0 B5R0.5 CC(C)C(=N)N BB20-1445 [0,0,0,0,0,0|3,0,1]=4 1 B5R0.5 CC(Cl)C(N)=O BB12-1307 [0,0,0,0,0,0|2,0,1]=3 2 B5R0.5 CC(O)C(=N)N BB58-0260 [0,0,0,0,0,0|2,0,2]=4 3 B5R0.5 CN(C)C(=N)N BB58-1392 [0,0,0,0,0,0|4,0,0]=4 4 B4R0.1 C#CC(=C)C BB54-0485 [1,0,0,0,0,0|1,0,2]=4 5 B4R0.1 CCC(=N)N BB54-4123 [1,0,0,0,0,0|2,0,1]=4 6 B4R0.1 COC(=S)[S-] BB12-3031 [1,0,0,0,0,0|2,1,0]=4 7 B4R0.1 CSC(=N)N BB01-6974 [1,0,0,0,0,0|3,0,0]=4 8 B4R0.1 C\C(N)=N\O BB53-1937 [1,0,0,0,0,0|2,0,1]=4 9 B6R0.3 CC(C)C(=O)NN BB12-1583 [0,1,0,0,0,0|2,0,1]=4 10 B6R0.3 CCC(Br)C(N)=O BB55-8830 [0,1,0,0,0,0|2,0,1]=4 11 B6R0.3 CN(C)C(=O)CBr BB57-2931 [0,1,0,0,0,0|2,0,0]=3 12 B6R0.3 CN(C)C(=O)CO BB12-3698 [0,1,0,0,0,0|2,0,0]=3 13 B6R0.3 CN(C)C(=O)NN BB12-2766 [0,1,0,0,0,0|3,0,0]=4 14 B6R0.3 CNC(=O)C(C)Br BB12-1295 [0,1,0,0,0,0|1,0,1]=3 15 B6R0.3 CNC(=O)C(C)Cl BB55-4738 [0,1,0,0,0,0|1,0,1]=3 16 B6R0.3 CNC(=O)[C@@H](C)N BB32-0279 [0,1,0,0,0,0|1,0,1]=3 17 B6R0.3 CNC(C)C(=O)O BB57-2982 [0,1,0,0,0,0|2,0,1]=4 18 B6R0.3 COC(=N)C(C)C BB12-3132 [0,1,0,0,0,0|2,0,1]=4 19 B6R0.3 COC(=O)N(C)N BB12-2783 [0,1,0,0,0,0|2,0,0]=3 20 B6R0.3 COC(C)C(=O)O BB57-2927 [0,1,0,0,0,0|1,0,2]=4 21 B6R0.3 CSC(C)C(=O)O BB12-2671 [0,1,0,0,0,0|1,1,1]=4 22 B6R0.3 NC(=O)\C(N)=N\O BB12-3387 [0,1,0,0,0,0|2,0,1]=4 23 B6R0.3 NC(CCl)C(=O)O BB57-2456 [0,1,0,0,0,0|2,0,1]=4 24 B6R0.3 NNC(=O)C(N)=O BB12-2523 [0,1,0,0,0,0|2,0,0]=3 25 B6R0.3 O=C(O)C(O)CCl BB57-6579 [0,1,0,0,0,0|1,0,2]=4 26 B6R0.7 CC(=O)C(C)(C)N BB54-1822 [0,1,0,0,0,0|1,0,1]=3 27 B6R0.7 CC(C)(Br)C(N)=O BB55-8836 [0,1,0,0,0,0|2,0,1]=4 28 B6R0.7 CC(C)(N)C(N)=O BB57-1099 [0,1,0,0,0,0|2,0,1]=4 29 B6R0.2 CC(=O)NC(=N)N BB56-2578 [0,0,0,0,0,1|2,0,0]=3 30 B6R0.2 CC(C)=CC(=O)O BB01-7468 [0,0,0,0,0,1|2,0,0]=3 31 B6R0.2 CC(C)NC(N)=O BB01-7616 [0,0,0,0,0,1|2,0,1]=4 32 