0  B11R0.29  C(CC(C(=O)O)N)CN=C(N)N S3174 [0,0,0,0,0,0|0,0,0]=0
1  B11R0.29  C(CC(C(=O)O)N)CN=C(N)N S3174 [0,0,0,0,0,0|0,0,0]=0
2  B11R0.29  C(CC(C(=O)O)N)CN=C(N)N S5549 [0,0,0,0,0,0|0,0,0]=0
3  B11R0.29  C(CC(C(=O)O)N)CN=C(N)N S5634 [0,0,0,0,0,0|0,0,0]=0
4  B11R0.29  C(CC(C(=O)O)N)CNC(=O)N S3798 [0,0,0,0,0,0|1,0,1]=2
5  B11R0.29  C(CC(C(=O)O)N)CNC(=O)N S5124 [0,0,0,0,0,0|1,0,1]=2
6  B10R0.98  C(C(C(=O)O)N)SCC(=O)O S5216 [0,0,0,0,1,0|3,0,0]=4
7  B10R0.98  C(CC(C(=O)O)N)CC(=O)O S5442 [0,0,0,0,1,0|2,0,0]=3
8  B12R0.42  C(CCN=C(N)N)CC(C(=O)O)N S5431 [0,0,0,0,0,1|0,0,0]=1
9  B12R0.42  C(CCN=C(N)N)CC(C(=O)O)N S5431 [0,0,0,0,0,1|0,0,0]=1
10  B12R0.42  C(CCN=C(N)N)CC(C(=O)O)N S6109 [0,0,0,0,0,1|0,0,0]=1
11  B12R0.42  C(CCNC(=O)N)CC(C(=O)O)N S6128 [0,0,0,0,0,1|1,0,1]=3
12  B12R0.42  CC(=O)NCCCCC(C(=O)O)N S6075 [0,0,0,0,0,1|2,0,1]=4
13  B9R0.55  C(CC(=O)O)CN=C(N)N S6137 [2,0,0,0,0,0|1,0,1]=4
14  B9R0.47  C(CCN)CC(C(=O)O)N S3953 [2,0,0,0,0,0|0,0,1]=3
15  B9R0.47  C(CCN)CC(C(=O)O)N S5630 [2,0,0,0,0,0|0,0,1]=3
16  B9R0.47  C=CCSCC(C(=O)O)N S4791 [2,0,0,0,0,0|2,0,0]=4
17  B13R0.1121  CNC(=NC)NCCCC(C(=O)O)N S5838 [0,2,0,0,0,0|0,0,2]=4
18  B13R0.1121  CNC(=NC)NCCCC(C(=O)O)N S5838 [0,2,0,0,0,0|0,0,2]=4
19  B11R1.35  C1=C(NC=N1)CC(C(=O)O)N S3989 [1,0,0,1,0,0|0,0,2]=4
20  B9R0.7  C(CC(=O)N)C(C(=O)O)N S1749 [0,0,0,0,2,0|1,0,0]=3
21  B9R0.7  C(CC(=O)N)C(C(=O)O)N S1893 [0,0,0,0,2,0|1,0,0]=3
22  B9R0.7  C(CC(=O)N)C(C(=O)O)N S1893 [0,0,0,0,2,0|1,0,0]=3
23  B9R0.7  C(CC(=O)N)C(C(=O)O)N S3963 [0,0,0,0,2,0|1,0,0]=3
24  B9R0.7  C(CC(=O)O)C(C(=O)O)N S6266 [0,0,0,0,2,0|2,0,0]=4