0  B7R0.9  CC(=O)O[Si](C)(C)C OR323246 [0,0,0,0,0,0|3,0,0]=3
1  B7R0.9  CC(C)(C)NC(=N)N OR300901 [0,0,0,0,0,0|4,0,0]=4
2  B7R0.9  CS(=O)(=O)CC(N)=O OR470513 [0,0,0,0,0,0|4,0,0]=4
3  B6R0.2  CC(C)NC(N)=O OR54393 [1,0,0,0,0,0|3,0,0]=4
4  B6R0.2  CC(O)CC(=O)[O-] OR28800 [1,0,0,0,0,0|2,0,0]=3
5  B6R0.2  CN(C)CC(N)=S OR315053 [1,0,0,0,0,0|1,1,1]=4
6  B8R0.24  CC(C)(C)OC(=O)CI OR471032 [0,1,0,0,0,0|3,0,0]=4
7  B8R0.24  C[N+](C)(C)C[C@H](O)CCl OR322303 [0,1,0,0,0,0|1,0,2]=4
8  B8R0.27  CC(C)(C)[C@@H](N)C(=O)O OR316030 [0,1,0,0,0,0|1,0,1]=3
9  B8R0.27  CC(C)(C)[C@H](O)C(=O)O OR322312 [0,1,0,0,0,0|1,0,1]=3
10  B8R0.27  CC(C)(F)C(N)C(=O)O PC4275 [0,1,0,0,0,0|2,0,1]=4
11  B8R0.34  CC(C)(CN)CC(=O)O OR53192 [0,1,0,0,0,0|1,0,1]=3
12  B8R0.34  CC(O)(CN)CC(=O)O OR54398 [0,1,0,0,0,0|2,0,1]=4
13  B6R0.7  CC(C)(C)C(=O)O OR322364 [0,0,0,0,1,0|1,0,1]=3
14  B6R0.7  CC(C)(C)C(N)=O OR30100 [0,0,0,0,1,0|2,0,0]=3
15  B6R0.7  CC(C)(F)C(=O)Cl PC01536 [0,0,0,0,1,0|3,0,0]=4
16  B6R0.7  CC(C)(F)C(=O)O PC8763 [0,0,0,0,1,0|2,0,1]=4
17  B6R0.7  CC(F)(F)C(=O)[O-] PC450283 [0,0,0,0,1,0|3,0,0]=4
18  B8R0.29  CC(C)(N)CCC(=O)O OR53210 [0,0,0,0,0,1|2,0,1]=4
19  B8R0.29  CC(C)(S)CCC(=O)O OR323129 [0,0,0,0,0,1|2,0,1]=4
20  B5R0.1  CC(C)=CC=O OR315230 [2,0,0,0,0,0|1,0,1]=4
21  B5R0.4  CC(C)(C)CO OR322097 [2,0,0,0,0,0|1,0,1]=4
22  B5R0.4  C[Si](C)(C)CO OR322469 [2,0,0,0,0,0|1,0,1]=4
23  B7R0.2  CC(CCl)CC(=O)Cl OR470807 [1,1,0,0,0,0|2,0,0]=4
24  B7R0.2  CC(CN)CC(=O)O OR53211 [1,1,0,0,0,0|1,0,1]=4
25  B7R0.16  CC(C)C(Br)C(=O)O OR26787 [1,1,0,0,0,0|1,0,1]=4
26  B7R0.8  C=CCC[Si](C)(C)C OR9105 [1,1,0,0,0,0|2,0,0]=4
27  B7R0.11  C[N+](C)(CF)CCO PC1838 [1,1,0,0,0,0|0,0,2]=4
28  B7R0.13  CC(C)(CF)C(=O)O PC201274 [0,1,0,0,1,0|1,0,1]=4
29  B9R0.10  CC(C)(C)[C@H](N)CC(=O)O OR313036 [0,1,0,0,0,1|1,0,1]=4
30  B9R0.25  CNC(=O)C(Br)C(C)(C)C OR28066 [0,2,0,0,0,0|2,0,0]=4
31  B9R0.25  COC(=O)[C@H](N)C(C)(C)C OR471306 [0,2,0,0,0,0|1,0,1]=4
32  B7R1.2  CN1CCC(=O)C1 OR309136 [1,0,0,1,0,0|1,0,1]=4
33  B7R1.12  CC1CC1C(N)=O OR302522 [1,0,0,1,0,0|2,0,0]=4
34  B9R1.171  CC1(CC(=O)O)COC1 OR312011 [0,1,0,1,0,0|1,0,1]=4
35  B7R0.6  CC(=O)CCC(C)C OR10031 [1,0,0,0,0,1|2,0,0]=4
36  B7R0.6  CN(C)CCC(=O)O OR322402 [1,0,0,0,0,1|0,0,2]=4