0  B10R1.20  CNC1=NC=CC=C1C=O 4090184 [0,0,0,0,0,0|3,0,1]=4
1  B10R1.20  COC1=CC=CN=C1CCl 4089597 [0,0,0,0,0,0|2,1,0]=3
2  B9R1.15  CC1=C(CCl)N=CC=C1 4088897 [1,0,0,0,0,0|2,0,0]=3
3  B9R1.15  CC1=NC=CC=C1CCl 4088270 [1,0,0,0,0,0|2,0,0]=3
4  B9R1.15  CC1=NC=CN=C1C=O 4030187 [1,0,0,0,0,0|1,0,1]=3
5  B9R1.15  CCC1=CC=CN=C1Cl 4037222 [1,0,0,0,0,0|2,0,0]=3
6  B11R1.41  CCOC1=NC=CC=C1CN 4090766 [0,1,0,0,0,0|2,1,0]=4
7  B11R1.41  COC1=NC=CC=C1CCN 4069505 [0,1,0,0,0,0|1,1,0]=3
8  B11R1.53  CN(C)C1=NC=CC=C1CO 4088867 [0,1,0,0,0,0|3,0,0]=4
9  B9R1.14  CCN1C=CN=C1CCl 4089564 [0,0,0,0,1,0|3,0,0]=4
10  B9R1.14  CCN1C=CN=C1CN 4004956 [0,0,0,0,1,0|3,0,0]=4
11  B8R1.2  BrCC1=CN=CC=C1 4090400 [2,0,0,0,0,0|2,0,0]=4
12  B10R1.4  CC1=CC=CN=C1CCN 4002940 [1,1,0,0,0,0|1,0,0]=3
13  B10R1.4  CNCC1=CC=CC=C1C 4090872 [1,1,0,0,0,0|2,0,0]=4
14  B10R1.39  CCN1N=CC=C1C(C)=O 4030142 [0,1,0,0,1,0|2,0,0]=4
15  B12R2.1081  NC1CCCC2=NC=CC=C21 4031914 [0,1,0,1,0,0|2,0,0]=4
16  B8R1.11  CC1=C(CBr)SC=N1 4089692 [1,0,0,0,1,0|2,0,0]=4
17  B8R1.11  CC1=C(CCl)N=CN1 4090770 [1,0,0,0,1,0|1,0,1]=4
18  B8R1.11  CC1=C(CN)NC=N1 4091171 [1,0,0,0,1,0|1,0,1]=4
19  B8R1.11  CC1=C(CN)SC=C1 4088805 [1,0,0,0,1,0|2,0,0]=4
20  B8R1.11  CC1=C(CO)N=CS1 4091170 [1,0,0,0,1,0|2,0,0]=4
21  B8R1.11  CC1=NON=C1CBr 4045731 [1,0,0,0,1,0|2,0,0]=4
22  B8R1.11  CC1=NON=C1CN 4089314 [1,0,0,0,1,0|2,0,0]=4
23  B8R1.11  CCN1C=CN=C1Br 4088617 [1,0,0,0,1,0|2,0,0]=4
24  B8R1.11  CCN1N=CN=C1N 4088125 [1,0,0,0,1,0|2,0,0]=4
25  B8R1.11  CN1C=CN=C1CN 4090095 [1,0,0,0,1,0|2,0,0]=4
26  B8R1.11  CN1N=CC=C1CCl 4089161 [1,0,0,0,1,0|2,0,0]=4
27  B8R1.11  CN1N=CN=C1CCl 4055378 [1,0,0,0,1,0|2,0,0]=4