0  B10R1.363  NC1(C(=O)O)CCCSC1 5096AB [1,0,0,0,0,0|1,0,0]=2
1  B10R1.363  NC1(C(=O)O)CCSCC1 2343AE [1,0,0,0,0,0|1,0,0]=2
2  B10R1.487  NCC1(CO)CCCCC1 0469AB [1,0,0,0,0,0|2,0,1]=4
3  B12R1.3098  O=C(O)C1(C(=O)O)CCCCC1 8963AC [0,1,0,0,0,0|2,0,0]=3
4  B10R0.133  CCCCC(N)(CC)C(=O)O 1471AJ [0,0,1,0,0,0|2,0,0]=3
5  B12R2.8  O=C1OCCC12CCNCC2 3189AH [0,0,0,1,0,0|2,0,0]=3
6  B12R1.3862  NCC1(CC(=O)O)CCCCC1 X5017 [0,0,0,0,0,1|2,0,0]=3
7  B9R0.13  CCCCC(CC)C(=O)[O-] O131 [1,0,1,0,0,0|1,0,1]=4
8  B9R0.13  CNC(CCCN)C(=O)O 0555AP [1,0,1,0,0,0|1,0,0]=3
9  B9R0.13  CN[C@@H](CCCN)C(=O)O Z5680 [1,0,1,0,0,0|1,0,0]=3
10  B9R0.47  C=CCCCC(N)C(=O)O 0772AA [1,0,1,0,0,0|0,0,2]=4
11  B9R0.47  NC(CCCC=O)C(=O)O Y1617 [1,0,1,0,0,0|1,0,1]=4
12  B9R1.6  N=C(N)C1CCCCC1 9639AJ [2,0,0,0,0,0|2,0,0]=4
13  B9R1.6  NC(=O)N1CCCCC1 0973AB [2,0,0,0,0,0|2,0,0]=4
14  B9R1.6  O=C(O)C1CCCCN1 3297AL [2,0,0,0,0,0|1,0,0]=3
15  B9R1.6  O=C(O)C1CCCCN1 6644AH [2,0,0,0,0,0|1,0,0]=3
16  B9R1.6  O=C(O)C1CNCCN1 V5196 [2,0,0,0,0,0|2,0,0]=4
17  B9R1.6  O=C(O)[C@H]1COCCN1 Z8033 [2,0,0,0,0,0|2,0,0]=4
18  B9R1.118  NCC1(N)CCCCC1 9516AH [2,0,0,0,0,0|1,0,1]=4
19  B13R2.22975  NC12CCC(C(=O)O)(CC1)CC2 X5549 [0,1,0,1,0,0|1,0,0]=3
20  B9R1.163  NC1(C(=O)O)CCCC1 Z5998 [1,0,0,0,1,0|0,0,0]=2