0  B10R1.18  C1=CC=C(C=C1)NC(=S)N 119 [0,0,0,0,0,0|2,0,1]=3
1  B10R1.18  CC(=S)NC1=CC=CC=C1 695 [0,0,0,0,0,0|2,0,1]=3
2  B10R1.18  CC(CC1=CC=CC=C1)N 262 [0,0,0,0,0,0|0,0,0]=0
3  B10R1.18  CC(CC1=CC=CC=C1)N 263 [0,0,0,0,0,0|0,0,0]=0
4  B10R1.18  C[C@@H](CC1=CC=CC=C1)N 170 [0,0,0,0,0,0|0,0,0]=0
5  B9R1.8  C1=CC=C(C=C1)CC=O 746 [1,0,0,0,0,0|1,0,1]=3
6  B9R1.8  C1=CC=C(C=C1)CCO 750 [1,0,0,0,0,0|1,0,0]=2
7  B11R1.20  CC(=O)NC1=CC=C(C=C1)O 121 [0,1,0,0,0,0|2,0,1]=4
8  B11R1.36  CC(C(C1=CC=CC=C1)O)N 1182 [0,1,0,0,0,0|0,0,0]=1
9  B11R1.40  C[C@@H](CC1=CC=CC=C1)NC 313 [0,1,0,0,0,0|0,0,0]=1
10  B11R1.509  CC(C)(CC1=CC=CC=C1)O 715 [0,1,0,0,0,0|1,0,0]=2
11  B9R1.6  C1=CC=C(C=C1)C(=O)N 57 [0,0,0,0,1,0|1,0,1]=3
12  B9R1.6  C1=CC=C(C=C1)C(=O)[O-] 67 [0,0,0,0,1,0|2,0,1]=4
13  B9R1.6  CC(=O)C1=CC=CC=C1 713 [0,0,0,0,1,0|1,0,1]=3
14  B11R1.91  CC(=O)OCC1=CC=CC=C1 723 [0,0,0,0,0,1|1,0,1]=3
15  B8R1.2  C1=CC=C(C=C1)C=O 15 [2,0,0,0,0,0|1,0,1]=4
16  B8R1.2  CCC1=NC=CN=C1 111 [2,0,0,0,0,0|2,0,0]=4
17  B10R1.17  C1=CC=C(C=C1)\C=C\CO 743 [1,1,0,0,0,0|0,0,2]=4
18  B10R1.61  C1=CC=C(C(=C1)C(=O)N)O 464 [0,1,0,0,1,0|1,0,1]=4
19  B12R1.107  CC(C1=CC=CC=C1)OC(=O)C 787 [0,1,0,0,0,1|1,0,1]=4
20  B12R1.34  C[C@@H]([C@H](C1=CC=CC=C1)O)NC 436 [0,2,0,0,0,0|0,0,0]=2
21  B12R1.478  CC(C)C(C=O)C1=CC=CC=C1 796 [0,2,0,0,0,0|1,0,0]=3
22  B12R1.32  CCOC(=O)CC1=CC=CC=C1 716 [0,2,0,0,0,0|1,0,1]=4
23  B12R1.118  COC(CC1=CC=CC=C1)OC 781 [0,2,0,0,0,0|1,0,0]=3