0 B6R0.1 C#CC(=O)OCC SC-05846 [0,0,0,0,0,0|3,0,1]=4 1 B6R0.1 C#CCC(=O)OC SC-13148 [0,0,0,0,0,0|1,0,1]=2 2 B6R0.1 C=CCC(=O)OC SC-48829 [0,0,0,0,0,0|1,0,1]=2 3 B6R0.1 CC#CC(=O)NN SC-50891 [0,0,0,0,0,0|3,0,1]=4 4 B6R0.1 CC#CC(=O)OC SC-48510 [0,0,0,0,0,0|1,0,1]=2 5 B6R0.1 CCC(=O)CC#N SC-26865 [0,0,0,0,0,0|3,0,0]=3 6 B6R0.1 CCC(O)COC SC-95930 [0,0,0,0,0,0|1,1,2]=4 7 B6R0.1 CCCC(Br)CC SC-87780 [0,0,0,0,0,0|3,0,1]=4 8 B6R0.1 CCOC(=O)C#N SC-20120 [0,0,0,0,0,0|4,0,0]=4 9 B6R0.1 CCOC(=O)C=O SC-25704 [0,0,0,0,0,0|4,0,0]=4 10 B6R0.1 CCOC(=O)CBr SC-17870 [0,0,0,0,0,0|4,0,0]=4 11 B6R0.1 CCOC(=O)CN SC-09569 [0,0,0,0,0,0|4,0,0]=4 12 B6R0.1 CCOC(=O)CN SC-48652 [0,0,0,0,0,0|4,0,0]=4 13 B6R0.1 CCOC(=O)CO SC-50412 [0,0,0,0,0,0|4,0,0]=4 14 B6R0.1 CCOC(=O)CS SC-18381 [0,0,0,0,0,0|4,0,0]=4 15 B6R0.1 CC[C@@H](N)COC SC-48788 [0,0,0,0,0,0|2,1,1]=4 16 B6R0.1 CC[C@@H](N)COC SC-65714 [0,0,0,0,0,0|2,1,1]=4 17 B6R0.1 CC[C@H](N)COC SC-48789 [0,0,0,0,0,0|2,1,1]=4 18 B6R0.1 CC[C@H](N)COC SC-89974 [0,0,0,0,0,0|2,1,1]=4 19 B6R0.1 CNC(=O)CC#N SC-97600 [0,0,0,0,0,0|3,0,0]=3 20 B6R0.1 CNCC(=O)OC SC-10432 [0,0,0,0,0,0|1,0,0]=1 21 B6R0.1 COC(=O)C#CBr SC-66291 [0,0,0,0,0,0|2,0,1]=3 22 B6R0.1 COC(=O)CC=O SC-53143 [0,0,0,0,0,0|2,0,0]=2 23 B6R0.1 COC(=O)CCCl SC-19880 [0,0,0,0,0,0|2,0,0]=2 24 B6R0.1 COC(=O)CCN SC-21486 [0,0,0,0,0,0|2,0,0]=2 25 B6R0.1 COC(=O)CCO SC-21690 [0,0,0,0,0,0|2,0,0]=2 26 B6R0.1 COC(=O)CSC SC-20536 [0,0,0,0,0,0|0,0,0]=0 27 B6R0.1 COC(=O)N=C=S SC-A2325 [0,0,0,0,0,0|3,0,0]=3 28 B6R0.1 COC(=O)OCCl SC-53303 [0,0,0,0,0,0|3,0,0]=3 29 B6R0.1 COCC(=O)NN SC-54001 [0,0,0,0,0,0|2,1,0]=3 30 B6R0.1 COC\C(N)=N\O SC-29295 [0,0,0,0,0,0|3,1,0]=4 31 B6R0.1 CO\C(C)=N\C#N SC-14025 [0,0,0,0,0,0|4,0,0]=4 32 B6R0.1 CSCC(C)NN SC-14209 [0,0,0,0,0,0|3,0,1]=4 33 B6R0.1 CSCC(N)CO SC-69757 [0,0,0,0,0,0|3,0,1]=4 34 B6R0.1 N#CCC(=O)NN SC-39668 [0,0,0,0,0,0|4,0,0]=4 35 B6R0.1 [C-]#[N+]CC(=O)OC SC-19522 [0,0,0,0,0,0|1,0,1]=2 