0 B11R1.91 CC(N)COC1=CC=CC=C1 BB58-0599 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.91 N=C(N)CCC1=CC=CC=C1 BB57-1742 [0,0,0,0,0,0|2,0,0]=2 2 B11R1.91 N=C(N)OCC1=CC=CC=C1 BB57-6018 [0,0,0,0,0,0|3,0,0]=3 3 B11R1.91 N=C(N)SCC1=CC=CC=C1 BB57-2949 [0,0,0,0,0,0|3,0,0]=3 4 B11R1.91 NC(=O)NCC1=CC=CC=C1 BB01-6935 [0,0,0,0,0,0|2,0,0]=2 5 B11R1.91 NC(=S)CCC1=NC=CC=C1 BB54-4361 [0,0,0,0,0,0|2,1,0]=3 6 B11R1.91 NC(=S)COC1=CC=CC=C1 BB20-4704 [0,0,0,0,0,0|2,1,0]=3 7 B11R1.91 NC(=S)COC1=CC=CN=C1 BB20-4557 [0,0,0,0,0,0|3,1,0]=4 8 B11R1.91 O=C(Cl)CSC1=NC=CC=C1 BB12-3011 [0,0,0,0,0,0|3,0,0]=3 9 B11R1.91 O=C(O)C#CC1=CC=CC=C1 BB55-0680 [0,0,0,0,0,0|0,0,2]=2 10 B11R1.91 O=C(O)CCC1=NC=CN=C1 BB58-4745 [0,0,0,0,0,0|2,0,0]=2 11 B11R1.91 O=C(O)CNC1=CC=CC=C1 BB12-2585 [0,0,0,0,0,0|1,0,0]=1 12 B11R1.91 O=C(O)CNC1=NC=CC=N1 BB58-4446 [0,0,0,0,0,0|3,0,0]=3 13 B11R1.91 O=C(O)CSC1=CC=CC=C1 BB54-0245 [0,0,0,0,0,0|1,0,0]=1 14 B11R1.91 O=C(O)CSC1=NC=CC=C1 BB05-0492 [0,0,0,0,0,0|2,0,0]=2 15 B11R1.91 O=C(O)\C=C\C1=NC=CN=C1 BB57-7143 [0,0,0,0,0,0|2,0,2]=4 16 B10R1.17 BrCCCC1=CN=CC=C1 BB54-3595 [1,0,0,0,0,0|2,0,1]=4 17 B10R1.17 BrCCOC1=CC=CC=C1 BB17-1654 [1,0,0,0,0,0|2,0,1]=4 18 B10R1.17 ClCCCC1=CC=NC=C1 BB57-3431 [1,0,0,0,0,0|2,0,1]=4 19 B10R1.17 N#CCCC1=NC=CC=C1 BB12-1756 [1,0,0,0,0,0|2,0,1]=4 20 B10R1.17 NCCCC1=CC=CC=N1 BB54-0788 [1,0,0,0,0,0|2,0,1]=4 21 B10R1.17 NCCCC1=CC=NC=C1 BB57-3430 [1,0,0,0,0,0|2,0,1]=4 22 B10R1.17 OCCCC1=CC=NC=C1 BB57-6720 [1,0,0,0,0,0|1,0,1]=3 23 B10R1.17 [C-]#[N+]CCC1=CC=NC=C1 BB56-1803 [1,0,0,0,0,0|3,0,0]=4 24 B12R1.21 CC(=O)NCC1=CC=C(Cl)N=C1 BB53-1661 [0,1,0,0,0,0|3,0,0]=4 25 B12R1.21 CC1=CC=C(CNC(N)=O)C=C1 BB01-7609 [0,1,0,0,0,0|2,0,0]=3 26 B12R1.21 CC1=CC=C(NCC(=O)O)C=C1 BB12-2588 [0,1,0,0,0,0|1,0,0]=2 27 B12R1.21 NC(=O)COC1=CC=C(N)C=C1 BB12-1839 [0,1,0,0,0,0|2,0,0]=3 28 B12R1.21 NC(=O)CSC1=CC=C(N)C=C1 BB58-2936 [0,1,0,0,0,0|2,0,0]=3 29 B12R1.21 NC(=O)NCC1=CC=C(F)C=C1 BB01-7619 [0,1,0,0,0,0|2,0,0]=3 30 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 BB05-4599 [0,1,0,0,0,0|0,0,0]=1 31 B12R1.21 NC1=CC=C(OCC(=O)O)C=C1 BB12-1847 [0,1,0,0,0,0|1,0,0]=2 32 B12R1.21 O=C(Cl)COC1=CC=C(Br)C=C1 BB55-5587 [0,1,0,0,0,0|2,0,0]=3 33 B12R1.21 O=C(O)CCC1=CC=C(Cl)C=C1 BB54-2898 [0,1,0,0,0,0|0,0,0]=1 34 B12R1.21 O=C(O)CNC1=CC=C(Br)C=C1 BB58-0806 [0,1,0,0,0,0|1,0,0]=2 35 B12R1.21 O=C(O)CNC1=CC=C(F)C=C1 BB58-0803 [0,1,0,0,0,0|1,0,0]=2 36 B12R1.21 O=C(O)CSC1=CC=C(Cl)N=N1 BB10-0312 [0,1,0,0,0,0|3,0,0]=4 37 B12R1.21 O=C(O)\C=C\C1=CC=C(I)C=C1 BB17-2516 [0,1,0,0,0,0|0,0,2]=3 38 B12R1.27 CCC(=O)NNC1=CC=CC=C1 BB01-7426 [0,1,0,0,0,0|3,0,0]=4 39 B12R1.27 NNC(=O)CNC1=CC=CC=C1 BB17-0801 [0,1,0,0,0,0|2,0,0]=3 40 B12R1.27 NNC(=O)COC1=CC=CC=C1 BB12-2509 [0,1,0,0,0,0|2,0,0]=3 41 B12R1.27 NNC(=O)CSC1=NC=CC=C1 