0  B5R0.1  N[C@@H](CCO)C AP00425 [0,0,0,0,0,0|3,0,1]=4
1  B4R0.2  BrCCC=C AP10272 [1,0,0,0,0,0|2,0,1]=4
2  B4R0.2  C(C=O)C#N AP00457 [1,0,0,0,0,0|2,0,1]=4
3  B4R0.2  Cl/C=C/CCl AP00032 [1,0,0,0,0,0|3,0,0]=4
4  B6R0.3  N[C@H](C(=O)N)CC AP00372 [0,1,0,0,0,0|2,0,0]=3
5  B6R0.3  N[C@H](CO)C(=O)O AP10045 [0,1,0,0,0,0|3,0,0]=4
6  B6R0.4  CN(CCNC)C AP10114 [0,1,0,0,0,0|3,0,0]=4
7  B6R1.2  N=1CCCC1N AP00416 [0,0,0,1,0,0|2,0,0]=3
8  B5R0.5  CC(C(=O)N)N AP10196 [1,1,0,0,0,0|1,0,0]=3
9  B7R0.4  C(C)OC=CC(=O)Cl AP10022 [0,2,0,0,0,0|1,1,0]=4
10  B7R1.2  S1C(NC(C1)=O)=O AP00324 [0,1,0,1,0,0|1,0,1]=4
11  B7R1.3  S1CCC(CC1)=O AP10112 [0,1,0,1,0,0|1,0,0]=3
12  B7R1.22  BrCC(=O)C1CC1 AP00135 [0,1,0,1,0,0|1,0,0]=3
13  B7R1.18  C1(CCC1)C(=O)O AP00003 [0,1,0,1,0,0|2,0,0]=4