0  B11R0.3  BrCCCCCCCCCCBr SC-58228 [0,0,0,0,0,0|2,0,1]=3
1  B11R0.3  C=CCOCCCCCCCC SC-88460 [0,0,0,0,0,0|2,0,0]=2
2  B11R0.3  CCCCCCCCCCCC SC-78851 [0,0,0,0,0,0|1,0,2]=3
3  B11R0.3  CCCCCCCCCCNC SC-53944 [0,0,0,0,0,0|2,0,1]=3
4  B11R0.3  OCCCOCCOCCCCl SC-50535 [0,0,0,0,0,0|3,0,1]=4
5  B10R0.71  CCCCCCCCCC=O SC-22770 [1,0,0,0,0,0|1,0,0]=2
6  B10R0.71  CCCCCCCCCCBr SC-00388 [1,0,0,0,0,0|1,0,1]=3
7  B10R0.71  CCCCCCCCCCC SC-79237 [1,0,0,0,0,0|0,0,2]=3
8  B10R0.71  CCCCCCCCN=C=S SC-65278 [1,0,0,0,0,0|2,0,1]=4
9  B10R0.71  ClCCCCCCCCCCl SC-44719 [1,0,0,0,0,0|2,0,0]=3
10  B12R0.5  CCCCCCCCCCCCC SC-74775 [0,1,0,0,0,0|1,0,2]=4
11  B12R0.5  CCCCCCCCCCCCCl SC-79153 [0,1,0,0,0,0|1,0,2]=4
12  B12R0.5  CCCCCCCCCCCNN SC-58981 [0,1,0,0,0,0|1,0,2]=4
13  B12R0.234  CCCCCCCCCCC(C)C SC-45506 [0,1,0,0,0,0|1,0,2]=4
14  B12R0.234  O=C(Cl)CCCCCCCCCBr SC-53802 [0,1,0,0,0,0|2,0,0]=3
15  B12R0.248  COC(=O)CCCCCCCCO SC-52678 [0,1,0,0,0,0|1,0,2]=4
16  B12R1.121  N#CCCN1CCCCC1CO SC-39340 [0,0,0,1,0,0|2,0,1]=4
17  B12R1.121  OCC1CCCCN1CCCCl SC-39700 [0,0,0,1,0,0|2,0,1]=4
18  B12R1.169  CCCN1CCCCC1CCO SC-61101 [0,0,0,1,0,0|1,0,2]=4
19  B12R1.267  N#CCCCN1CCCCC1O SC-39194 [0,0,0,1,0,0|2,0,1]=4
20  B12R1.267  OC1CCCCN1CCCCCl SC-39338 [0,0,0,1,0,0|2,0,1]=4
21  B12R1.410  CNC1CCCCCCCCC1 SC-21352 [0,0,0,1,0,0|2,0,1]=4
22  B9R0.45  CCCCCC#CCCO SC-89425 [2,0,0,0,0,0|0,0,2]=4
23  B9R0.45  CCCCCCCNCC SC-28603 [2,0,0,0,0,0|1,0,1]=4
24  B9R0.45  NCCCCCCCCBr SC-69472 [2,0,0,0,0,0|2,0,0]=4
25  B9R0.45  NCCCCCCCCO SC-50444 [2,0,0,0,0,0|1,0,0]=3
26  B11R0.40  C=CC(=O)OCCCCCCO SC-52181 [1,1,0,0,0,0|1,0,1]=4
27  B11R0.148  CCCCCCCCCC(C)=S SC-42170 [1,1,0,0,0,0|0,0,1]=3
28  B11R0.148  CCCCCCCCCC(C)C SC-87999 [1,1,0,0,0,0|0,0,2]=4
29  B11R0.148  CCCCCCCCOC(C)=O SC-78773 [1,1,0,0,0,0|1,0,1]=4
30  B13R0.54  CCCCCCCCCCCC(=N)N SC-38549 [0,2,0,0,0,0|1,0,1]=4
31  B13R0.54  CCCCCCCCCCCC(=O)[O-] SC-66928 [0,2,0,0,0,0|1,0,1]=4
32  B13R0.54  O=C(O)CCCCCCCCCCO SC-54145 [0,2,0,0,0,0|0,0,1]=3
33  B13R0.147  C=CCCCCCCCCC(=O)OC SC-65435 [0,2,0,0,0,0|0,0,1]=3
34  B13R0.336  OCCCCCCCCCCCCO SC-46917 [0,2,0,0,0,0|0,0,2]=4
35  B11R1.17  CCCCC1CNCCC1=O SC-35050 [1,0,0,1,0,0|2,0,0]=4
36  B11R1.17  OC1CCCCN1CCCCl SC-39794 [1,0,0,1,0,0|2,0,0]=4
37  B11R1.28  NNCCCC1CCCCC1 SC-59956 [1,0,0,1,0,0|2,0,0]=4
38  B11R1.28  OCCCCC1CCNCC1 SC-53149 [1,0,0,1,0,0|1,0,1]=4
39  B11R1.41  CCCC1CCCCC1NN SC-38966 [1,0,0,1,0,0|2,0,0]=4
40  B11R1.41  OCC1CCCCN1CCCl SC-39243 [1,0,0,1,0,0|2,0,0]=4
41  B13R1.654  CCCCCCCC1CCCC1=S SC-42705 [0,1,0,1,0,0|1,0,1]=4
42  B13R1.84  N#CCCCN1CCCCC1CO SC-39846 [0,1,0,1,0,0|1,0,1]=4
43  B13R1.84  OCC1CCCCN1CCCCCl SC-39603 [0,1,0,1,0,0|1,0,1]=4
44  B13R1.555  N#CCCCCN1CCCCC1O SC-39429 [0,1,0,1,0,0|1,0,1]=4