0 B5R0.1 C=C(C)CNN BB57-2407 [0,0,0,0,0,0|4,0,0]=4 1 B5R0.1 CC(=O)CC#N BB54-5411 [0,0,0,0,0,0|2,0,1]=3 2 B5R0.1 CC(N)CCO BB57-1076 [0,0,0,0,0,0|3,0,1]=4 3 B5R0.1 CCOC(C)=N BB12-3674 [0,0,0,0,0,0|1,0,0]=1 4 B5R0.1 CNCC(C)=O BB12-3010 [0,0,0,0,0,0|2,0,0]=2 5 B5R0.1 CNCC(C)O BB12-1288 [0,0,0,0,0,0|2,0,2]=4 6 B5R0.1 COCC(N)=S BB58-4256 [0,0,0,0,0,0|3,1,0]=4 7 B5R0.1 CS(=O)CCN BB55-5915 [0,0,0,0,0,0|3,0,0]=3 8 B5R0.1 NC(=O)CCO BB58-1090 [0,0,0,0,0,0|3,0,0]=3 9 B4R0.1 C#CC(=C)C BB54-0485 [1,0,0,0,0,0|1,0,2]=4 10 B4R0.1 CC(N)CO BB01-7506 [1,0,0,0,0,0|2,0,1]=4 11 B4R0.1 CCC(=N)N BB54-4123 [1,0,0,0,0,0|2,0,0]=3 12 B4R0.1 COC(=S)[S-] BB12-3031 [1,0,0,0,0,0|1,1,0]=3 13 B4R0.1 CSC(=N)N BB01-6974 [1,0,0,0,0,0|2,1,0]=4 14 B4R0.1 C[C@H](N)CO BB20-1224 [1,0,0,0,0,0|2,0,1]=4 15 B4R0.1 C\C(N)=N\O BB53-1937 [1,0,0,0,0,0|3,0,0]=4 16 B4R0.1 NC(=S)CO BB58-2954 [1,0,0,0,0,0|2,1,0]=4 17 B4R0.2 CCCNN BB58-2805 [1,0,0,0,0,0|3,0,0]=4 18 B4R0.2 CNCCCl BB57-4776 [1,0,0,0,0,0|3,0,0]=4 19 B4R0.2 CNCCI BB57-4692 [1,0,0,0,0,0|3,0,0]=4 20 B4R0.2 CSCCCl BB53-1396 [1,0,0,0,0,0|3,0,0]=4 21 B4R0.2 CSCCN BB12-0970 [1,0,0,0,0,0|3,0,0]=4 22 B6R0.1 C#CC(=O)OCC BB53-1426 [0,1,0,0,0,0|0,0,1]=2 23 B6R0.1 CCCC(O)CN BB58-4054 [0,1,0,0,0,0|1,0,2]=4 24 B6R0.1 CCC\C(N)=N\O BB10-0037 [0,1,0,0,0,0|2,0,1]=4 25 B6R0.1 CCNC(=O)CBr BB57-1139 [0,1,0,0,0,0|1,0,0]=2 26 B6R0.1 CCNC(=S)NN BB12-3098 [0,1,0,0,0,0|2,1,0]=4 27 B6R0.1 CCNC(C)CO BB12-1659 [0,1,0,0,0,0|1,0,2]=4 28 B6R0.1 CCOC(=N)CC BB57-3767 [0,1,0,0,0,0|1,0,0]=2 29 B6R0.1 CCOC(=N)CCl BB57-3987 [0,1,0,0,0,0|1,0,0]=2 30 B6R0.1 CCOC(C)CN BB57-2923 [0,1,0,0,0,0|1,0,1]=3 31 B6R0.1 CNC(=O)CC#N BB12-1423 [0,1,0,0,0,0|2,0,1]=4 32 B6R0.1 CNC(=O)CCCl BB12-1619 [0,1,0,0,0,0|2,0,0]=3 33 B6R0.1 CNC(=O)CCN BB12-1715 [0,1,0,0,0,0|2,0,0]=3 34 B6R0.1 CNC(=O)CCO BB12-3660 [0,1,0,0,0,0|2,0,0]=3 35 B6R0.1 CNCC(=O)NC BB01-4880 [0,1,0,0,0,0|2,0,0]=3 