36 B5R0.1 C#CCC(=O)O SC-40344 [1,0,0,0,0,0|1,0,1]=3 37 B5R0.1 C=C(C)CCBr SC-26305 [1,0,0,0,0,0|3,0,0]=4 38 B5R0.1 C=C(C)CCI SC-35692 [1,0,0,0,0,0|3,0,0]=4 39 B5R0.1 C=C(C)CCO SC-28771 [1,0,0,0,0,0|3,0,0]=4 40 B5R0.1 C=CCC(=O)O SC-49093 [1,0,0,0,0,0|1,0,1]=3 41 B5R0.1 CC#CC(=O)O SC-76460 [1,0,0,0,0,0|1,0,1]=3 42 B5R0.1 CC(=O)C=C=O SC-76855 [1,0,0,0,0,0|2,0,1]=4 43 B5R0.1 CC(=O)CC#N SC-26510 [1,0,0,0,0,0|2,0,0]=3 44 B5R0.1 CC(=O)CCCl SC-21586 [1,0,0,0,0,0|2,0,0]=3 45 B5R0.1 CC(=O)CCO SC-65678 [1,0,0,0,0,0|2,0,0]=3 46 B5R0.1 CC(=O)NCO SC-19774 [1,0,0,0,0,0|3,0,0]=4 47 B5R0.1 CC(=O)OCBr SC-44237 [1,0,0,0,0,0|3,0,0]=4 48 B5R0.1 CC(=O)OCCl SC-47539 [1,0,0,0,0,0|3,0,0]=4 49 B5R0.1 CC(=O)\C=N/O SC-89466 [1,0,0,0,0,0|2,0,1]=4 50 B5R0.1 CC(=O)\C=N\O SC-51367 [1,0,0,0,0,0|2,0,1]=4 51 B5R0.1 CC(=O)\C=N\O SC-68143 [1,0,0,0,0,0|2,0,1]=4 52 B5R0.1 CCCB(O)O SC-47544 [1,0,0,0,0,0|2,0,1]=4 53 B5R0.1 CCCC(=N)N SC-19347 [1,0,0,0,0,0|3,0,0]=4 54 B5R0.1 CCCC(=O)[O-] SC-15718 [1,0,0,0,0,0|1,0,1]=3 55 B5R0.1 CCCC(C)N SC-53929 [1,0,0,0,0,0|2,0,1]=4 56 B5R0.1 CCCC(C)O SC-03320 [1,0,0,0,0,0|1,0,2]=4 57 B5R0.1 CCC[C@@H](C)N SC-A6013 [1,0,0,0,0,0|2,0,1]=4 58 B5R0.1 CCC[C@@H](C)N SC-A6071 [1,0,0,0,0,0|2,0,1]=4 59 B5R0.1 CCC[C@H](C)N SC-A6072 [1,0,0,0,0,0|2,0,1]=4 60 B5R0.1 CCOC(C)=N SC-02547 [1,0,0,0,0,0|3,0,0]=4 61 B5R0.1 CCOC(C)=N SC-A3540 [1,0,0,0,0,0|3,0,0]=4 62 B5R0.1 CNCC(C)N SC-66085 [1,0,0,0,0,0|2,0,1]=4 63 B5R0.1 CNCC(N)=O SC-10429 [1,0,0,0,0,0|2,0,0]=3 64 B5R0.1 COCC(=N)N SC-41213 [1,0,0,0,0,0|2,1,0]=4 65 B5R0.1 COCC(=N)N SC-73218 [1,0,0,0,0,0|2,1,0]=4 66 B5R0.1 COCC(=O)Cl SC-27381 [1,0,0,0,0,0|1,1,0]=3 67 B5R0.1 COCC(C)=S SC-42217 [1,0,0,0,0,0|0,2,0]=3 68 B5R0.1 COCC(C)N SC-48787 [1,0,0,0,0,0|1,1,1]=4 69 B5R0.1 COC[C@@H](C)N SC-47724 [1,0,0,0,0,0|1,1,1]=4 70 B5R0.1 COC[C@@H](C)O SC-04836 [1,0,0,0,0,0|0,1,2]=4 71 B5R0.1 COC[C@H](C)N SC-51779 [1,0,0,0,0,0|1,1,1]=4 72 B5R0.1 CS(=O)CCN