0  B8R0.23  C=C(C)C[C@H](N)C(=O)O 4357-1-S3 [0,0,0,0,0,0|3,0,0]=3
1  B7R0.5  NCCC(F)C(=O)O 4157-3-06 [1,0,0,0,0,0|2,0,1]=4
2  B9R0.11  CC(C)CC(C)(O)C(=O)O 2129-1-0Z [0,1,0,0,0,0|2,0,1]=4
3  B9R0.39  CNC(CC(=O)O)C(=O)O 4157-1-46 [0,1,0,0,0,0|1,0,0]=2
4  B9R1.35  O=C1CC[C@@H](C(=O)O)C1 2229-1-R2 [0,0,0,1,0,0|2,0,0]=3
5  B9R1.35  O=C1CC[C@H](C(=O)O)C1 2229-1-S2 [0,0,0,1,0,0|2,0,0]=3
6  B9R1.112  O=C(O)[C@H](O)CC1CC1 2229-1-R4 [0,0,0,1,0,0|2,0,1]=4
7  B9R1.152  C=C1CC(C)(C(=O)O)C1 2321-1-0A [0,0,0,1,0,0|3,0,0]=4
8  B9R1.164  CC1(O)CC(C(=O)O)C1 2229-1-57 [0,0,0,1,0,0|2,0,1]=4
9  B7R0.16  C=C(C)[C@@H](N)C(=O)O 4357-5-R0 [0,0,0,0,1,0|3,0,0]=4
10  B7R0.16  C[C@H](O)[C@H](N)C(=O)O 4157-1-44 [0,0,0,0,1,0|2,0,1]=4
11  B9R0.7  CC(C)=CC[C@@H](N)C(=O)O 4357-1-R0 [0,0,0,0,0,1|3,0,0]=4
12  B9R0.7  CC(C)=CC[C@H](N)C(=O)O 4357-1-S0 [0,0,0,0,0,1|3,0,0]=4
13  B6R0.3  CCC(F)C(=O)O 2121-3-0L [2,0,0,0,0,0|1,0,1]=4
14  B6R0.3  NC(CF)C(=O)O 4157-3-01 [2,0,0,0,0,0|2,0,0]=4
15  B8R0.19  COC(=O)C[C@@H](O)CCl 2129-5-R0 [1,1,0,0,0,0|1,0,1]=4
16  B8R0.3  C=CC[C@H](N)C(=O)OC 4358-1-S0 [1,1,0,0,0,0|2,0,0]=4
17  B8R0.37  CC(C)(C(N)=O)C(=O)O 4148-1-40 [0,1,0,0,1,0|2,0,0]=4
18  B10R0.43  O=C(O)CCC(F)(F)C(=O)O 2121-3-1G [0,1,0,0,0,1|1,0,0]=3
19  B10R0.57  COC(=O)[C@@H](N)CCC(N)=O 4158-5-SX [0,1,0,0,0,1|2,0,0]=4
20  B10R0.92  NC(CCP(=O)(O)O)C(=O)O 8177-1-37 [0,1,0,0,0,1|2,0,0]=4
21  B8R1.1  C=CC1COC(=O)C1 2H25-1-2G [1,0,0,1,0,0|2,0,0]=4
22  B8R1.18  C[C@@H]1NC(=O)OC1=O 4H56-1-S0C [1,0,0,1,0,0|2,0,0]=4
23  B8R1.7  O=C(O)[C@H]1CCOC1 2H21-1-S0 [1,0,0,1,0,0|1,0,1]=4
24  B8R1.23  O=C(O)[C@H]1C[C@H](O)C1 2229-1-E2 [1,0,0,1,0,0|1,0,1]=4
25  B10R1.54  O=C(O)C[C@@H]1CCC(=O)N1 4H48-1-SN [0,0,0,1,0,1|2,0,0]=4
26  B10R1.14  COC(=O)[C@@H]1CCC(=O)C1 2229-1-R0 [0,1,0,1,0,0|2,0,0]=4
27  B10R1.14  COC(=O)[C@H]1CCC(=O)C1 2229-1-S0 [0,1,0,1,0,0|2,0,0]=4
28  B10R1.408  COC(=O)C1CC1C(=O)O 2223-1-1A [0,1,0,1,0,0|1,0,0]=3
29  B10R1.113  O=C1CCCC(C(=O)O)C1 2229-1-X0 [0,1,0,1,0,0|2,0,0]=4