0 B5R0.1 B(CCC)(O)O PI-35885 [0,0,0,0,0,0|2,1,0]=3 1 B5R0.1 BrCC=C(C)C PI-12725 [0,0,0,0,0,0|2,0,2]=4 2 B5R0.1 BrCCN(C)C PI-41040 [0,0,0,0,0,0|3,0,0]=3 3 B5R0.1 C(CBr)C(=O)Cl PI-47061 [0,0,0,0,0,0|2,1,1]=4 4 B5R0.1 C(CCl)C(=O)Cl PI-48842 [0,0,0,0,0,0|2,1,1]=4 5 B5R0.1 CC(=C)CCBr PI-40493 [0,0,0,0,0,0|2,0,1]=3 6 B5R0.1 CC(=O)NCO PI-29791 [0,0,0,0,0,0|2,1,1]=4 7 B5R0.1 CC(CCO)N PI-34839 [0,0,0,0,0,0|2,0,0]=2 8 B5R0.1 CC(CCO)N PI-35494 [0,0,0,0,0,0|2,0,0]=2 9 B5R0.1 CC(CCO)O PI-15618 [0,0,0,0,0,0|1,1,0]=2 10 B5R0.1 CC=CC(=O)C PI-45740 [0,0,0,0,0,0|0,1,3]=4 11 B5R0.1 CCCC(=O)N PI-32787 [0,0,0,0,0,0|1,1,1]=3 12 B5R0.1 CCCC(C)N PI-36925 [0,0,0,0,0,0|1,0,0]=1 13 B5R0.1 CCCC(C)O PI-42533 [0,0,0,0,0,0|0,1,0]=1 14 B5R0.1 CCC[C@@H](O)C PI-42532 [0,0,0,0,0,0|0,1,0]=1 15 B5R0.1 CCOC(=O)C PI-13192 [0,0,0,0,0,0|1,1,1]=3 16 B5R0.1 CCOC(=S)[S-] PI-47063 [0,0,0,0,0,0|2,0,2]=4 17 B5R0.1 CCO[Si](C)C PI-50089 [0,0,0,0,0,0|2,1,0]=3 18 B5R0.1 CCSC(=O)C PI-48509 [0,0,0,0,0,0|1,1,1]=3 19 B5R0.1 CCSC(=O)Cl PI-38596 [0,0,0,0,0,0|2,1,1]=4 20 B5R0.1 CNCC(=O)O PI-45053 [0,0,0,0,0,0|2,1,1]=4 21 B5R0.1 COCC(O)C PI-12912 [0,0,0,0,0,0|1,1,0]=2 22 B5R0.1 CSCC(=O)N PI-36555 [0,0,0,0,0,0|2,1,1]=4 23 B5R0.1 C[C@@H](CC#N)N PI-48104 [0,0,0,0,0,0|2,0,1]=3 24 B5R0.1 C[C@H](CCO)N PI-35493 [0,0,0,0,0,0|2,0,0]=2 25 B5R0.1 NC(CCC)=N PI-37197 [0,0,0,0,0,0|2,0,1]=3 26 B5R0.1 NCCC(=O)O PI-14317 [0,0,0,0,0,0|2,1,1]=4 27 B5R0.1 O=C(O)CCS PI-40342 [0,0,0,0,0,0|2,1,1]=4 28 B5R0.1 O=C=NC(C)C PI-11403 [0,0,0,0,0,0|3,0,1]=4 29 B5R0.1 O=S(CSC)C PI-39632 [0,0,0,0,0,0|2,1,0]=3 30 B5R0.1 OCCC(=C)Br PI-34814 [0,0,0,0,0,0|2,0,2]=4 31 B5R0.1 OCCC(=O)O PI-20855 [0,0,0,0,0,0|2,1,1]=4 32 B5R0.1 OCC[C@H](O)C PI-15617 [0,0,0,0,0,0|1,1,0]=2 33 B4R0.1 C(C(F)F)N PI-48941 [1,0,0,0,0,0|3,0,0]=4 34 B4R0.1 CC(=C)CBr PI-46510 [1,0,0,0,0,0|2,0,1]=4 35 B4R0.1 CC(=O)CBr PI-38994 [1,0,0,0,0,0|1,1,1]=4 36 B4R0.1 CC(C#C)O PI-44141 [1,0,0,0,0,0|0,1,2]=4 37 B4R0.1 CC(C)CN PI-46903 [1,0,0,0,0,0|2,0,0]=3 38 B4R0.1 CC(C)NC PI-41120 [1,0,0,0,0,0|2,0,0]=3 39 B4R0.1 CC(CN)O PI-16659 [1,0,0,0,0,0|1,1,0]=3 40 B4R0.1 CC(CO)O PI-16674 [1,0,0,0,0,0|1,1,0]=3 41 B4R0.1 CC(O)C#C PI-43256 [1,0,0,0,0,0|0,1,2]=4 42 B4R0.1 CCB(O)O PI-25578 [1,0,0,0,0,0|2,1,0]=4 43 B4R0.1 CCC(=N)N PI-35437 [1,0,0,0,0,0|2,0,1]=4 44 B4R0.1 CCC(C)O PI-15619 [1,0,0,0,0,0|0,1,0]=2 45 B4R0.1 CNN(C)C PI-40655 [1,0,0,0,0,0|3,0,0]=4 46 B4R0.1 C[C@@H](CO)N PI-12236 [1,0,0,0,0,0|2,0,0]=3 47 B4R0.1 C[C@@H](N)CO PI-16472 [1,0,0,0,0,0|2,0,0]=3 48 B4R0.1 C[C@@H](O)CN PI-12234 [1,0,0,0,0,0|1,1,0]=3 49 B4R0.1 NC[C@@H](N)C PI-39121 [1,0,0,0,0,0|2,0,0]=3 50 B4R0.1 NNC(C)C PI-37110 [1,0,0,0,0,0|3,0,0]=4 51 B4R0.1 OCC(F)F PI-21165 [1,0,0,0,0,0|3,0,0]=4 52 B4R0.1 OC[C@H](O)C PI-16673 [1,0,0,0,0,0|1,1,0]=3 53 B4R0.2 C#CCCCl PI-38919 [1,0,0,0,0,0|1,0,2]=4 54 B4R0.2 C#CCCN PI-40906 [1,0,0,0,0,0|1,0,2]=4 55 B4R0.2 C#CCCO PI-16501 [1,0,0,0,0,0|0,1,2]=4 56 B4R0.2 C(CF)CF PI-21236 [1,0,0,0,0,0|2,0,0]=3 57 B4R0.2 C(CF)CI PI-41494 [1,0,0,0,0,0|2,0,0]=3 58 B4R0.2 C(CN)CN PI-19035 [1,0,0,0,0,0|2,0,0]=3 59 B4R0.2 C(CN)CN PI-46906 [1,0,0,0,0,0|2,0,0]=3 60 B4R0.2 C(CN)CS PI-39174 [1,0,0,0,0,0|1,0,0]=2 61 B4R0.2 C(CO)CBr PI-15814 [1,0,0,0,0,0|1,1,0]=3 62 B4R0.2 C(CO)CI PI-50488 [1,0,0,0,0,0|1,1,0]=3 63 B4R0.2 C(CS)CS PI-11004 [1,0,0,0,0,0|1,0,0]=2 64 B4R0.2 C=CCCBr PI-20589 [1,0,0,0,0,0|1,0,2]=4 65 B4R0.2 CC#CCBr PI-20598 [1,0,0,0,0,0|1,0,2]=4 66 B4R0.2 CC#CCO PI-15652 [1,0,0,0,0,0|0,1,2]=4 67 B4R0.2 CC=CCO PI-41583 [1,0,0,0,0,0|0,1,2]=4 68 B4R0.2 CCCCCl PI-44613 [1,0,0,0,0,0|1,0,0]=2 69 B4R0.2 CCCNC PI-39187 [1,0,0,0,0,0|1,0,0]=2 70 B4R0.2 CCOC=C PI-12733 [1,0,0,0,0,0|1,0,2]=4 71 B4R0.2 CNCC#N PI-14282 [1,0,0,0,0,0|2,0,1]=4 72 B4R0.2 CNCC=C PI-41121 [1,0,0,0,0,0|1,0,2]=4 73 B4R0.2 COCCBr PI-21426 [1,0,0,0,0,0|2,0,0]=3 74 B4R0.2 ClCCNC PI-41980 [1,0,0,0,0,0|2,0,0]=3 75 B4R0.2 NCCC#C PI-36764 [1,0,0,0,0,0|1,0,2]=4 76 B4R0.2 OCCCS PI-39546 [1,0,0,0,0,0|1,0,0]=2 77 B6R0.1 C(C#N)C(CCl)O PI-16669 [0,1,0,0,0,0|1,1,1]=4 78 B6R0.1 C(CBr)C(CO)O PI-40398 [0,1,0,0,0,0|1,1,0]=3 79 B6R0.1 C(CO)C(CO)O PI-28525 [0,1,0,0,0,0|1,1,0]=3 80 B6R0.1 C(CO)C(CO)O PI-28767 [0,1,0,0,0,0|1,1,0]=3 81 B6R0.1 C(CO)C(CO)O PI-44643 [0,1,0,0,0,0|1,1,0]=3 82 B6R0.1 CC(CC=O)SC PI-48524 [0,1,0,0,0,0|1,0,1]=3 83 B6R0.1 CC(CCN)CO PI-48961 [0,1,0,0,0,0|1,1,0]=3 84 B6R0.1 CCCC(=O)NN PI-23070 [0,1,0,0,0,0|1,1,1]=4 85 B6R0.1 CCCC(=O)SC PI-48512 [0,1,0,0,0,0|0,1,1]=3 86 B6R0.1 CCCC(C=C)O PI-15324 [0,1,0,0,0,0|0,1,1]=3 87 B6R0.1 CCCC(CC)Cl PI-46859 [0,1,0,0,0,0|1,0,0]=2 88 B6R0.1 CCCC(CO)O PI-13556 [0,1,0,0,0,0|0,1,0]=2 89 B6R0.1 CCOC(=O)CBr PI-15815 [0,1,0,0,0,0|1,1,1]=4 90 B6R0.1 CCOC(=O)NC PI-50343 [0,1,0,0,0,0|1,1,1]=4 91 B6R0.1 CNCC(=O)OC PI-45586 [0,1,0,0,0,0|1,1,1]=4 92 B6R0.1 CNCC(CO)O PI-34729 [0,1,0,0,0,0|1,1,0]=3 93 B6R0.1 COC(=O)CCN PI-31148 [0,1,0,0,0,0|1,1,1]=4 94 B6R0.1 C[C@@H](CCO)CO PI-48285 [0,1,0,0,0,0|1,1,0]=3 95 B6R0.1 C\C(=N/O)\OCC PI-38013 [0,1,0,0,0,0|1,1,1]=4 96 B6R0.1 O=C(OC)CCO PI-41038 [0,1,0,0,0,0|1,1,1]=4 97 B6R0.1 O[C@H](CCl)CC#N PI-10363 [0,1,0,0,0,0|1,1,1]=4 98 B6R0.2 CC(Br)OC(=O)C PI-36668 [0,1,0,0,0,0|1,1,1]=4 99 B6R0.2 CC(C)CB(O)O PI-37377 [0,1,0,0,0,0|2,1,0]=4 100 B6R0.2 CC(C)CC(=O)[O-] PI-18660 [0,1,0,0,0,0|1,1,1]=4 101 B6R0.2 CC(C)NC(C)C PI-41089 [0,1,0,0,0,0|2,0,0]=3 102 B6R0.2 CC(C)NC(C)C PI-45766 [0,1,0,0,0,0|2,0,0]=3 103 B6R0.2 CC(CC(=O)O)N PI-35438 [0,1,0,0,0,0|1,1,1]=4 104 B6R0.2 CC(CC(=O)O)N PI-35481 [0,1,0,0,0,0|1,1,1]=4 105 B6R0.2 CC(CC(=O)O)N PI-43821 [0,1,0,0,0,0|1,1,1]=4 106 B6R0.2 CC(CC(=O)O)O PI-47070 [0,1,0,0,0,0|1,1,1]=4 107 B6R0.2 CC(CC(C)Br)Br PI-25295 [0,1,0,0,0,0|1,0,0]=2 108 B6R0.2 CC(OC(=O)C)Cl PI-36669 [0,1,0,0,0,0|1,1,1]=4 109 B6R0.2 CN(CN(C)C)C PI-39543 [0,1,0,0,0,0|3,0,0]=4 110 B6R0.2 C[C@@H](N)CC(O)=O PI-42153 [0,1,0,0,0,0|1,1,1]=4 111 B6R0.2 C[C@H](N)CC(O)=O PI-35439 [0,1,0,0,0,0|1,1,1]=4 112 B6R0.3 BrCC(=O)C(C)C PI-34836 [0,1,0,0,0,0|2,0,1]=4 113 B6R0.3 CC(C(=O)OC)Cl PI-13042 [0,1,0,0,0,0|2,0,1]=4 114 B6R0.3 CC(C(=O)OC)N PI-31127 [0,1,0,0,0,0|2,0,1]=4 115 B6R0.3 CCC(=O)C(C)Br PI-47067 [0,1,0,0,0,0|1,0,1]=3 116 B6R0.3 CCC(=O)C(C)C PI-39171 [0,1,0,0,0,0|1,0,1]=3 117 B6R0.3 CCC(C(=O)C)S PI-48501 [0,1,0,0,0,0|0,1,1]=3 118 B6R0.3 CCC(C(=O)N)N PI-10559 [0,1,0,0,0,0|1,1,1]=4 119 B6R0.3 CCC(C(=O)O)N PI-28320 [0,1,0,0,0,0|1,1,1]=4 120 B6R0.3 CCC(C(=O)O)N PI-43844 [0,1,0,0,0,0|1,1,1]=4 121 B6R0.3 CCC(C(C)Br)Br PI-25651 [0,1,0,0,0,0|1,0,0]=2 122 B6R0.3 CC[C@@H](C(=O)N)N PI-12596 [0,1,0,0,0,0|1,1,1]=4 123 B6R0.3 CC[C@@H](C(=O)O)N PI-10518 [0,1,0,0,0,0|1,1,1]=4 124 B6R0.3 CC[C@H](C)C(=O)O PI-48349 [0,1,0,0,0,0|1,1,1]=4 125 B6R0.3 COC(=O)C(N)C PI-10065 [0,1,0,0,0,0|2,0,1]=4 126 B6R0.3 COC(=O)[C@@H](C)O PI-15307 [0,1,0,0,0,0|1,1,1]=4 127 B6R0.3 COC(=O)[C@H](N)C PI-18185 [0,1,0,0,0,0|2,0,1]=4 128 B6R0.3 OC[C@H](C(C)C)N PI-16477 [0,1,0,0,0,0|2,0,0]=3 129 B6R0.3 OC[C@H](N)C(C)C PI-14330 [0,1,0,0,0,0|2,0,0]=3 130 B6R0.3 OC[C@H]([C@H](O)C)N PI-35711 [0,1,0,0,0,0|1,1,0]=3 131 B6R0.4 B(CCCC)(O)O PI-16470 [0,1,0,0,0,0|2,1,0]=4 132 B6R0.4 CC(NCCS)=O PI-37034 [0,1,0,0,0,0|1,1,1]=4 133 B6R0.4 CCC#CC(C)O PI-10903 [0,1,0,0,0,0|0,1,1]=3 134 B6R0.4 CCCCC(=O)[O-] PI-46856 [0,1,0,0,0,0|1,1,1]=4 135 B6R0.4 CCCCC(C)O PI-42555 [0,1,0,0,0,0|0,1,0]=2 136 B6R0.4 CCCC[C@@H](C)O PI-49839 [0,1,0,0,0,0|0,1,0]=2 137 B6R0.4 CCCNC(=O)N PI-19783 [0,1,0,0,0,0|1,1,1]=4 138 B6R0.4 CCNCC(=O)O PI-43211 [0,1,0,0,0,0|1,1,1]=4 139 B6R0.4 CN(C)CCCCl PI-50389 [0,1,0,0,0,0|2,0,0]=3 140 B6R0.4 CN(C)CCCO PI-31996 [0,1,0,0,0,0|2,0,0]=3 141 B6R0.4 CN(C)CCON PI-47242 [0,1,0,0,0,0|3,0,0]=4 142 B6R0.4 CNCCN(C)C PI-39257 [0,1,0,0,0,0|2,0,0]=3 143 B6R0.4 CSCCC(=O)O PI-31992 [0,1,0,0,0,0|1,1,1]=4 144 B6R0.4 ClCCCC(=O)C PI-39487 [0,1,0,0,0,0|0,1,1]=3 145 B6R0.4 ClCCCN(C)C PI-34098 [0,1,0,0,0,0|2,0,0]=3 146 B6R0.4 NCCCC(=O)O PI-35917 [0,1,0,0,0,0|1,1,1]=4 147 B6R0.4 O=C(O)CCCBr PI-40017 [0,1,0,0,0,0|1,1,1]=4 148 B6R0.4 O=C(O)CCCCl PI-41227 [0,1,0,0,0,0|1,1,1]=4 149 B6R0.4 OCCCC(=O)C PI-13555 [0,1,0,0,0,0|0,1,1]=3 150 B6R0.5 C(CCl)C(Cl)(Cl)Cl PI-48575 [0,1,0,0,0,0|3,0,0]=4 151 B6R0.5 C(CI)C(F)(F)F PI-40183 [0,1,0,0,0,0|3,0,0]=4 152 B6R0.5 CC(C)(CSC)N PI-50645 [0,1,0,0,0,0|2,0,0]=3 153 B6R0.5 CCCS(=O)(=O)Cl PI-42938 [0,1,0,0,0,0|2,1,0]=4 154 B6R0.5 CCC[Si](Cl)(C)C PI-45076 [0,1,0,0,0,0|1,1,0]=3 155 B6R0.5 CCOC(C)(C)C PI-39331 [0,1,0,0,0,0|2,0,0]=3 156 B6R0.5 CCO[Si](C)(C)C PI-45123 [0,1,0,0,0,0|2,1,0]=4 157 B6R0.5 CS(=O)(=O)CCBr PI-44875 [0,1,0,0,0,0|2,1,0]=4 158 B6R0.5 C[Si](C)(C)CCBr PI-45024 [0,1,0,0,0,0|2,1,0]=4 159 B6R0.5 NCC[S](=O)(=O)C PI-41234 [0,1,0,0,0,0|2,1,0]=4 160 B6R0.5 O=CCC(C)(C)C PI-36862 [0,1,0,0,0,0|2,0,1]=4 161 B6R0.5 OCCC(C)(C)C PI-38249 [0,1,0,0,0,0|2,0,0]=3 162 B6R0.5 OCCC(F)(F)F PI-39031 [0,1,0,0,0,0|3,0,0]=4 163 B6R0.5 OCC[Si](C)(C)C PI-13045 [0,1,0,0,0,0|2,1,0]=4 164 B6R1.2 C1C=CCC1N PI-35476 [0,0,0,1,0,0|1,0,2]=4 165 B6R1.2 C1CNCC1F PI-37496 [0,0,0,1,0,0|2,0,0]=3 166 B6R1.2 C1CNCC1N PI-12334 [0,0,0,1,0,0|2,0,0]=3 167 B6R1.2 C1CNCC1N PI-15467 [0,0,0,1,0,0|2,0,0]=3 168 B6R1.2 C1CNCC1N PI-15468 [0,0,0,1,0,0|2,0,0]=3 169 B6R1.2 C1CNCC1N PI-16581 [0,0,0,1,0,0|2,0,0]=3 170 B6R1.2 C1CNCC1N PI-16582 [0,0,0,1,0,0|2,0,0]=3 171 B6R1.2 C1CNCC1O PI-10126 [0,0,0,1,0,0|1,1,0]=3 172 B6R1.2 C1CNCC1O PI-42733 [0,0,0,1,0,0|1,1,0]=3 173 B6R1.2 C1COCC1Cl PI-42699 [0,0,0,1,0,0|2,0,0]=3 174 B6R1.2 C1COCC1N PI-42643 [0,0,0,1,0,0|2,0,0]=3 175 B6R1.2 C1COCC1N PI-44061 [0,0,0,1,0,0|2,0,0]=3 176 B6R1.2 C1COCC1O PI-42698 [0,0,0,1,0,0|1,1,0]=3 177 B6R1.2 C1CSC(=S)N1 PI-33314 [0,0,0,1,0,0|2,0,1]=4 178 B6R1.2 C1CSCC1=O PI-11167 [0,0,0,1,0,0|1,1,1]=4 179 B6R1.2 C1CSCC1O PI-48171 [0,0,0,1,0,0|1,1,0]=3 180 B6R1.2 CC1CCCN1 PI-35484 [0,0,0,1,0,0|1,0,0]=2 181 B6R1.2 CC1CCCN1 