0  B6R0.1  CCC(C)N=C=S B016332 [0,0,0,0,0,0|1,1,1]=3
1  B6R0.1  CCNC(C)CO B039551 [0,0,0,0,0,0|3,0,0]=3
2  B6R0.1  CNC(C)CCO B039563 [0,0,0,0,0,0|1,0,0]=1
3  B5R0.1  CC(N)CCO B039558 [1,0,0,0,0,0|1,0,0]=2
4  B5R0.2  CCSCCO B049702 [1,0,0,0,0,0|1,0,0]=2
5  B5R0.3  CC\C(N)=N\O B030359 [1,0,0,0,0,0|2,0,1]=4
6  B7R0.2  CC(CO)CN(C)C B039565 [0,1,0,0,0,0|3,0,0]=4
7  B7R0.3  CCN(C)CCCO B039576 [0,1,0,0,0,0|1,0,0]=2
8  B7R0.5  CC(CCN)N(C)C B039557 [0,1,0,0,0,0|2,0,0]=3
9  B7R0.5  CC(CCO)N(C)C B039575 [0,1,0,0,0,0|1,0,0]=2
10  B7R0.7  CCNC(C)CCO B039584 [0,1,0,0,0,0|0,0,0]=1
11  B7R0.7  O=S(CCO)CCO B048617 [0,1,0,0,0,0|2,0,0]=3
12  B7R0.11  C#CC(C)(O)CCC B049584 [0,1,0,0,0,0|1,0,2]=4
13  B7R1.3  NC1CCCOC1 B049073 [0,0,0,1,0,0|3,0,0]=4
14  B7R1.3  NC1CCOCC1 B050801 [0,0,0,1,0,0|1,0,0]=2
15  B4R0.1  OCC(F)F B019710 [2,0,0,0,0,0|2,0,0]=4
16  B6R0.3  CC(CN)N(C)C B039581 [1,1,0,0,0,0|2,0,0]=4
17  B6R0.5  OCCC(F)(F)F B039719 [1,1,0,0,0,0|2,0,0]=4
18  B6R0.8  C#CC(C)(N)CC B048725 [1,1,0,0,0,0|0,0,2]=4
19  B6R0.8  C#CC(C)(N)CC B049751 [1,1,0,0,0,0|0,0,2]=4
20  B6R0.8  C#CC(C)(O)CC B048853 [1,1,0,0,0,0|0,0,2]=4
21  B8R0.16  CCN(CC)CC(C)N B006616 [0,2,0,0,0,0|2,0,0]=4
22  B8R0.19  CCN(C)CC(C)CN B039547 [0,2,0,0,0,0|2,0,0]=4
23  B8R0.3  CCN(C)C(C)CCN B039548 [0,2,0,0,0,0|1,0,0]=3
24  B8R0.9  CCN(C)CCC(=O)O B039614 [0,2,0,0,0,0|1,0,0]=3
25  B6R1.11  CC(N)C1CC1 B039284 [1,0,0,1,0,0|2,0,0]=4
26  B8R1.1  OCC1CC(O)CN1 B050445 [0,1,0,1,0,0|1,0,0]=3
27  B8R1.4  CC1CCNC(C)C1 B016012 [0,1,0,1,0,0|1,0,0]=3
28  B8R1.51  O=S1(=O)CCC(O)C1 B048719 [0,1,0,1,0,0|2,0,0]=4
29  B8R1.2  CCC1CCNCC1 B039287 [0,1,0,1,0,0|1,0,0]=3
30  B8R1.2  ClCC1COCCO1 B039648 [0,1,0,1,0,0|1,0,0]=3
31  B8R1.2  NCC1CCCOC1 B049869 [0,1,0,1,0,0|1,0,0]=3
32  B8R1.3  CN1CCC(N)CC1 B016064 [0,1,0,1,0,0|2,0,0]=4
33  B8R1.3  CN1CCC(N)CC1 B036196 [0,1,0,1,0,0|2,0,0]=4
34  B8R1.5  CC1CCCNC1C B052585 [0,1,0,1,0,0|1,0,0]=3
35  B8R1.7  CC(N)C1CCCO1 B006178 [0,1,0,1,0,0|2,0,0]=4