BB12-2576 [0,1,0,0,0,0|3,0,0]=4 42 B12R1.43 CC(=O)C(N)CC1=CC=CC=C1 BB54-3217 [0,1,0,0,0,0|1,0,0]=2 43 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O BB01-8382 [0,1,0,0,0,0|1,0,0]=2 44 B12R1.43 O=C(O)C(=O)NC1=CC=CC=C1 BB55-4698 [0,1,0,0,0,0|1,0,1]=3 45 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 BB12-2875 [0,1,0,0,0,0|1,0,1]=3 46 B12R1.107 CC(C)CC(N)C1=CC=CC=C1 BB58-0616 [0,1,0,0,0,0|2,0,1]=4 47 B12R1.107 CC(NC(=N)N)C1=CC=CC=C1 BB54-4969 [0,1,0,0,0,0|3,0,0]=4 48 B12R1.107 CN(CC(=O)O)C1=CC=CC=C1 BB12-1278 [0,1,0,0,0,0|1,0,0]=2 49 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 BB54-0376 [0,1,0,0,0,0|0,0,0]=1 50 B12R1.107 O=[N+]([O-])CC(O)C1=CC=CC=C1 BB54-0417 [0,1,0,0,0,0|1,0,1]=3 51 B12R1.125 CC(=O)C#CC1=CC=CC=C1C BB58-2899 [0,1,0,0,0,0|1,0,2]=4 52 B12R1.125 CC1=C(\C=C\C(=O)O)C=CC=C1 BB56-1289 [0,1,0,0,0,0|0,0,2]=3 53 B12R1.125 CC1=CC=CC=C1NCC(=O)O BB12-2586 [0,1,0,0,0,0|1,0,0]=2 54 B12R1.125 CC1=CC=CC=C1OCC(=O)Cl BB55-5582 [0,1,0,0,0,0|2,0,0]=3 55 B12R1.125 CC1=CC=CC=C1OCC(=O)O BB01-6379 [0,1,0,0,0,0|1,0,0]=2 56 B12R1.125 N=C(N)SCC1=C(Cl)C=CC=C1 BB57-4436 [0,1,0,0,0,0|3,0,0]=4 57 B12R1.125 O=C(Cl)COC1=C(Cl)C=CC=C1 BB55-5589 [0,1,0,0,0,0|2,0,0]=3 58 B12R1.125 O=C(O)CCN1C=CC=CC1=O BB57-2035 [0,1,0,0,0,0|1,0,0]=2 59 B12R1.125 O=C(O)CNC1=C(Cl)C=CC=C1 BB58-0801 [0,1,0,0,0,0|1,0,0]=2 60 B12R1.125 O=C(O)COC1=C(F)C=CC=C1 BB12-2037 [0,1,0,0,0,0|1,0,0]=2 61 B12R1.226 CC1=CC(NCC(=O)O)=CC=C1 BB12-2587 [0,1,0,0,0,0|1,0,0]=2 62 B12R1.226 CC1=CC(OCC(=O)Cl)=CC=C1 BB55-5583 [0,1,0,0,0,0|2,0,0]=3 63 B12R1.226 CC1=CC=CC(\C=C\C(=O)O)=N1 BB54-4987 [0,1,0,0,0,0|1,0,2]=4 64 B12R1.226 NC(=O)NCC1=CC(F)=CC=C1 BB01-7606 [0,1,0,0,0,0|2,0,0]=3 65 B12R1.226 NC1=CC=CC(CCC(=O)O)=C1 BB12-2907 [0,1,0,0,0,0|0,0,0]=1 66 B12R1.226 NC1=CC=CC(\C=C\C(=O)O)=C1 BB55-3550 [0,1,0,0,0,0|0,0,2]=3 67 B12R1.226 O=C(O)CCC1=CC(F)=CC=C1 BB54-1054 [0,1,0,0,0,0|0,0,0]=1 68 B12R1.226 O=C(O)CNC1=CC(Cl)=CC=C1 BB58-0802 [0,1,0,0,0,0|1,0,0]=2 69 B12R1.226 O=C(O)\C=C\C1=CC(Cl)=CC=C1 BB17-0708 [0,1,0,0,0,0|0,0,2]=3 70 B12R1.226 O=C(O)\C=C\C1=CC(I)=CC=C1 BB56-2320 [0,1,0,0,0,0|0,0,2]=3 71 B12R1.891 CC(C)(O)CNC1=CC=CC=C1 BB58-3437 [0,1,0,0,0,0|2,0,1]=4 72 B12R1.891 NS(=O)(=O)NCC1=CC=CC=C1 BB05-4168 [0,1,0,0,0,0|2,0,1]=4 73 B12R1.891 O=S(=O)(Cl)CCC1=CC=CC=C1 BB54-4260 [0,1,0,0,0,0|1,0,1]=3 74 B12R1.891 O=S(=O)(O)CCC1=CC=NC=C1 BB57-6801 [0,1,0,0,0,0|2,0,0]=3 75 B12R2.24 NC1CCC2=C(C=CC=C2)C1 BB57-6610 [0,0,0,1,0,0|2,0,1]=4 76 B12R2.24 O=C1C=NC2=CC=CC=C2N1 BB57-5371 [0,0,0,1,0,0|2,0,1]=4 77 B12R2.24 O=C1COC2=CC=CN=C2N1 BB12-2193 [0,0,0,1,0,0|3,0,0]=4 78 B12R2.24 O=C1CSC2=CC=CC=C2N1 BB20-4697 [0,0,0,1,0,0|2,0,0]=3 79 B12R2.24 O=C1CSC2=NC=CC=C2N1 BB01-1150 [0,0,0,1,0,0|3,0,0]=4 80 B12R2.24 OC1=CC2=C(C=CC=C2)N=C1 BB57-3400 [0,0,0,1,0,0|2,0,1]=4 81 B12R2.24 S=C1COC2=CC=CC=C2N1 BB10-0259 [0,0,0,1,0,0|2,1,0]=4 82 B10R1.18 CC(=O)CC1=NC=CC=C1 BB55-8084 [0,0,0,0,1,0|2,0,0]=3 83 B10R1.18 CC(=O)CC1=NC=CN=C1 BB57-2158 [0,0,0,0,1,0|3,0,0]=4 84 B10R1.18 CC(=O)NC1=CC=CN=C1 BB12-1692 [0,0,0,0,1,0|3,0,0]=4 85 B10R1.18 CC(O)CC1=NC=CC=C1 BB55-7547 [0,0,0,0,1,0|2,0,1]=4 86 B10R1.18 N=C(N)CC1=CC=CC=C1 BB31-4317 [0,0,0,0,1,0|2,0,0]=3 87 B10R1.18 N=C(N)NC1=CC=CC=C1 BB57-2954 [0,0,0,0,1,0|3,0,0]=4 88 B10R1.18 NC(=O)NC1=CC=CC=C1 BB01-6936 [0,0,0,0,1,0|2,0,0]=3 89 B10R1.66 NC(=O)CCN1C=CC=N1 BB55-3573 [0,0,0,0,1,0|3,0,0]=4 90 B10R1.66 NC(=O)CCN1C=CN=C1 BB12-1773 [0,0,0,0,1,0|3,0,0]=4 91 B10R1.66 NC(=O)NCC1=CC=CO1 BB01-7602 [0,0,0,0,1,0|3,0,0]=4 92 B10R1.66 O=C(O)CCC1=CC=NO1 BB54-1995 [0,0,0,0,1,0|2,0,0]=3 93 B10R1.66 O=[N+]([O-])CCC1=CC=CO1 BB01-2590 [0,0,0,0,1,0|2,0,1]=4 94 B12R1.252 CC(=O)CCCC1=CC=CC=N1 BB54-3908 [0,0,0,0,0,1|2,0,0]=3 95 B12R1.252 CC(=O)NCCC1=CC=CC=C1 BB01-7779 [0,0,0,0,0,1|1,0,0]=2 96 B12R1.252 NC(=O)NCCC1=CC=CC=C1 BB01-7605 [0,0,0,0,0,1|1,0,0]=2 97 B12R1.252 NC(=O)N\N=C\C1=CC=CC=C1 BB01-7412 [0,0,0,0,0,1|2,0,1]=4 98 B12R1.252 O=C(O)CCCC1=CC=CC=N1 BB54-3321 [0,0,0,0,0,1|1,0,0]=2 99 B12R1.252 O=C(O)CCCC1=CC=NC=C1 BB54-3329 [0,0,0,0,0,1|1,0,0]=2 100 B12R1.252 O=C(O)COCC1=CC=CC=C1 BB01-5008 [0,0,0,0,0,1|0,0,0]=1 101 B9R1.8 BrCCC1=NC=CC=C1 BB54-3597 [2,0,0,0,0,0|2,0,0]=4 102 B9R1.8 ClCCC1=NC=CC=C1 BB54-3546 [2,0,0,0,0,0|2,0,0]=4 103 B9R1.8 NOCC1=CC=CC=C1 BB05-2313 [2,0,0,0,0,0|2,0,0]=4 104 B9R1.8 OCCC1=NC=CC=C1 BB01-4800 [2,0,0,0,0,0|1,0,0]=3 105 B9R1.8 OCCC1=NC=CN=C1 BB57-7201 [2,0,0,0,0,0|2,0,0]=4 106 B9R1.8 [C-]#[N+]CC1=CC=CC=C1 BB56-0588 [2,0,0,0,0,0|1,0,1]=4 107 B11R1.1 C(=O)NCC1=CC=C(C)C=C1 BB20-3386 [1,1,0,0,0,0|1,0,0]=3 108 B11R1.1 C=CCOC1=CC=C(Br)C=C1 BB58-0374 [1,1,0,0,0,0|2,0,0]=4 109 B11R1.1 C=CCOC1=CC=C(Cl)C=C1 BB31-2474 [1,1,0,0,0,0|2,0,0]=4 110 B11R1.1 C=CCOC1=CC=C(O)C=C1 BB20-1078 [1,1,0,0,0,0|2,0,0]=4 111 B11R1.1 CC1=CC=C(CCCN)C=C1 BB58-0569 [1,1,0,0,0,0|1,0,1]=4 112 B11R1.1 CC1=CC=C(CCCO)C=C1 BB32-2521 [1,1,0,0,0,0|0,0,1]=3 113 B11R1.1 CC1=CC=C(NCCO)C=C1 BB17-0653 [1,1,0,0,0,0|1,0,1]=4 114 B11R1.1 NC1=CC=C(OCCO)C=C1 BB58-1793 [1,1,0,0,0,0|1,0,1]=4 115 B11R1.1 NCCCC1=CC=C(Cl)C=C1 BB54-2040 [1,1,0,0,0,0|1,0,1]=4 116 B11R1.1 NCCCC1=CC=C(F)C=C1 BB58-0570 [1,1,0,0,0,0|1,0,1]=4 117 B11R1.1 OCCNC1=CC=C(Cl)C=C1 BB17-0633 [1,1,0,0,0,0|1,0,1]=4 118 B11R1.16 CC(N=C=O)C1=CC=CC=C1 BB12-1551 [1,1,0,0,0,0|1,0,1]=4 119 B11R1.16 CNCC(O)C1=CC=CC=C1 BB12-2195 [1,1,0,0,0,0|2,0,0]=4 120 B11R1.16 OC(CCCl)C1=CC=CC=C1 BB12-1401 [1,1,0,0,0,0|1,0,1]=4 121 B11R1.17 NC1=CC=CC=C1OCCO BB05-3292 [1,1,0,0,0,0|1,0,1]=4 122 B11R1.17 NCCCC1=C(Cl)C=CC=C1 BB58-0571 [1,1,0,0,0,0|1,0,1]=4 123 B11R1.24 C=CCOC1=CC=CC(N)=C1 BB57-1181 [1,1,0,0,0,0|2,0,0]=4 124 B11R1.24 CC1=CC=CC(CCCN)=C1 BB58-0568 [1,1,0,0,0,0|1,0,1]=4 125 B11R1.24 CC1=CC=CC(CCCO)=C1 BB31-8239 [1,1,0,0,0,0|0,0,1]=3 126 B11R1.24 ClC1=CC=CC(CCCBr)=C1 BB31-7544 [1,1,0,0,0,0|1,0,1]=4 127 B11R1.24 N#CCCC1=CC=CC(Br)=C1 BB32-1657 [1,1,0,0,0,0|1,0,1]=4 128 B11R1.24 O=C=NCC1=CC=CC(F)=C1 BB57-0297 [1,1,0,0,0,0|1,0,1]=4 129 B11R1.28 C=CCCNC1=CC=CC=C1 BB58-4953 [1,1,0,0,0,0|1,0,0]=3 130 B11R1.28 C=CCNCC1=CC=CC=C1 BB20-4594 [1,1,0,0,0,0|1,0,0]=3 131 B11R1.28 NCCOCC1=CC=CC=C1 BB55-4803 [1,1,0,0,0,0|1,0,1]=4 132 B11R1.28 NCCSCC1=CC=CC=C1 BB53-1385 [1,1,0,0,0,0|1,0,1]=4 133 B11R1.28 OCCNCC1=CC=CC=C1 BB17-0809 [1,1,0,0,0,0|0,0,1]=3 134 B11R1.28 O\N=C\C=C\C1=CC=CC=C1 BB12-1495 [1,1,0,0,0,0|0,0,2]=4 135 B11R1.28 S=C=NCCC1=CC=CC=C1 BB54-2698 [1,1,0,0,0,0|0,1,1]=4 136 B11R1.40 CCC(N)CC1=CC=CC=C1 BB17-0798 [1,1,0,0,0,0|1,0,1]=4 137 B11R1.40 NC(CO)CC1=CC=CC=C1 BB01-6619 [1,1,0,0,0,0|0,0,1]=3 138 B11R1.40 N\C(CC1=CC=CC=C1)=N/O BB53-1939 [1,1,0,0,0,0|1,0,1]=4 139 B11R1.40 O=C\C(Br)=C\C1=CC=CC=C1 BB17-2230 [1,1,0,0,0,0|0,0,2]=4 140 B11R1.20 CC(=O)NC1=CC=C(C)C=C1 BB12-3713 [0,1,0,0,1,0|2,0,0]=4 141 B11R1.20 CC(=O)NC1=CC=C(F)C=C1 BB12-3000 [0,1,0,0,1,0|2,0,0]=4 142 B11R1.20 CC(=O)OC1=CC=C(N)C=C1 BB31-9516 [0,1,0,0,1,0|2,0,0]=4 143 B11R1.20 CC1=CC=C(CC(N)=S)C=C1 BB20-4553 [0,1,0,0,1,0|1,1,0]=4 144 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 BB12-4748 [0,1,0,0,1,0|0,0,0]=2 145 B11R1.20 O=C(O)CC1=CC=C(Cl)N=C1 BB54-4732 [0,1,0,0,1,0|1,0,0]=3 146 B11R1.20 O=C1C=CN(CC(=O)O)C=C1 BB55-5163 [0,1,0,0,1,0|1,0,0]=3 147 B11R1.36 N=C(N)C(O)C1=CC=CC=C1 BB54-4112 [0,1,0,0,1,0|2,0,0]=4 148 B11R1.36 NC(=O)C(Cl)C1=CC=CC=C1 BB01-2614 [0,1,0,0,1,0|1,0,0]=3 149 B11R1.36 NC(=O)C(N)C1=CC=CC=C1 BB20-4534 [0,1,0,0,1,0|1,0,0]=3 150 B11R1.86 CC(=O)NC1=CC=CC=C1S BB12-2835 [0,1,0,0,1,0|2,0,0]=4 151 B11R1.86 O=C(O)CN1C=CC=NC1=O BB55-3622 [0,1,0,0,1,0|2,0,0]=4 152 B11R1.157 CC(=O)NC1=CC(Br)=CC=C1 BB57-1173 [0,1,0,0,1,0|2,0,0]=4 153 B11R1.157 CC(=O)OC1=CC(F)=CC=C1 BB12-2255 [0,1,0,0,1,0|2,0,0]=4 154 B11R1.157 N=C(N)CC1=CC(Cl)=CC=C1 BB53-1496 [0,1,0,0,1,0|2,0,0]=4 155 B11R1.25 COC(=O)CCN1C=CN=C1 BB58-0776 [0,1,0,0,1,0|2,0,0]=4 156 B11R1.35 CC(CN1C=CC=N1)C(=O)O BB05-3586 [0,1,0,0,1,0|2,0,0]=4 157 B11R1.35 NC(CC1=CC=CS1)C(=O)O BB57-4844 [0,1,0,0,1,0|1,0,0]=3 158 B11R1.75 CC1=CN(CCC(=O)O)N=C1 BB05-1409 [0,1,0,0,1,0|2,0,0]=4 159 B11R1.75 CN1C=C(CCC(=O)O)C=N1 BB05-2045 [0,1,0,0,1,0|2,0,0]=4 160 B11R1.75 CN1C=C(CCC(=O)O)C=N1 BB55-8079 [0,1,0,0,1,0|2,0,0]=4 161 B11R1.75 CN1C=CC(CCC(=O)O)=N1 BB05-2667 [0,1,0,0,1,0|2,0,0]=4 162 B11R1.75 NC1=CN(CCC(=O)O)N=C1 BB05-4477 [0,1,0,0,1,0|2,0,0]=4 163 B11R1.75 NC1=NC(CCC(=O)O)=CS1 BB58-1169 [0,1,0,0,1,0|2,0,0]=4 164 B11R1.75 NC1=NN(CCC(=O)O)C=C1 BB05-4624 [0,1,0,0,1,0|2,0,0]=4 165 B11R1.75 O=C(O)CCC1=CC(=O)NO1 BB54-3563 [0,1,0,0,1,0|2,0,0]=4 166 B11R1.75 O=C(O)CCC1=CC(Cl)=NO1 BB05-2083 [0,1,0,0,1,0|2,0,0]=4 167 B11R1.75 O=C(O)CCC1=CNC(=S)N1 BB54-5158 [0,1,0,0,1,0|2,0,0]=4 168 B11R1.75 O=C(O)CCN1C=C(Br)C=N1 BB05-1065 [0,1,0,0,1,0|2,0,0]=4 169 B11R1.75 O=C(O)CCN1C=C(Br)C=N1 BB55-2994 [0,1,0,0,1,0|2,0,0]=4 170 B11R1.75 O=C(O)CCN1C=C(Cl)C=N1 BB05-1066 [0,1,0,0,1,0|2,0,0]=4 171 B11R1.75 O=C(O)CCN1C=C(I)C=N1 BB57-1260 [0,1,0,0,1,0|2,0,0]=4 172 B11R1.77 NC(CC(=O)O)C1=CC=CS1 BB01-4064 [0,1,0,0,1,0|1,0,0]=3 173 B11R1.90 CC1=CC=NN1CCC(=O)O BB55-3473 [0,1,0,0,1,0|2,0,0]=4 174 B11R1.90 CC1=CN=CN1CCC(=O)O BB57-0625 [0,1,0,0,1,0|2,0,0]=4 175 B11R1.90 CC1=NC=CN1CCC(=O)O BB54-2342 [0,1,0,0,1,0|2,0,0]=4 176 B11R1.90 CN1N=CC=C1CCC(=O)O BB05-2669 [0,1,0,0,1,0|2,0,0]=4 177 B11R1.90 CN1N=CC=C1CCC(=O)O BB57-3362 [0,1,0,0,1,0|2,0,0]=4 178 B13R1.45 CN(CCC(=O)O)C1=CC=CC=C1 BB58-0842 [0,1,0,0,0,1|0,0,0]=2 179 B13R1.45 O=C(O)CCC(=O)C1=CN=CC=C1 BB54-1177 [0,1,0,0,0,1|1,0,0]=3 180 B13R1.45 O=C(O)CSC(=S)C1=CC=CC=C1 BB12-1361 [0,1,0,0,0,1|0,0,1]=3 181 B13R1.149 O=C(O)CNCC1=CC(F)=CC=C1 BB20-0187 [0,1,0,0,0,1|0,0,0]=2 182 B13R1.158 CC1=C(CNCC(=O)O)C=CC=C1 BB20-1222 [0,1,0,0,0,1|0,0,0]=2 183 B13R1.348 CC(=O)CC(=O)NC1=CC=CC=C1 BB12-1362 [0,1,0,0,0,1|1,0,1]=4 184 B13R1.351 NC(CCC1=CC=CC=N1)C(=O)O BB54-3436 [0,1,0,0,0,1|1,0,0]=3 185 B13R1.351 O=C(O)C(=O)CCC1=CC=CC=C1 BB12-2929 [0,1,0,0,0,1|0,0,0]=2 186 B13R1.718 CC(CO)CNCC1=CC=CC=C1 BB57-2239 [0,1,0,0,0,1|1,0,1]=4 187 B13R1.718 O=C(CCl)NCCC1=CC=CC=C1 BB54-0112 [0,1,0,0,0,1|1,0,0]=3 188 B13R1.3523 CC(C)(O)CNCC1=CC=CC=C1 BB58-2129 [0,1,0,0,0,1|1,0,1]=4 189 B13R1.3523 CS(=O)(=O)NCCC1=CC=CC=C1 BB17-1510 [0,1,0,0,0,1|1,0,1]=4 190 B13R1.3523 O=S(=O)(Cl)CCCC1=CC=CC=C1 BB58-0557 [0,1,0,0,0,1|1,0,1]=4 191 B13R1.3523 O=S(=O)(Cl)CCOC1=CC=CC=C1 BB57-5852 [0,1,0,0,0,1|1,0,1]=4 192 B13R1.3 CCC1=CC=C(OCC(=O)Cl)C=C1 BB55-5190 [0,2,0,0,0,0|2,0,0]=4 193 B13R1.3 CCC1=CC=C(OCC(N)=O)C=C1 BB17-0399 [0,2,0,0,0,0|2,0,0]=4 194 B13R1.3 COC1=CC=C(CCC(C)=O)C=C1 BB54-1640 [0,2,0,0,0,0|1,0,0]=3 195 B13R1.3 COC1=CC=C(CNC(N)=O)C=C1 BB01-7607 [0,2,0,0,0,0|2,0,0]=4 196 B13R1.3 COC1=CC=C(NCC(=O)O)C=C1 BB58-0807 [0,2,0,0,0,0|1,0,0]=3 197 B13R1.3 COC1=CC=C(OCC(=O)Cl)C=C1 BB55-5195 [0,2,0,0,0,0|2,0,0]=4 198 B13R1.3 CSC1=CC=C(OCC(=O)O)C=C1 BB55-4256 [0,2,0,0,0,0|1,0,0]=3 199 B13R1.3 O=CC1=CC=C(OCC(=O)O)C=C1 BB56-1280 [0,2,0,0,0,0|1,0,0]=3 200 B13R1.14 CC1=CC=C(NCC(=O)NN)C=C1 BB17-2395 [0,2,0,0,0,0|2,0,0]=4 201 B13R1.14 CNC(=O)CCC1=CC=C(N)C=C1 BB32-3697 [0,2,0,0,0,0|1,0,0]=3 202 B13R1.14 COC(=O)CCC1=CC=C(Cl)C=C1 BB54-2897 [0,2,0,0,0,0|0,0,0]=2 203 B13R1.14 NNC(=O)CNC1=CC=C(Cl)C=C1 BB12-2774 [0,2,0,0,0,0|2,0,0]=4 204 B13R1.14 NNC(=O)CNC1=CC=C(F)C=C1 BB12-2776 [0,2,0,0,0,0|2,0,0]=4 205 B13R1.14 NNC(=O)CNC1=CC=C(I)C=C1 BB12-2570 [0,2,0,0,0,0|2,0,0]=4 206 B13R1.14 NNC(=O)COC1=CC=C(I)C=C1 BB17-2214 [0,2,0,0,0,0|2,0,0]=4 207 B13R1.14 O=C(CBr)NCC1=CC=C(Br)C=C1 BB17-0264 [0,2,0,0,0,0|2,0,0]=4 208 B13R1.132 CC(=O)CC(=O)C1=CC=C(C)C=C1 BB12-2877 [0,2,0,0,0,0|1,0,1]=4 209 B13R1.132 CC(=O)CC(=O)C1=CC=C(Cl)C=C1 BB32-3001 [0,2,0,0,0,0|1,0,1]=4 210 B13R1.132 CC(=O)CC(=O)C1=CC=C(F)C=C1 BB01-8027 [0,2,0,0,0,0|1,0,1]=4 211 B13R1.133 CC(CC1=CC=C(N)C=C1)[N+](=O)[O-] BB55-7305 [0,2,0,0,0,0|1,0,1]=4 212 B13R1.133 CC(OC1=CC=C(Br)C=C1)C(=O)Cl BB55-5612 [0,2,0,0,0,0|2,0,0]=4 213 B13R1.133 CC(OC1=CC=C(F)C=C1)C(=O)Cl BB55-5202 [0,2,0,0,0,0|2,0,0]=4 214 B13R1.133 CC(OC1=CC=C(I)C=C1)C(=O)O BB05-4897 [0,2,0,0,0,0|1,0,0]=3 215 B13R1.133 CC(OC1=CC=C(O)C=C1)C(=O)O BB12-1748 [0,2,0,0,0,0|1,0,0]=3 216 B13R1.133 CC1=CC=C(OC(C)C(=O)Cl)C=C1 BB55-5608 [0,2,0,0,0,0|2,0,0]=4 217 B13R1.133 NC1=CC=C(CC(N)C(=O)O)C=C1 BB12-2267 [0,2,0,0,0,0|0,0,0]=2 218 B13R1.164 CC1=CC(=O)C(OCC(=O)O)=CN1 BB26-0390 [0,2,0,0,0,0|2,0,0]=4 219 B13R1.164 CC1=CC(=O)C(OCC(=O)O)=CO1 BB26-0389 [0,2,0,0,0,0|2,0,0]=4 220 B13R1.164 CC1=CC(Br)=C(\C=C\C(=O)O)C=C1 BB56-1347 [0,2,0,0,0,0|0,0,2]=4 221 B13R1.164 CC1=CC(C)=C(OCC(=O)Cl)C=C1 BB55-5717 [0,2,0,0,0,0|2,0,0]=4 222 B13R1.164 NC(=O)COC1=C(F)C=C(F)C=C1 BB17-1919 [0,2,0,0,0,0|2,0,0]=4 223 B13R1.164 O=C(Cl)COC1=C(Br)C=C(Br)C=C1 BB55-5572 [0,2,0,0,0,0|2,0,0]=4 224 B13R1.164 O=C(Cl)COC1=CC=C(Br)C=C1Cl BB55-5576 [0,2,0,0,0,0|2,0,0]=4 225 B13R1.164 O=C(Cl)COC1=CC=C(Cl)C=C1Cl BB55-5593 [0,2,0,0,0,0|2,0,0]=4 226 B13R1.164 O=C(Cl)COC1=CC=C(F)C=C1Cl BB55-5596 [0,2,0,0,0,0|2,0,0]=4 227 B13R1.164 O=C(Cl)COC1=CC=C(F)C=C1F BB55-5578 [0,2,0,0,0,0|2,0,0]=4 228 B13R1.164 O=C(O)COC1=C(F)C=C(F)C=C1 BB05-1219 [0,2,0,0,0,0|1,0,0]=3 229 B13R1.511 CC1=C(Cl)C=CC(OCC(N)=O)=C1 BB17-0398 [0,2,0,0,0,0|2,0,0]=4 230 B13R1.511 CC1=CC(OCC(=O)Cl)=CC=C1Cl BB55-5599 [0,2,0,0,0,0|2,0,0]=4 231 B13R1.511 CC1=CC=C(CCC(=O)O)C=C1N BB54-5144 [0,2,0,0,0,0|0,0,0]=2 232 B13R1.511 CC1=CC=C(OCC(=O)Cl)C=C1C BB55-5584 [0,2,0,0,0,0|2,0,0]=4 233 B13R1.511 NC1=C(Cl)C=CC(\C=C\C(=O)O)=C1 BB17-2789 [0,2,0,0,0,0|0,0,2]=4 234 B13R1.511 O=C(Cl)COC1=CC=C(F)C(Cl)=C1 BB55-5577 [0,2,0,0,0,0|2,0,0]=4 235 B13R1.11 COC(=O)CC(N)C1=CC=CC=C1 BB26-0866 [0,2,0,0,0,0|0,0,0]=2 236 B13R1.15 CC1=CC(NCC(=O)NN)=CC=C1 BB12-2537 [0,2,0,0,0,0|2,0,0]=4 237 B13R1.15 COC(=O)CNC1=CC=CC(Br)=C1 BB53-4201 [0,2,0,0,0,0|1,0,0]=3 238 B13R1.15 NNC(=O)CNC1=CC=CC(Br)=C1 BB17-2411 [0,2,0,0,0,0|2,0,0]=4 239 B13R1.15 N\C(COC1=CC(Cl)=CC=C1)=N/O BB53-1878 [0,2,0,0,0,0|2,0,0]=4 240 B13R1.15 O=C(CBr)NCC1=CC=CC(Cl)=C1 BB17-0256 [0,2,0,0,0,0|2,0,0]=4 241 B13R1.42 N#CCC(=O)NCC1=CC=CC=C1 BB05-2779 [0,2,0,0,0,0|2,0,0]=4 242 B13R1.42 N#CCC(=O)NCC1=CC=CC=C1 BB12-1367 [0,2,0,0,0,0|2,0,0]=4 243 B13R1.42 NCCC(=O)NCC1=CC=CC=C1 BB53-1853 [0,2,0,0,0,0|2,0,0]=4 244 B13R1.135 COC(=O)C(N)CC1=CC=CC=C1 BB01-7089 [0,2,0,0,0,0|0,0,0]=2 245 B13R1.254 C#CC(C)(O)CCC1=CC=CC=C1 BB54-1642 [0,2,0,0,0,0|1,0,1]=4 246 B13R1.528 CC1=C(NCC(=O)NN)C=CC=C1 BB12-2612 [0,2,0,0,0,0|2,0,0]=4 247 B13R1.528 O=C(CCl)NCC1=CC=CC=C1Cl BB01-5139 [0,2,0,0,0,0|2,0,0]=4 248 B13R1.528 O=C(CCl)NCC1=CC=CC=C1F BB55-1853 [0,2,0,0,0,0|2,0,0]=4 249 B13R1.148 CC(OC1=CC=CC(Br)=C1)C(=O)Cl BB55-5720 [0,2,0,0,0,0|2,0,0]=4 250 B13R1.148 CC1=CC(OC(C)C(=O)Cl)=CC=C1 BB55-5607 [0,2,0,0,0,0|2,0,0]=4 251 B13R1.152 CC(C(=O)O)N(C)C1=CC=CC=C1 BB58-0841 [0,2,0,0,0,0|1,0,0]=3 252 B13R1.202 CC(OC1=C(Cl)C=CC=C1)C(=O)Cl BB55-5614 [0,2,0,0,0,0|2,0,0]=4 253 B13R1.202 CC(OC1=CC=CC=C1Br)C(=O)Cl BB55-5719 [0,2,0,0,0,0|2,0,0]=4 254 B13R1.202 NC(CC1=CC=CC=C1F)C(=O)O BB12-2908 [0,2,0,0,0,0|0,0,0]=2 255 B13R1.202 O=C(O)C(=O)NC1=CC=CC=C1O BB12-3041 [0,2,0,0,0,0|1,0,1]=4 256 B13R1.1073 CC(C)(CC1=CC=CC=C1)C(=O)O BB58-2555 [0,2,0,0,0,0|0,0,0]=2 257 B13R1.1073 CC(C)(OC1=CC=CC=C1)C(=O)O BB05-1228 [0,2,0,0,0,0|1,0,0]=3 258 B13R1.147 CC(=O)NC(C)C1=CC=CC(N)=C1 BB55-4873 [0,2,0,0,0,0|2,0,0]=4 259 B13R1.147 NC(CC(=O)O)C1=CC(I)=CC=C1 BB56-0130 [0,2,0,0,0,0|0,0,0]=2 260 B13R1.201 CC(=O)CC(=O)C1=C(Br)C=CC=C1 BB32-3227 [0,2,0,0,0,0|1,0,1]=4 261 B13R1.201 CC(=O)CC(=O)C1=C(F)C=CC=C1 BB31-7739 [0,2,0,0,0,0|1,0,1]=4 262 B13R1.201 NC(CC(=O)O)C1=CC=CC=C1Br BB56-0119 [0,2,0,0,0,0|0,0,0]=2 263 B13R1.347 CC(C)(CC(=O)O)C1=CC=CC=C1 BB58-1450 [0,2,0,0,0,0|0,0,0]=2 264 B13R1.347 O=C(O)CS(=O)(=O)C1=CC=CC=C1 BB55-4660 [0,2,0,0,0,0|1,0,0]=3 265 B13R1.713 NCC(CC(=O)O)C1=CC=CC=C1 BB54-0073 [0,2,0,0,0,0|0,0,0]=2 266 B13R1.90 CC(=O)COC1=C(C#N)C=CC=C1 BB12-1473 [0,2,0,0,0,0|2,0,0]=4 267 B13R1.90 CCC1=C(\C=C\C(=O)O)C=CC=C1 BB56-1346 [0,2,0,0,0,0|0,0,2]=4 268 B13R1.90 NC(=O)COC1=CC=CC=C1C=O BB05-0715 [0,2,0,0,0,0|2,0,0]=4 269 B13R1.150 CC1=C(C)C(OCC(=O)Cl)=CC=C1 BB55-5586 [0,2,0,0,0,0|2,0,0]=4 270 B13R1.150 CC1=CC=CC(\C=C\C(=O)O)=C1C BB56-1349 [0,2,0,0,0,0|0,0,2]=4 271 B13R1.150 O=C(Cl)COC1=CC=CC(Cl)=C1Cl BB55-5740 [0,2,0,0,0,0|2,0,0]=4 272 B13R1.893 CC1=CC=C(C)C(OCC(=O)Cl)=C1 BB55-5739 [0,2,0,0,0,0|2,0,0]=4 273 B13R1.893 O=C(Cl)COC1=C(Cl)C=CC(Cl)=C1 BB55-5588 [0,2,0,0,0,0|2,0,0]=4 274 B13R1.893 O=C(O)\C=C\C1=CC(Br)=CC=C1F BB56-1288 [0,2,0,0,0,0|0,0,2]=4 275 B13R1.643 COC1=CC(CNC(N)=O)=CC=C1 BB01-7617 [0,2,0,0,0,0|2,0,0]=4 276 B13R1.643 COC1=CC(OCC(=O)Cl)=CC=C1 BB55-5749 [0,2,0,0,0,0|2,0,0]=4 277 B13R1.3420 O=C(O)COC1=CC(Cl)=CC(Cl)=C1 BB17-2833 [0,2,0,0,0,0|1,0,0]=3 278 B11R1.57 O=CC1=CC=CN1CC(=O)O BB01-2977 [0,0,1,1,0,0|2,0,0]=4 279 B11R2.1 O=C1NCC2=CC=CC=C12 BB57-1240 [1,0,0,1,0,0|1,0,0]=3 280 B11R2.10 CC1=NC2=CC=CC=C2O1 BB12-1505 [0,0,0,1,1,0|2,0,0]=4 281 