PI-35485 [0,0,0,1,0,0|1,0,0]=2 182 B6R1.2 CC1CCCS1 PI-47093 [0,0,0,1,0,0|0,0,0]=1 183 B6R1.2 CC1CCNC1 PI-48326 [0,0,0,1,0,0|2,0,0]=3 184 B6R1.2 CC1CNCC1 PI-36287 [0,0,0,1,0,0|2,0,0]=3 185 B6R1.2 CN1CCCC1 PI-49852 [0,0,0,1,0,0|2,0,0]=3 186 B6R1.2 C[C@@H]1CCNC1 PI-48327 [0,0,0,1,0,0|2,0,0]=3 187 B6R1.2 FC1CNCC1 PI-38496 [0,0,0,1,0,0|2,0,0]=3 188 B6R1.2 F[C@@H]1CNCC1 PI-37497 [0,0,0,1,0,0|2,0,0]=3 189 B6R1.2 IC1COCC1 PI-42701 [0,0,0,1,0,0|2,0,0]=3 190 B6R1.2 NC1=NCCS1 PI-15432 [0,0,0,1,0,0|2,0,1]=4 191 B6R1.2 NC1CCNC1 PI-42734 [0,0,0,1,0,0|2,0,0]=3 192 B6R1.2 NC1COCC1 PI-42705 [0,0,0,1,0,0|2,0,0]=3 193 B6R1.2 NN1CCCC1 PI-14899 [0,0,0,1,0,0|2,0,0]=3 194 B6R1.2 O=C1CCOC1 PI-42678 [0,0,0,1,0,0|1,1,1]=4 195 B6R1.2 OC1CC=CC1 PI-38265 [0,0,0,1,0,0|0,1,2]=4 196 B6R1.2 OC1COCC1 PI-20870 [0,0,0,1,0,0|1,1,0]=3 197 B6R1.2 O[C@@H]1CCOC1 PI-41161 [0,0,0,1,0,0|1,1,0]=3 198 B6R1.2 O[C@@H]1CNCC1 PI-10127 [0,0,0,1,0,0|1,1,0]=3 199 B6R1.2 O[C@@H]1CNCC1 PI-12902 [0,0,0,1,0,0|1,1,0]=3 200 B6R1.2 O[C@H]1CCOC1 PI-41160 [0,0,0,1,0,0|1,1,0]=3 201 B6R1.2 O[C@H]1CNCC1 PI-10148 [0,0,0,1,0,0|1,1,0]=3 202 B6R1.3 C1CC1CCI PI-48331 [0,0,0,1,0,0|2,0,0]=3 203 B6R1.3 COCC1CO1 PI-24540 [0,0,0,1,0,0|1,1,0]=3 204 B6R1.3 COCC1CO1 PI-24541 [0,0,0,1,0,0|1,1,0]=3 205 B6R1.3 N#CCC1CC1 PI-13560 [0,0,0,1,0,0|2,0,1]=4 206 B6R1.3 OCCC1CC1 PI-17339 [0,0,0,1,0,0|2,0,0]=3 207 B6R1.5 C1C(CC1=O)N PI-48953 [0,0,0,1,0,0|1,1,1]=4 208 B6R1.5 OC1CN(C1)C PI-37502 [0,0,0,1,0,0|1,1,0]=3 209 B6R1.10 C[Si]1(CCC1)Cl PI-45038 [0,0,0,1,0,0|1,1,0]=3 210 B6R1.11 C1CC1C(=N)N PI-13557 [0,0,0,1,0,0|2,0,1]=4 211 B6R1.11 C1CC1C(=O)Cl PI-32773 [0,0,0,1,0,0|1,1,1]=4 212 B6R1.11 C1CC1C(=O)N PI-30796 [0,0,0,1,0,0|1,1,1]=4 213 B6R1.11 CC(=O)C1CC1 PI-12875 [0,0,0,1,0,0|0,1,1]=3 214 B6R1.11 C[C@@H](C1CC1)N PI-48052 [0,0,0,1,0,0|1,0,0]=2 215 B6R1.11 OB(O)C1CC1 PI-25551 [0,0,0,1,0,0|2,1,0]=4 216 B3R0.1 C(CBr)Cl PI-44621 [2,0,0,0,0,0|2,0,0]=4 217 B3R0.1 C(CF)F PI-21164 [2,0,0,0,0,0|2,0,0]=4 218 B3R0.1 C(CS)N PI-39848 [2,0,0,0,0,0|1,0,0]=3 219 B3R0.1 C(F)CN PI-41615 [2,0,0,0,0,0|2,0,0]=4 220 B3R0.1 CCC=O PI-28552 [2,0,0,0,0,0|0,1,1]=4 221 B3R0.1 CCCN PI-46904 [2,0,0,0,0,0|1,0,0]=3 222 B3R0.1 CCCN PI-46913 [2,0,0,0,0,0|1,0,0]=3 223 B3R0.1 CNCC PI-40147 [2,0,0,0,0,0|1,0,0]=3 224 B3R0.1 COCBr PI-22152 [2,0,0,0,0,0|2,0,0]=4 225 B3R0.1 CONC PI-16632 [2,0,0,0,0,0|2,0,0]=4 226 B3R0.1 NCCN PI-38127 [2,0,0,0,0,0|2,0,0]=4 227 B3R0.1 NCCN PI-38389 [2,0,0,0,0,0|2,0,0]=4 228 B3R0.1 OCCBr PI-37291 [2,0,0,0,0,0|1,1,0]=4 229 B3R0.1 [CH2-]CCC PI-37346 [2,0,0,0,0,0|0,0,1]=3 230 B3R0.2 CC(C)[O-] PI-47044 [2,0,0,0,0,0|0,1,0]=3 231 B3R0.2 C[S+](C)C PI-41785 [2,0,0,0,0,0|2,0,0]=4 232 B5R0.3 C(C(CBr)O)Br PI-47056 [1,1,0,0,0,0|1,1,0]=4 233 B5R0.3 C(C(CCl)O)F PI-20093 [1,1,0,0,0,0|1,1,0]=4 234 B5R0.3 C(C(CCl)O)O PI-16668 [1,1,0,0,0,0|1,1,0]=4 235 B5R0.3 C(C(CO)N)O PI-16192 [1,1,0,0,0,0|2,0,0]=4 236 B5R0.3 C(C(CO)O)N PI-10528 [1,1,0,0,0,0|1,1,0]=4 237 B5R0.3 C([C@@H](CCl)O)N PI-48662 [1,1,0,0,0,0|1,1,0]=4 238 B5R0.3 CCC(=O)CBr PI-20588 [1,1,0,0,0,0|0,1,1]=4 239 B5R0.3 CCC(CO)N PI-45910 [1,1,0,0,0,0|1,0,0]=3 240 B5R0.3 NCC(O)CO PI-12972 [1,1,0,0,0,0|1,1,0]=4 241 B5R0.3 NC[C@H](O)CO PI-28266 [1,1,0,0,0,0|1,1,0]=4 242 B5R0.3 OCC(CO)N