0  B9R1.6  O=C(O)C1CCSCN1 B050771 [0,0,0,0,0,0|2,0,0]=2
1  B8R1.2  CCC1CCNCC1 B039287 [1,0,0,0,0,0|2,0,1]=4
2  B8R1.2  NCC1CCCOC1 B049869 [1,0,0,0,0,0|2,0,1]=4
3  B10R1.13  CN1CCC(C(=O)O)CC1 B036594 [0,1,0,0,0,0|1,0,0]=2
4  B10R1.15  NNC(=O)C1CCCCC1 B017809 [0,1,0,0,0,0|1,0,0]=2
5  B10R1.28  CC(C)(O)C1CCNCC1 B049074 [0,1,0,0,0,0|2,0,1]=4
6  B10R1.363  CC(=O)C1(N)CCCCC1 B049125 [0,1,0,0,0,0|1,0,0]=2
7  B8R0.8  CCCCC(N)C(C)=O B050536 [0,0,1,0,0,0|2,0,0]=3
8  B10R2.351  C12CNCC1C2C(=O)O B052460 [0,0,0,1,0,0|1,0,0]=2
9  B10R1.18  CC(=O)CN1CCCCC1 B039380 [0,0,0,0,0,1|2,0,0]=3
10  B10R1.18  O=C(O)CC1CCCCO1 B050169 [0,0,0,0,0,1|1,0,0]=2
11  B10R1.18  O=C(O)CN1CCCCC1 B050089 [0,0,0,0,0,1|1,0,0]=2
12  B10R1.18  O=C(O)CN1CCOCC1 B036397 [0,0,0,0,0,1|2,0,0]=3
13  B7R0.1  CCCCSCCO B049703 [1,0,1,0,0,0|1,0,1]=4
14  B7R1.3  NC1CCCOC1 B049073 [2,0,0,0,0,0|2,0,0]=4
15  B7R1.3  NC1CCOCC1 B050801 [2,0,0,0,0,0|2,0,0]=4
16  B9R0.4  COCCN(C)CC(=O)O B039628 [0,1,1,0,0,0|2,0,0]=4
17  B9R0.46  CCCCCCC(=O)NN B014971 [0,1,1,0,0,0|1,0,0]=3
18  B9R0.42  CCN(C)CC(C)C(=O)O B039610 [0,1,1,0,0,0|1,0,0]=3
19  B9R1.1  CN1CCC(CO)CC1 B037955 [1,1,0,0,0,0|1,0,1]=4
20  B9R1.118  C#CC1(Cl)CCCCC1 B048743 [1,1,0,0,0,0|1,0,1]=4
21  B9R1.118  C#CC1(N)CCCCC1 B049569 [1,1,0,0,0,0|1,0,1]=4
22  B9R1.11  COC(=O)C1CCCN1 B022514 [0,1,0,0,1,0|1,0,0]=3
23  B11R1.20  CC1CCN(CC(=O)O)CC1 B039519 [0,1,0,0,0,1|1,0,0]=3
24  B11R1.20  NC1CCN(CC(=O)O)CC1 B050651 [0,1,0,0,0,1|1,0,0]=3
25  B11R1.40  COC(=O)CC1CCNCC1 B037491 [0,1,0,0,0,1|1,0,0]=3
26  B11R1.40  C\C(CN1CCCCC1)=N/O B006539 [0,1,0,0,0,1|2,0,0]=4
27  B11R1.40  NNC(=O)CC1CCNCC1 B039451 [0,1,0,0,0,1|2,0,0]=4
28  B11R1.86  CC(=O)CN1CCCCC1C B039383 [0,1,0,0,0,1|2,0,0]=4
29  B11R1.86  CC1CCCCN1CC(=O)O B039626 [0,1,0,0,0,1|1,0,0]=3
30  B11R1.86  CN1CCCCC1CC(=O)O B039484 [0,1,0,0,0,1|1,0,0]=3
31  B11R1.157  CC(=O)CN1CCCC(C)C1 B039382 [0,1,0,0,0,1|2,0,0]=4
32  B11R1.21  CN1CC(C(=O)O)CCC1=O B036410 [0,2,0,0,0,0|1,0,1]=4
33  B11R1.21  CN1CCC(C(=O)O)CC1=O B039456 [0,2,0,0,0,0|1,0,1]=4
34  B11R1.222  COC(=O)C1CCCNC1=O B048739 [0,2,0,0,0,0|1,0,1]=4
35  B9R1.13  O=C(O)CC1CCCO1 B050170 [0,0,1,1,0,0|1,0,0]=3
36  B9R1.13  O=C(O)CN1CCCC1 B039449 [0,0,1,1,0,0|1,0,0]=3
37  B11R2.10  O=C1OC2CCCCC2O1 B048883 [0,0,0,1,0,1|0,0,0]=2
38  B11R2.905  C12CNCC1C2C(=O)OC B052459 [0,1,0,1,0,0|1,0,0]=3
39  B11R1.91  O=C(O)CCC1CCCNC1 B050665 [0,0,0,0,0,2|1,0,0]=3
40  B11R1.91  O=C(O)CCN1CCOCC1 B050092 [0,0,0,0,0,2|2,0,0]=4
41  B11R1.742  CC(=O)CN1CCCCCC1 B039379 [0,0,0,0,0,2|2,0,0]=4