0  B7R0.1  C#CCCCCCO ACT09966 [1,0,0,0,0,0|0,0,3]=4
1  B7R0.1  C(CCCO)CCN ACT05269 [1,0,0,0,0,0|1,0,1]=3
2  B7R0.1  C(CCCS)CCS ACT06276 [1,0,0,0,0,0|1,1,1]=4
3  B9R0.45  CCCCCCCCC#C ACT10241 [0,1,0,0,0,0|1,0,2]=4
4  B9R0.45  CCCC\C=C\C=C\C=O ACT06049 [0,1,0,0,0,0|0,0,3]=4
5  B9R1.8  C1CCN(CC1)CCCl ACT05803 [0,0,0,1,0,0|2,0,1]=4
6  B9R1.8  C1CCN[C@@H](C1)CCO ACT02082 [0,0,0,1,0,0|1,0,2]=4
7  B9R1.8  C1COCCC1CCO ACT09747 [0,0,0,1,0,0|1,0,2]=4
8  B9R1.12  CCCCc1ccsc1 ACT11573 [0,0,0,1,0,0|2,0,1]=4
9  B9R1.15  CN1CCCCC1CO ACT04178 [0,0,0,1,0,0|1,0,2]=4
10  B9R1.15  CN1CCCC[C@@H]1CO ACT10048 [0,0,0,1,0,0|1,0,2]=4
11  B9R1.15  CN1CCCC[C@H]1CO ACT08347 [0,0,0,1,0,0|1,0,2]=4
12  B6R0.6  C=CCCCCCl ACT10617 [2,0,0,0,0,0|1,0,0]=3
13  B6R0.6  C=CCCCCO ACT10087 [2,0,0,0,0,0|1,0,0]=3
14  B6R0.6  CCC\C=C\C=O ACT06041 [2,0,0,0,0,0|0,0,2]=4
15  B6R0.6  CNCCCNC ACT10138 [2,0,0,0,0,0|2,0,0]=4
16  B8R0.6  C(CCN)C[C@@H](CO)N ACT07913 [1,1,0,0,0,0|1,0,1]=4
17  B8R0.6  CCCCCC(C=C)O ACT05316 [1,1,0,0,0,0|0,0,2]=4
18  B8R0.6  CCCCCC(CC)O ACT06057 [1,1,0,0,0,0|0,0,2]=4
19  B8R0.6  COCCCC(=O)OC ACT03831 [1,1,0,0,0,0|2,0,0]=4
20  B10R0.19  CCCCC(C(=O)OCC)Br ACT02550 [0,2,0,0,0,0|2,0,0]=4
21  B10R0.71  C(CCCCO)CCCCBr ACT09848 [0,2,0,0,0,0|0,0,2]=4
22  B10R0.71  CCCCC\C=C\C=C\C=O ACT06064 [0,2,0,0,0,0|0,0,2]=4
23  B8R1.2  C1CC(CNC1)CO ACT04176 [1,0,0,1,0,0|1,0,1]=4
24  B8R1.2  C1CCC(CC1)CO ACT10090 [1,0,0,1,0,0|0,0,1]=3
25  B8R1.2  C1CCNC(C1)CO ACT02103 [1,0,0,1,0,0|1,0,1]=4
26  B8R1.2  C1CCN[C@@H](C1)CO ACT09705 [1,0,0,1,0,0|1,0,1]=4
27  B8R1.2  C1CCN[C@H](C1)CO ACT09534 [1,0,0,1,0,0|1,0,1]=4
28  B8R1.2  C1CNCCC1CO ACT02060 [1,0,0,1,0,0|1,0,1]=4
29  B8R1.2  C1COCCC1CO ACT04637 [1,0,0,1,0,0|1,0,1]=4
30  B8R1.8  C1CC(NC1)CCO ACT09194 [1,0,0,1,0,0|1,0,1]=4
31  B8R1.11  CN1CCCC1CO ACT09599 [1,0,0,1,0,0|1,0,1]=4
32  B8R1.11  CN1CCC[C@@H]1CO ACT10747 [1,0,0,1,0,0|1,0,1]=4
33  B8R1.11  CN1CCC[C@H]1CO ACT09566 [1,0,0,1,0,0|1,0,1]=4
34  B10R1.1  CCCC1CCC(=O)CC1 ACT05145 [0,1,0,1,0,0|1,0,1]=4
35  B10R2.99  C1C2CC(C1C=C2)CN ACT11563 [0,0,0,2,0,0|2,0,0]=4
36  B10R2.99  C1[C@H]2CC([C@@H]1C=C2)CO ACT11562 [0,0,0,2,0,0|2,0,0]=4