PI-10243 [1,1,0,0,0,0|2,0,0]=4 243 B5R0.3 OCC(O)CO PI-12961 [1,1,0,0,0,0|1,1,0]=4 244 B5R0.3 OC[C@H](O)CCl PI-16667 [1,1,0,0,0,0|1,1,0]=4 245 B5R0.4 CC(C)(C)CN PI-21979 [1,1,0,0,0,0|2,0,0]=4 246 B5R0.4 CC(C)(CO)N PI-50412 [1,1,0,0,0,0|2,0,0]=4 247 B5R0.4 CC(CCl)(F)Cl PI-21038 [1,1,0,0,0,0|2,0,0]=4 248 B5R0.4 CCC(C)(C)[O-] PI-38669 [1,1,0,0,0,0|0,1,0]=3 249 B5R0.4 NCC(C)(C)C PI-14589 [1,1,0,0,0,0|2,0,0]=4 250 B5R0.4 NCC(O)(C)C PI-37508 [1,1,0,0,0,0|1,1,0]=4 251 B5R0.4 OCC(F)(F)C PI-39537 [1,1,0,0,0,0|2,0,0]=4 252 B5R0.5 CC(C(=O)C)Br PI-35002 [1,1,0,0,0,0|0,1,1]=4 253 B5R0.5 CC(C(=O)C)S PI-48502 [1,1,0,0,0,0|0,0,1]=3 254 B5R0.5 CC(C(C)S)O PI-13701 [1,1,0,0,0,0|0,0,0]=2 255 B5R0.5 CC(C(C)S)O PI-48503 [1,1,0,0,0,0|0,0,0]=2 256 B5R0.5 CC(C(C)S)S PI-48471 [1,1,0,0,0,0|0,0,0]=2 257 B5R0.2 BrCCCC=C PI-39146 [1,1,0,0,0,0|0,0,2]=4 258 B5R0.2 BrCCSCC PI-21417 [1,1,0,0,0,0|1,0,0]=3 259 B5R0.2 C(CC#N)CBr PI-41208 [1,1,0,0,0,0|1,0,1]=4 260 B5R0.2 C(CCBr)CCl PI-15812 [1,1,0,0,0,0|1,0,0]=3 261 B5R0.2 C(CCBr)CN PI-46910 [1,1,0,0,0,0|1,0,0]=3 262 B5R0.2 C(CCCl)CO PI-15813 [1,1,0,0,0,0|0,1,0]=3 263 B5R0.2 C(CCS)CS PI-11005 [1,1,0,0,0,0|0,0,0]=2 264 B5R0.2 CCCSSC PI-48493 [1,1,0,0,0,0|1,0,0]=3 265 B5R0.2 CCNCCN PI-13215 [1,1,0,0,0,0|1,0,0]=3 266 B5R0.2 CCO\C=C\C PI-12734 [1,1,0,0,0,0|0,0,2]=4 267 B5R0.2 CCSCCN PI-22120 [1,1,0,0,0,0|1,0,0]=3 268 B5R0.2 CCSSCC PI-45874 [1,1,0,0,0,0|1,0,0]=3 269 B5R0.2 CNCCNC PI-39066 [1,1,0,0,0,0|1,0,0]=3 270 B5R0.2 CNCCSC PI-35879 [1,1,0,0,0,0|1,0,0]=3 271 B5R0.2 COCCC=O PI-45882 [1,1,0,0,0,0|0,1,1]=4 272 B5R0.2 COCCCCl PI-38032 [1,1,0,0,0,0|1,0,0]=3 273 B5R0.2 COCCCO PI-10094 [1,1,0,0,0,0|0,1,0]=3 274 B5R0.2 CSCCC=O PI-45744 [1,1,0,0,0,0|0,1,1]=4 275 B5R0.2 ClCCCC#C PI-20198 [1,1,0,0,0,0|0,0,2]=4 276 B5R0.2 ClCCCC#N PI-38313 [1,1,0,0,0,0|1,0,1]=4 277 B5R0.2 FCCCCBr PI-14440 [1,1,0,0,0,0|1,0,0]=3 278 B5R0.2 NCCCCO PI-38298 [1,1,0,0,0,0|0,1,0]=3 279 B5R0.2 OCCCC#C PI-13238 [1,1,0,0,0,0|0,0,2]=4 280 B5R0.2 OCCCC=C PI-13243 [1,1,0,0,0,0|0,0,2]=4 281 B5R0.2 OCCCCBr PI-12762 [1,1,0,0,0,0|0,1,0]=3 282 B7R0.2 CC(C)CC(CO)N PI-35868 [0,2,0,0,0,0|1,0,0]=3 283 B7R0.2 CC(CC(=O)OC)N PI-42254 [0,2,0,0,0,0|0,1,1]=4 284 B7R0.2 CC(CC(=O)OC)O PI-42249 [0,2,0,0,0,0|0,1,1]=4 285 B7R0.2 CC(CC(=O)OC)O PI-42250 [0,2,0,0,0,0|0,1,1]=4 286 B7R0.2 COC(=O)CC(C)N PI-42155 [0,2,0,0,0,0|0,1,1]=4 287 B7R0.2 C[C@@H](N)CC(OC)=O PI-42154 [0,2,0,0,0,0|0,1,1]=4 288 B7R0.2 C[C@H](N)CC(OC)=O PI-42253 [0,2,0,0,0,0|0,1,1]=4 289 B7R0.2 NC(C)CC(C)CC PI-36995 [0,2,0,0,0,0|1,0,0]=3 290 B7R0.2 OC[C@@H](CC(C)C)N PI-35776 [0,2,0,0,0,0|1,0,0]=3 291 B7R0.3 COC(=O)CCCBr PI-44980 [0,2,0,0,0,0|0,1,1]=4 292 B7R0.3 COC(=O)CCCN PI-42165 [0,2,0,0,0,0|0,1,1]=4 293 B7R0.3 COC(=O)CCSC PI-45979 [0,2,0,0,0,0|0,1,1]=4 294 B7R0.3 CSCCC(C#N)O PI-49851 [0,2,0,0,0,0|0,1,1]=4 295 B7R0.3 O=C(OC)CCNC PI-40057 [0,2,0,0,0,0|0,1,1]=4 296 B7R0.5 CCCC(C(=O)O)Br PI-44608 [0,2,0,0,0,0|1,0,1]=4 297 B7R0.5 CCCC(C(=O)O)N PI-13494 [0,2,0,0,0,0|1,0,1]=4 298 B7R0.5 CCC[C@H](C(=O)O)N PI-39155 [0,2,0,0,0,0|1,0,1]=4 299 B7R0.5 CCOC(=O)C(C)Br PI-44612 [0,2,0,0,0,0|1,0,1]=4 300 B7R0.5 CCOC(=O)C(C)Cl PI-21896 [0,2,0,0,0,0|1,0,1]=4 301 B7R0.5 CCOC(=O)C(C)F PI-12305 [0,2,0,0,0,0|1,0,1]=4 302 B7R0.5 