0 B9R1.6 NC(=S)C1=CC=NC=C1 BB12-3482 [0,0,0,0,0,0|2,1,1]=4 1 B9R1.6 NC(=S)C1=CN=CC=C1 BB12-3483 [0,0,0,0,0,0|2,1,1]=4 2 B9R1.6 OB(O)C1=CN=CN=C1 BB01-0942 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.13 CC(=O)C1=CC=C(I)C=C1 BB17-2376 [0,1,0,0,0,0|0,0,2]=3 4 B10R1.13 CC(O)C1=CC=C(N)C=C1 BB12-2291 [0,1,0,0,0,0|0,0,0]=1 5 B10R1.13 CC1=CC=C(C(=N)N)C=C1 BB20-3270 [0,1,0,0,0,0|2,0,1]=4 6 B10R1.13 NC1=NC=C(C(=O)O)C=C1 BB01-7654 [0,1,0,0,0,0|2,0,1]=4 7 B10R1.13 O=C(O)C1=CC=C(O)C=N1 BB56-1848 [0,1,0,0,0,0|2,0,1]=4 8 B10R1.13 O=C1C=CC(C(=O)O)=CO1 BB26-0398 [0,1,0,0,0,0|2,0,1]=4 9 B10R1.15 CC(C=O)C1=CC=CC=C1 BB17-2274 [0,1,0,0,0,0|0,0,1]=2 10 B10R1.15 CCC(=O)C1=NC=CC=C1 BB12-2185 [0,1,0,0,0,0|1,0,2]=4 11 B10R1.15 CNC(C)C1=CC=CC=C1 BB12-1671 [0,1,0,0,0,0|1,0,0]=2 12 B10R1.15 COC(=O)C1=CC=NC=C1 BB20-4674 [0,1,0,0,0,0|1,0,2]=4 13 B10R1.15 N=C(NO)C1=CC=CC=C1 BB20-3129 [0,1,0,0,0,0|1,0,1]=3 14 B10R1.15 N=C(NO)C1=CC=CN=C1 BB20-3167 [0,1,0,0,0,0|2,0,1]=4 15 B10R1.15 N=C(NO)C1=CC=NC=C1 BB20-3168 [0,1,0,0,0,0|2,0,1]=4 16 B10R1.15 NC(CO)C1=CC=CC=C1 BB01-6618 [0,1,0,0,0,0|1,0,0]=2 17 B10R1.15 NCC(=O)C1=CC=CC=C1 BB26-0680 [0,1,0,0,0,0|0,0,2]=3 18 B10R1.15 NNC(=O)C1=CC=CC=C1 BB20-4243 [0,1,0,0,0,0|1,0,2]=4 19 B10R1.15 N\C(=N/O)C1=NC=CC=C1 BB12-3473 [0,1,0,0,0,0|2,0,1]=4 20 B10R1.15 N\N=C(/N)C1=CC=CC=C1 BB10-1016 [0,1,0,0,0,0|2,0,1]=4 21 B10R1.15 [C-]#[N+]C(C)C1=CC=NC=C1 BB56-1680 [0,1,0,0,0,0|2,0,0]=3 22 B10R1.61 CN(C)C1=C(N)C=CC=C1 BB12-1582 [0,1,0,0,0,0|2,0,0]=3 23 B10R1.61 CN(C)C1=NC=CC=C1N BB12-1642 [0,1,0,0,0,0|3,0,0]=4 24 B10R1.61 NC1=C(C(=O)O)C=CN=C1 BB12-1728 [0,1,0,0,0,0|2,0,1]=4 25 B10R1.113 CC(C)C1=CC=NC(N)=N1 BB12-3696 [0,1,0,0,0,0|3,0,0]=4 26 B10R1.113 CC(C)C1=CC=NC(O)=N1 BB12-3691 [0,1,0,0,0,0|3,0,0]=4 27 B10R1.113 CC(N)C1=CC(Br)=CC=C1 BB53-1527 [0,1,0,0,0,0|1,0,0]=2 28 B10R1.113 NC1=CC=CC(B(O)O)=C1 BB12-2221 [0,1,0,0,0,0|2,0,0]=3 29 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 BB17-0499 [0,1,0,0,0,0|2,0,1]=4 30 B8R1.7 CC(C)C1=CC=NN1 BB12-3679 [0,0,0,0,1,0|3,0,0]=4 31 B8R1.7 OB(O)C1=CC=CO1 BB56-0777 [0,0,0,0,1,0|3,0,0]=4 32 B10R1.18 CC(=O)NC1=CC=CN=C1 BB12-1692 [0,0,0,0,0,1|1,0,2]=4 33 B7R1.3 CC1=CC=NC=N1 BB17-0193 [2,0,0,0,0,0|2,0,0]=4 34 B9R1.1 CCC1=CN=C(O)N=C1 BB12-3538 [1,1,0,0,0,0|2,0,0]=4 35 B9R1.1 ClCC1=CC=C(Cl)N=C1 BB12-1167 [1,1,0,0,0,0|2,0,0]=4 36 B9R1.1 NCC1=CC=C(O)C=C1 BB12-1603 [1,1,0,0,0,0|1,0,0]=3 37 B9R1.1 NNC1=CC=C(I)C=C1 BB56-2534 [1,1,0,0,0,0|2,0,0]=4 38 B9R1.1 [C-]#[N+]C1=CC=C(Br)C=C1 BB56-0563 [1,1,0,0,0,0|1,0,1]=4 39 B9R1.1 [C-]#[N+]C1=CC=C(Cl)C=C1 BB56-1817 [1,1,0,0,0,0|1,0,1]=4 40 B9R1.1 [C-]#[N+]C1=CC=C(F)C=C1 BB56-1216 [1,1,0,0,0,0|1,0,1]=4 41 B9R1.2 CC1=CC(NN)=CC=C1 BB56-2532 [1,1,0,0,0,0|2,0,0]=4 42 B9R1.2 CCC1=CC=NC(N)=N1 BB12-3720 [1,1,0,0,0,0|2,0,0]=4 43 B9R1.2 CCC1=CC=NC(O)=N1 BB12-3719 [1,1,0,0,0,0|2,0,0]=4 44 B9R1.2 CNC1=CC(F)=CC=C1 BB01-7291 [1,1,0,0,0,0|1,0,0]=3 45 B9R1.2 N#CC1=CC(O)=CC=C1 BB20-4617 [1,1,0,0,0,0|1,0,1]=4 46 B9R1.2 NC1=NC(CO)=CC=N1 BB12-1255 [1,1,0,0,0,0|2,0,0]=4 47 B9R1.2 NCC1=CC=CC(Cl)=C1 BB01-4636 [1,1,0,0,0,0|1,0,0]=3 48 B9R1.2 NNC1=CC(Br)=CC=C1 BB56-0176 [1,1,0,0,0,0|2,0,0]=4 49 B9R1.2 NNC1=CC=CC(Cl)=C1 BB56-0328 [1,1,0,0,0,0|2,0,0]=4 50 B9R1.2 NNC1=CC=CC(F)=C1 BB56-0065 [1,1,0,0,0,0|2,0,0]=4 51 B9R1.2 [C-]#[N+]C1=CC=CC(Cl)=C1 BB56-1196 [1,1,0,0,0,0|1,0,1]=4 52 B9R1.8 N#CCC1=NC=CC=C1 BB53-1348 [1,1,0,0,0,0|1,0,1]=4 53 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 BB56-0588 [1,1,0,0,0,0|0,0,1]=3 54 B9R1.8 [C-]#[N+]CC1=CC=CN=C1 BB56-1200 [1,1,0,0,0,0|1,0,1]=4 55 B9R1.15 CNC1=C(C)C=CC=C1 BB01-7286 [1,1,0,0,0,0|1,0,0]=3 56 B9R1.15 CNC1=CC=CC=C1N BB12-2750 [1,1,0,0,0,0|1,0,0]=3 57 B9R1.15 CNC1=CC=CN=C1N BB12-1643 [1,1,0,0,0,0|2,0,0]=4 58 B9R1.15 CNC1=NC=CC=C1Cl BB12-1745 [1,1,0,0,0,0|2,0,0]=4 59 B9R1.15 COC1=CC=CN=C1C BB17-0165 [1,1,0,0,0,0|2,0,0]=4 60 B9R1.15 NCC1=CC=CN=C1N BB12-1525 [1,1,0,0,0,0|2,0,0]=4 61 B9R1.15 NNC1=CC=CC=C1I BB56-0829 [1,1,0,0,0,0|2,0,0]=4 62 B9R1.15 OCC1=CC=CN=C1Cl BB12-3681 [1,1,0,0,0,0|1,0,0]=3 63 B9R1.15 [C-]#[N+]C1=C(I)C=CC=C1 BB56-0362 [1,1,0,0,0,0|1,0,1]=4 64 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 