0  B7R0.12  COC(CCBr)OC CS-W023200 [0,0,0,0,0,0|4,0,0]=4
1  B6R0.1  COC(C)CCO CS-W013686 [1,0,0,0,0,0|2,0,0]=3
2  B6R0.9  CCN(C=O)CC CS-W009551 [1,0,0,0,0,0|0,0,2]=3
3  B8R0.11  CCCCC(CC)CBr CS-W004392 [0,1,0,0,0,0|3,0,0]=4
4  B8R0.11  CCCCC(CC)CO CS-0016002 [0,1,0,0,0,0|3,0,0]=4
5  B8R1.1  OC[C@@H]1C[C@@H](O)CN1 CS-0043961 [0,0,0,1,0,0|3,0,0]=4
6  B8R1.2  N#CC1CCOCC1 CS-W019661 [0,0,0,1,0,0|2,0,1]=4
7  B8R1.2  O=CN1CCOCC1 CS-W016603 [0,0,0,1,0,0|1,0,1]=3
8  B8R1.8  NCCN1CCCC1 CS-D1372 [0,0,0,1,0,0|1,0,0]=2
9  B8R1.11  CCN1CCCC1=O CS-W013650 [0,0,0,1,0,0|2,0,1]=4
10  B5R0.1  CC(=O)CCO CS-0044370 [2,0,0,0,0,0|2,0,0]=4
11  B5R0.1  CC(N)CCO CS-W004841 [2,0,0,0,0,0|2,0,0]=4
12  B5R0.3  CC[C@@H](N)CO CS-W020734 [2,0,0,0,0,0|2,0,0]=4
13  B5R0.3  CC[C@H](N)CO CS-W013745 [2,0,0,0,0,0|2,0,0]=4
14  B7R0.15  CCN(CC)C(=S)[S-] CS-B1734 [1,1,0,0,0,0|0,1,1]=4
15  B7R1.1  NCC1CCOC1 CS-W004787 [1,0,0,1,0,0|2,0,0]=4
16  B7R1.1  OCC1CCOC1 CS-D1159 [1,0,0,1,0,0|2,0,0]=4
17  B7R1.2  NC1CCC(O)C1 CS-W005211 [1,0,0,1,0,0|2,0,0]=4
18  B7R1.2  N[C@@H]1CC[C@H](O)C1 CS-0058643 [1,0,0,1,0,0|2,0,0]=4
19  B9R1.1  CCN1CCC(=O)CC1 CS-0046794 [0,1,0,1,0,0|0,0,1]=3
20  B9R1.12  NCCCN1CCCC1 CS-W007457 [0,1,0,1,0,0|1,0,0]=3
21  B9R1.12  OCCCN1CCCC1 CS-W005320 [0,1,0,1,0,0|0,0,0]=2
22  B9R1.6  CC(=O)N1CCOCC1 CS-W011119 [0,1,0,1,0,0|0,0,1]=3
23  B9R1.11  O=C(CCl)N1CCCC1 CS-0037280 [0,1,0,1,0,0|1,0,1]=4
24  B9R1.14  CCN1CCC[C@H]1CN CS-W002498 [0,1,0,1,0,0|1,0,0]=3
25  B9R1.8  BrCCN1CCOCC1 CS-W005009 [0,1,0,1,0,0|0,0,0]=2
26  B9R1.8  ClCCN1CCOCC1 CS-0015128 [0,1,0,1,0,0|0,0,0]=2
27  B9R1.8  NCCN1CCCCC1 CS-W007776 [0,1,0,1,0,0|1,0,0]=3
28  B9R1.8  OCCN1CCNCC1 CS-W020134 [0,1,0,1,0,0|0,0,0]=2
29  B9R1.8  OCCN1CCOCC1 CS-W011103 [0,1,0,1,0,0|0,0,0]=2
30  B9R2.39  [C@H]1(N)C[C@@H]2CC[C@H]1C2 CS-0044000 [0,0,0,2,0,0|2,0,0]=4
31  B9R2.39  [C@H]12CC[C@H](C1)[C@H](O)C2 CS-0063194 [0,0,0,2,0,0|1,0,0]=3
32  B9R2.49  C1CN2CCN1CC2 CS-W020025 [0,0,0,2,0,0|1,0,0]=3