SC-89327 [1,0,0,0,0,0|3,0,0]=4 73 B5R0.1 CSCC(=N)N SC-59669 [1,0,0,0,0,0|2,0,0]=3 74 B5R0.1 CSCC(N)=O SC-27108 [1,0,0,0,0,0|1,0,0]=2 75 B5R0.1 CSCS(C)=O SC-87090 [1,0,0,0,0,0|1,0,0]=2 76 B5R0.1 CSNC(C)=O SC-28667 [1,0,0,0,0,0|1,0,0]=2 77 B5R0.1 C\C=C/C(C)=O SC-48085 [1,0,0,0,0,0|1,0,1]=3 78 B5R0.1 C\C=C\C(=O)Cl SC-16256 [1,0,0,0,0,0|2,0,1]=4 79 B5R0.1 C\C=C\C(=O)O SC-25924 [1,0,0,0,0,0|1,0,1]=3 80 B5R0.1 N#CCC(N)=O SC-26759 [1,0,0,0,0,0|3,0,0]=4 81 B5R0.1 NCCC(N)=O SC-48688 [1,0,0,0,0,0|3,0,0]=4 82 B5R0.1 NCCC(N)=O SC-84499 [1,0,0,0,0,0|3,0,0]=4 83 B5R0.1 O=C(Cl)CCCl SC-16310 [1,0,0,0,0,0|3,0,0]=4 84 B5R0.1 O=C(O)CCF SC-53145 [1,0,0,0,0,0|2,0,0]=3 85 B5R0.1 O=C(O)CCS SC-22642 [1,0,0,0,0,0|2,0,0]=3 86 B5R0.2 CCCNCC SC-02236 [1,0,0,0,0,0|3,0,0]=4 87 B5R0.2 CNCCNC SC-19090 [1,0,0,0,0,0|2,0,1]=4 88 B5R0.2 CNCCSC SC-74374 [1,0,0,0,0,0|1,0,1]=3 89 B5R0.2 CNCCSC SC-83575 [1,0,0,0,0,0|1,0,1]=3 90 B5R0.2 COCCC=O SC-85357 [1,0,0,0,0,0|2,0,1]=4 91 B5R0.2 COCCCBr SC-20920 [1,0,0,0,0,0|2,0,1]=4 92 B5R0.2 COCCNN SC-53129 [1,0,0,0,0,0|2,0,1]=4 93 B5R0.2 COCCNN SC-70814 [1,0,0,0,0,0|2,0,1]=4 94 B5R0.2 COCCOC SC-16461 [1,0,0,0,0,0|0,1,1]=3 95 B5R0.3 C#CC(=O)OC SC-27849 [1,0,0,0,0,0|0,0,2]=3 96 B5R0.3 CCC(=O)CN SC-94912 [1,0,0,0,0,0|2,0,0]=3 97 B5R0.3 CCC(=O)NN SC-25039 [1,0,0,0,0,0|2,0,0]=3 98 B5R0.3 CCC(Br)CC SC-71668 [1,0,0,0,0,0|2,0,1]=4 99 B5R0.3 CCC(O)CC SC-62307 [1,0,0,0,0,0|1,0,2]=4 100 B5R0.3 CCC(O)OC SC-25588 [1,0,0,0,0,0|0,0,2]=3 101 B5R0.3 CC[PH](=O)CC SC-96905 [1,0,0,0,0,0|2,0,0]=3 102 B5R0.3 CNC(=O)CBr SC-27946 [1,0,0,0,0,0|2,0,0]=3 103 B5R0.3 CNC(=O)CCl SC-27694 [1,0,0,0,0,0|2,0,0]=3 104 B5R0.3 CNC(=O)CN SC-47802 [1,0,0,0,0,0|2,0,0]=3 105 B5R0.3 CNC(=O)CO SC-48574 [1,0,0,0,0,0|1,1,0]=3 106 B5R0.3 COC(=O)C#N SC-49091 [1,0,0,0,0,0|1,0,1]=3 107 B5R0.3 COC(=O)CN SC-09571 [1,0,0,0,0,0|1,0,0]=2 108 B5R0.3 COC(=O)CN SC-49390 [1,0,0,0,0,0|1,0,0]=2 109 B5R0.3 COC(=O)CO SC-28291 [1,0,0,0,0,0|0,1,0]=2 110 B5R0.3 COC(=O)CS SC-54102 [1,0,0,0,0,0|0,0,0]=1 111 B5R0.3 COC(=O)NN SC-16058 [1,0,0,0,0,0|2,0,0]=3 112 B5R0.3 COC(=S)SC SC-A5822 [1,0,0,0,0,0|0,1,0]=2 113 B5R0.3 COC(C)CN SC-A4864 [1,0,0,0,0,0|2,0,1]=4 114 B5R0.3 COC(C)CO SC-97662 [1,0,0,0,0,0|1,1,1]=4 115 B5R0.3 COS(=O)OC SC-25522 [1,0,0,0,0,0|1,1,0]=3 116 B5R0.3 CO[C@H](C)CO SC-71357 [1,0,0,0,0,0|1,1,1]=4 117 B5R0.3 CSC(=S)SC SC-19457 [1,0,0,0,0,0|0,2,0]=3 118 B5R0.3 CS\C(N)=N\N SC-47788 [1,0,0,0,0,0|3,0,0]=4 119 B5R0.3 NNC(=O)CO SC-83204 [1,0,0,0,0,0|2,1,0]=4 120 B5R0.3 O=C(CBr)CBr SC-99341 [1,0,0,0,0,0|3,0,0]=4 121 B5R0.3 O=C(CO)CO SC-07450 [1,0,0,0,0,0|2,1,0]=4 122 B7R0.2 CCC(=O)OC(C)=O SC-96821 [0,1,0,0,0,0|3,0,0]=4 123 B7R0.2 COC(=O)CC(=O)O SC-21351 [0,1,0,0,0,0|2,0,0]=3 124 B7R0.2 COC(=O)CC(C)Br SC-67097 [0,1,0,0,0,0|1,0,0]=2 125 B7R0.2 COC(=O)CC(N)=O SC-67031 [0,1,0,0,0,0|2,0,0]=3 126 B7R0.2 COC(=O)C[C@@H](C)N SC-88822 [0,1,0,0,0,0|1,0,0]=2 127 B7R0.2 COC(=O)C[C@@H](C)N SC-A1096 [0,1,0,0,0,0|1,0,0]=2 128 B7R0.2 COC(=O)C[C@@H](C)O SC-08902 [0,1,0,0,0,0|1,0,0]=2 129 B7R0.3 C#CCCC(=O)OC SC-92252 [0,1,0,0,0,0|1,0,1]=3 130 B7R0.3 C=CCCC(=O)OC SC-85069 [0,1,0,0,0,0|1,0,1]=3 131 B7R0.3 C=CCOC(=O)OC SC-82329 [0,1,0,0,0,0|1,0,1]=3 132 B7R0.3 CCCCC(=O)NN SC-59745 [0,1,0,0,0,0|3,0,0]=4 133 B7R0.3 CCOCC(=O)NN SC-59718 [0,1,0,0,0,0|2,1,0]=4 134 B7R0.3 CCOCC(Cl)OC SC-94025 [0,1,0,0,0,0|1,1,1]=4 135 B7R0.3 CCSCS(=O)CC SC-51200 [0,1,0,0,0,0|2,0,0]=3 136 B7R0.3 CC\C=C\C(=O)OC SC-62851 [0,1,0,0,0,0|1,0,1]=3 137 B7R0.3 CNC(=O)CCCN SC-A4646 [0,1,0,0,0,0|2,0,0]=3 138 B7R0.3 CNCCC(=O)NC SC-02483 [0,1,0,0,0,0|2,0,0]=3 139 B7R0.3 COC(=O)C#CCO SC-48272 [0,1,0,0,0,0|1,0,1]=3 140 B7R0.3 COC(=O)CCC#N SC-20469 [0,1,0,0,0,0|1,0,1]=3 141 B7R0.3 COC(=O)CCC=O SC-47529 [0,1,0,0,0,0|1,0,1]=3 142 B7R0.3 COC(=O)CCCBr SC-46963 [0,1,0,0,0,0|1,0,0]=2 143 B7R0.3 COC(=O)CCCO SC-43794 [0,1,0,0,0,0|1,0,0]=2 144 B7R0.3 COC(=O)CN=C=O