0  B10R1.17  CNCCC1=CC=CC=N1 DB06698 [1,0,0,0,0,0|3,0,0]=4
1  B10R1.17  NNCCC1=CC=CC=C1 DB00780 [1,0,0,0,0,0|2,0,0]=3
2  B10R1.17  OCCOC1=CC=CC=C1 DB11304 [1,0,0,0,0,0|1,0,1]=3
3  B12R1.43  N[C@@H](CC1=CC=CC=C1)C(=O)O DB00120 [0,1,0,0,0,0|0,0,0]=1
4  B12R1.226  N=C(N)NCC1=CC([123I])=CC=C1 DB09546 [0,1,0,0,0,0|3,0,0]=4
5  B12R1.226  NC(N)=NCC1=CC(I)=CC=C1 DB06704 [0,1,0,0,0,0|3,0,0]=4
6  B10R1.18  CC(N)CC1=CC=CC=C1 DB00182 [0,0,0,0,1,0|2,0,1]=4
7  B10R1.18  C[C@H](N)CC1=CC=CC=C1 DB01576 [0,0,0,0,1,0|2,0,1]=4
8  B10R1.18  O=C(O)CC1=CC=CC=C1 DB09269 [0,0,0,0,1,0|0,0,0]=1
9  B12R1.252  O=C(O)CCCC1=CC=CC=C1 DB06819 [0,0,0,0,0,1|0,0,0]=1
10  B11R1.40  CN[C@@H](C)CC1=CC=CC=C1 DB01577 [1,1,0,0,0,0|2,0,0]=4
11  B11R1.40  CN[C@H](C)CC1=CC=CC=C1 DB09571 [1,1,0,0,0,0|2,0,0]=4
12  B11R1.20  CC(=O)NC1=CC=C(O)C=C1 DB00316 [0,1,0,0,1,0|2,0,0]=4
13  B11R1.35  N[C@@H](CC1=CN=CN1)C(=O)O DB00117 [0,1,0,0,1,0|2,0,0]=4
14  B13R1.348  NC(=O)NC(=O)CC1=CC=CC=C1 DB01121 [0,1,0,0,0,1|1,0,1]=4
15  B13R1.133  N[C@@H](CC1=CC=C(O)C=C1)C(=O)O DB00135 [0,2,0,0,0,0|0,0,0]=2
16  B11R2.4  NC1CC1C2=CC=CC=C2 DB00752 [1,0,0,1,0,0|1,0,1]=4
17  B9R1.6  NC(=O)C1=CC=CN=C1 DB02701 [0,0,0,0,2,0|2,0,0]=4
18  B9R1.6  O=C(O)C1=CC=CC=C1 DB03793 [0,0,0,0,2,0|0,0,0]=2
19  B9R1.6  O=C(O)C1=CN=CC=C1 DB00627 [0,0,0,0,2,0|1,0,0]=3
20  B9R1.6  O=C([O-])C1=CC=CC=N1 DB11175 [0,0,0,0,2,0|1,0,1]=4