0 B3R0.1 C#CCBr CUR-0002725 [0,0,0,0,0,0|2,0,2]=4 1 B3R0.1 C#CCN CUR-0101424 [0,0,0,0,0,0|2,0,2]=4 2 B3R0.1 C#CCO CUR-0007009 [0,0,0,0,0,0|1,1,2]=4 3 B3R0.1 C(=O)C=O CUR-0024623 [0,0,0,0,0,0|2,1,1]=4 4 B3R0.1 C(=O)NN CUR-0101193 [0,0,0,0,0,0|1,1,2]=4 5 B3R0.1 C(C#N)Br CUR-0100898 [0,0,0,0,0,0|3,0,1]=4 6 B3R0.1 C(C#N)Cl CUR-0018708 [0,0,0,0,0,0|3,0,1]=4 7 B3R0.1 C(C#N)N CUR-0101408 [0,0,0,0,0,0|3,0,1]=4 8 B3R0.1 C(C=O)Cl CUR-0018990 [0,0,0,0,0,0|2,1,1]=4 9 B3R0.1 C(CBr)Br CUR-0000806 [0,0,0,0,0,0|3,0,1]=4 10 B3R0.1 C(CBr)Cl CUR-0006161 [0,0,0,0,0,0|3,0,1]=4 11 B3R0.1 C(CBr)N CUR-0103516 [0,0,0,0,0,0|3,0,1]=4 12 B3R0.1 C(CBr)O CUR-0021042 [0,0,0,0,0,0|2,1,1]=4 13 B3R0.1 C(CCl)N CUR-0015629 [0,0,0,0,0,0|3,0,1]=4 14 B3R0.1 C(CCl)O CUR-0101474 [0,0,0,0,0,0|2,1,1]=4 15 B3R0.1 C(CN)N CUR-0009355 [0,0,0,0,0,0|3,0,1]=4 16 B3R0.1 C(CN)N CUR-0101207 [0,0,0,0,0,0|3,0,1]=4 17 B3R0.1 C(CN)N CUR-0101271 [0,0,0,0,0,0|3,0,1]=4 18 B3R0.1 C(CO)N CUR-0010085 [0,0,0,0,0,0|2,1,1]=4 19 B3R0.1 C(CO)O CUR-0026540 [0,0,0,0,0,0|2,1,1]=4 20 B3R0.1 C(CS)N CUR-0000633 [0,0,0,0,0,0|2,0,2]=4 21 B3R0.1 C(CS)N CUR-0101235 [0,0,0,0,0,0|2,0,2]=4 22 B3R0.1 C(CS)O CUR-0013730 [0,0,0,0,0,0|2,0,2]=4 23 B3R0.1 C=CC#N CUR-0023863 [0,0,0,0,0,0|2,0,2]=4 24 B3R0.1 C=CCBr CUR-0014802 [0,0,0,0,0,0|2,0,2]=4 25 B3R0.1 C=CCCl CUR-0002102 [0,0,0,0,0,0|2,0,2]=4 26 B3R0.1 C=CCI CUR-0024817 [0,0,0,0,0,0|2,0,2]=4 27 B3R0.1 C=CCN CUR-0009493 [0,0,0,0,0,0|2,0,2]=4 28 B3R0.1 C=CCO CUR-0101427 [0,0,0,0,0,0|1,1,2]=4 29 B3R0.1 CCC#N CUR-0100813 [0,0,0,0,0,0|2,0,1]=3 30 B3R0.1 CCC=O CUR-0015273 [0,0,0,0,0,0|1,1,1]=3 31 B3R0.1 CCCBr CUR-0028377 [0,0,0,0,0,0|2,0,1]=3 32 B3R0.1 CCCI CUR-0010202 [0,0,0,0,0,0|2,0,1]=3 33 B3R0.1 CCCN CUR-0000120 [0,0,0,0,0,0|2,0,1]=3 34 B3R0.1 CCCO CUR-0017382 [0,0,0,0,0,0|1,1,1]=3 35 B3R0.1 CCCS CUR-0009615 [0,0,0,0,0,0|1,0,2]=3 36 B3R0.1 CCNN CUR-0017500 [0,0,0,0,0,0|3,0,0]=3 37 B3R0.1 CN=C=S CUR-0012135 [0,0,0,0,0,0|0,0,0]=0 38 B3R0.1 CNC=O CUR-0012781 [0,0,0,0,0,0|0,1,2]=3 39 B3R0.1 CNOC CUR-0015640 [0,0,0,0,0,0|2,0,1]=3 40 B3R0.1 COCCl CUR-0028317 [0,0,0,0,0,0|2,0,1]=3 41 B3R0.1 CSSC CUR-0101553 [0,0,0,0,0,0|3,0,0]=3 42 B2R0.1 C(#N)N CUR-0024768 [1,0,0,0,0,0|1,0,2]=4 43 B2R0.1 C(=O)N CUR-0026798 [1,0,0,0,0,0|0,1,2]=4 44 B2R0.1 C(=O)O CUR-0018439 [1,0,0,0,0,0|1,1,1]=4 45 B2R0.1 C(Br)Br CUR-0005423 [1,0,0,0,0,0|2,0,1]=4 46 B2R0.1 C(I)I CUR-0100965 [1,0,0,0,0,0|2,0,1]=4 47 B2R0.1 CC=O CUR-0008743 [1,0,0,0,0,0|0,1,1]=3 48 B2R0.1 CCBr CUR-0012119 [1,0,0,0,0,0|1,0,1]=3 49 B2R0.1 CCI CUR-0000443 [1,0,0,0,0,0|1,0,1]=3 50 B2R0.1 CCN CUR-0101229 [1,0,0,0,0,0|1,0,1]=3 51 B2R0.1 CCS CUR-0022672 [1,0,0,0,0,0|0,0,2]=3 52 B2R0.1 CNC CUR-0026541 [1,0,0,0,0,0|0,0,2]=3 53 B2R0.1 CNC CUR-0101266 [1,0,0,0,0,0|0,0,2]=3 54 B2R0.1 CNN CUR-0101255 [1,0,0,0,0,0|1,0,1]=3 55 B2R0.1 CON CUR-0007384 [1,0,0,0,0,0|2,0,0]=3 56 B4R0.1 C(=S)(N)NN CUR-0004669 [0,1,0,0,0,0|1,0,2]=4 57 B4R0.1 CC(=C)C=O CUR-0101443 [0,1,0,0,0,0|1,1,1]=4 58 B4R0.1 CC(=C)CCl CUR-0011941 [0,1,0,0,0,0|2,0,1]=4 59 B4R0.1 CC(=C)OC CUR-0101450 [0,1,0,0,0,0|2,0,1]=4 60 B4R0.1 CC(=O)C=C CUR-0013098 [0,1,0,0,0,0|2,0,1]=4 61 B4R0.1 CC(=O)C=O CUR-0101448 [0,1,0,0,0,0|1,1,1]=4 62 B4R0.1 CC(=O)CCl CUR-0002239 [0,1,0,0,0,0|2,0,1]=4 63 B4R0.1 CC(=O)CO CUR-0005016 [0,1,0,0,0,0|1,1,1]=4 64 B4R0.1 CC(C#C)N CUR-0083146 [0,1,0,0,0,0|2,0,1]=4 65 B4R0.1 CC(C#C)O CUR-0101444 [0,1,0,0,0,0|2,0,1]=4 66 B4R0.1 CC(C#N)Cl CUR-0101233 [0,1,0,0,0,0|2,0,1]=4 67 B4R0.1 CC(C)C#N CUR-0009528 [0,1,0,0,0,0|2,0,1]=4 68 B4R0.1 CC(C)C=O CUR-0017872 [0,1,0,0,0,0|1,1,1]=4 69 B4R0.1 CC(C)CBr CUR-0024115 [0,1,0,0,0,0|2,0,1]=4 70 B4R0.1 CC(C)CI CUR-0028804 [0,1,0,0,0,0|2,0,1]=4 