0 B7R1.2 CC1=CC=C([Mg+])S1 399696 [0,0,0,0,0,0|1,1,0]=2 1 B7R1.2 CC1=CN(C)C=N1 075144 [0,0,0,0,0,0|3,0,0]=3 2 B7R1.2 CC1COC(=O)O1 102084 [0,0,0,0,0,0|2,0,2]=4 3 B8R1.1 BrCC1=CN=C(Br)S1 230460 [0,1,0,0,0,0|2,1,0]=4 4 B8R1.1 CC1=CSC(CN)=N1 031058 [0,1,0,0,0,0|2,0,0]=3 5 B8R1.1 CN1C=CC(CN)=N1 030481 [0,1,0,0,0,0|2,0,0]=3 6 B8R1.18 CC1=CC(=O)NN1C 180024 [0,1,0,0,0,0|3,0,0]=4 7 B8R1.50 CC1=NNC(C)=C1N 030286 [0,1,0,0,0,0|3,0,0]=4 8 B8R1.3 CC1=CC=[N+](C)C=C1 180824 [0,0,0,0,0,1|2,0,0]=3 9 B8R1.3 CC1=CN=C(O)C=N1 077046 [0,0,0,0,0,1|3,0,0]=4 10 B8R1.3 CC1=NC=C(O)C=N1 077095 [0,0,0,0,0,1|3,0,0]=4 11 B8R1.3 SC1=CC=C(S)N=N1 180154 [0,0,0,0,0,1|3,0,0]=4 12 B8R1.3 [2H]C1=CC=C(Br)C=C1 043269 [0,0,0,0,0,1|3,0,0]=4 13 B8R1.4 C[N+]1=CC(Cl)=NC=C1 181726 [0,0,0,0,0,1|3,0,0]=4 14 B8R1.4 C[N+]1=CC(I)=CC=C1 189774 [0,0,0,0,0,1|3,0,0]=4 15 B8R1.4 C[N+]1=CC=CC(N)=C1 181312 [0,0,0,0,0,1|3,0,0]=4 16 B8R1.4 NC1=NC(Br)=CN=C1 076762 [0,0,0,0,0,1|3,0,0]=4 17 B8R1.4 [2H]C1=CC(Br)=CC=C1 043268 [0,0,0,0,0,1|3,0,0]=4 18 B5R0.1 C=COC(=O)Cl 101273 [1,0,1,0,0,0|2,0,0]=4 19 B5R0.1 O=C(O)\C=C\Cl 180014 [1,0,1,0,0,0|2,0,0]=4 20 B5R1.1 C1=CN[NH+]=C1 180087 [2,0,0,0,0,0|2,0,0]=4 21 B7R1.1 NCC1=CSC=N1 358537 [1,1,0,0,0,0|2,0,0]=4 22 B9R1.69 CC1=CC(Cl)=C(S)C=C1 070834 [0,1,0,0,0,1|2,0,0]=4 23 B9R1.69 CC1=CC(S)=C(Br)C=C1 037984 [0,1,0,0,0,1|2,0,0]=4 24 B9R1.69 CC1=CC(S)=C(F)C=C1 037942 [0,1,0,0,0,1|2,0,0]=4 25 B9R1.69 CC1=CC=C(C)C(N)=N1 032657 [0,1,0,0,0,1|1,0,0]=3 26 B9R1.69 CC1=CC=C(S)C=C1F 023072 [0,1,0,0,0,1|2,0,0]=4 27 B9R1.69 CC1=CC=[N+](C)C=C1C 032583 [0,1,0,0,0,1|2,0,0]=4 28 B9R1.69 CC1=[N+](C)C=C(O)C=C1 181609 [0,1,0,0,0,1|2,0,0]=4 29 B9R1.2 CCC1=CC(C)=CN=C1 180046 [0,1,0,0,0,1|1,0,0]=3 30 B9R1.2 C[N+]1=CC(CO)=CC=C1 181608 [0,1,0,0,0,1|2,0,0]=4 31 B9R1.3 CC1=C(C)C(Br)=NC=C1 335456 [0,1,0,0,0,1|2,0,0]=4 32 B9R1.3 CC1=C(C)C(N)=NC=C1 208701 [0,1,0,0,0,1|2,0,0]=4 33 B9R1.3 CC1=C(I)C(Br)=CC=C1 038624 [0,1,0,0,0,1|2,0,0]=4 34 B9R1.3 CC1=CC=CC(S)=C1Br 061615 [0,1,0,0,0,1|2,0,0]=4 35 B9R1.34 CC1=CC(C)=NC(I)=N1 438023 [0,1,0,0,0,1|2,0,0]=4 36 B9R1.34 CC1=CC(C)=[O+]C(C)=C1 181073 [0,1,0,0,0,1|0,0,1]=3 37 B9R1.34 CC1=CC(Cl)=CC(I)=C1 070851 [0,1,0,0,0,1|2,0,0]=4