0  B9R0.45  CCCCCCCCCCl 8135AF [0,0,0,0,0,0|4,0,0]=4
1  B9R0.45  CCCCCCCCCS Q791 [0,0,0,0,0,0|4,0,0]=4
2  B10R1.4  CC1CCCCN1CCO 5913AD [0,0,0,1,0,0|3,0,0]=4
3  B10R1.4  CCCN1CCNCC1=O 7489AE [0,0,0,1,0,0|2,0,1]=4
4  B10R1.5  C=CCN1CCCC1CN W7743 [0,0,0,1,0,0|2,0,1]=4
5  B10R1.17  NCCCC1CCCNC1 2033AJ [0,0,0,1,0,0|2,0,0]=3
6  B10R1.17  NCCSC1CCCCC1 7883AE [0,0,0,1,0,0|3,0,0]=4
7  B10R1.17  OCCCC1CCCNC1 1979AB [0,0,0,1,0,0|3,0,0]=4
8  B7R0.1  CCCCCCNC Y1198 [2,0,0,0,0,0|2,0,0]=4
9  B7R0.1  CCCCNCCC 6811AD [2,0,0,0,0,0|1,0,0]=3
10  B9R1.5  N[C@H]1CCCCC[C@@H]1O 0321AQ [1,0,0,1,0,0|2,0,0]=4
11  B9R1.8  BrCCC1CCCCN1 8894AE [1,0,0,1,0,0|2,0,0]=4
12  B9R1.8  OCCC1CNCCN1 4749AE [1,0,0,1,0,0|1,0,0]=3
13  B9R1.8  OCCC1CNCCO1 1271AJ [1,0,0,1,0,0|2,0,0]=4
14  B9R1.8  OCCC1CNCCO1 6034AA [1,0,0,1,0,0|2,0,0]=4
15  B9R1.8  OCCC1COCCN1 5273AB [1,0,0,1,0,0|2,0,0]=4
16  B9R1.8  OCC[C@@H]1COCCN1 5478AC [1,0,0,1,0,0|2,0,0]=4
17  B9R1.8  OCC[C@H]1COCCN1 1846AC [1,0,0,1,0,0|2,0,0]=4
18  B9R1.15  N[C@@H]1CCCC[C@@H]1CO 8475AJ [1,0,0,1,0,0|2,0,0]=4
19  B9R1.15  N[C@@H]1CCCC[C@H]1CO 4877AJ [1,0,0,1,0,0|2,0,0]=4
20  B9R1.33  NCCN1CCCC1=O 3487AF [1,0,0,1,0,0|1,0,1]=4
21  B9R1.103  C1CCCCNCCC1 8287AB [1,0,0,1,0,0|2,0,0]=4
22  B11R1.16  CN(CCN)C1CCCCC1 8250AD [0,1,0,1,0,0|2,0,0]=4
23  B11R1.5  NCCN1CCCCCC1=O 2607AB [0,1,0,1,0,0|2,0,0]=4
24  B11R1.18  NCCCN1CCCC1CO 1447AF [0,1,0,1,0,0|2,0,0]=4
25  B11R1.605  CC1CCCC(C)N1CCN 5976AD [0,1,0,1,0,0|2,0,0]=4
26  B11R2.20  [C@@H]12CCCCN1CCNC2 9231AH [0,0,0,2,0,0|2,0,0]=4
27  B11R2.20  [C@H]12CNCCN1CCOC2 9051AH [0,0,0,2,0,0|2,0,0]=4
28  B11R2.18  C1CC2CCNCCN2C1 3904AC [0,0,0,2,0,0|2,0,0]=4
29  B11R2.1261  C1CCC2(C1)CNCCN2 2977AL [0,0,0,2,0,0|2,0,0]=4
30  B11R2.1261  C1CCC2(C1)CNCCN2 2978AL [0,0,0,2,0,0|2,0,0]=4
31  B11R2.1261  C1CCC2(C1)CNCCN2 3396AJ [0,0,0,2,0,0|2,0,0]=4
32  B11R2.60  NC1COC2C(N)COC12 7035AA [0,0,0,2,0,0|2,0,0]=4