CCOC(=O)C(N)C PI-10064 [0,2,0,0,0,0|1,0,1]=4 303 B7R0.5 CCOC(=O)[C@@H](N)C PI-31019 [0,2,0,0,0,0|1,0,1]=4 304 B7R0.7 CC(CCBr)CCBr PI-25581 [0,2,0,0,0,0|2,0,0]=4 305 B7R0.7 CCCC(=O)OCCl PI-36667 [0,2,0,0,0,0|0,1,1]=4 306 B7R0.7 CCCC(CCC)N PI-15988 [0,2,0,0,0,0|1,0,0]=3 307 B7R0.7 CCCC(S)CCO PI-37281 [0,2,0,0,0,0|0,0,0]=2 308 B7R0.7 COCC(N)COC PI-36402 [0,2,0,0,0,0|2,0,0]=4 309 B7R0.7 CSCC(CNN)O PI-45806 [0,2,0,0,0,0|1,1,0]=4 310 B7R0.10 CCC(C(=O)CC)O PI-47068 [0,2,0,0,0,0|0,1,1]=4 311 B7R0.10 CCC(C(C)CO)S PI-48470 [0,2,0,0,0,0|0,1,0]=3 312 B7R0.10 CCC(N)C(OC)=O PI-42163 [0,2,0,0,0,0|0,1,1]=4 313 B7R0.10 CC[C@@H](C(OC)=O)N PI-42161 [0,2,0,0,0,0|0,1,1]=4 314 B7R0.10 CC[C@@H]([C@@H](CO)N)C PI-36847 [0,2,0,0,0,0|1,0,0]=3 315 B7R0.10 CC[C@H](C(=O)OC)N PI-48278 [0,2,0,0,0,0|0,1,1]=4 316 B7R0.10 SC[C@H]([C@@H](CS)O)O PI-27013 [0,2,0,0,0,0|1,1,0]=4 317 B7R0.12 CCCC(CO)CO PI-44018 [0,2,0,0,0,0|0,1,0]=3 318 B7R0.9 CC(=O)CC(C)(C)C PI-21968 [0,2,0,0,0,0|0,1,1]=4 319 B7R0.9 CC(C)(CN(C)C)N PI-49000 [0,2,0,0,0,0|2,0,0]=4 320 B7R0.13 BrCC(C(Br)C)(Br)Br PI-30474 [0,2,0,0,0,0|2,0,0]=4 321 B7R0.13 CC(S(=O)(CC)=O)C PI-41041 [0,2,0,0,0,0|2,0,0]=4 322 B7R0.14 CC(C)(C)C(CO)N PI-47156 [0,2,0,0,0,0|2,0,0]=4 323 B7R0.14 CC(C)(C)[C@@H](CCl)O PI-49828 [0,2,0,0,0,0|2,0,0]=4 324 B7R0.14 CC(C)(C)[C@H](CCl)O PI-49827 [0,2,0,0,0,0|2,0,0]=4 325 B7R0.15 COC(OC)C(C)Br PI-39528 [0,2,0,0,0,0|2,0,0]=4 326 B7R0.4 CC(=O)CCCCCl PI-28023 [0,2,0,0,0,0|0,1,1]=4 327 B7R0.4 CCCCC[C@@H](C)O PI-49829 [0,2,0,0,0,0|0,1,0]=3 328 B7R0.4 CN(C)CCCCN PI-23376 [0,2,0,0,0,0|2,0,0]=4 329 B7R0.4 CNCCCN(C)C PI-19630 [0,2,0,0,0,0|2,0,0]=4 330 B7R0.4 COCCOC(=O)C PI-12910 [0,2,0,0,0,0|0,1,1]=4 331 B7R0.6 CC(=O)CCC(=O)C PI-48500 [0,2,0,0,0,0|0,1,1]=4 332 B7R0.6 CC(C)CCC(=O)O PI-25767 [0,2,0,0,0,0|1,0,1]=4 333 B7R0.6 CC(C)CCC(C)N PI-49380 [0,2,0,0,0,0|1,0,0]=3 334 B7R0.6 CC(C)CCC(C)O PI-30803 [0,2,0,0,0,0|0,1,0]=3 335 B7R0.6 CC(C)SSC(C)C PI-48489 [0,2,0,0,0,0|2,0,0]=4 336 B7R0.6 C[C@H](O)CC[C@H](C)O PI-20708 [0,2,0,0,0,0|0,1,0]=3 337 B7R0.8 BrCCCC(F)(F)F PI-15587 [0,2,0,0,0,0|2,0,0]=4 338 B7R0.8 CCCC[Si](C)(C)Cl PI-22927 [0,2,0,0,0,0|1,1,0]=4 339 B7R0.8 C[Si](C)(C)CCCO PI-45066 [0,2,0,0,0,0|1,1,0]=4 340 B7R0.8 C[Si](C)(CCCCl)Cl PI-50112 [0,2,0,0,0,0|1,1,0]=4 341 B7R0.8 NCCSC(C)(C)C PI-23048 [0,2,0,0,0,0|2,0,0]=4 342 B7R0.8 OCCCC(F)(F)F PI-36762 [0,2,0,0,0,0|2,0,0]=4 343 B5R1.2 BrC1CCC1 PI-37245 [1,0,0,1,0,0|1,0,0]=3 344 B5R1.2 FC1CNC1 PI-36097 [1,0,0,1,0,0|2,0,0]=4 345 B5R1.2 NC1CCC1 PI-15786 [1,0,0,1,0,0|1,0,0]=3 346 B5R1.2 NC1COC1 PI-41949 [1,0,0,1,0,0|2,0,0]=4 347 B5R1.2 O=C1CCC1 PI-36783 [1,0,0,1,0,0|0,1,1]=4 348 B5R1.2 OC1CNC1 PI-20728 [1,0,0,1,0,0|1,1,0]=4 349 B5R1.2 OC1COC1 PI-38454 [1,0,0,1,0,0|1,1,0]=4 350 B5R1.3 BrCC1CC1 PI-12057 [1,0,0,1,0,0|2,0,0]=4 351 B5R1.3 C1C(O1)CO PI-10360 [1,0,0,1,0,0|1,1,0]=4 352 B5R1.3 C1CC1CN PI-17835 [1,0,0,1,0,0|2,0,0]=4 353 B5R1.3 ClCC1OC1 PI-37744 [1,0,0,1,0,0|1,1,0]=4 354 B5R1.3 ClC[C@@H]1CO1 PI-16630 [1,0,0,1,0,0|1,1,0]=4 355 B5R1.3 ClC[C@H]1CO1 PI-16629 [1,0,0,1,0,0|1,1,0]=4 356 B5R1.3 FCC1CO1 PI-22023 [1,0,0,1,0,0|1,1,0]=4 357 B5R1.3 NCC1CC1 PI-12825 [1,0,0,1,0,0|2,0,0]=4 358 B5R1.3 OC[C@H]1CO1 PI-10359 [1,0,0,1,0,0|1,1,0]=4 359 B5R1.4 