0  B6R0.1  CCC(C)CNC F8889-4114 [0,0,0,0,0,0|3,0,1]=4
1  B6R0.1  CCNC(=O)CBr F3310-0889 [0,0,0,0,0,0|3,0,0]=3
2  B6R0.1  CCS(=O)CCN F2147-1018 [0,0,0,0,0,0|3,0,0]=3
3  B5R0.1  CC(O)CCN F8880-3625 [1,0,0,0,0,0|1,0,2]=4
4  B5R0.1  CNCC(N)=O F8880-4275 [1,0,0,0,0,0|2,0,0]=3
5  B5R0.1  COCC(N)=O F1913-0020 [1,0,0,0,0,0|2,0,0]=3
6  B7R0.2  CC(C)C\C(N)=N\O F2145-0870 [0,1,0,0,0,0|3,0,0]=4
7  B7R0.3  COC(=O)NCCN F8882-3539 [0,1,0,0,0,0|1,1,0]=3
8  B7R1.1  CCC1CCCN1 F8880-6440 [0,0,0,1,0,0|2,0,1]=4
9  B7R1.1  CCC1CCCN1 F8888-3269 [0,0,0,1,0,0|2,0,1]=4
10  B7R1.2  NC1CNC(=O)C1 F2158-1004 [0,0,0,1,0,0|2,0,0]=3
11  B7R1.3  NC1=NCCSC1 F2155-0023 [0,0,0,1,0,0|3,0,0]=4
12  B7R1.4  CC1CCCC1N F8888-6869 [0,0,0,1,0,0|2,0,1]=4
13  B7R1.4  CN1CCSC1=N F0861-0066 [0,0,0,1,0,0|3,0,0]=4
14  B7R1.4  O=C1CCCC1Br F8888-2301 [0,0,0,1,0,0|2,0,0]=3
15  B6R0.2  CC(=O)CC(C)N F1791-1136 [1,1,0,0,0,0|0,0,0]=2
16  B6R0.2  CC(=O)CC(C)N F1997-0017 [1,1,0,0,0,0|0,0,0]=2
17  B6R0.4  C=C(C)CCCBr F1913-0542 [1,1,0,0,0,0|1,0,0]=3
18  B6R0.4  C=C(C)CCCO F1913-0541 [1,1,0,0,0,0|1,0,0]=3
19  B6R0.4  CCCNC(C)C F8889-6089 [1,1,0,0,0,0|1,0,1]=4
20  B6R0.4  CCNCC(C)C F8880-2710 [1,1,0,0,0,0|1,0,1]=4
21  B6R0.4  CCOCC(C)N F2167-3742 [1,1,0,0,0,0|1,0,1]=4
22  B6R0.6  CCOCCNC F8880-1014 [1,1,0,0,0,0|1,0,1]=4
23  B8R0.2  CCC(Br)C(=O)N(C)C F1913-0281 [0,2,0,0,0,0|1,0,0]=3
24  B8R0.2  COC(=O)C(Cl)C(C)C F8882-8699 [0,2,0,0,0,0|0,1,0]=3
25  B8R0.5  CCCC(=O)NC(C)C F3310-1187 [0,2,0,0,0,0|1,0,0]=3
26  B8R0.23  CC(=O)CC(=O)C(C)C F8887-7353 [0,2,0,0,0,0|1,0,1]=4
27  B8R0.3  CCOC(=O)N(C)OC F1903-0372 [0,2,0,0,0,0|1,1,0]=4
28  B8R0.8  CC(C)C(=O)NCCN F8889-0178 [0,2,0,0,0,0|2,0,0]=4
29  B8R0.30  CCCS(=O)(=O)CCCl F0907-4175 [0,2,0,0,0,0|2,0,0]=4
30  B6R1.5  CC1CC(C)N1 F8887-5508 [1,0,0,1,0,0|1,0,1]=4
31  B6R1.6  CCC1CNC1 F8881-5075 [1,0,0,1,0,0|1,0,1]=4
32  B8R1.1  CNC1=NCC(C)S1 F0266-3754 [0,1,0,1,0,0|1,1,0]=4
33  B8R1.1  O=C1NC(CO)CO1 F2147-2878 [0,1,0,1,0,0|1,1,0]=4
34  B8R1.18  CN1CC(N)CC1=O F2147-0202 [0,1,0,1,0,0|1,0,0]=3
35  B8R1.40  NCC(=O)NC1CC1 F2158-0297 [0,1,0,1,0,0|2,0,0]=4
36  B8R1.51  CC1(C)COC(=O)C1 F1913-2916 [0,1,0,1,0,0|0,1,0]=3
37  B8R1.3  O=C1CCC(O)CN1 F1911-5594 [0,1,0,1,0,0|1,0,0]=3
38  B8R1.3  O=C1CC[C@H](O)CN1 F1911-5595 [0,1,0,1,0,0|1,0,0]=3
39  B8R1.50  CN1CCC(N)C1=O F1905-0252 [0,1,0,1,0,0|1,0,0]=3
40  B8R1.37  CSCC(N)C1CC1 F2147-8202 [0,1,0,1,0,0|1,0,1]=4
41  B8R1.8  CCSC1=NCCN1 F2147-0319 [0,1,0,1,0,0|2,0,0]=4
42  B8R1.8  CSCC1CCCN1 F2167-0496 [0,1,0,1,0,0|1,0,1]=4
43  B8R1.11  O=C1CCCN1CCl F0861-0039 [0,1,0,1,0,0|1,0,0]=3