0  B6R1.1  C1=CCONC1 BB12-1719 [0,0,0,0,0,0|2,0,2]=4
1  B7R1.3  NC1CCCOC1 BB12-2177 [0,1,0,0,0,0|1,0,0]=2
2  B7R1.3  OC1CCOCC1 BB12-1171 [0,1,0,0,0,0|1,0,0]=2
3  B7R1.3  OC1CCSCC1 BB53-1540 [0,1,0,0,0,0|1,0,0]=2
4  B5R0.2  CCSCCN BB53-1545 [0,0,1,0,0,0|2,0,0]=3
5  B5R0.2  CSCCC#N BB12-3714 [0,0,1,0,0,0|2,0,1]=4
6  B5R0.2  [C-]#[N+]CCCC BB56-0718 [0,0,1,0,0,0|1,0,1]=3
7  B5R0.2  [C-]#[N+]CCOC BB56-1837 [0,0,1,0,0,0|2,0,1]=4
8  B7R1.24  C1CNCCNC1 BB12-2760 [0,0,0,0,0,1|1,0,0]=2
9  B4R0.2  CSCCCl BB53-1396 [1,0,1,0,0,0|2,0,0]=4
10  B4R0.2  CSCCN BB12-0970 [1,0,1,0,0,0|2,0,0]=4
11  B6R0.1  CC(CN)CCN BB12-1906 [0,1,1,0,0,0|2,0,0]=4
12  B6R0.1  CCNC(C)CO BB12-1659 [0,1,1,0,0,0|2,0,0]=4
13  B6R0.1  CC[C@H](N)COC BB20-3253 [0,1,1,0,0,0|1,0,0]=3
14  B6R0.1  CNC(C)CCO BB12-1373 [0,1,1,0,0,0|2,0,0]=4
15  B6R0.4  CC(C)SCCCl BB53-1373 [0,1,1,0,0,0|2,0,0]=4
16  B6R0.4  CC(C)SCCN BB53-1544 [0,1,1,0,0,0|2,0,0]=4
17  B6R0.4  CC(C)SCCO BB53-1392 [0,1,1,0,0,0|2,0,0]=4
18  B6R0.4  CCNCC(C)O BB12-1676 [0,1,1,0,0,0|1,0,0]=3
19  B6R0.6  CCCSCCN BB53-1582 [0,1,1,0,0,0|1,0,0]=3
20  B6R0.6  CCSCCNC BB12-0971 [0,1,1,0,0,0|1,0,0]=3
21  B6R0.6  [C-]#[N+]CCCOC BB56-1464 [0,1,1,0,0,0|1,0,1]=4
22  B6R1.2  OC1CNOC1 BB12-1709 [0,1,0,0,1,0|2,0,0]=4
23  B6R1.2  O[C@@H]1CCNC1 BB12-3487 [0,1,0,0,1,0|1,0,0]=3
24  B8R1.22  CC1CCCCCN1 BB12-3099 [0,1,0,0,0,1|0,0,0]=2
25  B8R1.22  CC1CCCNCC1 BB12-1445 [0,1,0,0,0,1|0,0,0]=2
26  B8R1.22  O=C1CCOCCN1 BB20-4217 [0,1,0,0,0,1|1,0,1]=4
27  B8R1.2  CNC1CCCCC1 BB53-1677 [0,2,0,0,0,0|0,0,0]=2
28  B8R1.2  CNC1CCOCC1 BB53-1688 [0,2,0,0,0,0|1,0,0]=3
29  B8R1.2  CNC1CCSCC1 BB53-1643 [0,2,0,0,0,0|1,0,0]=3
30  B8R1.2  COC1CCCNC1 BB12-3161 [0,2,0,0,0,0|1,0,0]=3
31  B8R1.2  COC1CCNCC1 BB12-3162 [0,2,0,0,0,0|1,0,0]=3
32  B8R1.2  NCC1COCCO1 BB01-4608 [0,2,0,0,0,0|2,0,0]=4
33  B8R1.2  O=CC1CC=CCC1 BB01-8334 [0,2,0,0,0,0|0,0,2]=4
34  B8R1.2  OCC1CCCCC1 BB20-4574 [0,2,0,0,0,0|0,0,0]=2
35  B8R1.2  OCC1CCCCN1 BB56-1322 [0,2,0,0,0,0|1,0,0]=3
36  B8R1.2  OCC1CCCOC1 BB12-1755 [0,2,0,0,0,0|1,0,0]=3
37  B8R1.2  ON=C1CCCCC1 BB12-1685 [0,2,0,0,0,0|0,0,1]=3
38  B8R1.2  [C-]#[N+]C1CCCCC1 BB56-1202 [0,2,0,0,0,0|0,0,0]=2
39  B8R1.3  O=C1CCS(=O)CC1 BB53-1536 [0,2,0,0,0,0|1,0,1]=4
40  B8R1.4  CC1CNCC(C)N1 BB20-4583 [0,2,0,0,0,0|2,0,0]=4
41  B8R1.5  O=C1CCOCC1O BB17-2979 [0,2,0,0,0,0|1,0,1]=4
42  B8R1.5  O=C1OCCCC1Br BB17-3008 [0,2,0,0,0,0|1,0,1]=4
43  B8R1.72  CC1(C)CCCNC1 BB12-1606 [0,2,0,0,0,0|1,0,0]=3
44  B8R1.72  O=S1(=O)CCNCC1 BB12-1778 [0,2,0,0,0,0|2,0,0]=4
45  B6R1.3  CC#CC1CC1 BB12-2979 [0,0,1,1,0,0|0,0,2]=4
46  B6R1.6  NCC1CCC1 BB12-1679 [0,0,1,1,0,0|1,0,0]=3