1,0,0]=3
17  B7R0.10  COC(=O)[C@@H](CO)N HAA6540 [0,1,1,0,0,0|2,0,0]=4
18  B7R0.10  COC(=O)[C@H](CO)N HAA7210 [0,1,1,0,0,0|2,0,0]=4
19  B7R1.4  C1COC(=O)[C@@H]1N HAA1538 [0,1,0,0,1,0|1,0,0]=3
20  B7R1.4  C1COC(=O)[C@H]1N HAA1543 [0,1,0,0,1,0|1,0,0]=3
21  B7R1.4  C1[C@@H](C(=O)NO1)N HAA1519 [0,1,0,0,1,0|2,0,0]=4
22  B7R1.4  CN1CCCC1=O SOL-009 [0,1,0,0,1,0|1,0,0]=3
23  B9R1.6  C1CCN[C@@H](C1)C(=O)O HAA1124 [0,2,0,0,0,0|1,0,1]=4
24  B9R1.6  C1CCN[C@H](C1)C(=O)O HAA6470 [0,2,0,0,0,0|1,0,1]=4