BB12-3713 [0,1,0,0,0,1|0,0,2]=4 65 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 BB12-3000 [0,1,0,0,0,1|0,0,2]=4 66 B11R1.20 FC(F)SC1=CC=C(Br)C=C1 BB53-1954 [0,1,0,0,0,1|2,0,0]=4 67 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 BB12-4748 [0,1,0,0,0,1|1,0,1]=4 68 B11R1.40 CCC(N)CC1=CC=CC=C1 BB17-0798 [0,1,0,0,0,1|1,0,0]=3 69 B11R1.40 NC(CO)CC1=CC=CC=C1 BB01-6619 [0,1,0,0,0,1|1,0,0]=3 70 B11R1.40 O=C(CS)NC1=CC=CC=C1 BB12-3947 [0,1,0,0,0,1|0,0,2]=4 71 B11R1.86 CC(=O)NC1=CC=CC=C1S BB12-2835 [0,1,0,0,0,1|0,0,2]=4 72 B11R1.157 CC(=O)OC1=CC(F)=CC=C1 BB12-2255 [0,1,0,0,0,1|0,0,2]=4 73 B11R1.509 CS(=O)(=O)NC1=CC=CC=C1 BB53-1859 [0,1,0,0,0,1|1,0,1]=4 74 B11R1.3 CC(C)C1=CC=C(NN)C=C1 BB56-1861 [0,2,0,0,0,0|1,0,0]=3 75 B11R1.3 NNC1=CC=C(C(=O)O)C=C1 BB56-2538 [0,2,0,0,0,0|1,0,1]=4 76 B11R1.3 OCC1=CC=C(B(O)O)C=C1 BB12-2258 [0,2,0,0,0,0|2,0,0]=4 77 B11R1.21 CC(=O)C1=CC(N)=C(O)C=C1 BB12-2899 [0,2,0,0,0,0|0,0,2]=4 78 B11R1.21 CC(N)C1=CC(Cl)=C(Cl)C=C1 BB17-1112 [0,2,0,0,0,0|1,0,0]=3 79 B11R1.21 CC(N)C1=CC(F)=C(O)C=C1 BB53-1533 [0,2,0,0,0,0|1,0,0]=3 80 B11R1.21 O=C(O)C1=CC=C(F)C(Cl)=C1 BB12-4696 [0,2,0,0,0,0|1,0,1]=4 81 B11R1.21 OB(O)C1=CC(F)=C(Cl)C=C1 BB56-0403 [0,2,0,0,0,0|2,0,0]=4 82 B11R1.21 OB(O)C1=CC=C(F)C(Cl)=C1 BB01-0065 [0,2,0,0,0,0|2,0,0]=4 83 B11R1.22 CC1=CC=C(C(=O)CBr)C=C1 BB53-4156 [0,2,0,0,0,0|0,0,2]=4 84 B11R1.22 CC1=CC=C(C(N)CO)C=C1 BB56-2094 [0,2,0,0,0,0|1,0,0]=3 85 B11R1.22 CCC(=O)C1=CC=C(Cl)C=C1 BB17-2353 [0,2,0,0,0,0|0,0,2]=4 86 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 BB12-1843 [0,2,0,0,0,0|0,0,2]=4 87 B11R1.22 CNC(C)C1=CC=C(F)C=C1 BB12-1331 [0,2,0,0,0,0|1,0,0]=3 88 B11R1.22 NC(CO)C1=CC=C(Br)C=C1 BB56-2167 [0,2,0,0,0,0|1,0,0]=3 89 B11R1.22 NC(CO)C1=CC=C(Cl)C=C1 BB56-2226 [0,2,0,0,0,0|1,0,0]=3 90 B11R1.22 NC(CO)C1=CC=C(F)C=C1 BB12-1444 [0,2,0,0,0,0|1,0,0]=3 91 B11R1.22 NCC(=O)C1=CC=C(Cl)C=C1 BB26-0169 [0,2,0,0,0,0|0,0,2]=4 92 B11R1.22 O=C(CBr)C1=CC=C(Br)C=C1 BB01-6328 [0,2,0,0,0,0|0,0,2]=4 93 B11R1.22 O=C(CBr)C1=CC=C(Cl)C=C1 BB53-4155 [0,2,0,0,0,0|0,0,2]=4 94 B11R1.22 O=C(CBr)C1=CC=C(I)C=C1 