36 B6R0.1 CNCC(=O)NN BB12-1497 [0,1,0,0,0,0|3,0,0]=4 37 B6R0.1 CNNC(=O)OC BB58-0264 [0,1,0,0,0,0|2,0,0]=3 38 B6R0.1 COC(=O)CCN BB12-2761 [0,1,0,0,0,0|2,0,0]=3 39 B6R0.1 COC(=O)CCO BB12-1300 [0,1,0,0,0,0|2,0,0]=3 40 B6R0.1 COCC(=O)NN BB55-2156 [0,1,0,0,0,0|3,0,0]=4 41 B6R0.2 CC(=O)NC(=N)N BB56-2578 [0,1,0,0,0,0|2,0,1]=4 42 B6R0.2 CC(C)=CC(=O)O BB01-7468 [0,1,0,0,0,0|2,0,1]=4 43 B6R0.2 CC(C)NC(N)=O BB01-7616 [0,1,0,0,0,0|2,0,0]=3 44 B6R0.2 CC(N)CC(=O)O BB12-2890 [0,1,0,0,0,0|2,0,0]=3 45 B6R0.2 CC(N)CC(C)O BB58-3424 [0,1,0,0,0,0|1,0,2]=4 46 B6R0.2 O=C(O)CC(F)F BB31-2950 [0,1,0,0,0,0|3,0,0]=4 47 B6R0.3 CCC(Br)C(N)=O BB55-8830 [0,1,0,0,0,0|2,0,0]=3 48 B6R0.3 CNC(C)C(=O)O BB57-2982 [0,1,0,0,0,0|3,0,0]=4 49 B6R0.3 COC(C)C(=O)O BB57-2927 [0,1,0,0,0,0|3,0,0]=4 50 B6R0.3 CSC(C)C(=O)O BB12-2671 [0,1,0,0,0,0|3,0,0]=4 51 B6R0.3 NC(CCl)C(=O)O BB57-2456 [0,1,0,0,0,0|3,0,0]=4 52 B6R0.3 O=C(O)C(O)CCl BB57-6579 [0,1,0,0,0,0|3,0,0]=4 53 B6R0.4 CC(=O)NCC#N BB57-3731 [0,1,0,0,0,0|1,0,1]=3 54 B6R0.4 CC(C)SCCCl BB53-1373 [0,1,0,0,0,0|1,1,1]=4 55 B6R0.4 CC(C)SCCN BB53-1544 [0,1,0,0,0,0|1,1,1]=4 56 B6R0.4 CC(C)SCCO BB53-1392 [0,1,0,0,0,0|1,1,1]=4 57 B6R0.4 CCCCC(N)=S BB31-3291 [0,1,0,0,0,0|2,1,0]=4 58 B6R0.4 CCCNC(N)=O BB01-7603 [0,1,0,0,0,0|2,0,0]=3 59 B6R0.4 CCNCC(C)O BB12-1676 [0,1,0,0,0,0|1,0,2]=4 60 B6R0.4 CCOCC(=O)Cl BB01-8267 [0,1,0,0,0,0|1,0,0]=2 61 B6R0.4 CCSCC(=O)O BB12-3264 [0,1,0,0,0,0|1,1,0]=3 62 B6R0.4 CNCCC(=O)O BB12-1452 [0,1,0,0,0,0|2,0,0]=3 63 B6R0.4 COCCC(=O)Cl BB20-1617 [0,1,0,0,0,0|2,0,0]=3 64 B6R0.4 COCCC(C)=O BB58-1056 [0,1,0,0,0,0|1,0,0]=2 65 B6R0.4 CSCCC(=N)N BB12-3715 [0,1,0,0,0,0|3,0,0]=4 66 B6R0.4 N=C(N)CCCCl BB54-4116 [0,1,0,0,0,0|3,0,0]=4 67 B6R0.4 NC(=O)CCCCl BB57-2489 [0,1,0,0,0,0|2,0,0]=3 68 B6R0.4 NCCCC(N)=O BB57-4725 [0,1,0,0,0,0|2,0,0]=3 69 B6R0.4 NCCNC(N)=S BB58-1242 [0,1,0,0,0,0|2,1,0]=4 70 B6R0.5 