71 B4R0.1 CC(C)CN CUR-0020747 [0,1,0,0,0,0|2,0,1]=4 72 B4R0.1 CC(C)CO CUR-0012302 [0,1,0,0,0,0|1,1,1]=4 73 B4R0.1 CC(C)NN CUR-0014509 [0,1,0,0,0,0|3,0,0]=4 74 B4R0.1 CC(CN)N CUR-0101461 [0,1,0,0,0,0|2,0,1]=4 75 B4R0.1 CC(CN)O CUR-0024952 [0,1,0,0,0,0|2,0,1]=4 76 B4R0.1 CC(CN)S CUR-0003165 [0,1,0,0,0,0|2,0,1]=4 77 B4R0.1 CC(CO)O CUR-0022593 [0,1,0,0,0,0|1,1,1]=4 78 B4R0.1 CC(CS)N CUR-0021165 [0,1,0,0,0,0|1,0,2]=4 79 B4R0.1 CCC(=O)Cl CUR-0101547 [0,1,0,0,0,0|1,1,1]=4 80 B4R0.1 CCC(=O)N CUR-0101453 [0,1,0,0,0,0|1,1,1]=4 81 B4R0.1 CCC(=O)O CUR-0010221 [0,1,0,0,0,0|1,1,1]=4 82 B4R0.1 CCC(C)Br CUR-0102085 [0,1,0,0,0,0|2,0,1]=4 83 B4R0.1 CCC(C)I CUR-0055396 [0,1,0,0,0,0|2,0,1]=4 84 B4R0.1 CCC(C)N CUR-0001789 [0,1,0,0,0,0|2,0,1]=4 85 B4R0.1 CCN(C)C CUR-0101456 [0,1,0,0,0,0|1,0,2]=4 86 B4R0.1 CC[N+](=O)[O-] CUR-0012449 [0,1,0,0,0,0|2,1,0]=4 87 B4R0.1 CN(C)C#N CUR-0101445 [0,1,0,0,0,0|1,0,2]=4 88 B4R0.1 CNC(=O)N CUR-0025342 [0,1,0,0,0,0|0,1,2]=4 89 B4R0.1 CNC(=S)N CUR-0004136 [0,1,0,0,0,0|0,0,2]=3 90 B4R0.1 COC(=N)N CUR-0101458 [0,1,0,0,0,0|2,0,1]=4 91 B4R0.1 COC(=O)Cl CUR-0019109 [0,1,0,0,0,0|1,1,1]=4 92 B4R0.1 COC(Cl)Cl CUR-0101733 [0,1,0,0,0,0|2,0,1]=4 93 B4R0.1 CSC(=N)N CUR-0104011 [0,1,0,0,0,0|2,0,1]=4 94 B4R0.1 C\C(=N\O)\N CUR-0098903 [0,1,0,0,0,0|2,0,1]=4 95 B4R0.2 C#CCCN CUR-0100609 [0,1,0,0,0,0|2,0,1]=4 96 B4R0.2 C#CCCO CUR-0101442 [0,1,0,0,0,0|2,0,1]=4 97 B4R0.2 C(CBr)CBr CUR-0016721 [0,1,0,0,0,0|2,0,1]=4 98 B4R0.2 C(CCl)C#N CUR-0025838 [0,1,0,0,0,0|2,0,1]=4 99 B4R0.2 C(CCl)CBr CUR-0004377 [0,1,0,0,0,0|2,0,1]=4 100 B4R0.2 C(CN)CBr CUR-0103678 [0,1,0,0,0,0|2,0,1]=4 101 B4R0.2 C(CN)CCl CUR-0101958 [0,1,0,0,0,0|2,0,1]=4 102 B4R0.2 C(CN)CN CUR-0101462 [0,1,0,0,0,0|2,0,1]=4 103 B4R0.2 C(CN)CO CUR-0005687 [0,1,0,0,0,0|1,1,1]=4 104 B4R0.2 C(CO)C#N CUR-0000520 [0,1,0,0,0,0|2,0,1]=4 105 B4R0.2 C(CO)CCl CUR-0004180 [0,1,0,0,0,0|1,1,1]=4 106 B4R0.2 C(CO)CO CUR-0007262 [0,1,0,0,0,0|1,1,1]=4 107 B4R0.2 C(CO)NN CUR-0100819 [0,1,0,0,0,0|3,0,0]=4 108 B4R0.2 C(CS)CS CUR-0006323 [0,1,0,0,0,0|1,0,2]=4 109 B4R0.2 C=CCCBr CUR-0002027 [0,1,0,0,0,0|2,0,1]=4 110 B4R0.2 C=CCCI CUR-0000685 [0,1,0,0,0,0|2,0,1]=4 111 B4R0.2 C=CCCO CUR-0101449 [0,1,0,0,0,0|2,0,1]=4 112 B4R0.2 CC#CCBr CUR-0102000 [0,1,0,0,0,0|2,0,1]=4 113 B4R0.2 CC=CC#N CUR-0028876 [0,1,0,0,0,0|2,0,1]=4 114 B4R0.2 CCCC#N CUR-0101440 [0,1,0,0,0,0|2,0,1]=4 115 B4R0.2 CCCC=O CUR-0100896 [0,1,0,0,0,0|1,1,1]=4 116 B4R0.2 CCCCBr CUR-0023794 [0,1,0,0,0,0|2,0,1]=4 117 B4R0.2 CCCCCl CUR-0023945 [0,1,0,0,0,0|2,0,1]=4 118 B4R0.2 CCCCI CUR-0001021 [0,1,0,0,0,0|2,0,1]=4 119 B4R0.2 CCCCN CUR-0017800 [0,1,0,0,0,0|2,0,1]=4 120 B4R0.2 CCCCN CUR-0101317 [0,1,0,0,0,0|2,0,1]=4 121 B4R0.2 CCCCO CUR-0016718 [0,1,0,0,0,0|1,1,1]=4 122 B4R0.2 CCCNN CUR-0022831 [0,1,0,0,0,0|2,0,1]=4 123 B4R0.2 CCN=C=O CUR-0101447 [0,1,0,0,0,0|0,1,0]=2 124 B4R0.2 CCN=C=S CUR-0006416 [0,1,0,0,0,0|0,0,0]=1 125 B4R0.2 CCNCC CUR-0022731 [0,1,0,0,0,0|1,0,2]=4 126 B4R0.2 CCNCC CUR-0101285 [0,1,0,0,0,0|1,0,2]=4 127 B4R0.2 CCOC=C CUR-0100764 [0,1,0,0,0,0|2,0,1]=4 128 B4R0.2 CCOC=O CUR-0010493 [0,1,0,0,0,0|1,1,1]=4 129 B4R0.2 CNCCI CUR-0017490 [0,1,0,0,0,0|1,0,2]=4 130 B4R0.2 CNCCO CUR-0011813 [0,1,0,0,0,0|0,1,2]=4 131 B4R0.2 COCC#N CUR-0101446 [0,1,0,0,0,0|2,0,1]=4 132 B4R0.2 COCCBr CUR-0009505 [0,1,0,0,0,0|2,0,1]=4 133 B4R0.2 COCCCl CUR-0000941 [0,1,0,0,0,0|2,0,1]=4 134 B4R0.2 COCCN CUR-0012344 [0,1,0,0,0,0|2,0,1]=4 135 B4R0.2 COCCO CUR-0101466 [0,1,0,0,0,0|1,1,1]=4 136 B4R0.2 COCOC CUR-0101465 [0,1,0,0,0,0|1,1,1]=4 137 B4R0.2 CSCCN CUR-0101544 [0,1,0,0,0,0|2,0,1]=4 138 B4R0.2 C\C=C\C#N CUR-0101432 [0,1,0,0,0,0|2,0,1]=4 139 B4R0.2 C\C=C\C=O