B6R0.2 CC(N)CC(=O)O BB12-2890 [0,0,0,0,0,1|2,0,1]=4 33 B6R0.2 NC(=O)CC(=O)O BB55-4726 [0,0,0,0,0,1|2,0,0]=3 34 B6R0.2 NC(=O)C[N+](=O)[O-] BB54-0037 [0,0,0,0,0,1|3,0,0]=4 35 B3R0.1 CNOC BB01-7679 [2,0,0,0,0,0|2,0,0]=4 36 B3R0.1 NNC=O BB12-2770 [2,0,0,0,0,0|2,0,0]=4 37 B3R0.2 CS(=O)[O-] BB12-1172 [2,0,0,0,0,0|1,0,1]=4 38 B3R0.2 N[13C](N)=O BB54-5648 [2,0,0,0,0,0|2,0,0]=4 39 B5R0.1 CC(=O)CC#N BB54-5411 [1,1,0,0,0,0|0,0,2]=4 40 B5R0.1 CCOC(C)=N BB12-3674 [1,1,0,0,0,0|1,0,1]=4 41 B5R0.1 CNCC(C)=O BB12-3010 [1,1,0,0,0,0|0,0,1]=3 42 B5R0.1 CS(=O)CCN BB55-5915 [1,1,0,0,0,0|1,0,1]=4 43 B5R0.1 NC(=O)CCO BB58-1090 [1,1,0,0,0,0|1,0,1]=4 44 B5R0.3 CNC(=O)CBr BB55-6801 [1,1,0,0,0,0|1,0,0]=3 45 B5R0.3 CNC(=O)CO BB58-0349 [1,1,0,0,0,0|1,0,0]=3 46 B5R0.3 NNC(=O)CO BB12-3095 [1,1,0,0,0,0|2,0,0]=4 47 B5R0.3 NNC(=O)CS BB58-4379 [1,1,0,0,0,0|2,0,0]=4 48 B7R0.2 CC(C)NC(=O)CBr BB57-1138 [0,1,0,0,0,1|1,0,1]=4 49 B7R0.2 CCN(C)CC(C)=O BB12-2316 [0,1,0,0,0,1|2,0,0]=4 50 B7R0.2 CNC(=O)CC(=O)O BB55-4725 [0,1,0,0,0,1|1,0,0]=3 51 B7R0.2 CNC(=O)CC(C)N BB12-1658 [0,1,0,0,0,1|1,0,1]=4 52 B7R0.2 COC(=O)C[N+](=O)[O-] BB54-0206 [0,1,0,0,0,1|2,0,0]=4 53 B7R0.2 C\C(C=O)=C\N(C)C BB12-3546 [0,1,0,0,0,1|2,0,0]=4 54 B7R0.9 CC(=O)CS(C)(=O)=O BB12-0011 [0,1,0,0,0,1|1,0,0]=3 55 B7R0.16 CC(=O)C(=O)N(C)C BB58-1081 [0,1,0,0,0,1|2,0,0]=4 56 B7R0.16 CC(C(=O)O)C(=O)O BB20-4558 [0,1,0,0,0,1|2,0,0]=4 57 B7R0.5 CC(=O)N(C)CCO BB55-7164 [0,2,0,0,0,0|1,0,1]=4 58 B7R0.5 CC(NC=O)C(=O)O BB12-1345 [0,2,0,0,0,0|1,0,1]=4 59 B7R0.5 CCNC(=O)C(=O)O BB57-2473 [0,2,0,0,0,0|1,0,0]=3 60 B7R0.5 CCNC(=O)C(C)Cl BB55-4743 [0,2,0,0,0,0|1,0,1]=4 61 B7R0.5 CCOC(=O)N(C)N BB57-3659 [0,2,0,0,0,0|2,0,0]=4 62 B7R0.5 CN(C)C(=O)CC#N BB12-1492 [0,2,0,0,0,0|2,0,0]=4 63 B7R0.5 CN(C)C(=O)CCCl BB12-1527 [0,2,0,0,0,0|2,0,0]=4 