0  B9R0.44  CCOC(=O)CC(C)(C)C CSC000170348 [0,0,0,0,0,0|1,0,0]=1
1  B9R0.44  CCOC(=O)CC(C)(F)F CSC000070698 [0,0,0,0,0,0|2,0,0]=2
2  B9R0.44  CCOC(=O)CS(=O)(=O)C CSC011215758 [0,0,0,0,0,0|2,0,1]=3
3  B9R0.44  COCC(=O)NC(C)(C)C CSC000191696 [0,0,0,0,0,0|4,0,0]=4
4  B10R0.28  CC(C)(C)NC(=O)NCCO CSC000217861 [0,1,0,0,0,0|3,0,0]=4
5  B10R0.28  CCCNC(=O)NC(C)(C)C CSC000163414 [0,1,0,0,0,0|3,0,0]=4
6  B10R0.100  CCOC(=O)C(C)S(=O)(=O)C CSC011435737 [0,1,0,0,0,0|2,0,1]=4
7  B10R1.373  CC(C)(C)NC(=O)C1CC1 CSC000171328 [0,0,0,1,0,0|3,0,0]=4
8  B10R0.109  CCCC(=O)NCC(C)(C)C CSC011466744 [0,0,0,0,0,1|2,0,0]=3
9  B10R0.109  CCOC(=O)CCC(C)(C)C CSC012130662 [0,0,0,0,0,1|1,0,0]=2
10  B10R0.109  CCOC(=O)CCC(C)(F)F CSC000054117 [0,0,0,0,0,1|2,0,0]=3
11  B10R0.109  CCOC(=O)CCC(F)(F)F CSC011215681 [0,0,0,0,0,1|3,0,0]=4
12  B10R0.109  CCOC(=O)CNS(=O)(=O)C CSC000238371 [0,0,0,0,0,1|2,0,1]=4
13  B9R0.4  CC(C)CC(=O)OCC=C CSC000006416 [1,1,0,0,0,0|0,0,1]=3
14  B9R0.4  CC(C)NC(=O)NCCN CSC011374587 [1,1,0,0,0,0|2,0,0]=4
15  B9R0.4  CCCCC(=O)OC(C)C CSC000169914 [1,1,0,0,0,0|2,0,0]=4
16  B9R0.4  CCCNC(=O)NC(C)C CSC000163085 [1,1,0,0,0,0|2,0,0]=4
17  B9R0.4  CCCOC(=O)CC(C)C CSC000170144 [1,1,0,0,0,0|0,0,0]=2
18  B9R0.4  CNCCC(=O)NC(C)C CSC011534604 [1,1,0,0,0,0|2,0,0]=4
19  B9R0.34  CCCC(=O)OC(C)CC CSC000062825 [1,1,0,0,0,0|2,0,0]=4
20  B9R0.34  CCOC(=O)CC(C)CC CSC011218107 [1,1,0,0,0,0|0,0,0]=2
21  B9R0.53  CC(C)CC(=O)NC(C)C CSC000157551 [1,1,0,0,0,0|1,0,0]=3
22  B9R0.53  CC(C)CC(=O)OC(C)C CSC000170143 [1,1,0,0,0,0|0,0,0]=2
23  B9R0.22  CCC(=O)NC(C)(C)CC CSC000174106 [1,1,0,0,0,0|2,0,0]=4
24  B9R0.25  CNC(=O)[C@@H](N)C(C)(C)C CSC011422891 [1,1,0,0,0,0|2,0,0]=4
25  B9R0.57  CC(C)C(=O)NC(C)(C)C CSC000171314 [1,1,0,0,0,0|2,0,0]=4
26  B9R0.10  CC(C)NC(=O)C(C)(C)C CSC000171935 [0,1,0,0,1,0|2,0,0]=4
27  B9R0.10  CC(C)NC(=O)C(C)(C)N CSC011440756 [0,1,0,0,1,0|2,0,0]=4
28  B9R0.19  CCOC(=O)C(C)(C)C#N CSC011216776 [0,1,0,0,1,0|1,0,0]=3
29  B9R0.19  CCOC(=O)C(C)(C)C=C CSC012186761 [0,1,0,0,1,0|1,0,0]=3
30  B9R0.19  CCOC(=O)C(C)(C)CO CSC011765865 [0,1,0,0,1,0|0,0,0]=2
31  B9R0.19  CCOC(=O)C(C)(C)SC CSC000036217 [0,1,0,0,1,0|0,1,0]=3
32  B11R0.165  CC(C)(C)CC(=O)NCCC#C CSC011979668 [0,2,0,0,0,0|2,0,0]=4
33  B11R0.51  CC(C)NC(=O)C(Br)C(C)(C)C CSC009814059 [0,2,0,0,0,0|2,0,0]=4
34  B11R0.359  CC(C)(C)CC(=O)NC(C)(C)C CSC000171351 [0,2,0,0,0,0|2,0,0]=4
35  B11R1.1417  CC(C)(C)CNC(=O)C1CC1 CSC011466760 [0,0,0,1,0,1|2,0,0]=4
36  B9R0.48  CCCC(=O)OCC(C)C CSC000005790 [1,0,0,0,0,1|1,0,0]=3
37  B9R0.48  CCOC(=O)CCC(=O)C CSC011212338 [1,0,0,0,0,1|0,0,2]=4
38  B9R0.48  CCOC(=O)CCC(C)C CSC011212201 [1,0,0,0,0,1|0,0,0]=2
39  B9R0.48  CNCC(=O)NCC(C)C CSC000168150 [1,0,0,0,0,1|2,0,0]=4