0  B4R0.2  C=CCSC m_62__875850__8363982 [0,0,0,0,0,0|2,0,1]=3
1  B5R0.1  C=C(Br)CSC m_7__22602174__5046 [0,1,0,0,0,0|2,0,1]=4
2  B5R0.1  C=C(C)CSC m_62__6464432__876088 [0,1,0,0,0,0|2,0,1]=4
3  B5R0.1  C=C(Cl)CSC m_62__875850__11986396 [0,1,0,0,0,0|2,0,1]=4
4  B5R0.1  C=C(F)CSC m_62__17849116__876088 [0,1,0,0,0,0|2,0,1]=4
5  B5R0.1  C=C(I)CSC m_62__875850__18682540 [0,1,0,0,0,0|2,0,1]=4
6  B5R0.1  C=CCC(=O)N m_22__58357__16783972 [0,1,0,0,0,0|2,0,0]=3
7  B5R0.1  C=CCN(C)C m_2230__9044904__2463448 [0,1,0,0,0,0|2,0,1]=4
8  B5R0.1  CC=CC(=O)N m_22__58357__12103014 [0,1,0,0,0,0|2,0,1]=4
9  B5R0.1  CCOC(=O)C m_1458__473186__1327610 [0,1,0,0,0,0|0,0,3]=4
10  B5R0.1  CCOC(=O)N m_282070__22187654__22150950 [0,1,0,0,0,0|1,0,2]=4
11  B5R0.2  C=CCCSC m_62__875850__9875548 [0,1,0,0,0,0|1,0,2]=4
12  B5R0.2  C=CCNCC m_270004__9143632__24715004 [0,1,0,0,0,0|1,0,2]=4
13  B5R0.2  C=CCSCC m_62__875846__8363982 [0,1,0,0,0,0|0,1,2]=4
14  B5R0.2  CC=CCSC m_62__4275932__876088 [0,1,0,0,0,0|2,0,1]=4
15  B5R0.2  CSC/C=C\Br m_7__22544354__5046 [0,1,0,0,0,0|2,0,1]=4
16  B5R0.3  C=CC(=C)CF m_271570__15607576__15157968 [0,1,0,0,0,0|2,0,1]=4
17  B5R0.3  C=CC(=CC)C m_271570__15607576__16886636 [0,1,0,0,0,0|1,0,1]=3
18  B5R0.3  C=CC(C)NC m_2230__22399842__2463448 [0,1,0,0,0,0|2,0,1]=4
19  B4R0.1  COC(=O)C m_276436__14076652__14088324 [1,1,0,0,0,0|0,0,2]=4
20  B4R0.1  COC(=O)N m_282070__22187654__22151046 [1,1,0,0,0,0|1,0,1]=4
21  B6R0.1  C=C(C=CC)CF m_271570__16945674__15157968 [0,2,0,0,0,0|1,0,1]=4
22  B6R0.1  C=CC=C(C)C#N m_271570__15607576__17565480 [0,2,0,0,0,0|1,0,1]=4
23  B6R0.1  C=CCC(=O)NN m_240690__7868478__21409900 [0,2,0,0,0,0|2,0,0]=4
24  B6R0.1  C=CNC(=O)NC m_68__1086610__21690260 [0,2,0,0,0,0|1,0,1]=4
25  B6R0.1  CC=CC(=CC)C m_271570__16945674__16886636 [0,2,0,0,0,0|1,0,1]=4
26  B6R0.3  C=C(C)C(=CC)C m_271570__19608422__16886636 [0,2,0,0,0,0|1,0,1]=4
27  B6R0.3  C=CC(C)C(=O)N m_22__58357__24596752 [0,2,0,0,0,0|2,0,0]=4
28  B6R0.3  C=CC(O)C(=O)N m_22__58357__10475936 [0,2,0,0,0,0|2,0,0]=4
29  B6R0.4  C=C=CCC(=O)N m_22__58357__16970332 [0,2,0,0,0,0|2,0,0]=4
30  B6R0.4  C=CCCC(=O)N m_22__58357__2757558 [0,2,0,0,0,0|1,0,1]=4
31  B6R0.4  C=CCNC(=N)N m_58668__2551054__2227896 [0,2,0,0,0,0|2,0,0]=4
32  B6R0.4  C=CCNC(=O)C m_270062__7594896__15585492 [0,2,0,0,0,0|1,0,1]=4
33  B6R0.4  C=CCNC(=O)N m_2554__826722__788524 [0,2,0,0,0,0|2,0,0]=4
34  B6R0.4  C=CCOC(=O)C m_1458__473186__489874 [0,2,0,0,0,0|0,0,1]=3
35  B6R0.4  C=CCOC(=O)N m_282070__22187654__22151028 [0,2,0,0,0,0|1,0,0]=3
36  B6R0.4  CC=CCC(=O)N m_22__58357__21288486 [0,2,0,0,0,0|2,0,0]=4
37  B6R0.6  C=CCSCC=C m_62__8363994__8363982 [0,2,0,0,0,0|0,1,0]=3
38  B6R1.2  CC1=CSC=N1 m_43__14773936__87467 [0,1,0,1,0,0|1,0,1]=4
39  B6R1.2  CN1C=CC=N1 m_34__5127994__7119626 [0,1,0,1,0,0|2,0,0]=4
40  B6R1.2  CN1C=CN=C1 m_34__15541202__7119628 [0,1,0,1,0,0|1,0,1]=4