64 B7R0.5 CN(C)C(=O)CCN BB57-3998 [0,2,0,0,0,0|2,0,0]=4 65 B7R0.5 CN(C)C(=O)CCO BB12-3663 [0,2,0,0,0,0|2,0,0]=4 66 B7R0.5 CNCC(=O)N(C)C BB57-3999 [0,2,0,0,0,0|2,0,0]=4 67 B7R0.10 CCN(C)C(=O)CCl BB12-2479 [0,2,0,0,0,0|2,0,0]=4 68 B7R0.10 CNC(=O)C(C)NC BB12-3606 [0,2,0,0,0,0|1,0,1]=4 69 B7R0.10 CNC(=O)\C(N)=N\O BB57-2408 [0,2,0,0,0,0|1,0,1]=4 70 B7R0.10 CNC(C)C(=O)OC BB57-2496 [0,2,0,0,0,0|1,0,1]=4 71 B7R0.10 COC(=O)C(=O)NN BB55-7573 [0,2,0,0,0,0|1,0,0]=3 72 B7R0.10 COC(=O)C(O)CCl BB57-4961 [0,2,0,0,0,0|0,0,2]=4 73 B7R0.10 COC(=O)\C(N)=N\O BB58-1318 [0,2,0,0,0,0|1,0,1]=4 74 B7R0.10 NNC(=O)C(=O)NN BB12-1807 [0,2,0,0,0,0|2,0,0]=4 75 B7R0.14 CC(C)(C)C(=O)CN BB12-1271 [0,2,0,0,0,0|1,0,1]=4 76 B7R0.14 CNC(=O)C(C)(C)N BB57-2984 [0,2,0,0,0,0|1,0,1]=4 77 B5R1.2 O=C1CNC1 BB20-3400 [1,0,0,1,0,0|1,0,1]=4 78 B7R1.2 CC1=CC(C)=NO1 BB01-6357 [0,0,0,1,0,1|1,0,1]=4 79 B7R1.2 CC1=NNC(C)=N1 BB12-3420 [0,0,0,1,0,1|2,0,0]=4 80 B7R1.2 O=C1C=C(O)CC1 BB12-0743 [0,0,0,1,0,1|0,0,1]=3 81 B7R1.2 O=C1C=C(O)CO1 BB54-5190 [0,0,0,1,0,1|1,0,1]=4 82 B7R1.2 O=C1CNC(=S)N1 BB20-3124 [0,0,0,1,0,1|1,1,0]=4 83 B7R1.2 O=C1NC(=S)CS1 BB58-2054 [0,0,0,1,0,1|1,1,0]=4 84 B7R1.2 O=[13C]1CC[13C](=O)O1 BB54-5289 [0,0,0,1,0,1|0,0,0]=2 85 B7R1.4 CC1=CNNC1=O BB58-3426 [0,1,0,1,0,0|2,0,0]=4 86 B7R1.4 NC1CCCC1=O BB58-3328 [0,1,0,1,0,0|1,0,1]=4 87 B7R1.4 NC1CCNC1=O BB12-2184 [0,1,0,1,0,0|1,0,1]=4 88 B7R1.22 COC(=O)C1CN1 BB58-4742 [0,1,0,1,0,0|1,0,1]=4 89 B7R1.22 O=C(CBr)C1CC1 BB55-6968 [0,1,0,1,0,0|1,0,1]=4 90 B7R1.22 O=C(CCl)N1CC1 BB57-2872 [0,1,0,1,0,0|2,0,0]=4 91 B7R0.6 C=C(C)COC(C)=O BB12-2984 [0,0,0,0,0,2|1,0,0]=3 92 B7R0.6 CC(=O)OCC(=O)Cl BB12-3445 [0,0,0,0,0,2|1,0,0]=3 93 B7R0.6 CC(C)=NNC(N)=O BB12-2973 [0,0,0,0,0,2|2,0,0]=4 94 B7R0.6 NC(=O)NNC(N)=O BB12-2767 [0,0,0,0,0,2|2,0,0]=4