CCCS(=O)(=O)Cl BB01-7478 [0,1,0,0,0,0|3,0,0]=4 71 B6R0.5 CCNS(=O)(=O)O BB57-2465 [0,1,0,0,0,0|3,0,0]=4 72 B6R0.5 CS(=O)(=O)CCCl BB53-1551 [0,1,0,0,0,0|3,0,0]=4 73 B6R0.5 CS(=O)(=O)CCN BB53-1620 [0,1,0,0,0,0|3,0,0]=4 74 B6R0.5 CS(=O)(=O)CCO BB53-1360 [0,1,0,0,0,0|3,0,0]=4 75 B6R1.2 CC1=NCCN1 BB01-8036 [0,0,0,1,0,0|2,0,0]=3 76 B6R1.2 N=C1NCCN1 BB20-0100 [0,0,0,1,0,0|3,0,0]=4 77 B6R1.3 CCNC1CC1 BB57-0155 [0,0,0,1,0,0|2,0,1]=4 78 B6R1.10 CC1(N)CCC1 BB57-6091 [0,0,0,1,0,0|2,0,1]=4 79 B6R1.11 CC(N)C1CC1 BB05-4551 [0,0,0,1,0,0|2,0,1]=4 80 B6R1.11 CC(N)C1CC1 BB55-7032 [0,0,0,1,0,0|2,0,1]=4 81 B6R1.11 N=C(N)C1CC1 BB53-1675 [0,0,0,1,0,0|3,0,0]=4 82 B6R1.11 NC(=S)C1CC1 BB12-3485 [0,0,0,1,0,0|2,1,0]=4 83 B3R0.1 CNOC BB01-7679 [2,0,0,0,0,0|1,0,0]=3 84 B3R0.1 NNC=O BB12-2770 [2,0,0,0,0,0|2,0,0]=4 85 B3R0.1 [C-]#[N+]CC BB56-1802 [2,0,0,0,0,0|1,0,1]=4 86 B3R0.2 CS(=O)[O-] BB12-1172 [2,0,0,0,0,0|1,0,1]=4 87 B3R0.2 N[13C](N)=O BB54-5648 [2,0,0,0,0,0|2,0,0]=4 88 B5R0.3 CCC(C)NC BB53-1672 [1,1,0,0,0,0|1,0,1]=4 89 B5R0.3 CC\C(N)=N\O BB12-3467 [1,1,0,0,0,0|1,0,1]=4 90 B5R0.3 CNC(=O)CBr BB55-6801 [1,1,0,0,0,0|1,0,0]=3 91 B5R0.3 CNC(=O)CO BB58-0349 [1,1,0,0,0,0|1,0,0]=3 92 B5R0.3 COC(C)C#N BB57-3722 [1,1,0,0,0,0|1,0,1]=4 93 B5R0.3 COC(C)CN BB55-4647 [1,1,0,0,0,0|1,0,1]=4 94 B5R0.3 NNC(=O)CO BB12-3095 [1,1,0,0,0,0|2,0,0]=4 95 B5R0.3 NNC(=O)CS BB58-4379 [1,1,0,0,0,0|2,0,0]=4 96 B5R0.3 [C-]#[N+]C(C)CC BB56-1204 [1,1,0,0,0,0|1,0,1]=4 97 B5R0.5 CC(C)C(=N)N BB20-1445 [1,1,0,0,0,0|2,0,0]=4 98 B5R0.5 CC(Cl)C(N)=O BB12-1307 [1,1,0,0,0,0|1,0,0]=3 99 B5R0.5 CC(O)C(=N)N BB58-0260 [1,1,0,0,0,0|2,0,0]=4 100 B5R0.2 C=COCCN BB57-6790 [1,1,0,0,0,0|0,0,1]=3 101 B5R0.2 CCC#CCO BB58-4730 [1,1,0,0,0,0|1,0,1]=4 102 B5R0.2 CCSCCN BB53-1545 [1,1,0,0,0,0|0,1,1]=4 103 B5R0.2 CCSCCO BB54-1799 [1,1,0,0,0,0|0,1,1]=4 104 B5R0.2 CNCCSC BB57-4145 [1,1,0,0,0,0|2,0,0]=4 105 B7R0.2 