C1[C@H]([C@@H]1N)N PI-49016 [1,0,0,1,0,0|2,0,0]=4 360 B7R1.1 C1CC(NC1)CN PI-35678 [0,1,0,1,0,0|1,0,0]=3 361 B7R1.1 C1CC(OC1)CBr PI-30089 [0,1,0,1,0,0|0,1,0]=3 362 B7R1.1 C1CCC(C1)CO PI-44131 [0,1,0,1,0,0|0,1,0]=3 363 B7R1.1 C1CCC(C1)ON PI-47243 [0,1,0,1,0,0|0,1,0]=3 364 B7R1.1 C1CCN(C1)N=O PI-47048 [0,1,0,1,0,0|1,1,0]=4 365 B7R1.1 C1CNCC1CO PI-40189 [0,1,0,1,0,0|1,1,0]=4 366 B7R1.1 C1CNCC1CO PI-40190 [0,1,0,1,0,0|1,1,0]=4 367 B7R1.1 C1COCC1CBr PI-42703 [0,1,0,1,0,0|2,0,0]=4 368 B7R1.1 C1COCC1CCl PI-42702 [0,1,0,1,0,0|2,0,0]=4 369 B7R1.1 C1COCC1CO PI-41224 [0,1,0,1,0,0|1,1,0]=4 370 B7R1.1 C1C[C@H](NC1)C#N PI-48319 [0,1,0,1,0,0|1,0,1]=4 371 B7R1.1 CCN1CCCC1 PI-47092 [0,1,0,1,0,0|2,0,0]=4 372 B7R1.1 COC1OCCO1 PI-47112 [0,1,0,1,0,0|1,1,0]=4 373 B7R1.1 ICC1COCC1 PI-42704 [0,1,0,1,0,0|2,0,0]=4 374 B7R1.1 NNC1CCCC1 PI-36366 [0,1,0,1,0,0|1,0,0]=3 375 B7R1.1 NNC1CCCC1 PI-38997 [0,1,0,1,0,0|1,0,0]=3 376 B7R1.1 OC[C@@H]1CCCN1 PI-16636 [0,1,0,1,0,0|1,0,0]=3 377 B7R1.1 OC[C@H]1CCCN1 PI-16475 [0,1,0,1,0,0|1,0,0]=3 378 B7R1.2 C1CC(CC1N)O PI-44226 [0,1,0,1,0,0|0,1,0]=3 379 B7R1.2 C1CC(CC1O)O PI-43989 [0,1,0,1,0,0|0,1,0]=3 380 B7R1.2 CC1CCC(C1)O PI-44641 [0,1,0,1,0,0|0,1,0]=3 381 B7R1.2 CN1CCC(O)C1 PI-33498 [0,1,0,1,0,0|0,1,0]=3 382 B7R1.2 C[C@@H]1CCC(=O)O1 PI-27751 [0,1,0,1,0,0|0,1,1]=4 383 B7R1.3 BrC1CCCOC1 PI-35181 [0,1,0,1,0,0|1,0,0]=3 384 B7R1.3 BrC1CCOCC1 PI-35207 [0,1,0,1,0,0|1,0,0]=3 385 B7R1.3 C1CC(=O)COC1 PI-39263 [0,1,0,1,0,0|0,1,1]=4 386 B7R1.3 C1CC(CNC1)Br PI-13262 [0,1,0,1,0,0|1,0,0]=3 387 B7R1.3 C1CC(CNC1)F PI-48937 [0,1,0,1,0,0|1,0,0]=3 388 B7R1.3 C1CC(CNC1)N PI-11065 [0,1,0,1,0,0|1,0,0]=3 389 B7R1.3 C1CC(CNC1)N PI-27492 [0,1,0,1,0,0|1,0,0]=3 390 B7R1.3 C1CC(CNC1)O PI-10129 [0,1,0,1,0,0|0,1,0]=3 391 B7R1.3 C1CC(CNC1)O PI-11069 [0,1,0,1,0,0|0,1,0]=3 392 B7R1.3 C1CC(CNC1)O PI-31252 [0,1,0,1,0,0|0,1,0]=3 393 B7R1.3 C1CCC(=CC1)Cl PI-46532 [0,1,0,1,0,0|1,0,1]=4 394 B7R1.3 C1CCN(CC1)N PI-34077 [0,1,0,1,0,0|2,0,0]=4 395 B7R1.3 C1CCN(CC1)N PI-43331 [0,1,0,1,0,0|2,0,0]=4 396 B7R1.3 C1CCNC(=O)C1 PI-40996 [0,1,0,1,0,0|0,1,1]=4 397 B7R1.3 C1CCNC(C1)Br PI-13261 [0,1,0,1,0,0|1,0,0]=3 398 B7R1.3 C1CCNC(C1)Cl PI-13259 [0,1,0,1,0,0|1,0,0]=3 399 B7R1.3 C1CCNC(C1)O PI-11062 [0,1,0,1,0,0|0,1,0]=3 400 B7R1.3 C1CNCCC1=O PI-43209 [0,1,0,1,0,0|0,1,1]=4 401 B7R1.3 C1CNCCC1Br PI-34736 [0,1,0,1,0,0|1,0,0]=3 402 B7R1.3 C1CNCCC1Cl PI-13260 [0,1,0,1,0,0|1,0,0]=3 403 B7R1.3 C1CNCCC1F PI-48939 [0,1,0,1,0,0|1,0,0]=3 404 B7R1.3 C1CNCCC1N PI-12453 [0,1,0,1,0,0|1,0,0]=3 405 B7R1.3 C1CNCCC1N PI-43332 [0,1,0,1,0,0|1,0,0]=3 406 B7R1.3 C1CNCCC1O PI-43307 [0,1,0,1,0,0|0,1,0]=3 407 B7R1.3 C1COC(CN1)O PI-41771 [0,1,0,1,0,0|1,1,0]=4 408 B7R1.3 C1COCCC1=O PI-47224 [0,1,0,1,0,0|0,1,1]=4 409 B7R1.3 C1COCCC1Cl PI-45093 [0,1,0,1,0,0|1,0,0]=3 410 B7R1.3 C1COCCC1I PI-45407 [0,1,0,1,0,0|1,0,0]=3 411 B7R1.3 C1COCCN1N PI-33201 [0,1,0,1,0,0|2,0,0]=4 412 B7R1.3 C1C[C@@H](CNC1)F PI-48938 [0,1,0,1,0,0|1,0,0]=3 413 B7R1.3 C=C1CCNCC1 PI-41106 [0,1,0,1,0,0|1,0,1]=4 414 B7R1.3 C=C1CCOCC1 PI-42723 [0,1,0,1,0,0|1,0,1]=4 415 B7R1.3 CC1=CCCCC1 PI-42686 [0,1,0,1,0,0|1,0,1]=4 416 B7R1.3 CC1=CCOCC1 PI-42722 [0,1,0,1,0,0|1,0,1]=4 417 B7R1.3 CC1CCOCO1 PI-47110 [0,1,0,1,0,0|0,1,0]=3 418 B7R1.3 CC1CNCCN1 