SC-49023 [0,1,0,0,0,0|1,0,1]=3 145 B7R0.3 COC(=O)CN=[N+]=[N-] SC-96313 [0,1,0,0,0,0|2,0,0]=3 146 B7R0.3 COC(=O)\C=C\CBr SC-17676 [0,1,0,0,0,0|1,0,1]=3 147 B7R0.3 COC(=O)\C=C\CBr SC-49570 [0,1,0,0,0,0|1,0,1]=3 148 B7R0.3 COCCC(=O)OC SC-46379 [0,1,0,0,0,0|0,1,0]=2 149 B7R0.3 CO\C=C\C(=O)OC SC-62260 [0,1,0,0,0,0|0,1,1]=3 150 B7R0.3 CO\C=C\C(=O)OC SC-90792 [0,1,0,0,0,0|0,1,1]=3 151 B7R0.5 CC(C)C(=O)CC#N SC-26894 [0,1,0,0,0,0|3,0,0]=4 152 B7R0.5 CCNC(=O)[C@H](C)O SC-12514 [0,1,0,0,0,0|3,0,0]=4 153 B7R0.5 CCOC(=O)C(C)=O SC-15232 [0,1,0,0,0,0|3,0,0]=4 154 B7R0.5 CCOC(=O)C(C)Cl SC-13657 [0,1,0,0,0,0|3,0,0]=4 155 B7R0.5 CCOC(=O)C(C)F SC-75945 [0,1,0,0,0,0|3,0,0]=4 156 B7R0.5 CCOC(=O)C(C)N SC-09294 [0,1,0,0,0,0|3,0,0]=4 157 B7R0.5 CCOC(=O)C(C)N SC-13100 [0,1,0,0,0,0|3,0,0]=4 158 B7R0.5 CCOC(=O)N(C)C SC-88157 [0,1,0,0,0,0|3,0,0]=4 159 B7R0.5 CCOC(=O)[C@@H](C)N SC-41949 [0,1,0,0,0,0|3,0,0]=4 160 B7R0.5 CCOC(=O)[C@@H](C)O SC-15791 [0,1,0,0,0,0|3,0,0]=4 161 B7R0.5 CCOC(=O)[C@H](C)N SC-50937 [0,1,0,0,0,0|3,0,0]=4 162 B7R0.5 CN(C)C(=O)CC#N SC-46380 [0,1,0,0,0,0|3,0,0]=4 163 B7R0.5 CNCC(=O)N(C)C SC-A2871 [0,1,0,0,0,0|2,0,0]=3 164 B7R0.7 CC#CC(=O)OCC SC-54369 [0,1,0,0,0,0|1,0,1]=3 165 B7R0.7 CCOC(=N)CCBr SC-59650 [0,1,0,0,0,0|3,0,0]=4 166 B7R0.7 CCOC(=N)CCCl SC-54611 [0,1,0,0,0,0|3,0,0]=4 167 B7R0.7 CCOC(=N)CCO SC-54612 [0,1,0,0,0,0|3,0,0]=4 168 B7R0.7 CCOC(=N)CSC SC-59670 [0,1,0,0,0,0|1,0,0]=2 169 B7R0.7 CCOC(=O)C=[N+]=[N-] SC-25567 [0,1,0,0,0,0|2,0,1]=4 170 B7R0.7 CCOC(=O)CC#N SC-22643 [0,1,0,0,0,0|2,0,0]=3 171 B7R0.7 CCOC(=O)CC=O SC-14726 [0,1,0,0,0,0|2,0,0]=3 172 B7R0.7 CCOC(=O)CCI SC-02730 [0,1,0,0,0,0|2,0,0]=3 173 B7R0.7 CCOC(=O)CCN SC-83852 [0,1,0,0,0,0|2,0,0]=3 174 B7R0.7 CCOC(=O)CCO SC-43709 [0,1,0,0,0,0|2,0,0]=3 175 B7R0.7 CCOC(=O)CCS SC-44443 [0,1,0,0,0,0|2,0,0]=3 176 B7R0.7 CCOC(=O)CNC SC-10431 [0,1,0,0,0,0|1,0,0]=2 177 B7R0.7 CCOC(=O)CNN SC-06315 [0,1,0,0,0,0|2,0,0]=3 178 