0 B5R0.3 CC\C(N)=N\O BB12-3467 [0,0,0,0,0,0|4,0,0]=4 1 B5R0.3 CNC(=N)NN BB32-1370 [0,0,0,0,0,0|4,0,0]=4 2 B5R0.3 CNC(=O)CBr BB55-6801 [0,0,0,0,0,0|2,0,1]=3 3 B5R0.3 CNC(=O)CO BB58-0349 [0,0,0,0,0,0|2,0,1]=3 4 B5R0.3 CNC(=S)NN BB12-2784 [0,0,0,0,0,0|3,1,0]=4 5 B5R0.3 COC(C)C#N BB57-3722 [0,0,0,0,0,0|2,0,2]=4 6 B5R0.3 COC(C)CN BB55-4647 [0,0,0,0,0,0|2,0,2]=4 7 B5R0.3 NNC(=O)CO BB12-3095 [0,0,0,0,0,0|3,0,1]=4 8 B5R0.3 NNC(=O)CS BB58-4379 [0,0,0,0,0,0|3,0,1]=4 9 B4R0.1 C#CC(=C)C BB54-0485 [1,0,0,0,0,0|1,0,2]=4 10 B4R0.1 CCC(=N)N BB54-4123 [1,0,0,0,0,0|3,0,0]=4 11 B4R0.1 COC(=S)[S-] BB12-3031 [1,0,0,0,0,0|1,1,0]=3 12 B4R0.1 CSC(=N)N BB01-6974 [1,0,0,0,0,0|2,1,0]=4 13 B4R0.1 C\C(N)=N\O BB53-1937 [1,0,0,0,0,0|3,0,0]=4 14 B6R0.1 C#CC(=O)OCC BB53-1426 [0,1,0,0,0,0|0,0,2]=3 15 B6R0.1 CCNC(=O)CBr BB57-1139 [0,1,0,0,0,0|2,0,1]=4 16 B6R0.1 CCOC(=N)CC BB57-3767 [0,1,0,0,0,0|1,0,2]=4 17 B6R0.1 CCOC(=N)CCl BB57-3987 [0,1,0,0,0,0|2,0,1]=4 18 B6R0.1 CNC(=O)CC#N BB12-1423 [0,1,0,0,0,0|1,0,2]=4 19 B6R0.1 CNC(=O)CCCl BB12-1619 [0,1,0,0,0,0|1,0,2]=4 20 B6R0.1 CNC(=O)CCN BB12-1715 [0,1,0,0,0,0|1,0,2]=4 21 B6R0.1 CNC(=O)CCO BB12-3660 [0,1,0,0,0,0|1,0,2]=4 22 B6R0.1 CNCC(=O)NC BB01-4880 [0,1,0,0,0,0|1,0,2]=4 23 B6R0.1 CNCC(=O)NN BB12-1497 [0,1,0,0,0,0|3,0,0]=4 24 B6R0.1 CNNC(=O)OC BB58-0264 [0,1,0,0,0,0|1,0,1]=3 25 B6R0.1 COC(=O)CCN BB12-2761 [0,1,0,0,0,0|0,0,2]=3 26 B6R0.1 COC(=O)CCO BB12-1300 [0,1,0,0,0,0|0,0,2]=3 27 B6R0.1 COCC(=O)NN BB55-2156 [0,1,0,0,0,0|2,0,0]=3 28 B6R0.1 COC\C(N)=N\O BB20-4328 [0,1,0,0,0,0|3,0,0]=4 29 B6R0.3 CC(C)C(=O)NN BB12-1583 [0,1,0,0,0,0|3,0,0]=4 30 B6R0.3 CN(C)C(=O)CBr BB57-2931 [0,1,0,0,0,0|2,0,1]=4 31 B6R0.3 CN(C)C(=O)CO BB12-3698 [0,1,0,0,0,0|2,0,1]=4 32 B6R0.3 CN(C)C(=O)NN BB12-2766 [0,1,0,0,0,0|3,0,0]=4 33 B6R0.3 CNC(=O)C(C)Br BB12-1295 [0,1,0,0,0,0|1,0,2]=4 