0 B4R0.1 C#CC(C)N BBS-00030121 [0,0,0,0,0,0|2,0,1]=3 1 B4R0.1 C=CC(C)=O BBS-00028059 [0,0,0,0,0,0|1,0,3]=4 2 B4R0.1 CC(=O)CCl BBS-00004082 [0,0,0,0,0,0|1,0,2]=3 3 B4R0.1 CC(C)CN BBS-00020833 [0,0,0,0,0,0|2,0,0]=2 4 B4R0.1 CC(C)NN BBS-00024807 [0,0,0,0,0,0|3,0,0]=3 5 B4R0.1 CC(N)CF BBS-00026269 [0,0,0,0,0,0|2,0,0]=2 6 B4R0.1 CCC(=N)N BBS-00024955 [0,0,0,0,0,0|3,0,1]=4 7 B4R0.1 CCC(N)=O BBS-00028396 [0,0,0,0,0,0|2,0,2]=4 8 B4R0.1 COC(C)=O BBS-00032571 [0,0,0,0,0,0|2,0,2]=4 9 B4R0.1 CSC(N)N BBS-00013733 [0,0,0,0,0,0|4,0,0]=4 10 B4R0.1 C\C(N)=N\O BBS-00013452 [0,0,0,0,0,0|2,0,1]=3 11 B4R0.1 C\N=[N+](/C)[O-] BBS-00022567 [0,0,0,0,0,0|3,0,1]=4 12 B4R0.1 N=C(N)CO BBS-00025049 [0,0,0,0,0,0|2,0,1]=3 13 B4R0.1 NCC(=O)O BBS-00003777 [0,0,0,0,0,0|2,0,1]=3 14 B4R0.1 O=C(Br)CBr BBS-00004286 [0,0,0,0,0,0|2,0,2]=4 15 B4R0.1 O=C(O)CO BBS-00004277 [0,0,0,0,0,0|1,0,1]=2 16 B4R0.1 O=CC(=O)O BBS-00020891 [0,0,0,0,0,0|1,0,3]=4 17 B3R0.1 C=CC[CH2-] BBS-00027244 [1,0,0,0,0,0|1,0,2]=4 18 B3R0.1 CCNO BBS-00026502 [1,0,0,0,0,0|1,0,0]=2 19 B3R0.1 NCCBr BBS-00028408 [1,0,0,0,0,0|2,0,0]=3 20 B3R0.1 NCCN BBS-00032793 [1,0,0,0,0,0|2,0,0]=3 21 B3R0.1 NCCN BBS-00032909 [1,0,0,0,0,0|2,0,0]=3 22 B3R0.1 NCCS BBS-00020848 [1,0,0,0,0,0|1,1,0]=3 23 B3R0.1 N\C=N/O BBS-00031964 [1,0,0,0,0,0|2,0,1]=4 24 B3R0.1 OCCO BBS-00004320 [1,0,0,0,0,0|0,0,0]=1 25 B3R0.1 OCCS BBS-00024265 [1,0,0,0,0,0|0,1,0]=2 26 B3R0.2 CC(=N)N BBS-00004306 [1,0,0,0,0,0|2,0,1]=4 27 B3R0.2 CC(=N)N BBS-00028162 [1,0,0,0,0,0|2,0,1]=4 28 B3R0.2 CC(N)=O BBS-00020846 [1,0,0,0,0,0|1,0,2]=4 29 B3R0.2 CC(N)=S BBS-00004249 [1,0,0,0,0,0|1,1,1]=4 30 B5R0.1 CC(C)CNN BBS-00006851 [0,1,0,0,0,0|2,0,0]=3 31 B5R0.1 CC(C)N=C=O BBS-00020504 [0,1,0,0,0,0|1,0,2]=4 32 B5R0.1 CC(N)CCO BBS-00017066 [0,1,0,0,0,0|1,0,0]=2 33 B5R0.1 CNCC(=O)O BBS-00022461 [0,1,0,0,0,0|2,0,1]=4 34 B5R0.1 COCC(C)N BBS-00028799 [0,1,0,0,0,0|1,0,0]=2 35 B5R0.1 CSCC(C)N BBS-00032559 [0,1,0,0,0,0|1,1,0]=3 36 B5R0.1 NCCC(=O)O BBS-00028074 [0,1,0,0,0,0|2,0,1]=4 37 B5R0.1 NNCC(F)F BBS-00024837 [0,1,0,0,0,0|3,0,0]=4 