CUR-0001472 [0,1,0,0,0,0|1,1,1]=4 140 B4R1.1 C1CNC1 CUR-0026397 [0,0,0,1,0,0|1,0,2]=4 141 B4R1.2 C1CC1Br CUR-0101807 [0,0,0,1,0,0|2,0,1]=4 142 B4R1.2 C1CC1N CUR-0000296 [0,0,0,1,0,0|2,0,1]=4 143 B4R1.2 CC1CO1 CUR-0006075 [0,0,0,1,0,0|1,1,1]=4 144 B1R0.1 CI CUR-0009105 [2,0,0,0,0,0|1,0,0]=3 145 B1R0.1 CN CUR-0101232 [2,0,0,0,0,0|0,0,1]=3 146 B3R0.2 C(=N)(N)N CUR-0011215 [1,1,0,0,0,0|1,0,1]=4 147 B3R0.2 C(=S)(N)N CUR-0027936 [1,1,0,0,0,0|0,0,2]=4 148 B3R0.2 CC(=N)N CUR-0023632 [1,1,0,0,0,0|1,0,1]=4 149 B3R0.2 CC(=O)Br CUR-0004133 [1,1,0,0,0,0|0,1,1]=4 150 B3R0.2 CC(=O)Cl CUR-0019985 [1,1,0,0,0,0|0,1,1]=4 151 B3R0.2 CC(=O)N CUR-0016336 [1,1,0,0,0,0|0,1,1]=4 152 B3R0.2 CC(=O)O CUR-0005925 [1,1,0,0,0,0|0,1,1]=4 153 B3R0.2 CC(=S)N CUR-0008655 [1,1,0,0,0,0|0,0,1]=3 154 B3R0.2 CC(C)Br CUR-0027321 [1,1,0,0,0,0|1,0,1]=4 155 B3R0.2 CC(C)Cl CUR-0022523 [1,1,0,0,0,0|1,0,1]=4 156 B3R0.2 CC(C)I CUR-0026227 [1,1,0,0,0,0|1,0,1]=4 157 B3R0.2 CC(C)N CUR-0024558 [1,1,0,0,0,0|1,0,1]=4 158 B3R0.2 CC(C)S CUR-0012379 [1,1,0,0,0,0|0,0,2]=4 159 B3R0.2 CN(C)C CUR-0004768 [1,1,0,0,0,0|0,0,2]=4 160 B3R0.2 CP(C)C CUR-0006076 [1,1,0,0,0,0|0,1,1]=4 161 B3R0.2 C[N+](=O)[O-] CUR-0016305 [1,1,0,0,0,0|0,1,1]=4 162 B3R0.2 C[S+](C)C CUR-0103505 [1,1,0,0,0,0|1,0,1]=4 163 B5R0.1 CC(C)N=C=O CUR-0101492 [0,2,0,0,0,0|0,1,0]=3 164 B5R0.1 CC(C)N=C=S CUR-0101608 [0,2,0,0,0,0|0,0,0]=2 165 B5R0.3 CNC(=S)NC CUR-0101643 [0,2,0,0,0,0|0,0,2]=4 166 B5R0.3 CNC(=S)NN CUR-0026769 [0,2,0,0,0,0|0,0,2]=4 167 B5R0.5 CN(C)C(=S)Cl CUR-0101854 [0,2,0,0,0,0|0,0,2]=4 168 B5R0.5 CN(C)C(=S)N CUR-0099857 [0,2,0,0,0,0|0,0,2]=4 169 B5R0.2 C#CCN=C=O CUR-0021951 [0,2,0,0,0,0|0,1,0]=3 170 B5R0.2 C(CCl)N=C=O CUR-0029062 [0,2,0,0,0,0|0,1,0]=3 171 B5R0.2 C=CCN=C=S CUR-0101580 [0,2,0,0,0,0|0,0,0]=2 172 B5R0.2 CCCN=C=O CUR-0101493 [0,2,0,0,0,0|0,1,0]=3