CC(C)CC(=O)NN BB12-2655 [0,2,0,0,0,0|2,0,0]=4 106 B7R0.2 CC(C)NC(=O)CBr BB57-1138 [0,2,0,0,0,0|1,0,0]=3 107 B7R0.2 CCC(C)NC(N)=O BB01-7615 [0,2,0,0,0,0|2,0,0]=4 108 B7R0.2 CCN(C)CC(=O)O BB12-1321 [0,2,0,0,0,0|2,0,0]=4 109 B7R0.2 CCN(C)CC(C)=O BB12-2316 [0,2,0,0,0,0|1,0,0]=3 110 B7R0.2 CNC(=O)CC(C)N BB12-1658 [0,2,0,0,0,0|1,0,0]=3 111 B7R0.2 CNC(C)CC(=O)O BB12-1285 [0,2,0,0,0,0|2,0,0]=4 112 B7R0.2 C\C(C=O)=C\N(C)C BB12-3546 [0,2,0,0,0,0|2,0,0]=4 113 B7R0.3 C=CCNC(=O)CCl BB17-2019 [0,2,0,0,0,0|1,0,1]=4 114 B7R0.3 CCC(=O)NCCN BB12-2323 [0,2,0,0,0,0|1,0,0]=3 115 B7R0.3 CCCCC(=O)NN BB12-2550 [0,2,0,0,0,0|2,0,0]=4 116 B7R0.3 CCCOC(C)CN BB55-6921 [0,2,0,0,0,0|1,0,1]=4 117 B7R0.3 CCO\C=C(\C)C=O BB12-3547 [0,2,0,0,0,0|0,0,0]=2 118 B7R0.3 CNC(=O)CCCN BB55-7167 [0,2,0,0,0,0|1,0,0]=3 119 B7R0.3 CNCCC(=O)NC BB12-1428 [0,2,0,0,0,0|1,0,0]=3 120 B7R0.3 COCCC(=O)NN BB20-4502 [0,2,0,0,0,0|2,0,0]=4 121 B7R0.3 NNC(=O)CCCO BB55-4806 [0,2,0,0,0,0|2,0,0]=4 122 B7R0.3 O=C(CCl)NCCCl BB57-4227 [0,2,0,0,0,0|1,0,0]=3 123 B7R0.5 CC(=O)N(C)CCO BB55-7164 [0,2,0,0,0,0|1,0,0]=3 124 B7R0.5 CCNC(=O)C(=O)O BB57-2473 [0,2,0,0,0,0|1,0,1]=4 125 B7R0.5 CCNC(=O)C(C)Cl BB55-4743 [0,2,0,0,0,0|1,0,0]=3 126 B7R0.5 CCOC(=N)C(C)C BB57-3768 [0,2,0,0,0,0|1,0,0]=3 127 B7R0.5 CCOC(=N)C(C)O BB58-1354 [0,2,0,0,0,0|1,0,0]=3 128 B7R0.5 CCOC(=O)N(C)N BB57-3659 [0,2,0,0,0,0|0,0,0]=2 129 B7R0.5 CCSC(C)C(=O)O BB12-3261 [0,2,0,0,0,0|0,1,1]=4 130 B7R0.5 CN(C)C(=O)CCCl BB12-1527 [0,2,0,0,0,0|2,0,0]=4 131 B7R0.5 CN(C)C(=O)CCN BB57-3998 [0,2,0,0,0,0|2,0,0]=4 132 B7R0.5 CN(C)C(=O)CCO BB12-3663 [0,2,0,0,0,0|2,0,0]=4 133 B7R0.5 CNCC(=O)N(C)C BB57-3999 [0,2,0,0,0,0|2,0,0]=4 134 B7R0.5 CNCC(C)C(=O)O BB12-1637 [0,2,0,0,0,0|2,0,0]=4 135 B7R0.7 CCOC(=N)CCCl BB12-2325 [0,2,0,0,0,0|1,0,0]=3 136 B7R0.7 CCOC(=O)CCO BB12-1446 [0,2,0,0,0,0|0,0,0]=2 137 B7R0.7 CCOC(=O)CNN BB05-1938 [0,2,0,0,0,0|0,0,0]=2 