0  B8R0.8  C#CCC[C@@H](N)C(=O)O BICR101 [0,0,0,0,0,0|2,0,2]=4
1  B8R0.8  C#CCC[C@H](N)C(=O)O BICR103 [0,0,0,0,0,0|2,0,2]=4
2  B8R0.8  CSCC[C@H](N)C(=O)O BIM0715 [0,0,0,0,0,0|3,0,1]=4
3  B8R0.8  C[Se]CC[C@H](N)C(=O)O BIS0110 [0,0,0,0,0,0|3,0,1]=4
4  B8R0.8  NCCC[C@H](N)C(=O)O BIO1005 [0,0,0,0,0,0|1,0,1]=2
5  B7R0.5  N[C@@H](CCS)C(=O)O BIB6065 [1,0,0,0,0,0|2,0,1]=4
6  B9R0.7  NC(=O)CC[C@H](N)C(=O)O BIG0708 [0,1,0,0,0,0|1,0,2]=4
7  B9R0.7  O=C(O)CCC(=O)C(=O)[O-] BIK8011 [0,1,0,0,0,0|1,0,2]=4
8  B9R0.47  C#CCCC[C@@H](N)C(=O)O BICR120 [0,1,0,0,0,0|2,0,1]=4
9  B9R0.47  C#CCCC[C@H](N)C(=O)O BICR115 [0,1,0,0,0,0|2,0,1]=4
10  B9R0.47  NCCCC[C@H](N)C(=O)O BIL0713 [0,1,0,0,0,0|1,0,1]=3
11  B9R0.47  NCCCC[C@H](N)C(=O)O BIL0714 [0,1,0,0,0,0|1,0,1]=3
12  B9R1.6  O=C(O)C1CCCCN1 BIP0698 [0,0,0,1,0,0|2,0,1]=4
13  B9R1.163  NC1(C(=O)O)CCCC1 BIA1472 [0,0,0,1,0,0|2,0,1]=4
14  B6R0.3  CCC(=O)C(=O)[O-] BIK8008 [2,0,0,0,0,0|0,0,1]=3
15  B8R0.2  CC[C@H](C)[C@H](N)C(=O)O BII0711 [1,1,0,0,0,0|1,0,1]=4
16  B8R0.23  CC(C)C[C@@H](N)C(=O)O BIL0710 [1,1,0,0,0,0|1,0,1]=4
17  B8R0.23  CC(C)C[C@H](N)C(=O)O BIL0712 [1,1,0,0,0,0|1,0,1]=4
18  B8R0.23  O=C(O)CC(=O)C(=O)O BIO0513 [1,1,0,0,0,0|1,0,1]=4
19  B8R1.7  O=C(O)[C@@H]1CCCN1 BIP0717 [1,0,0,1,0,0|0,0,1]=3
20  B8R1.7  O=C(O)[C@H]1CCCN1 BIA0718 [1,0,0,1,0,0|0,0,1]=3