0  B11R1.35  NC(CC1=CN=CN1)C(=O)O M19027 [0,0,0,0,0,0|0,0,0]=0
1  B12R1.104  Cn1cnc(C[C@H](N)C(=O)O)c1 M19729 [0,1,0,0,0,0|0,0,2]=3
2  B12R1.145  Cn1cncc1C[C@H](N)C(=O)O M21431 [0,1,0,0,0,0|0,0,0]=1
3  B10R1.23  N[C@H](C(=O)O)c1ccsc1 M28171 [0,0,0,0,1,0|2,0,0]=3
4  B12R1.43  N[C@@H](CC1=CC=CC=C1)C(=O)O M15427 [0,0,0,0,0,1|2,0,0]=3
5  B12R1.43  N[C@H](CC1=CC=CC=C1)C(=O)O M15568 [0,0,0,0,0,1|2,0,0]=3
6  B12R1.43  O=C(O)C(O)Cc1ccccc1 M19335 [0,0,0,0,0,1|3,0,0]=4
7  B12R1.43  O=C(O)[C@@H](O)Cc1ccccc1 M20030 [0,0,0,0,0,1|3,0,0]=4
8  B12R1.43  O=C(O)[C@H](O)Cc1ccccc1 M19976 [0,0,0,0,0,1|3,0,0]=4
9  B12R1.43  [15NH2][C@@H](CC1=CC=CC=C1)C(=O)O M28293 [0,0,0,0,0,1|2,0,0]=3
10  B9R0.47  C=CCSC[C@H](N)C(=O)O M18241 [1,0,1,0,0,0|2,0,0]=4
11  B11R0.29  NC(N)=NCCCC(N)C(=O)O M19068 [0,1,1,0,0,0|0,0,2]=4
12  B11R1.314  NC(C(=O)O)c1cc(O)no1 M29621 [0,1,0,0,1,0|2,0,0]=4
13  B13R1.133  NC(Cc1ccc(Cl)cc1)C(=O)O M15837 [0,1,0,0,0,1|2,0,0]=4
14  B13R1.133  N[C@@H](CC1=CC=C(O)C=C1)C(=O)O M15242 [0,1,0,0,0,1|2,0,0]=4
15  B13R1.133  N[C@@H](CC1=CC=C(O)C=C1)C(=O)O M23631 [0,1,0,0,0,1|2,0,0]=4
16  B13R1.133  N[C@@H](Cc1ccc(F)cc1)C(=O)O M28352 [0,1,0,0,0,1|2,0,0]=4
17  B13R1.133  N[C@@H](Cc1ccc(O)cc1)C(=O)O M29133 [0,1,0,0,0,1|2,0,0]=4
18  B13R1.133  N[C@H](CC1=CC=C(F)C=C1)C(=O)O M23404 [0,1,0,0,0,1|2,0,0]=4
19  B13R1.133  N[C@H](Cc1ccc(O)cc1)C(=O)O M22478 [0,1,0,0,0,1|2,0,0]=4
20  B13R1.148  N[C@@H](Cc1cccc(O)c1)C(=O)O M27192 [0,1,0,0,0,1|2,0,0]=4
21  B13R1.202  NC(CC1=CC=CC=C1O)C(=O)O M13685 [0,1,0,0,0,1|2,0,0]=4
22  B11R1.74  O=C1C[C@@H](C(=O)O)NC(=O)N1 M19640 [0,0,1,1,0,0|2,0,0]=4
23  B11R1.91  O=C(O)CCc1ccccc1 M18665 [1,0,0,0,0,1|2,0,0]=4