38 B5R0.1 NNCC(F)F BBS-00032794 [0,1,0,0,0,0|3,0,0]=4 39 B5R0.1 NOCC(=O)O BBS-00039484 [0,1,0,0,0,0|1,0,1]=3 40 B5R0.1 O=C(O)CCS BBS-00038803 [0,1,0,0,0,0|1,1,1]=4 41 B5R0.3 C(=O)C(O)CO BBS-00029374 [0,1,0,0,0,0|0,0,1]=2 42 B5R0.3 C(C)=C(\C)CO BBS-00029567 [0,1,0,0,0,0|1,0,1]=3 43 B5R0.3 CC(C#N)CBr BBS-00033139 [0,1,0,0,0,0|2,0,0]=3 44 B5R0.3 CC(CN)CO BBS-00016648 [0,1,0,0,0,0|1,0,0]=2 45 B5R0.3 CC(CO)NN BBS-00022979 [0,1,0,0,0,0|1,0,0]=2 46 B5R0.3 CCC(C)NN BBS-00032568 [0,1,0,0,0,0|2,0,0]=3 47 B5R0.3 CCC(N)CN BBS-00027091 [0,1,0,0,0,0|2,0,0]=3 48 B5R0.3 CCN(N)CC BBS-00006718 [0,1,0,0,0,0|3,0,0]=4 49 B5R0.3 CC\C(N)=N\O BBS-00019746 [0,1,0,0,0,0|2,0,1]=4 50 B5R0.3 CNC(=O)CBr BBS-00025180 [0,1,0,0,0,0|1,0,2]=4 51 B5R0.3 COC(=O)CN BBS-00028749 [0,1,0,0,0,0|1,0,2]=4 52 B5R0.3 NCC(=O)NO BBS-00022565 [0,1,0,0,0,0|1,0,2]=4 53 B5R0.3 NCC(Br)CBr BBS-00029305 [0,1,0,0,0,0|2,0,0]=3 54 B5R0.3 O=C(CCl)CCl BBS-00020931 [0,1,0,0,0,0|1,0,2]=4 55 B5R0.3 OCC(Br)CBr BBS-00028809 [0,1,0,0,0,0|1,0,0]=2 56 B5R0.4 CC(C)(C)NN BBS-00004238 [0,1,0,0,0,0|3,0,0]=4 57 B5R0.4 CC(C)(N)C#N BBS-00008429 [0,1,0,0,0,0|2,0,1]=4 58 B5R0.4 CC(C)(N)CO BBS-00020842 [0,1,0,0,0,0|1,0,0]=2 59 B5R0.4 CC(C)(O)C#N BBS-00004270 [0,1,0,0,0,0|1,0,1]=3 60 B5R0.5 CC(Cl)C(=N)N BBS-00032606 [0,1,0,0,0,0|2,0,1]=4 61 B5R0.5 CC(N)C(=O)O BBS-00003820 [0,1,0,0,0,0|1,0,1]=3 62 B5R0.5 CC(N)C(C)N BBS-00028767 [0,1,0,0,0,0|2,0,0]=3 63 B5R0.5 CC(N)C(N)=O BBS-00028694 [0,1,0,0,0,0|1,0,2]=4 64 B5R0.5 CC(O)C(=O)[O-] BBS-00028838 [0,1,0,0,0,0|0,0,2]=3 65 B5R0.5 CC(O)C(=O)[O-] BBS-00038938 [0,1,0,0,0,0|0,0,2]=3 66 B5R0.5 C[C@H](N)C(=O)O BBS-00039166 [0,1,0,0,0,0|1,0,1]=3 67 B5R1.2 CC1CCN1 BBS-00016641 [0,0,0,1,0,0|2,0,0]=3 68 B5R1.3 ClCC1CO1 BBS-00004288 [0,0,0,1,0,0|1,0,0]=2 69 B5R1.3 N#CC1CC1 BBS-00024193 [0,0,0,1,0,0|2,0,1]=4 70 B5R1.3 NCC1CC1 BBS-00020859 [0,0,0,1,0,0|2,0,0]=3 71 B5R1.3 NNC1CC1 BBS-00033254 [0,0,0,1,0,0|3,0,0]=4 72 B5R1.4 C[C@@H]1C[C@H]1N BBS-00016702 [0,0,0,1,0,0|2,0,0]=3 73 B5R1.5 CC1(N)CC1 BBS-00017204 [0,0,0,1,0,0|2,0,0]=3 