B11R2.10 NC1=NC2=CC=CC=C2O1 BB05-4615 [0,0,0,1,1,0|2,0,0]=4 282 B11R2.10 O=C1CN2C=CC=CC2=N1 BB01-7771 [0,0,0,1,1,0|2,0,0]=4 283 B11R2.10 O=C1NC2=CC=CC=C2N1 BB12-1666 [0,0,0,1,1,0|2,0,0]=4 284 B11R2.10 O=C1NC2=CC=CC=C2O1 BB01-7355 [0,0,0,1,1,0|1,0,0]=3 285 B13R2.10 NC1=NN(C2=CC=CC=C2)CC1 BB01-4298 [0,0,0,1,0,1|2,0,0]=4 286 B13R2.10 O=C1C=C(C2=CC=CC=C2)CC1 BB54-5037 [0,0,0,1,0,1|1,0,0]=3 287 B13R2.10 O=C1CCC(C2=CC=CC=C2)C1 BB31-5154 [0,0,0,1,0,1|1,0,0]=3 288 B13R2.10 O=C1CCN(C2=CC=CC=C2)N1 BB54-0220 [0,0,0,1,0,1|1,0,0]=3 289 B13R2.72 O=C(O)C1=NSC2=CC=CC=C21 BB51-1350 [0,0,0,1,0,1|1,0,1]=4 290 B13R2.72 O=C(O)C1CNC2=C1C=CC=C2 BB57-4095 [0,0,0,1,0,1|0,0,0]=2 291 B13R2.423 O=C(O)C1CC1C2=CC=CC=C2 BB05-2321 [0,0,0,1,0,1|0,0,0]=2 292 B13R2.3122 CC1(O)CCCC2=CC=CC=C21 BB57-5155 [0,0,0,1,0,1|1,0,1]=4 293 B13R2.147 O=C1CC(C2=CC=C(Br)C=C2)N1 BB31-9884 [0,1,0,1,0,0|1,0,0]=3 294 B13R2.147 O=C1CC(C2=CC=C(F)C=C2)N1 BB54-4963 [0,1,0,1,0,0|1,0,0]=3 295 B13R2.155 NC1=CC2=C(C=C1)CCC(=O)N2 BB54-0787 [0,1,0,1,0,0|1,0,0]=3 296 B13R2.155 NC1=CC=C2OCC(=O)NC2=C1 BB54-2617 [0,1,0,1,0,0|2,0,0]=4 297 B13R2.155 O=C1COC2=CC=C(Cl)C=C2N1 BB51-0720 [0,1,0,1,0,0|2,0,0]=4 298 B13R2.155 O=C1COC2=CC=C(F)C=C2N1 BB54-4229 [0,1,0,1,0,0|2,0,0]=4 299 B13R2.32 O=C1C=CC2=C(C=CC=C2)N1O BB58-1194 [0,1,0,1,0,0|0,0,2]=4 300 B13R2.33 O=C1COC2=CC=CC=C2CN1 BB57-5539 [0,1,0,1,0,0|1,0,0]=3 301 B13R2.369 CC1OC2=CC=CC=C2NC1=O BB57-5543 [0,1,0,1,0,0|2,0,0]=4 302 B13R2.369 NC1CC2=CC=CC=C2NC1=O BB55-4907 [0,1,0,1,0,0|1,0,0]=3 303 B13R2.369 O=C1NC2=CC=CC=C2OC1=O BB12-1662 [0,1,0,1,0,0|1,0,1]=4 304 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)S1 BB50-0386 [0,1,0,1,0,0|0,0,2]=4 305 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)N1 BB54-4264 [0,1,0,1,0,0|1,0,1]=4 306 B13R2.435 O=C(O)C1CC2=CC=CC=C2C1 BB54-1488 [0,1,0,1,0,0|0,0,0]=2 307 B13R2.5179 O=C1COC2=C(Cl)C=CC=C2N1 BB54-2962 [0,1,0,1,0,0|2,0,0]=4 308 B13R2.3683 CC1=CC=C2NC(=O)COC2=C1 BB10-0258 [0,1,0,1,0,0|2,0,0]=4 309 B13R2.3683 NC1=CC=C2NC(=O)CCC2=C1 BB54-1362 [0,1,0,1,0,0|1,0,0]=3 310 B13R2.3683 O=C1COC2=C(C=CC(O)=C2)N1 BB54-5767 [0,1,0,1,0,0|2,0,0]=4 311 B13R2.3683 O=C1COC2=CC(Cl)=CC=C2N1 BB10-0256 [0,1,0,1,0,0|2,0,0]=4 312 B9R1.6 O=C(O)C1=CC=CN=N1 BB58-3622 [0,0,0,0,2,0|2,0,0]=4 313 B9R1.6 O=C(O)C1=CC=NC=N1 BB54-3716 [0,0,0,0,2,0|2,0,0]=4 314 B9R1.13 CC(=O)CC1=CC=CS1 BB12-3710 [0,0,0,0,2,0|2,0,0]=4 315 B9R1.13 O=C(O)CC1=CC=CN1 BB58-0483 [0,0,0,0,2,0|1,0,0]=3 316 B9R1.13 O=C(O)CC1=CSC=N1 BB54-4129 [0,0,0,0,2,0|2,0,0]=4 317 B9R1.13 O=C(O)CN1C=CC=C1 BB55-6532 [0,0,0,0,2,0|1,0,0]=3 318 B9R1.13 O=C(O)CN1C=CN=C1 BB01-4993 [0,0,0,0,2,0|2,0,0]=4 319 B13R1.337 CC(=O)NCCOC1=CC=CN=C1 BB57-6466 [0,0,0,0,0,2|2,0,0]=4 320 B13R1.337 O=C(O)CCSCC1=CC=CC=C1 BB12-2751 [0,0,0,0,0,2|0,0,0]=2