B7R0.7 CCOC(=O)CON SC-70950 [0,1,0,0,0,0|1,1,0]=3 179 B7R0.7 CCOC(=O)N=C=S SC-27157 [0,1,0,0,0,0|3,0,0]=4 180 B7R0.7 CCOC(=O)OCCl SC-35252 [0,1,0,0,0,0|2,0,0]=3 181 B7R0.7 CCOC(=O)\C=C\[O-] SC-71247 [0,1,0,0,0,0|2,0,1]=4 182 B7R0.7 COCC(=O)COC SC-43684 [0,1,0,0,0,0|0,1,0]=2 183 B7R0.7 COCC(C)COC SC-66246 [0,1,0,0,0,0|1,1,1]=4 184 B7R0.7 COCC(O)COC SC-65162 [0,1,0,0,0,0|0,1,2]=4 185 B7R0.7 O=C(CCCl)CCCl SC-03815 [0,1,0,0,0,0|3,0,0]=4 186 B7R0.7 [C-]#[N+]CC(=O)OCC SC-03259 [0,1,0,0,0,0|1,0,1]=3 187 B7R0.10 C=C(CBr)C(=O)OC SC-17134 [0,1,0,0,0,0|2,0,1]=4 188 B7R0.10 C=C(CCl)C(=O)OC SC-50074 [0,1,0,0,0,0|2,0,1]=4 189 B7R0.10 C=C(CO)C(=O)OC SC-53992 [0,1,0,0,0,0|2,0,1]=4 190 B7R0.10 CCC(=O)C(=O)OC SC-27261 [0,1,0,0,0,0|1,0,1]=3 191 B7R0.10 CC[C@@H](O)C(=O)OC SC-49455 [0,1,0,0,0,0|1,0,0]=2 192 B7R0.10 CC[C@H](N)C(=O)OC SC-33322 [0,1,0,0,0,0|1,0,0]=2 193 B7R0.10 CC[C@H](N)C(=O)OC SC-91370 [0,1,0,0,0,0|1,0,0]=2 194 B7R0.10 CNC(=O)C(N)C#N SC-55454 [0,1,0,0,0,0|3,0,0]=4 195 B7R0.10 CNC(C)C(=O)OC SC-82127 [0,1,0,0,0,0|1,0,0]=2 196 B7R0.10 CN[C@@H](C)C(=O)OC SC-84501 [0,1,0,0,0,0|1,0,0]=2 197 B7R0.10 CN[C@@H](C)C(=O)OC SC-A4993 [0,1,0,0,0,0|1,0,0]=2 198 B7R0.10 COC(=O)C(=O)CBr SC-15244 [0,1,0,0,0,0|2,0,1]=4 199 B7R0.10 COC(=O)C(=O)OC SC-81002 [0,1,0,0,0,0|0,1,1]=3 200 B7R0.10 COC(=O)C(=S)SC SC-66217 [0,1,0,0,0,0|0,0,1]=2 201 B7R0.10 COC(=O)C(Br)CO SC-87315 [0,1,0,0,0,0|2,0,0]=3 202 B7R0.10 COC(=O)C(Br)SC SC-83274 [0,1,0,0,0,0|0,0,0]=1 203 B7R0.10 COC(=O)C(C)CN SC-53925 [0,1,0,0,0,0|2,0,0]=3 204 B7R0.10 COC(=O)C(C)CO SC-08906 [0,1,0,0,0,0|2,0,0]=3 205 B7R0.10 COC(=O)C(C)CO SC-08907 [0,1,0,0,0,0|2,0,0]=3 206 B7R0.10 COC(=O)C(C)OC SC-92649 [0,1,0,0,0,0|0,1,0]=2 207 B7R0.10 COC(=O)C(Cl)C=O SC-53173 [0,1,0,0,0,0|2,0,0]=3 208 B7R0.10 COC(=O)C(Cl)CCl SC-48264 [0,1,0,0,0,0|2,0,0]=3 209 B7R0.10 COC(=O)C(N)CO SC-09862 [0,1,0,0,0,0|2,0,0]=3 210 B7R0.10 COC(=O)C(N)CO SC-51728 [0,1,0,0,0,0|2,0,0]=3 