0  B8R0.23  CC(C)CC(=O)N(C)C BB57-2001 [0,0,0,0,0,0|2,0,0]=2
1  B8R0.23  CC(C)NC(=O)C(=O)O BB55-4701 [0,0,0,0,0,0|2,0,0]=2
2  B8R0.23  CC(C)NC(=O)C(C)Br BB58-4930 [0,0,0,0,0,0|2,0,1]=3
3  B8R0.23  CC(C)NC(=O)C(C)Cl BB57-1146 [0,0,0,0,0,0|2,0,1]=3
4  B7R0.2  CC(C)NC(=O)CCl BB01-5507 [1,0,0,0,0,0|2,0,1]=4
5  B7R0.2  CC(O)CC(=O)NN BB55-2167 [1,0,0,0,0,0|3,0,0]=4
6  B7R0.5  C=C(C)C(=O)NCO BB57-4784 [1,0,0,0,0,0|3,0,0]=4
7  B7R0.5  CCNC(=O)C(C)Br BB58-4929 [1,0,0,0,0,0|2,0,1]=4
8  B7R0.5  CCOC(=O)C(=O)[O-] BB58-2852 [1,0,0,0,0,0|2,0,0]=3
9  B7R0.5  CCOC(=O)C(N)=S BB01-2471 [1,0,0,0,0,0|2,1,0]=4
10  B7R0.6  CC(=O)CCN(C)C BB55-6125 [1,0,0,0,0,0|1,0,1]=3
11  B7R0.6  CC(C)OCC(=O)O BB55-5141 [1,0,0,0,0,0|2,0,1]=4
12  B9R0.23  CCC(Br)C(=O)NC(C)C BB01-5516 [0,1,0,0,0,0|2,0,1]=4
13  B9R0.23  COC(=O)C(=O)CC(C)=O BB17-2983 [0,1,0,0,0,0|1,0,1]=3
14  B9R0.23  COC(=O)C(N)CC(C)C BB58-4604 [0,1,0,0,0,0|1,0,1]=3
15  B9R0.42  CCC(C)NC(=O)C(=O)O BB55-4719 [0,1,0,0,0,0|2,0,0]=3
16  B9R0.57  CC(Br)C(=O)NC(C)(C)C BB58-4931 [0,1,0,0,0,0|2,0,1]=4
17  B9R0.57  CC(Cl)C(=O)NC(C)(C)C BB57-1145 [0,1,0,0,0,0|2,0,1]=4
18  B9R1.69  CC1CNC(=O)N(C)C1 BB58-3643 [0,0,0,1,0,0|3,0,0]=4
19  B9R1.112  CC(Br)C(=O)NC1CC1 BB58-2131 [0,0,0,1,0,0|2,0,1]=4
20  B9R0.7  CC(C)CNC(=O)C(=O)O BB57-0815 [0,0,0,0,0,1|1,0,0]=2
21  B9R0.53  CC(C)CC(N)CC(=O)O BB57-0289 [0,0,0,0,0,1|2,0,1]=4
22  B9R0.53  CC(C)NC(=O)NC(C)C BB01-2280 [0,0,0,0,0,1|2,0,1]=4
23  B9R0.53  C\C(N)=C\C(=O)OC(C)C BB55-8437 [0,0,0,0,0,1|2,0,0]=3
24  B6R0.1  CCCC(=O)NN BB01-6388 [2,0,0,0,0,0|2,0,0]=4
25  B6R0.1  CNC(=O)CCN BB32-2825 [2,0,0,0,0,0|2,0,0]=4
26  B6R0.2  CC(C)CC(C)N BB01-6378 [2,0,0,0,0,0|1,0,1]=4
27  B6R0.4  CC(=O)NCCN BB20-2208 [2,0,0,0,0,0|2,0,0]=4
28  B6R0.4  CC(C)CCC=O BB58-4980 [2,0,0,0,0,0|0,0,1]=3
29  B8R0.5  CC(C)NC(=O)CCCl BB57-1148 [1,1,0,0,0,0|1,0,1]=4
30  B8R0.5  CNCC(=O)NC(C)C BB01-4844 [1,1,0,0,0,0|1,0,1]=4
31  B8R0.24  CC(C)(C)CC(=O)NN BB58-1385 [1,1,0,0,0,0|2,0,0]=4
32  B8R0.3  CCCC(N)C(=O)OC BB55-8831 [1,1,0,0,0,0|1,0,1]=4
33  B8R0.8  CCCNC(=O)C(=O)O BB55-4706 [1,1,0,0,0,0|1,0,0]=3
34  B8R0.8  CCCNC(=O)C(C)Br BB58-4933 [1,1,0,0,0,0|1,0,1]=4
35  B8R0.8  CCCNC(=O)C(C)Cl BB55-4741 [1,1,0,0,0,0|1,0,1]=4
36  B8R0.9  CC(C)CNC(=O)CCl BB53-1221 [1,1,0,0,0,0|1,0,0]=3
37  B10R0.32  CCOC(=O)C(N)CC(C)C BB57-0270 [0,2,0,0,0,0|1,0,1]=4
38  B10R0.67  CCC(C)(C)NC(=O)C(=O)O BB55-4723 [0,2,0,0,0,0|2,0,0]=4
39  B10R0.72  CCC(CC)NC(=O)C(=O)O BB57-0814 [0,2,0,0,0,0|2,0,0]=4
40  B10R1.271  CN1C(=O)NC(C)(C)C1=O BB58-3106 [0,1,0,1,0,0|2,0,0]=4
41  B10R0.98  CC(C)CCNC(=O)C(C)Br BB01-8238 [0,0,0,0,0,2|1,0,1]=4