0  B5R0.5  C=C(C(=O)O)F DA-28919 [0,0,0,0,0,0|1,0,1]=2
1  B5R0.5  CC(C)C(=N)N DA-25790 [0,0,0,0,0,0|3,0,1]=4
2  B6R0.3  B(C(=C)CCl)(O)O DA-23714 [0,1,0,0,0,0|2,0,1]=4
3  B6R0.3  CC(C(=O)OC)I DA-32957 [0,1,0,0,0,0|1,0,1]=3
4  B6R0.3  CCC(C(=O)N)Cl DA-26397 [0,1,0,0,0,0|2,0,1]=4
5  B6R0.3  COC(=O)C(=S)N DA-41073 [0,1,0,0,0,0|1,1,0]=3
6  B6R0.7  C(=O)(C(F)(F)F)O DA-38928 [0,1,0,0,0,0|2,0,1]=4
7  B6R1.4  CC1CNC1=O DA-23380 [0,0,0,1,0,0|2,0,1]=4
8  B6R0.2  B(C=C(C)C)(O)O DA-35283 [0,0,0,0,0,1|2,0,1]=4
9  B6R0.2  CC(=CC(=O)N)N DA-24318 [0,0,0,0,0,1|2,0,0]=3
10  B6R0.2  C\C(=C\C(=O)C)\[O-] DA-34907 [0,0,0,0,0,1|1,0,1]=3
11  B5R0.1  C(C(=O)O)NN DA-26159 [1,1,0,0,0,0|1,0,1]=4
12  B5R0.1  CC(=O)CCN DA-21357 [1,1,0,0,0,0|1,0,1]=4
13  B5R0.1  CN(C)CC=O DA-27712 [1,1,0,0,0,0|2,0,0]=4
14  B5R0.1  CN(C)CC=O DA-27713 [1,1,0,0,0,0|2,0,0]=4
15  B5R0.1  CN(C)CC=O DA-27714 [1,1,0,0,0,0|2,0,0]=4
16  B5R0.1  C\C(=C/C=O)\Br DA-32109 [1,1,0,0,0,0|1,0,0]=3
17  B5R0.3  C(=C(C=O)Cl)N DA-24317 [1,1,0,0,0,0|1,0,1]=4
18  B5R0.3  C(C(=O)C=O)Cl DA-23845 [1,1,0,0,0,0|0,0,0]=2
19  B5R0.3  CN(C=O)OC DA-42814 [1,1,0,0,0,0|1,0,1]=4
20  B5R0.4  CC(C=O)(Cl)Cl DA-27513 [1,1,0,0,0,0|1,0,1]=4
21  B7R0.2  CC(=O)NC(=O)CCl DA-43520 [0,1,0,0,0,1|1,0,0]=3
22  B7R0.2  CC(=S)CC(=O)CCl DA-29563 [0,1,0,0,0,1|1,1,0]=4
23  B7R0.2  COC(=O)CC(=S)N DA-32774 [0,1,0,0,0,1|1,1,0]=4
24  B7R0.5  C#CCC(C(=O)O)O DA-26130 [0,2,0,0,0,0|0,0,2]=4
25  B7R0.5  CCNC(=O)C(=O)O DA-27699 [0,2,0,0,0,0|0,0,0]=2
26  B7R0.5  CN(C)C(=O)CON DA-45503 [0,2,0,0,0,0|2,0,0]=4
27  B7R0.10  CC(C#C)C(=O)OC DA-32932 [0,2,0,0,0,0|1,0,1]=4
28  B7R0.10  COC(C(=O)OC)Cl DA-33008 [0,2,0,0,0,0|1,0,1]=4
29  B7R0.10  C[C@@H](C(=O)OC)NC DA-47787 [0,2,0,0,0,0|1,0,1]=4
30  B7R0.15  CCC(C=C)C(=O)O DA-26255 [0,2,0,0,0,0|1,0,1]=4
31  B7R1.2  C1C(=O)SC(=O)N1 DA-27172 [0,0,0,1,0,1|1,0,0]=3
32  B7R1.2  Cc1c[nH]c(=O)s1 DA-37141 [0,0,0,1,0,1|2,0,0]=4
33  B7R1.2  Cc1ccc(s1)O DA-37079 [0,0,0,1,0,1|2,0,0]=4
34  B7R1.12  C=C1CC1C(=O)O DA-25803 [0,0,0,1,0,1|1,0,0]=3
35  B7R1.4  Cc1c(=O)[nH]sn1 DA-39175 [0,1,0,1,0,0|1,1,0]=4
36  B7R1.4  Cc1cnoc1C DA-21946 [0,1,0,1,0,0|2,0,0]=4
37  B7R0.6  CC(C#CC(=O)O)O DA-41638 [0,0,0,0,0,2|0,0,2]=4
38  B7R0.6  CC(CCC(=O)O)I DA-41244 [0,0,0,0,0,2|1,0,1]=4