0  B9R0.7  CC(C)C(=O)NCC(=O)O 4029604 [0,0,0,0,0,0|1,0,2]=3
1  B9R0.7  CC(C)N(C)CCC(=O)O 4028345 [0,0,0,0,0,0|4,0,0]=4
2  B9R0.7  CC(C)N(C)CCC(=O)O 4091071 [0,0,0,0,0,0|4,0,0]=4
3  B9R0.7  CN(C)C(=O)NCC(=O)O 4028570 [0,0,0,0,0,0|2,0,2]=4
4  B8R0.9  CCC(=O)NCC(=O)O 4027002 [1,0,0,0,0,0|0,0,2]=3
5  B8R0.9  CCN(C)CCC(=O)O 4027808 [1,0,0,0,0,0|3,0,0]=4
6  B8R0.9  CCN(C)CCC(=O)O 4089689 [1,0,0,0,0,0|3,0,0]=4
7  B8R0.9  CCS(=O)CCC(=O)O 4027513 [1,0,0,0,0,0|2,0,1]=4
8  B8R0.23  CC(=O)CC(=O)C(C)C 4036300 [0,0,0,0,1,0|2,0,1]=4
9  B8R0.23  CC(C)N(C)CC(=O)O 4027636 [0,0,0,0,1,0|3,0,0]=4
10  B7R0.4  CCCOCC(=O)O 4020861 [2,0,0,0,0,0|1,0,1]=4
11  B7R0.4  CCCSCC(=O)O 4028731 [2,0,0,0,0,0|1,0,1]=4
12  B7R0.4  CCSCCC(=O)O 4028457 [2,0,0,0,0,0|2,0,0]=4
13  B11R1.175  CC(C)C1=NOC(C(=O)O)C1 4010761 [0,0,0,1,0,1|2,0,0]=4
14  B7R0.2  CCN(C)CC(=O)O 4026801 [1,0,0,0,1,0|2,0,0]=4
15  B7R0.2  CNC(=O)CC(=O)O 4027258 [1,0,0,0,1,0|1,0,1]=4