0  B7R0.6  CC(=O)NCC(=O)O BIA1745 [0,0,0,0,0,0|2,0,1]=3
1  B7R0.6  CN(C)CCN(C)C BIT7140 [0,0,0,0,0,0|4,0,0]=4
2  B7R0.6  CN(C)CCN(C)C BIT7141 [0,0,0,0,0,0|4,0,0]=4
3  B7R0.6  O=C(O)CCC(=O)O BI225 [0,0,0,0,0,0|2,0,1]=3
4  B8R0.9  NCC(=O)NCC(=O)O BIG0603 [0,1,0,0,0,0|2,0,1]=4
5  B8R0.9  NCC(=O)NCC(=O)O BIG5066 [0,1,0,0,0,0|2,0,1]=4
6  B8R0.23  CC(=O)N[C@@H](C)C(=O)O BIA1219 [0,1,0,0,0,0|2,0,1]=4
7  B8R0.23  CC(=O)N[C@H](C)C(=O)O BIA1217 [0,1,0,0,0,0|2,0,1]=4
8  B8R0.23  CC(C)C[C@@H](N)C(=O)O BIL0710 [0,1,0,0,0,0|0,0,0]=1
9  B8R0.23  CC(C)C[C@H](N)C(=O)O BIL0712 [0,1,0,0,0,0|0,0,0]=1
10  B8R0.23  NC(=O)CC(N)C(=O)O BIB6283 [0,1,0,0,0,0|2,0,1]=4
11  B8R0.23  NC(=O)C[C@H](N)C(=O)O BIA0725 [0,1,0,0,0,0|2,0,1]=4
12  B8R0.23  N[C@@H](CC(=O)O)C(=O)O BIA0705 [0,1,0,0,0,0|2,0,1]=4
13  B8R0.23  N[C@H](CC(=O)O)C(=O)O BIA0866 [0,1,0,0,0,0|2,0,1]=4
14  B8R0.28  O=C(O)CNCC(=O)O BIB6303 [0,0,0,0,0,1|2,0,1]=4
15  B5R0.1  CNCC(=O)O BIS0907 [2,0,0,0,0,0|1,0,0]=3
16  B7R0.2  CC(C)C[C@@H](N)CO BIL0711 [1,1,0,0,0,0|0,0,1]=3
17  B7R0.5  N[C@@H](CCS)C(=O)O BIB6065 [1,1,0,0,0,0|1,0,0]=3
18  B7R0.16  CC(C)[C@H](N)C(=O)O BIV0722 [0,1,0,0,1,0|0,0,0]=2
19  B7R0.16  C[C@@H](O)[C@H](N)C(=O)O BIT0719 [0,1,0,0,1,0|1,0,0]=3
20  B7R0.16  C[C@@H](O)[C@H](N)C(=O)O BIT0724 [0,1,0,0,1,0|1,0,0]=3
21  B7R0.16  C[C@H](O)[C@@H](N)C(=O)O BIT0801 [0,1,0,0,1,0|1,0,0]=3
22  B7R0.16  C[C@H](O)[C@H](N)C(=O)O BIT0901 [0,1,0,0,1,0|1,0,0]=3
23  B9R0.7  CS(=O)CCC(N)C(=O)O BIB6099 [0,1,0,0,0,1|2,0,0]=4
24  B9R0.56  CC(=O)SCC[N+](C)(C)C BIA4001 [0,1,0,0,0,1|2,0,0]=4
25  B9R0.79  C[C@H](O)[C@H](C)[C@H](N)C(=O)O BII0712 [0,2,0,0,0,0|1,0,0]=3
26  B5R0.5  CC(=O)N(C)C BIA3145 [0,0,0,0,2,0|2,0,0]=4
27  B5R0.5  CC(N)C(=O)O BIA0868 [0,0,0,0,2,0|1,0,0]=3
28  B5R0.5  C[C@@H](N)C(=O)O BIA0863 [0,0,0,0,2,0|1,0,0]=3
29  B5R0.5  C[C@H](N)C(=O)O BIA0703 [0,0,0,0,2,0|1,0,0]=3