74 B4R0.2 CCCNN BBS-00032546 [1,1,0,0,0,0|1,0,0]=3 75 B4R0.2 CCN=C=S BBS-00004372 [1,1,0,0,0,0|0,1,1]=4 76 B4R0.2 CNCCI BBS-00032731 [1,1,0,0,0,0|1,0,0]=3 77 B4R0.2 COCC#N BBS-00021196 [1,1,0,0,0,0|1,0,1]=4 78 B4R0.2 N#CCCCl BBS-00028153 [1,1,0,0,0,0|1,0,1]=4 79 B4R0.2 NCCCN BBS-00004281 [1,1,0,0,0,0|1,0,0]=3 80 B4R0.2 NCCCS BBS-00016508 [1,1,0,0,0,0|0,1,0]=3 81 B4R0.2 OCCCO BBS-00004418 [1,1,0,0,0,0|0,0,0]=2 82 B4R0.3 CC(C)(C)N BBS-00004218 [1,1,0,0,0,0|1,0,0]=3 83 B4R0.3 CS(C)(=N)=O BBS-00025062 [1,1,0,0,0,0|1,0,1]=4 84 B4R0.3 C[N+](C)(C)N BBS-00027955 [1,1,0,0,0,0|2,0,0]=4 85 B6R0.1 CCC(C)N=C=S BBS-00024244 [0,2,0,0,0,0|1,1,0]=4 86 B6R0.1 CNC(C)CSC BBS-00032852 [0,2,0,0,0,0|1,1,0]=4 87 B6R0.1 [NH3+]CCC(F)C[NH3+] BBS-00026129 [0,2,0,0,0,0|2,0,0]=4 88 B6R0.2 CC(=O)CC(C)C BBS-00028076 [0,2,0,0,0,0|1,0,1]=4 89 B6R0.2 CC(C)CC(N)=O BBS-00025732 [0,2,0,0,0,0|1,0,1]=4 90 B6R0.2 CC(N)CC(=O)O BBS-00020853 [0,2,0,0,0,0|1,0,0]=3 91 B6R0.2 CC(O)CC(C)S BBS-00029294 [0,2,0,0,0,0|0,1,0]=3 92 B6R0.2 CN(C)CC(=O)O BBS-00031818 [0,2,0,0,0,0|2,0,0]=4 93 B6R0.2 O=C(O)CC(=O)O BBS-00003780 [0,2,0,0,0,0|1,0,1]=4 94 B6R0.3 CC(C)\C(N)=N\O BBS-00013453 [0,2,0,0,0,0|1,0,1]=4 95 B6R0.3 CC(CN)N(C)C BBS-00008309 [0,2,0,0,0,0|2,0,0]=4 96 B6R0.3 CCC(N)C(=O)O BBS-00028679 [0,2,0,0,0,0|1,0,1]=4 97 B6R0.3 CCC(O)C(C)Br BBS-00033232 [0,2,0,0,0,0|1,0,0]=3 98 B6R0.3 COC(=O)C(C)Br BBS-00028786 [0,2,0,0,0,0|1,0,1]=4 99 B6R0.3 COC(=O)C(C)Cl BBS-00028077 [0,2,0,0,0,0|1,0,1]=4 100 B6R0.3 COC(=O)C(C)N BBS-00027542 [0,2,0,0,0,0|1,0,1]=4 101 B6R0.3 COC(=O)C(C)O BBS-00028814 [0,2,0,0,0,0|0,0,1]=3 102 B6R0.3 COC(=O)[C@@H](C)N BBS-00011131 [0,2,0,0,0,0|1,0,1]=4 103 B6R0.3 COC(C)C(=N)N BBS-00032075 [0,2,0,0,0,0|1,0,1]=4 104 B6R0.3 COC(C)C(N)=O BBS-00032082 [0,2,0,0,0,0|0,0,2]=4 105 B6R0.3 NC(=O)C(N)CO BBS-00028920 [0,2,0,0,0,0|1,0,1]=4 106 B6R0.3 NC(CO)C(=O)O BBS-00027543 [0,2,0,0,0,0|1,0,0]=3 107 B6R0.3 NC(CS)C(=O)O BBS-00025588 [0,2,0,0,0,0|1,0,1]=4 108 B6R0.3 O=C(O)C(Br)CBr BBS-00032702 [0,2,0,0,0,0|1,0,1]=4 109 B6R0.3 O=C(O)C(S)CS