34 B6R0.3 CNC(=O)C(C)Cl BB55-4738 [0,1,0,0,0,0|1,0,2]=4 35 B6R0.3 CNC(=O)[C@@H](C)N BB32-0279 [0,1,0,0,0,0|1,0,2]=4 36 B6R0.3 COC(=N)C(C)C BB12-3132 [0,1,0,0,0,0|1,0,2]=4 37 B6R0.3 COC(=O)N(C)N BB12-2783 [0,1,0,0,0,0|1,0,1]=3 38 B6R0.3 COC(C)C(=O)O BB57-2927 [0,1,0,0,0,0|2,0,1]=4 39 B6R0.3 NNC(=O)C(N)=O BB12-2523 [0,1,0,0,0,0|3,0,0]=4 40 B6R1.2 BrC1=CC=NS1 BB54-5514 [0,0,0,1,0,0|2,1,0]=4 41 B6R1.2 CC1=CC=NN1 BB56-1939 [0,0,0,1,0,0|3,0,0]=4 42 B6R1.2 NC1=NC=CO1 BB54-4580 [0,0,0,1,0,0|2,0,1]=4 43 B6R1.2 NC1=NNC=C1 BB54-4623 [0,0,0,1,0,0|3,0,0]=4 44 B6R1.2 O=C1NC=CN1 BB57-4795 [0,0,0,1,0,0|2,0,1]=4 45 B6R1.2 O=C1NC=NN1 BB54-5765 [0,0,0,1,0,0|3,0,0]=4 46 B3R0.1 CNOC BB01-7679 [2,0,0,0,0,0|1,0,1]=4 47 B3R0.1 NNC=O BB12-2770 [2,0,0,0,0,0|2,0,0]=4 48 B3R0.1 N\C=N/O BB12-3512 [2,0,0,0,0,0|2,0,0]=4 49 B3R0.2 CS(=O)[O-] BB12-1172 [2,0,0,0,0,0|2,0,0]=4 50 B3R0.2 N[13C](N)=O BB54-5648 [2,0,0,0,0,0|2,0,0]=4 51 B5R0.1 CC(=O)CC#N BB54-5411 [1,1,0,0,0,0|0,0,2]=4 52 B5R0.1 CCOC(C)=N BB12-3674 [1,1,0,0,0,0|1,0,1]=4 53 B5R0.1 CNCC(C)=O BB12-3010 [1,1,0,0,0,0|0,0,2]=4 54 B5R0.1 COCC(N)=S BB58-4256 [1,1,0,0,0,0|1,1,0]=4 55 B5R0.1 NC(=O)CCO BB58-1090 [1,1,0,0,0,0|2,0,0]=4 56 B5R0.5 CC(Cl)C(N)=O BB12-1307 [1,1,0,0,0,0|2,0,0]=4 57 B5R0.2 C=COCCN BB57-6790 [1,1,0,0,0,0|2,0,0]=4 58 B7R0.2 CNC(=O)CC(=O)O BB55-4725 [0,2,0,0,0,0|1,0,1]=4 59 B7R0.2 COC(=O)C[N+](=O)[O-] BB54-0206 [0,2,0,0,0,0|1,0,1]=4 60 B7R0.3 C=CCNC(=O)CCl BB17-2019 [0,2,0,0,0,0|2,0,0]=4 61 B7R0.3 CCO\C=C(\C)C=O BB12-3547 [0,2,0,0,0,0|2,0,0]=4 62 B7R0.3 COCCC(=O)NN BB20-4502 [0,2,0,0,0,0|2,0,0]=4 63 B7R0.5 CCNC(=O)C(=O)O BB57-2473 [0,2,0,0,0,0|2,0,0]=4 64 B7R0.5 CCOC(=O)N(C)N BB57-3659 [0,2,0,0,0,0|1,0,1]=4 65 B7R0.7 CCOC(=O)CCO BB12-1446 [0,2,0,0,0,0|0,0,2]=4 66 B7R0.7 CCOC(=O)CNN BB05-1938 [0,2,0,0,0,0|1,0,1]=4 67 B7R0.7 [C-]#[N+]CC(=O)OCC BB56-1762 [0,2,0,0,0,0|0,0,2]=4 68 B7R0.10 CNC(=O)\C(N)=N\O BB57-2408 [0,2,0,0,0,0|2,0,0]=4 69 B7R0.10 CNC(C)C(=O)OC BB57-2496 [0,2,0,0,0,0|0,0,2]=4 70 B7R0.10 COC(=O)C(=O)NN BB55-7573 [0,2,0,0,0,0|1,0,0]=3 71 B7R0.10 COC(=O)C(O)CCl BB57-4961 [0,2,0,0,0,0|0,0,2]=4 72 B7R0.10 COC(=O)\C(N)=N\O BB58-1318 [0,2,0,0,0,0|1,0,0]=3 73 B7R0.16 CC(=O)C(=O)N(C)C BB58-1081 [0,2,0,0,0,0|1,0,1]=4 74 B5R1.2 O=C1CNC1 BB20-3400 [1,0,0,1,0,0|1,0,1]=4 75 B5R1.1 C1=CSN=C1 BB58-1903 [1,0,0,1,0,0|1,1,0]=4 76 B7R1.1 CCC1=NNC=C1 BB12-3522 [0,1,0,1,0,0|2,0,0]=4 77 B7R1.1 COC1=NN=CS1 BB12-3086 [0,1,0,1,0,0|1,1,0]=4 78 B7R1.2 BrC1=CC=C(Br)O1 BB57-2079 [0,1,0,1,0,0|1,0,1]=4 79 B7R1.2 CC1=CC(C)=NO1 BB01-6357 [0,1,0,1,0,0|2,0,0]=4 80 B7R1.2 CC1=CC=C(N)S1 BB55-4553 [0,1,0,1,0,0|1,1,0]=4 81 B7R1.2 CC1=NOC(N)=C1 BB12-3489 [0,1,0,1,0,0|2,0,0]=4 82 B7R1.2 CC1CNC(=O)O1 BB57-3655 [0,1,0,1,0,0|1,0,1]=4 83 B7R1.2 CC1COC(=O)N1 BB57-2454 [0,1,0,1,0,0|0,0,2]=4 84 B7R1.2 CN1C=CC(Br)=N1 BB54-4890 [0,1,0,1,0,0|2,0,0]=4 85 B7R1.2 CN1C=CC(N)=N1 BB54-4712 [0,1,0,1,0,0|2,0,0]=4 86 B7R1.2 NC1=CC(=O)NO1 BB54-5766 [0,1,0,1,0,0|2,0,0]=4 87 B7R1.2 NC1=CC(O)=NO1 BB57-4169 [0,1,0,1,0,0|2,0,0]=4 88 B7R1.2 O=C1C=C(O)CC1 BB12-0743 [0,1,0,1,0,0|1,0,0]=3 89 B7R1.2 O=C1C=C(O)CO1 BB54-5190 [0,1,0,1,0,0|0,0,0]=2 90 B7R1.2 O=C1NC(=S)CS1 BB58-2054 [0,1,0,1,0,0|1,1,0]=4 91 B7R1.2 O=[13C]1CC[13C](=O)O1 BB54-5289 [0,1,0,1,0,0|2,0,0]=4 92 B7R1.4 CC1=C(Br)SC=C1 BB56-2325 [0,1,0,1,0,0|2,0,0]=4 93 B7R1.4 CC1=CN=CN1C BB58-5003 [0,1,0,1,0,0|2,0,0]=4 94 B7R1.4 CC1=CNNC1=O BB58-3426 [0,1,0,1,0,0|2,0,0]=4 95 B7R1.4 CN1N=CC=C1Br BB58-0095 [0,1,0,1,0,0|2,0,0]=4 96 B7R1.4 CN1N=CC=C1N BB05-2488 [0,1,0,1,0,0|2,0,0]=4 97 B7R1.22 COC(=O)C1CN1 BB58-4742 [0,1,0,1,0,0|0,0,2]=4 98 B7R1.14 O=S1(=O)C=CCC1 BB54-3187 [0,1,0,1,0,0|2,0,0]=4