0  B10R1.61  CC1=C(C(=O)O)C=NC=N1 1402 [0,0,0,0,0,0|3,0,0]=3
1  B10R1.61  NC(=O)C1=C(O)C=CN=C1 1411 [0,0,0,0,0,0|2,0,0]=2
2  B10R1.61  NC1=C(C(=O)O)C=CN=C1 1274 [0,0,0,0,0,0|2,0,0]=2
3  B10R1.61  O=C(O)C1=C(O)C=CN=C1 1401 [0,0,0,0,0,0|1,0,0]=1
4  B9R1.6  CC(=O)C1=NC=CC=N1 1413 [1,0,0,0,0,0|3,0,0]=4
5  B9R1.6  O=C(O)C1=CC=CN=N1 1275 [1,0,0,0,0,0|2,0,0]=3
6  B11R1.87  NC1=C(P(=O)(O)O)C=CC=C1 1683 [0,1,0,0,0,0|2,0,0]=3
7  B11R1.87  O=P(O)(O)C1=C(Br)C=CC=C1 1458 [0,1,0,0,0,0|2,0,0]=3
8  B11R1.87  O=P(O)(O)C1=CC=CC=C1O 1462 [0,1,0,0,0,0|1,0,0]=2
9  B11R1.222  COC(=O)C1=C(O)C=CN=C1 1410 [0,1,0,0,0,0|1,0,0]=2
10  B11R2.1  ClC1=CSC2=CC=CC=C12 1776 [0,0,0,1,0,0|2,1,0]=4
11  B11R2.1  OC1=NNC2=CC=CC=C21 1563 [0,0,0,1,0,0|2,0,0]=3
12  B9R1.41  NC1=CSN=C1C(=O)O 1963 [0,0,0,0,1,0|3,0,0]=4
13  B10R1.194  CC1=C(C)C(C(=O)O)=CS1 2261 [0,1,0,0,1,0|2,0,0]=4
14  B12R1.511  CC1=CC(C)=C(O)C([N+](=O)[O-])=C1 1465 [0,2,0,0,0,0|1,0,1]=4
15  B12R1.354  NC1=CC(C(=O)NO)=C(O)C=C1 1404 [0,2,0,0,0,0|0,0,0]=2
16  B12R2.2028  O=C1OC(=O)C2=CN=CC=C12 1422 [0,1,0,1,0,0|1,0,1]=4
17  B12R2.2028  O=C1OC(=O)C2=NC=CC=C12 1421 [0,1,0,1,0,0|1,0,1]=4
18  B8R1.7  O=C(O)C1=CN=CN1 1277 [1,0,0,0,1,0|2,0,0]=4
19  B8R1.7  O=C(O)C1=CN=CS1 1276 [1,0,0,0,1,0|2,0,0]=4
20  B8R1.7  O=C(O)C1=NNC=C1 1960 [1,0,0,0,1,0|2,0,0]=4