BBS-00021075 [0,2,0,0,0,0|0,1,1]=4 110 B6R0.4 CC(C)CN=C=O BBS-00018035 [0,2,0,0,0,0|1,0,1]=4 111 B6R0.4 CC(C)SCCCl BBS-00015673 [0,2,0,0,0,0|2,0,0]=4 112 B6R0.5 CC(C)(C)CNN BBS-00024836 [0,2,0,0,0,0|2,0,0]=4 113 B6R0.5 CCNC(C)(C)C BBS-00025642 [0,2,0,0,0,0|2,0,0]=4 114 B6R0.5 COCC(C)(C)N BBS-00011997 [0,2,0,0,0,0|1,0,0]=3 115 B6R0.8 CC(C)(C=O)CO BBS-00036931 [0,2,0,0,0,0|0,0,1]=3 116 B6R0.8 CC(C)(CN)CO BBS-00017068 [0,2,0,0,0,0|1,0,0]=3 117 B6R0.9 C\N=C(\CO)NC BBS-00035774 [0,2,0,0,0,0|1,0,1]=4 118 B6R0.9 NCC(CO)CO BBS-00024800 [0,2,0,0,0,0|0,0,0]=2 119 B6R0.7 CC(C)(O)C(=O)O BBS-00020862 [0,2,0,0,0,0|0,0,1]=3 120 B6R0.7 CC(N)C(C)(C)C BBS-00021123 [0,2,0,0,0,0|2,0,0]=4 121 B6R0.7 CC(O)C(C)(C)N BBS-00023354 [0,2,0,0,0,0|1,0,0]=3 122 B4R1.1 C1CNC1 BBS-00020861 [1,0,0,1,0,0|1,0,0]=3 123 B4R1.2 NC1CC1 BBS-00003593 [1,0,0,1,0,0|1,0,0]=3 124 B6R1.2 NC1CCCC1 BBS-00003621 [0,1,0,1,0,0|2,0,0]=4 125 B6R1.2 OC1CCNC1 BBS-00033264 [0,1,0,1,0,0|1,0,0]=3 126 B6R1.3 CNCC1CC1 BBS-00024851 [0,1,0,1,0,0|2,0,0]=4 127 B6R1.3 NCCC1CC1 BBS-00025097 [0,1,0,1,0,0|2,0,0]=4 128 B6R1.3 NNCC1CC1 BBS-00026257 [0,1,0,1,0,0|2,0,0]=4 129 B6R1.3 [NH3+]OCC1CC1 BBS-00032418 [0,1,0,1,0,0|1,0,0]=3 130 B6R1.8 CC1CC1CN BBS-00017216 [0,1,0,1,0,0|2,0,0]=4 131 B6R1.8 CC1CC1CO BBS-00017218 [0,1,0,1,0,0|1,0,0]=3 132 B6R1.8 CCC1OC1C BBS-00033237 [0,1,0,1,0,0|1,0,0]=3 133 B6R1.8 CO[C@@H]1C[C@H]1N BBS-00022900 [0,1,0,1,0,0|1,0,0]=3 134 B6R1.9 CC1(C)CC1N BBS-00017200 [0,1,0,1,0,0|2,0,0]=4 135 B6R1.10 CC1(C)CNC1 BBS-00016642 [0,1,0,1,0,0|2,0,0]=4 136 B6R1.6 BrCC1CCC1 BBS-00021122 [0,1,0,1,0,0|2,0,0]=4 137 B6R1.6 CNC1CCC1 BBS-00032931 [0,1,0,1,0,0|2,0,0]=4 138 B6R1.6 NCC1CCC1 BBS-00021146 [0,1,0,1,0,0|2,0,0]=4 139 B6R1.6 NNC1CCC1 BBS-00024536 [0,1,0,1,0,0|2,0,0]=4 140 B6R1.6 NNC1CCC1 BBS-00032863 [0,1,0,1,0,0|2,0,0]=4 141 B6R1.6 NNC1COC1 BBS-00024839 [0,1,0,1,0,0|1,0,0]=3 142 B6R1.6 NOC1COC1 BBS-00024841 [0,1,0,1,0,0|0,0,0]=2 143 B6R1.7 CC1(CN)CC1 BBS-00017203 [0,1,0,1,0,0|2,0,0]=4 144 B6R1.7 CC1(CO)CC1 BBS-00017202 [0,1,0,1,0,0|1,0,0]=3