0  B22R3.253815  NC1=CC=CC=C1C(=O)OC2=CC=C3C=CC=CC3=C2 CNP0002589.0 [0,0,0,0,0,0|0,0,0]=0
1  B22R3.253815  O=C(NC1=CN=C2C=CC=CC2=C1)C3=CC=CC=C3Cl CNP0536710.0 [0,0,0,0,0,0|3,0,0]=3
2  B22R3.253815  O=C(OC1=CC=C2C=CC=CC2=C1)C3=CC=CC=C3O CNP0512448.0 [0,0,0,0,0,0|1,0,0]=1
3  B21R3.24492  O=C(C[N+]1=CC=C2C=CC=CC2=C1)C3=CC=CC=C3 CNP0593117.0 [1,0,0,0,0,0|2,0,0]=3
4  B21R3.24492  O=C(OC1=CC=C2C=CC=CC2=C1)C3=CC=CC=C3 CNP0071014.0 [1,0,0,0,0,0|0,0,0]=1
5  B23R3.168032  O=C(CC1=CC=C2C=CC=NC2=C1)C3=CC=C(C=C3O)O CNP0361866.0 [0,1,0,0,0,0|3,0,0]=4
6  B23R3.2054088  COC1=CC=CC=C1C(=O)OC2=CC=C3C=CC=CC3=C2 CNP0496063.0 [0,1,0,0,0,0|1,0,0]=2
7  B23R3.7972431  O=C(OC1=CC=C2C=CC(=O)OC2=C1)C3=CC=CC=C3Cl CNP0519504.0 [0,1,0,0,0,0|2,0,0]=3
8  B23R4.1529622  C1=CC=C2C=[N+](C=CC2=C1)CC3=CNC4=CC=CC=C34 CNP0511885.0 [0,0,0,1,0,0|3,0,0]=4
9  B23R4.1529622  C1=CC=C2C=[N+](C=CC2=C1)CC3=CNC4=CC=CC=C34 CNP0524410.0 [0,0,0,1,0,0|3,0,0]=4
10  B20R2.8343  NC1=CC=CC=C1C(=O)OCC=CC2=CC=CC=C2 CNP0140089.0 [1,0,1,0,0,0|0,0,1]=3
11  B20R3.30190  C(#CC1=CC=C2C=CC=CC2=C1)C3=CC=CC=C3 CNP0397726.0 [2,0,0,0,0,0|1,0,1]=4
12  B20R3.30190  C(=CC1=CN=C2C=CC=CC2=C1)C3=CC=CC=C3 CNP0460043.0 [2,0,0,0,0,0|2,0,0]=4
13  B22R3.28944  O=C(NC1=CC2=CC=CC=C2OC1=O)C3=CC=CC=C3 CNP0221928.0 [1,1,0,0,0,0|2,0,0]=4
14  B22R3.242340  O=C(OC1=CC=C2C=CC(=O)OC2=C1)C3=CC=CC=C3 CNP0071130.0 [1,1,0,0,0,0|1,0,0]=3
15  B22R3.242707  O=C(OC1=CC=C2C=C(C=CC2=C1)Cl)C3=CC=CC=C3 CNP0476740.0 [1,1,0,0,0,0|0,0,0]=2
16  B22R3.3256750  O=C(C(=O)C1=CC=C2C=CC=CC2=C1)C3=CC=CC=C3 CNP0464027.0 [1,1,0,0,0,0|1,0,0]=3
17  B24R3.2144004  COC1=CC=CC=C1NC(=O)NC2=CC=C3C=CC=CC3=C2 CNP0082969.0 [0,1,0,0,0,1|2,0,0]=4
18  B24R3.2144004  N#CC1=CC=CC=C1NC(=O)NC2=CC=C3C=CC=CC3=C2 CNP0022371.0 [0,1,0,0,0,1|1,0,1]=4
19  B24R3.12033559  O=C(OC1=CC=C2C=CC(=O)OC2=C1)C3=CC=C(C=C3Cl)Cl CNP0521898.0 [0,2,0,0,0,0|2,0,0]=4
20  B24R3.123236146  CC1=CC(=O)OC2=CC(=CC=C12)OC(=O)C3=CC=CC=C3Br CNP0239693.0 [0,2,0,0,0,0|2,0,0]=4
21  B22R3.791519  O=C(CC1=CC=CC=C1)OC2=CC=C3C=CC=CC3=C2 CNP0495225.0 [0,0,1,1,0,0|1,0,1]=4
22  B22R4.6118280  NC1=CC2=CC3=CC=CC=C3C=C2C4=CC=CC=C14 CNP0277783.0 [1,0,0,1,0,0|2,0,0]=4
23  B22R4.562900  OC1=CC=CC2=C1C=CC3=CC4=CC=CC=C4C=C23 CNP0321303.0 [1,0,0,1,0,0|2,0,0]=4
24  B22R4.3225226  C1=CC=C2C=C(C=CC2=C1)C3=CC4=CC=CC=C4S3 CNP0193859.0 [1,0,0,1,0,0|2,0,0]=4
25  B22R4.21677  O=C1C2=CC=CC=C2C=C3N1C=CC4=CC=CC=C34 CNP0444770.0 [0,0,0,1,1,0|2,0,0]=4
26  B22R4.1440993  C1=CC=C2N=CC(=CC2=C1)C3=CNC4=CC=CC=C34 CNP0234461.0 [0,0,0,1,1,0|2,0,0]=4
27  B24R4.3486419  O=C1NC2=CC=CC=C2C1=CC3=CC=C4N=CC=CC4=C3 CNP0397795.0 [0,1,0,1,0,0|2,0,0]=4