0  B11R1.40  CN[C@@H](C)CC1=CC=CC=C1 DB01577 [0,0,0,0,0,0|2,0,1]=3
1  B11R1.40  CN[C@H](C)CC1=CC=CC=C1 DB09571 [0,0,0,0,0,0|2,0,1]=3
2  B10R1.17  CNCCC1=CC=CC=N1 DB06698 [1,0,0,0,0,0|2,0,1]=4
3  B10R1.17  NNCCC1=CC=CC=C1 DB00780 [1,0,0,0,0,0|2,0,1]=4
4  B10R1.18  CC(N)CC1=CC=CC=C1 DB00182 [1,0,0,0,0,0|1,0,1]=3
5  B10R1.18  C[C@H](N)CC1=CC=CC=C1 DB01576 [1,0,0,0,0,0|1,0,1]=3
6  B10R1.18  O=C(O)CC1=CC=CC=C1 DB09269 [1,0,0,0,0,0|0,0,0]=1
7  B12R1.34  CN[C@@H](C)[C@@H](O)C1=CC=CC=C1 DB00852 [0,1,0,0,0,0|2,0,1]=4
8  B12R1.34  CN[C@@H](C)[C@H](O)C1=CC=CC=C1 DB01364 [0,1,0,0,0,0|2,0,1]=4
9  B12R1.194  CNC(C)(C)CC1=CC=CC=C1 DB01365 [0,1,0,0,0,0|2,0,1]=4
10  B10R1.15  COC(=O)C1=CN=CC=C1 DB13882 [0,0,0,0,1,0|1,0,0]=2
11  B10R1.15  NNC(=O)C1=CC=NC=C1 DB00951 [0,0,0,0,1,0|3,0,0]=4
12  B11R1.20  CC(=O)NC1=CC=C(O)C=C1 DB00316 [1,1,0,0,0,0|1,0,0]=3
13  B11R1.20  CC(N)CC1=CC=C(O)C=C1 DB09352 [1,1,0,0,0,0|1,0,1]=4
14  B11R1.36  C[C@@H](N)[C@@H](O)C1=CC=CC=C1 DB00397 [1,1,0,0,0,0|1,0,1]=4
15  B11R1.509  CC(C)(N)CC1=CC=CC=C1 DB00191 [1,1,0,0,0,0|1,0,1]=4
16  B11R1.222  COC(=O)C1=CC=CC=C1O DB09543 [0,1,0,0,1,0|0,0,0]=2
17  B13R1.417  C\N=C(/NC)NCC1=CC=CC=C1 DB00217 [0,1,0,0,0,1|2,0,0]=4
18  B13R1.348  NC(=O)NC(=O)CC1=CC=CC=C1 DB01121 [0,2,0,0,0,0|1,0,1]=4
19  B13R2.64  C1=CC=C(CC2=NCCN2)C=C1 DB00797 [0,1,0,1,0,0|2,0,0]=4
20  B9R1.6  NC(=O)C1=CC=CN=C1 DB02701 [1,0,0,0,1,0|2,0,0]=4
21  B9R1.6  O=C(O)C1=CC=CC=C1 DB03793 [1,0,0,0,1,0|0,0,0]=2
22  B9R1.6  O=C(O)C1=CN=CC=C1 DB00627 [1,0,0,0,1,0|1,0,0]=3
23  B9R1.6  O=C([O-])C1=CC=CC=N1 DB11175 [1,0,0,0,1,0|1,0,1]=4