138 B7R0.7 CCO\C(C)=N/C#N BB58-1101 [0,2,0,0,0,0|1,0,0]=3 139 B7R0.7 [C-]#[N+]CC(=O)OCC BB56-1762 [0,2,0,0,0,0|0,0,0]=2 140 B7R0.10 CCC(C)C(=O)NN BB55-8843 [0,2,0,0,0,0|2,0,0]=4 141 B7R0.10 CCC(N)C(=O)NO BB57-4144 [0,2,0,0,0,0|2,0,0]=4 142 B7R0.10 CCN(C)C(=O)CCl BB12-2479 [0,2,0,0,0,0|1,0,0]=3 143 B7R0.10 CNC(=O)C(C)NC BB12-3606 [0,2,0,0,0,0|2,0,0]=4 144 B7R0.10 CNC(C)C(=O)OC BB57-2496 [0,2,0,0,0,0|2,0,0]=4 145 B7R0.10 COC(=O)C(O)CCl BB57-4961 [0,2,0,0,0,0|2,0,0]=4 146 B7R0.12 CCOC(CC)CBr BB12-3730 [0,2,0,0,0,0|1,0,1]=4 147 B7R0.9 CC(=O)CS(C)(=O)=O BB12-0011 [0,2,0,0,0,0|2,0,0]=4 148 B7R0.9 CC(C)(C)NC(N)=O BB01-7611 [0,2,0,0,0,0|2,0,0]=4 149 B7R0.9 CC(C)(C)OC(N)=O BB56-2323 [0,2,0,0,0,0|1,0,0]=3 150 B7R0.16 CC(=O)C(=O)N(C)C BB58-1081 [0,2,0,0,0,0|2,0,0]=4 151 B7R0.13 CCC(C)(N)C(=O)O BB56-0974 [0,2,0,0,0,0|2,0,0]=4 152 B7R0.15 CCC(CN)C(=O)O BB58-3841 [0,2,0,0,0,0|2,0,0]=4 153 B7R0.15 CCC(NC)C(=O)O BB57-2477 [0,2,0,0,0,0|2,0,0]=4 154 B7R0.15 CCC(NC)C(N)=O BB57-1806 [0,2,0,0,0,0|2,0,0]=4 155 B7R0.15 CCC(OC)C(=O)O BB57-2928 [0,2,0,0,0,0|2,0,0]=4 156 B7R0.4 CC(=O)NCCCN BB32-2735 [0,2,0,0,0,0|1,0,0]=3 157 B7R0.4 CC(=O)NCCCO BB12-3384 [0,2,0,0,0,0|1,0,0]=3 158 B7R0.4 CCCNCC(=O)O BB20-0186 [0,2,0,0,0,0|2,0,0]=4 159 B7R0.4 CCCOCC(=O)O BB55-7872 [0,2,0,0,0,0|1,0,0]=3 160 B7R0.4 CCCSCC(=O)O BB12-3263 [0,2,0,0,0,0|1,1,0]=4 161 B7R0.4 CCOCCC(=O)Cl BB58-1931 [0,2,0,0,0,0|1,0,0]=3 162 B7R0.4 CCO\C=C\C(C)C BB57-4132 [0,2,0,0,0,0|1,0,1]=4 163 B7R0.4 CCSCCC(=O)O BB12-3270 [0,2,0,0,0,0|1,1,0]=4 164 B7R0.4 NC(=O)CSCCO BB53-1357 [0,2,0,0,0,0|1,1,0]=4 165 B7R0.4 O=C(O)CNCCO BB58-1263 [0,2,0,0,0,0|2,0,0]=4 166 B7R0.6 C=C(C)COC(C)=O BB12-2984 [0,2,0,0,0,0|0,0,0]=2 167 B7R0.6 CC(=O)OCC(=O)Cl BB12-3445 [0,2,0,0,0,0|0,0,1]=3 168 B7R0.6 CC(C)CNC(N)=O BB01-7595 [0,2,0,0,0,0|2,0,0]=4 169 B7R0.6 CC(C)SCC(=O)O BB12-3365 [0,2,0,0,0,0|1,1,0]=4 170 B7R0.6 