BB20-3112 [0,2,0,0,0,0|0,0,2]=4 95 B11R1.22 O=C(CCl)C1=CC=C(Cl)C=C1 BB01-6260 [0,2,0,0,0,0|0,0,2]=4 96 B11R1.22 [C-]#[N+]C(C)C1=CC=C(Cl)C=C1 BB56-1668 [0,2,0,0,0,0|1,0,0]=3 97 B11R1.166 CC(=O)C1=C(F)C=C(O)C=C1 BB12-2243 [0,2,0,0,0,0|0,0,2]=4 98 B11R1.166 CN(C)C1=CC=C(Br)C=C1N BB12-2661 [0,2,0,0,0,0|2,0,0]=4 99 B11R1.166 NC1=CC(Br)=C(C(=O)O)C=C1 BB17-0728 [0,2,0,0,0,0|1,0,1]=4 100 B11R1.166 O=C(O)C1=C(Cl)C=C(Br)C=C1 BB20-4599 [0,2,0,0,0,0|1,0,1]=4 101 B11R1.166 O=C(O)C1=C(Cl)C=C(Cl)C=C1 BB12-2552 [0,2,0,0,0,0|1,0,1]=4 102 B11R1.16 CC(N=C=O)C1=CC=CC=C1 BB12-1551 [0,2,0,0,0,0|0,0,1]=3 103 B11R1.16 CN(CCN)C1=CC=CC=C1 BB56-2834 [0,2,0,0,0,0|2,0,0]=4 104 B11R1.16 CNCC(O)C1=CC=CC=C1 BB12-2195 [0,2,0,0,0,0|0,0,0]=2 105 B11R1.16 OC(CCCl)C1=CC=CC=C1 BB12-1401 [0,2,0,0,0,0|0,0,0]=2 106 B11R1.23 [C-]#[N+]C(C)C1=CC(Cl)=CC=C1 BB56-1669 [0,2,0,0,0,0|1,0,0]=3 107 B11R1.222 CC1=C(\C(N)=N\O)C=CC=C1 BB12-3478 [0,2,0,0,0,0|1,0,1]=4 108 B11R1.222 COC(=O)C1=C(S)C=CC=C1 BB12-1508 [0,2,0,0,0,0|0,0,2]=4 109 B11R1.222 NC(CO)C1=CC=CC=C1F BB56-2224 [0,2,0,0,0,0|1,0,0]=3 110 B11R1.222 N\C(=N/O)C1=CC=CC=C1F BB10-0059 [0,2,0,0,0,0|1,0,1]=4 111 B11R1.53 CC(C)C1=CC=CC=C1NN BB56-0329 [0,2,0,0,0,0|1,0,0]=3 112 B11R1.53 NNC1=CC=CC=C1C(=O)O BB12-2554 [0,2,0,0,0,0|1,0,1]=4 113 B11R1.156 O=C(O)C1=C(Cl)C=CC=C1Br BB20-4624 [0,2,0,0,0,0|1,0,1]=4 114 B11R1.159 O=C(O)C1=C(O)C(Br)=CC=C1 BB12-4608 [0,2,0,0,0,0|1,0,1]=4 115 B11R1.159 O=C(O)C1=C(O)C(Cl)=CC=C1 BB12-4662 [0,2,0,0,0,0|1,0,1]=4 116 B11R1.167 CC(=O)C1=C(O)C=CC(Br)=C1 BB53-1900 [0,2,0,0,0,0|0,0,2]=4 117 B11R1.167 CC(O)C1=C(O)C=CC(Br)=C1 BB53-1844 [0,2,0,0,0,0|0,0,0]=2 118 B11R1.167 OB(O)C1=CC(F)=CC=C1F BB12-2208 [0,2,0,0,0,0|2,0,0]=4 119 B11R2.10 CC1=NC2=CC=CC=C2O1 BB12-1505 [0,0,0,1,0,1|0,0,1]=3 120 B7R1.1 CCC1=CNN=C1 BB12-3535 [1,0,0,0,1,0|2,0,0]=4 121 B7R1.1 CCC1=NNC=C1 BB12-3522 [1,0,0,0,1,0|2,0,0]=4 122 B7R1.1 OCC1=COC=C1 BB12-2281 [1,0,0,0,1,0|1,0,0]=3 123 B11R1.91 CC(N)\C=C\C1=CC=CC=C1 BB12-1707 [0,0,0,0,0,2|1,0,0]=3 124 B11R1.91 O=C(O)CNC1=CC=CC=C1 BB12-2585 [0,0,0,0,0,2|1,0,1]=4