PI-31297 [0,1,0,1,0,0|1,0,0]=3 419 B7R1.3 CC1CNCCN1 PI-33175 [0,1,0,1,0,0|1,0,0]=3 420 B7R1.3 CC1CNCCO1 PI-34764 [0,1,0,1,0,0|0,1,0]=3 421 B7R1.3 CC1SCCCS1 PI-25717 [0,1,0,1,0,0|0,0,0]=2 422 B7R1.3 CN1CCNCC1 PI-50345 [0,1,0,1,0,0|2,0,0]=4 423 B7R1.3 C[C@@H]1CNCCN1 PI-31298 [0,1,0,1,0,0|1,0,0]=3 424 B7R1.3 C[C@H]1CCCCN1 PI-48288 [0,1,0,1,0,0|1,0,0]=3 425 B7R1.3 C[C@H]1CNCCO1 PI-37360 [0,1,0,1,0,0|0,1,0]=3 426 B7R1.3 C[C@H]1COCCN1 PI-38135 [0,1,0,1,0,0|1,0,0]=3 427 B7R1.3 NC1CCCCN1 PI-13252 [0,1,0,1,0,0|1,0,0]=3 428 B7R1.3 NC1CCCNC1 PI-13253 [0,1,0,1,0,0|1,0,0]=3 429 B7R1.3 NC1CCOCC1 PI-14135 [0,1,0,1,0,0|1,0,0]=3 430 B7R1.3 NC1CCOCC1 PI-39008 [0,1,0,1,0,0|1,0,0]=3 431 B7R1.3 N[C@@H]1CCCNC1 PI-27493 [0,1,0,1,0,0|1,0,0]=3 432 B7R1.3 N[C@@H]1CCCNC1 PI-38031 [0,1,0,1,0,0|1,0,0]=3 433 B7R1.3 O1CCCC(C1)O PI-42688 [0,1,0,1,0,0|0,1,0]=3 434 B7R1.3 O=C1CCCCO1 PI-37295 [0,1,0,1,0,0|0,1,1]=4 435 B7R1.3 O=C1CCCNC1 PI-35479 [0,1,0,1,0,0|0,1,1]=4 436 B7R1.3 O=C1CCNCC1 PI-12489 [0,1,0,1,0,0|0,1,1]=4 437 B7R1.3 O=C1CCNCC1 PI-37237 [0,1,0,1,0,0|0,1,1]=4 438 B7R1.3 O=C1CCOCC1 PI-13776 [0,1,0,1,0,0|0,1,1]=4 439 B7R1.3 O=C1CCSCC1 PI-40196 [0,1,0,1,0,0|0,1,1]=4 440 B7R1.3 OC1CCNCC1 PI-31377 [0,1,0,1,0,0|0,1,0]=3 441 B7R1.3 OC1CCOCC1 PI-37145 [0,1,0,1,0,0|0,1,0]=3 442 B7R1.3 O[C@H]1CCCNC1 PI-10130 [0,1,0,1,0,0|0,1,0]=3 443 B7R1.4 C1COC(C1Cl)Cl PI-13234 [0,1,0,1,0,0|1,1,0]=4 444 B7R1.4 CC1C(=O)CCO1 PI-14228 [0,1,0,1,0,0|0,1,1]=4 445 B7R1.4 CC1C(CCO1)S PI-14229 [0,1,0,1,0,0|0,1,0]=3 446 B7R1.4 O=C1NCCC1C PI-27005 [0,1,0,1,0,0|1,1,0]=4 447 B7R1.4 O[C@@H]1CCC[C@H]1N PI-27472 [0,1,0,1,0,0|0,1,0]=3 448 B7R1.4 O[C@@H]1CCC[C@H]1O PI-39444 [0,1,0,1,0,0|0,1,0]=3 449 B7R1.4 O[C@@H]1[C@H](N)CCC1 PI-37163 [0,1,0,1,0,0|0,1,0]=3 450 B7R1.4 O[C@H]1CCC[C@@H]1N PI-38121 [0,1,0,1,0,0|0,1,0]=3 451 B7R1.4 O[C@H]1CCC[C@@H]1N PI-38122 [0,1,0,1,0,0|0,1,0]=3 452 B7R1.6 NCCC1COC1 PI-36429 [0,1,0,1,0,0|1,1,0]=4 453 B7R1.6 OCCC1COC1 PI-36428 [0,1,0,1,0,0|1,1,0]=4 454 B7R1.10 CN1CC(C1)C#N PI-44060 [0,1,0,1,0,0|2,0,0]=4 455 B7R1.10 O=C1CC(OC)C1 PI-46660 [0,1,0,1,0,0|0,1,1]=4 456 B7R1.22 COC(=O)C1CC1 PI-32774 [0,1,0,1,0,0|0,1,1]=4 457 B7R1.25 CC1(CNC1)C#N PI-48198 [0,1,0,1,0,0|2,0,0]=4 458 B7R1.25 CC1(COC1)CO PI-24315 [0,1,0,1,0,0|1,1,0]=4 459 B7R1.25 NCC1(O)CCC1 PI-36089 [0,1,0,1,0,0|0,1,0]=3 460 B7R1.16 C1C(CC1(F)F)N PI-43129 [0,1,0,1,0,0|2,0,0]=4 461 B7R1.16 C1C(CC1(F)F)N PI-43174 [0,1,0,1,0,0|2,0,0]=4 462 B7R1.18 CN(C)C1CNC1 PI-48736 [0,1,0,1,0,0|2,0,0]=4 463 B7R1.23 BrCC1CC1(F)F PI-22149 [0,1,0,1,0,0|2,0,0]=4 464 B7R1.7 C=CCCC1CO1 PI-41845 [0,1,0,1,0,0|0,1,1]=4 465 B7R1.7 C=CCC[C@H]1CO1 PI-48268 [0,1,0,1,0,0|0,1,1]=4 466 B7R1.14 C1CCC(C1)(F)F PI-21161 [0,1,0,1,0,0|1,0,0]=3 467 B7R1.14 CC1(NCCS1)C PI-11721 [0,1,0,1,0,0|1,0,0]=3 468 B7R1.14 CC1(O)CCCC1 PI-36469 [0,1,0,1,0,0|0,1,0]=3 469 B7R1.14 C[Si]1(CCCC1)C PI-45650 [0,1,0,1,0,0|1,1,0]=4 470 B7R1.14 FC1(F)CNCC1 PI-21240 [0,1,0,1,0,0|2,0,0]=4 471 B7R1.26 CC(C)(C1CC1)O PI-17152 [0,1,0,1,0,0|0,1,0]=3 472 B7R2.13 C1CC2C(C1)O2 PI-35919 [0,0,0,2,0,0|0,1,0]=3 473 B7R2.13 O1CC2C(C1)O2 PI-22024 [0,0,0,2,0,0|1,1,0]=4 474 B7R2.1 C1C(O1)C2CO2 PI-13815 [0,0,0,2,0,0|1,1,0]=4 475 B7R2.5 C12CC(C1)(N)C2 PI-49249 [0,0,0,2,0,0|1,0,0]=3