0  B6R0.2  C\C(N)=C\[N+](=O)[O-] 22212 [0,0,0,0,0,0|2,0,1]=3
1  B5R0.1  C\C(Br)=C/CO 103149 [1,0,0,0,0,0|1,0,1]=3
2  B5R0.1  C\C(I)=C\CO 103135 [1,0,0,0,0,0|1,0,1]=3
3  B5R0.1  O=C(O)\C=C\I 103159 [1,0,0,0,0,0|1,0,0]=2
4  B7R0.2  CNC(=O)NC(C)=O 18364 [0,1,0,0,0,0|3,0,0]=4
5  B7R0.16  CC(=O)C(Br)C(C)C 20064 [0,1,0,0,0,0|1,0,2]=4
6  B7R0.16  CC(Br)C(Br)C(=O)O 16612 [0,1,0,0,0,0|1,0,2]=4
7  B7R1.2  CC1=CC(C)=NN1 16674 [0,0,0,1,0,0|3,0,0]=4
8  B7R1.2  CC1=CC(C)=NN1 22069 [0,0,0,1,0,0|3,0,0]=4
9  B7R1.2  CC1=CC(C)=NN1 537 [0,0,0,1,0,0|3,0,0]=4
10  B7R1.2  O=C1CNC(=O)N1 15424 [0,0,0,1,0,0|3,0,0]=4
11  B7R0.6  CC(C)=CCC(=O)O 16792 [0,0,0,0,0,1|0,0,0]=1
12  B7R0.6  CC(C)\C=C\C(=O)O 16790 [0,0,0,0,0,1|0,0,1]=2
13  B7R0.6  CC(O)=NNC(N)=O 12257 [0,0,0,0,0,1|3,0,0]=4
14  B7R0.6  O=C(O)\C=C\C(=O)O 20756 [0,0,0,0,0,1|2,0,0]=3
15  B4R0.1  NCC(=O)O 21671 [2,0,0,0,0,0|1,0,1]=4
16  B4R0.2  C\C=C/CO 102650 [2,0,0,0,0,0|0,0,1]=3
17  B4R0.2  OC\C=C/I 103154 [2,0,0,0,0,0|1,0,1]=4
18  B4R0.2  OC\C=C\I 103137 [2,0,0,0,0,0|1,0,1]=4
19  B6R0.1  C=C\C=C(/C)CO 15823 [1,1,0,0,0,0|1,0,0]=3
20  B6R0.1  CO\C=C(/F)CO 100818 [1,1,0,0,0,0|2,0,0]=4
21  B6R0.3  CC(C)=C(C)CN 102343 [1,1,0,0,0,0|1,0,1]=4
22  B6R0.3  CC(C)=C(F)CBr 100836 [1,1,0,0,0,0|1,0,1]=4
23  B6R0.3  CC(C)=C(F)CN 102362 [1,1,0,0,0,0|1,0,1]=4
24  B6R0.3  CC(C)=C(F)CO 100842 [1,1,0,0,0,0|0,0,1]=3
25  B6R0.4  CC(O)\C=C/CO 103155 [1,1,0,0,0,0|1,0,1]=4
26  B6R0.5  CC(C)(C)\C=C\Cl 102620 [1,1,0,0,0,0|1,0,1]=4
27  B6R0.7  CC(=O)C(C)(C)Br 20056 [0,1,0,0,1,0|1,0,1]=4
28  B8R0.9  COC(=O)CNC(C)=O 22216 [0,1,0,0,0,1|1,0,1]=4
29  B8R0.23  CC(=O)CC(=O)C(C)C 16776 [0,1,0,0,0,1|1,0,1]=4
30  B8R0.23  CC(=O)\C=C(/C)C(C)C 16787 [0,1,0,0,0,1|1,0,1]=4
31  B8R0.5  CCOC(=O)\C=C(\C)Br 103130 [0,2,0,0,0,0|1,0,0]=3
32  B8R0.16  CSC(=C[N+](=O)[O-])SC 522 [0,2,0,0,0,0|1,0,1]=4
33  B8R0.19  CN\C(C)=C/C(=O)OC 13305 [0,2,0,0,0,0|0,0,0]=2
34  B8R0.18  CC(=O)C(=CN)C(C)=O 13125 [0,2,0,0,0,0|2,0,0]=4
35  B6R1.2  CC1=NNC=C1 16756 [1,0,0,1,0,0|2,0,0]=4
36  B6R1.2  O=C1C=CCC1 16113 [1,0,0,1,0,0|1,0,0]=3
37  B6R1.2  OC1=NNC=C1 20767 [1,0,0,1,0,0|2,0,0]=4
38  B8R1.3  CC1=CCC(=O)CC1 102607 [0,0,0,1,0,1|1,0,0]=3
39  B8R1.1  CC1=CC(CO)=NN1 19867 [0,1,0,1,0,0|2,0,0]=4
40  B8R1.4  CC1=CC(=O)CCC1 19984 [0,1,0,1,0,0|1,0,0]=3
41  B8R1.4  O=C1C=C(O)CCC1 19981 [0,1,0,1,0,0|2,0,0]=4
42  B8R0.28  CC(C)\C=C\CC(=O)O 16794 [0,0,0,0,0,2|0,0,1]=3