0  B9R1.6  NC(=O)C1=CC=CN=C1 BIN0610 [1,0,0,0,0,0|2,0,0]=3
1  B9R1.6  O=C(O)C1=CC=CN=C1 BIN0611 [1,0,0,0,0,0|2,0,0]=3
2  B9R1.15  COC1=CC=CC=C1O BIG036 [1,0,0,0,0,0|2,0,0]=3
3  B11R1.53  O=[IH2]C1=C(C(=O)O)C=CC=C1 BIM111 [0,1,0,0,0,0|2,0,0]=3
4  B11R1.159  N[C@H]1C(C(=O)O)=CC=C[C@@H]1O BICR105 [0,1,0,0,0,0|1,0,2]=4
5  B11R2.1  [O-]C1=NSC2=C1C=CC=C2 BIB6310 [0,0,0,1,0,0|2,0,1]=4
6  B10R1.13  N=C(N)C1=CC=C(N)C=C1 BIMI2126 [1,1,0,0,0,0|2,0,0]=4
7  B10R1.13  NC1=CC=C(C(=O)O)C=C1 BIA0601 [1,1,0,0,0,0|1,0,0]=3
8  B10R1.15  COC(=N)C1=NC=CC=C1 BIM0164 [1,1,0,0,0,0|2,0,0]=4
9  B10R1.113  NC(=O)C1=CC(N)=CC=C1 BIA0116 [1,1,0,0,0,0|1,0,0]=3
10  B10R1.20  O=CC1=C(C=O)C=CC=C1 BIA120 [1,1,0,0,0,0|1,0,0]=3
11  B10R1.20  O=CC1=C(C=O)C=CC=C1 BIP0693 [1,1,0,0,0,0|1,0,0]=3
12  B10R1.25  CCC1=C(O)C=C(O)C=C1 BIE1003 [1,1,0,0,0,0|1,0,1]=4
13  B12R1.894  O=C(O)[13C]1=[13C](Cl)[13CH]=[13CH][13C](Cl)=[13C]1O BISC1014 [0,2,0,0,0,0|2,0,0]=4
14  B12R1.511  O=C([O-])C1=C(I)C(I)=CC(I)=C1 BIT3070 [0,2,0,0,0,0|2,0,0]=4
15  B12R1.893  CC(=O)C1=C(O)C(O)=C(O)C=C1 BIG1001 [0,2,0,0,0,0|1,0,0]=3
16  B10R1.66  O=[13C](O)\[13CH]=[13CH]/C1=CN=CN1 BISC1057 [0,0,1,1,0,0|2,0,0]=4
17  B10R2.7  C1=CN=C2NC=CC2=C1 BIA1470 [1,0,0,1,0,0|1,0,1]=4
18  B8R1.7  CC(=O)N1C=CN=C1 BIA1755 [1,0,0,0,1,0|2,0,0]=4