0  B8R0.1  CCOC(=O)CCCBr ACT03470 [0,0,0,0,0,0|2,0,2]=4
1  B8R0.1  CCOC(=O)CCSC ACT06366 [0,0,0,0,0,0|0,0,2]=2
2  B8R0.1  CCOC(=O)NCCCl ACT09961 [0,0,0,0,0,0|3,0,1]=4
3  B7R0.1  CCC=CC=CC=O ACT06050 [1,0,0,0,0,0|3,0,0]=4
4  B7R0.3  COC(=O)CCSC ACT06346 [1,0,0,0,0,0|0,0,2]=3
5  B7R0.7  CCOC(=O)C#CC ACT02922 [1,0,0,0,0,0|0,0,2]=3
6  B7R0.7  CCOC(=O)CCN ACT00057 [1,0,0,0,0,0|1,0,2]=4
7  B7R0.7  CCOC(=O)CNC ACT08249 [1,0,0,0,0,0|1,0,1]=3
8  B7R0.7  CCOC(=O)C[N+]#[C-] ACT02731 [1,0,0,0,0,0|1,0,2]=4
9  B9R0.5  CCOC(=O)COCCCl ACT02883 [0,1,0,0,0,0|2,0,1]=4
10  B9R0.5  CCO\C=C\C(=O)OCC ACT04466 [0,1,0,0,0,0|0,1,0]=2
11  B9R0.48  CCOC(=O)CNC(=O)C ACT05046 [0,1,0,0,0,0|2,0,1]=4
12  B6R0.6  CCC\C=C\C=O ACT06041 [2,0,0,0,0,0|1,1,0]=4
13  B6R0.1  CC#CC(=O)OC ACT09348 [2,0,0,0,0,0|0,0,2]=4
14  B6R0.1  CCCC(=O)SC ACT06405 [2,0,0,0,0,0|1,0,0]=3
15  B6R0.1  CCOC(=O)C#C ACT08916 [2,0,0,0,0,0|0,0,2]=4
16  B6R0.1  CCOC(=O)CBr ACT01957 [2,0,0,0,0,0|1,0,1]=4
17  B6R0.1  CCOC(=O)CN ACT03311 [2,0,0,0,0,0|1,0,1]=4
18  B6R0.1  CNCC(=O)OC ACT07185 [2,0,0,0,0,0|1,0,1]=4
19  B6R0.4  C(\C=C\C(=O)O)Cl ACT11965 [2,0,0,0,0,0|2,0,0]=4
20  B10R0.2  CCOC(=O)OC(=O)OCC ACT07307 [0,2,0,0,0,0|1,1,0]=4
21  B8R1.18  Cc1c(oc(=O)o1)C ACT08015 [1,0,0,1,0,0|1,0,1]=4
22  B8R1.18  Cc1cc(c(o1)C)S ACT06481 [1,0,0,1,0,0|1,0,1]=4
23  B10R1.11  CCOC(=O)c1c[nH]cn1 ACT09368 [0,1,0,1,0,0|1,0,1]=4
24  B10R1.11  CCOC(=O)c1c[nH]nc1 ACT01767 [0,1,0,1,0,0|1,0,1]=4
25  B10R1.11  CCOC(=O)c1ccc[nH]1 ACT01682 [0,1,0,1,0,0|1,0,1]=4
26  B10R1.11  CCOC(=O)c1cscn1 ACT07238 [0,1,0,1,0,0|0,0,1]=3