0  B8R1.4  C1CC(=CC(=O)C1)N 8165 [1,0,0,0,0,0|1,0,1]=3
1  B8R1.4  C1CC(=O)CC(=O)C1 10153 [1,0,0,0,0,0|1,0,2]=4
2  B8R1.4  CC1CCCC(N1)C 10243 [1,0,0,0,0,0|2,0,1]=4
3  B8R0.2  CC[C@H](C)[C@@H](C(=O)O)N 9707 [0,0,1,0,0,0|2,0,1]=4
4  B8R1.50  CN1CCN(C1=O)C 6841 [0,0,0,0,1,0|3,0,0]=4
5  B7R0.5  CCOC(=O)[C@H](C)O 9449 [1,0,1,0,0,0|2,0,0]=4
6  B7R0.16  CN(C)C(=O)C(=O)O 8405 [1,0,1,0,0,0|2,0,0]=4
7  B7R0.7  CCOC(=O)CCN 8696 [1,0,1,0,0,0|2,0,0]=4
8  B7R1.3  C1CC=CC(C1)Br 8970 [2,0,0,0,0,0|1,0,0]=3
9  B7R1.3  C1CCC(=O)CC1 5327 [2,0,0,0,0,0|0,0,1]=3
10  B7R1.3  C1CNC(=O)CN1 8468 [2,0,0,0,0,0|2,0,0]=4
11  B7R1.3  C1CNCCC1=O 10646 [2,0,0,0,0,0|1,0,1]=4
12  B7R1.3  C1CNCCC1=O 8608 [2,0,0,0,0,0|1,0,1]=4
13  B7R1.3  C1COCCC1=O 9746 [2,0,0,0,0,0|1,0,1]=4
14  B9R0.47  CCCCCC(C)C(=O)O 8193 [0,1,1,0,0,0|1,0,1]=4
15  B7R1.4  C1COC(=O)C1Br 8284 [1,0,0,0,1,0|2,0,0]=4
16  B7R1.4  CC1C(=O)CCO1 10277 [1,0,0,0,1,0|1,0,0]=3
17  B7R1.4  CN1CCCC1=O 5092 [1,0,0,0,1,0|1,0,0]=3
18  B7R1.4  CN1CCCC1=O M0011 [1,0,0,0,1,0|1,0,0]=3