0  B10R1.10  CCOC1=CC(=O)CCC1 SC-70370 [1,0,0,0,0,0|2,0,1]=4
1  B10R1.17  BrCCCC1CCCCC1 SC-74207 [1,0,0,0,0,0|2,0,1]=4
2  B10R1.17  BrCCOC1CCCCO1 SC-87088 [1,0,0,0,0,0|2,0,1]=4
3  B10R1.17  NCCOC1CCCCO1 SC-89164 [1,0,0,0,0,0|2,0,1]=4
4  B12R1.17  CCOC(=O)C1CCCC(=O)C1 SC-14694 [0,1,0,0,0,0|2,0,1]=4
5  B10R0.4  CC(=O)OCCCCCCBr SC-93957 [0,0,1,0,0,0|3,0,0]=4
6  B10R0.4  CCCCCCCCN(C)C SC-65204 [0,0,1,0,0,0|3,0,0]=4
7  B10R0.4  NCCOCCOCC(=O)O SC-49931 [0,0,1,0,0,0|3,0,0]=4
8  B10R0.4  NCCOCCOCC(=O)O SC-97450 [0,0,1,0,0,0|3,0,0]=4
9  B10R0.4  O=C(O)CCCCCCCBr SC-15671 [0,0,1,0,0,0|1,0,0]=2
10  B10R0.4  O=C(O)CCCCCCCO SC-46068 [0,0,1,0,0,0|1,0,0]=2
11  B10R0.4  [N-]=[N+]=NCCCCCC(=O)O SC-99952 [0,0,1,0,0,0|3,0,0]=4
12  B10R1.29  CCCCN1CCCC1=O SC-A2633 [0,0,0,0,1,0|1,0,0]=2
13  B9R0.5  CCOC(=O)CCCCBr SC-01170 [1,0,1,0,0,0|2,0,0]=4
14  B9R0.45  C#CCCCCCCCC SC-65396 [1,0,1,0,0,0|1,0,1]=4
15  B9R0.45  CCCCCCCCCBr SC-65114 [1,0,1,0,0,0|1,0,1]=4
16  B9R0.45  CCCCCCCCNC SC-62266 [1,0,1,0,0,0|2,0,0]=4
17  B9R0.45  OCCCCCCCCBr SC-13899 [1,0,1,0,0,0|1,0,1]=4
18  B9R0.2  CCCCCCCC(=O)O SC-27437 [1,0,1,0,0,0|0,0,0]=2
19  B9R0.2  CCCCCCOC(=O)Cl SC-53671 [1,0,1,0,0,0|2,0,0]=4
20  B9R0.2  NCCCCCCC(=O)O SC-10087 [1,0,1,0,0,0|1,0,0]=3
21  B9R1.2  CCC1CC(=O)CCN1 SC-35111 [2,0,0,0,0,0|2,0,0]=4
22  B9R1.2  O=C1CCCC(CO)N1 SC-21439 [2,0,0,0,0,0|2,0,0]=4
23  B11R0.42  CCCCCCC[C@@H](N)C(=O)O SC-10110 [0,1,1,0,0,0|0,0,0]=2
24  B11R0.46  CCCCCN(C)CCC(=O)O SC-19427 [0,1,1,0,0,0|1,0,0]=3
25  B11R0.148  CCCCCCCCCC(=O)Cl SC-20640 [0,1,1,0,0,0|1,0,0]=3
26  B11R0.148  CCCCCCCCOC(=O)Cl SC-46831 [0,1,1,0,0,0|1,0,0]=3
27  B11R0.148  O=C(O)CCCCCCCCBr SC-52958 [0,1,1,0,0,0|0,0,0]=2
28  B11R0.159  CCCCCCCCS(=O)(=O)[O-] SC-17731 [0,1,1,0,0,0|1,0,1]=4
29  B11R0.77  C=CC(CCCCC)OC(C)=O SC-93544 [0,1,1,0,0,0|0,0,2]=4
30  B11R1.28  BrCCCOC1CCCCO1 SC-95241 [1,1,0,0,0,0|1,0,1]=4
31  B11R1.199  CCOC(=O)C1CCCC1=O SC-17409 [0,1,0,0,1,0|1,0,1]=4
32  B11R1.30  CCOC(=O)CC1CCCC1 SC-36644 [0,0,1,1,0,0|2,0,0]=4
33  B11R1.53  CCN1CCCC[C@@H]1C(=O)[O-] SC-22825 [0,0,1,1,0,0|1,0,1]=4
34  B11R1.20  CC(=O)NC1CCC(O)CC1 SC-93564 [0,0,1,1,0,0|2,0,0]=4
35  B11R1.20  CC(=O)N[C@H]1CC[C@H](N)CC1 SC-89271 [0,0,1,1,0,0|2,0,0]=4
36  B11R2.106  O=C1CCNC2CCCC12 SC-95623 [1,0,0,1,0,0|2,0,0]=4
37  B13R2.13501  O=C1CC(=O)OC2(CCCC2)O1 SC-83456 [0,1,0,1,0,0|1,0,1]=4
38  B9R0.13  CCCCC(CC)C(=O)[O-] SC-15914 [0,0,1,0,1,0|1,0,0]=3
39  B9R0.13  CCCCC(CC)C(=O)[O-] SC-21305 [0,0,1,0,1,0|1,0,0]=3
40  B9R1.12  BrCCCC1OCCO1 SC-A3539 [1,0,0,0,1,0|2,0,0]=4