0  B5R0.3  CC(CCl)CCl 098443 [0,0,0,0,0,0|3,0,0]=3
1  B5R0.3  CCC(S)CC 105148 [0,0,0,0,0,0|2,1,0]=3
2  B4R0.2  CSCCBr 472152 [1,0,0,0,0,0|3,0,0]=4
3  B6R0.1  COCC(C)CN 105383 [0,1,0,0,0,0|2,0,0]=3
4  B6R0.3  CCC(C)C(C)N 214338 [0,1,0,0,0,0|3,0,0]=4
5  B6R0.3  CCC(N)C(C)C 214340 [0,1,0,0,0,0|3,0,0]=4
6  B6R1.7  OCC1(Br)CC1 105295 [0,0,0,1,0,0|2,0,0]=3
7  B3R0.1  N[13CH2][13CH2]O 105350 [2,0,0,0,0,0|1,0,0]=3
8  B3R0.1  [C-]#[N+]CC 433365 [2,0,0,0,0,0|2,0,0]=4
9  B3R0.2  CC(=O)O 035907 [2,0,0,0,0,0|0,0,2]=4
10  B3R0.2  CC(=O)O 044721 [2,0,0,0,0,0|0,0,2]=4
11  B3R0.2  CC(C)=O 050332 [2,0,0,0,0,0|0,0,2]=4
12  B3R0.2  O=C(O)O 094746 [2,0,0,0,0,0|0,0,2]=4
13  B3R0.2  O=C(O)O 105338 [2,0,0,0,0,0|0,0,2]=4
14  B5R0.4  CC(C)(C)CBr 403118 [1,1,0,0,0,0|2,0,0]=4
15  B5R0.4  CC(C)(F)CBr 386871 [1,1,0,0,0,0|2,0,0]=4
16  B5R0.4  CC(C)(F)CO 104410 [1,1,0,0,0,0|1,0,0]=3
17  B7R0.11  CC(C)(CO)CCBr 105090 [0,2,0,0,0,0|2,0,0]=4
18  B7R0.12  CCC(COC)OC 105044 [0,2,0,0,0,0|1,0,0]=3
19  B7R0.18  CCC(C)(CN)OC 214328 [0,2,0,0,0,0|2,0,0]=4
20  B5R1.1  C1CCOC1 046883 [1,0,0,1,0,0|1,0,0]=3
21  B5R1.1  C1CCOC1 046883 [1,0,0,1,0,0|1,0,0]=3
22  B5R1.1  C1CCOC1 106169 [1,0,0,1,0,0|1,0,0]=3