0  B7R0.1  C(CCCBr)CCBr AS03558 [0,0,0,0,0,0|3,0,0]=3
1  B7R0.1  C(CCCI)CCI AS02139 [0,0,0,0,0,0|3,0,0]=3
2  B7R0.1  CCCCCCCBr AS03337 [0,0,0,0,0,0|2,0,0]=2
3  B7R0.1  CCCCCCCI AS02231 [0,0,0,0,0,0|2,0,0]=2
4  B7R0.1  CCCCCCOC AS00996 [0,0,0,0,0,0|3,0,0]=3
5  B7R0.1  CCCCCOCC AS02569 [0,0,0,0,0,0|3,0,0]=3
6  B6R0.6  C(CCBr)CCBr AS03580 [1,0,0,0,0,0|2,0,0]=3
7  B6R0.6  C(CCI)CCI AS02144 [1,0,0,0,0,0|2,0,0]=3
8  B6R0.6  CCCCCCBr AS03338 [1,0,0,0,0,0|1,0,0]=2
9  B6R0.6  CCCCCCI AS02232 [1,0,0,0,0,0|1,0,0]=2
10  B6R0.6  CCCCCOC AS01005 [1,0,0,0,0,0|2,0,0]=3
11  B8R0.4  C(CCCBr)CCCBr AS03556 [0,1,0,0,0,0|2,0,0]=3
12  B8R0.4  C(CCCI)CCCI AS02138 [0,1,0,0,0,0|2,0,0]=3
13  B8R0.4  CCCCCCCCBr AS03445 [0,1,0,0,0,0|2,0,0]=3
14  B8R0.4  CCCCCCCCI AS02279 [0,1,0,0,0,0|2,0,0]=3
15  B8R0.4  CCCCCCCOC AS00995 [0,1,0,0,0,0|1,0,0]=2
16  B8R0.4  CCCCCCOCC AS02559 [0,1,0,0,0,0|2,0,0]=3
17  B8R0.4  COCCCCCOC AS02538 [0,1,0,0,0,0|2,0,0]=3
18  B8R0.7  C(CCC(=O)O)CCBr AS03339 [0,1,0,0,0,0|2,0,1]=4
19  B5R0.2  C(CCBr)CBr AS03526 [2,0,0,0,0,0|2,0,0]=4
20  B5R0.2  C(CCI)CI AS02133 [2,0,0,0,0,0|2,0,0]=4
21  B5R0.2  CCCCCI AS02280 [2,0,0,0,0,0|1,0,0]=3
22  B7R0.3  CCCCC(CBr)Br AS03557 [1,1,0,0,0,0|1,0,0]=3
23  B7R0.4  C(CCBr)CC(=O)O AS03476 [1,1,0,0,0,0|1,0,1]=4
24  B9R0.45  C(CCCCBr)CCCBr AS03579 [0,2,0,0,0,0|2,0,0]=4
25  B9R0.45  C(CCCCI)CCCI AS02143 [0,2,0,0,0,0|2,0,0]=4
26  B9R0.45  CCCCCCCCCBr AS03444 [0,2,0,0,0,0|2,0,0]=4
27  B9R0.45  CCCCCCCCCI AS02278 [0,2,0,0,0,0|2,0,0]=4
28  B9R0.45  CCCCCCCCOC AS01004 [0,2,0,0,0,0|1,0,0]=3
29  B9R0.45  CCCCCCCOCC AS02558 [0,2,0,0,0,0|1,0,0]=3
30  B9R0.45  CCOCCCCOCC AS02501 [0,2,0,0,0,0|2,0,0]=4
31  B9R0.45  COCCCCCCOC AS02532 [0,2,0,0,0,0|1,0,0]=3
32  B9R0.46  CCCCCCC(CBr)Br AS03578 [0,2,0,0,0,0|2,0,0]=4
33  B7R1.1  C1CCC(C1)C#N AS05826 [1,0,0,1,0,0|1,0,1]=4