CN(C)CCC(=O)O BB55-3488 [0,2,0,0,0,0|2,0,0]=4 171 B7R0.8 CS(=O)(=O)CCCO BB57-2922 [0,2,0,0,0,0|2,0,0]=4 172 B7R0.8 CS(=O)(=O)NCCN BB12-2754 [0,2,0,0,0,0|2,0,0]=4 173 B7R0.8 O=P(Cl)(Cl)OCCBr BB54-5401 [0,2,0,0,0,0|2,0,0]=4 174 B5R1.2 O=C1CNC1 BB20-3400 [1,0,0,1,0,0|1,0,0]=3 175 B5R1.5 CC1(N)CC1 BB58-0060 [1,0,0,1,0,0|1,0,1]=4 176 B7R1.1 ClCC1=NCCN1 BB12-2991 [0,1,0,1,0,0|2,0,0]=4 177 B7R1.1 NCC1CCCO1 BB12-1343 [0,1,0,1,0,0|1,0,1]=4 178 B7R1.2 CC1=CC(C)=NO1 BB01-6357 [0,1,0,1,0,0|1,0,1]=4 179 B7R1.2 CC1CNC(=O)C1 BB58-5429 [0,1,0,1,0,0|1,0,0]=3 180 B7R1.2 CC1CNC(=O)O1 BB57-3655 [0,1,0,1,0,0|0,0,0]=2 181 B7R1.2 CC1CNC(=S)N1 BB20-1218 [0,1,0,1,0,0|1,1,0]=4 182 B7R1.2 CC1COC(=O)N1 BB57-2454 [0,1,0,1,0,0|1,0,0]=3 183 B7R1.2 O=C1C=C(O)CC1 BB12-0743 [0,1,0,1,0,0|1,0,1]=4 184 B7R1.2 O=C1C=C(O)CO1 BB54-5190 [0,1,0,1,0,0|0,0,2]=4 185 B7R1.2 O=[13C]1CC[13C](=O)O1 BB54-5289 [0,1,0,1,0,0|0,0,1]=3 186 B7R1.3 BrC1CCCOC1 BB55-3590 [0,1,0,1,0,0|1,0,1]=4 187 B7R1.3 CC1=CCNCC1 BB57-2457 [0,1,0,1,0,0|2,0,0]=4 188 B7R1.3 CC1CNCCO1 BB57-2444 [0,1,0,1,0,0|1,0,1]=4 189 B7R1.3 NC1CCCOC1 BB12-2177 [0,1,0,1,0,0|1,0,1]=4 190 B7R1.3 O=C1CNCCN1 BB54-4362 [0,1,0,1,0,0|1,0,0]=3 191 B7R1.3 O=C1CSCCN1 BB20-1255 [0,1,0,1,0,0|1,0,0]=3 192 B7R1.4 NC1CCCC1=O BB58-3328 [0,1,0,1,0,0|1,0,0]=3 193 B7R1.4 NC1CCNC1=O BB12-2184 [0,1,0,1,0,0|1,0,0]=3 194 B7R1.22 COC(=O)C1CN1 BB58-4742 [0,1,0,1,0,0|2,0,0]=4 195 B7R1.22 O=C(CBr)C1CC1 BB55-6968 [0,1,0,1,0,0|1,0,0]=3 196 B7R1.22 O=C(CCl)N1CC1 BB57-2872 [0,1,0,1,0,0|1,0,0]=3 197 B7R1.12 O=C(O)[C@H]1C[C@@H]1F BB31-3333 [0,1,0,1,0,0|2,0,0]=4 198 B7R1.20 O=C(Cl)CC1CC1 BB57-3744 [0,1,0,1,0,0|2,0,0]=4 199 B7R1.18 NC(=O)C1CCC1 BB12-3033 [0,1,0,1,0,0|2,0,0]=4 200 B7R1.18 O=C(O)C1CCN1 BB57-4884 [0,1,0,1,0,0|2,0,0]=4 201 B7R1.18 O=C(O)C1CCO1 BB31-4760 [0,1,0,1,0,0|1,0,0]=3 202 B7R1.19 NC(=O)C1(N)CC1 BB58-3762 [0,1,0,1,0,0|2,0,0]=4