211 B7R0.10 COC(=O)[C@@H](C)CBr SC-08853 [0,1,0,0,0,0|2,0,0]=3 212 B7R0.10 COC(=O)[C@@H](N)CO SC-88547 [0,1,0,0,0,0|2,0,0]=3 213 B7R0.10 COC(=O)[C@@H](N)CS SC-22400 [0,1,0,0,0,0|2,0,0]=3 214 B7R0.10 COC(=O)[C@@H](O)CO SC-44674 [0,1,0,0,0,0|2,0,0]=3 215 B7R0.10 COC(=O)[C@H](C)CBr SC-08854 [0,1,0,0,0,0|2,0,0]=3 216 B7R0.10 COC(=O)[C@H](N)CCl SC-44813 [0,1,0,0,0,0|2,0,0]=3 217 B7R0.10 COC(=O)[C@H](N)CO SC-21448 [0,1,0,0,0,0|2,0,0]=3 218 B7R0.10 COC(=O)[C@H](N)CS SC-95830 [0,1,0,0,0,0|2,0,0]=3 219 B7R0.10 C\C=C(/Br)C(=O)OC SC-89362 [0,1,0,0,0,0|1,0,1]=3 220 B7R0.12 COCC(OC)OC SC-73556 [0,1,0,0,0,0|0,1,2]=4 221 B7R1.1 COC1=CSC=C1 SC-44608 [0,0,0,1,0,0|1,0,2]=4 222 B7R1.1 COC1=NCCC1 SC-72634 [0,0,0,1,0,0|2,0,0]=3 223 B7R1.1 COC1CCNC1 SC-12454 [0,0,0,1,0,0|2,0,1]=4 224 B7R1.1 COC1CCNC1 SC-24177 [0,0,0,1,0,0|2,0,1]=4 225 B7R1.1 CO[C@@H]1CCNC1 SC-25526 [0,0,0,1,0,0|2,0,1]=4 226 B7R1.1 CO[C@@H]1CCNC1 SC-51990 [0,0,0,1,0,0|2,0,1]=4 227 B7R1.1 CO[C@H]1CCNC1 SC-25506 [0,0,0,1,0,0|2,0,1]=4 228 B7R1.1 CO[C@H]1CCNC1 SC-51991 [0,0,0,1,0,0|2,0,1]=4 229 B7R1.2 CC1=CC(=O)CC1 SC-18727 [0,0,0,1,0,0|2,0,1]=4 230 B7R1.2 CC1=CC(=O)OC1 SC-25541 [0,0,0,1,0,0|1,0,1]=3 231 B7R1.2 CC1CCC(=O)C1 SC-93748 [0,0,0,1,0,0|2,0,0]=3 232 B7R1.2 CC1CCC(=O)N1 SC-89347 [0,0,0,1,0,0|3,0,0]=4 233 B7R1.2 CC1CNC(=O)C1 SC-50248 [0,0,0,1,0,0|2,0,0]=3 234 B7R1.2 CC1CNC(=O)N1 SC-65644 [0,0,0,1,0,0|3,0,0]=4 235 B7R1.2 CC1COC(=O)C1 SC-60836 [0,0,0,1,0,0|1,0,0]=2 236 B7R1.2 C[C@@H]1CCC(=O)O1 SC-65777 [0,0,0,1,0,0|3,0,0]=4 237 B7R1.2 C[C@@H]1COC(=O)C1 SC-45465 [0,0,0,1,0,0|1,0,0]=2 238 B7R1.2 C[C@@H]1COC(=O)N1 SC-43641 [0,0,0,1,0,0|2,0,0]=3 239 B7R1.2 C[C@@H]1COC(=O)N1 SC-51055 [0,0,0,1,0,0|2,0,0]=3 240 B7R1.2 C[C@H]1CCC(=O)O1 SC-86851 [0,0,0,1,0,0|3,0,0]=4 241 B7R1.2 C[C@H]1COC(=O)N1 SC-51056 [0,0,0,1,0,0|2,0,0]=3 242 B7R1.2 C[C@H]1COC(=O)O1 SC-04943 [0,0,0,1,0,0|2,0,0]=3 243 B7R1.2 NC1CNC(=O)C1 SC-66063 [0,0,0,1,0,0|3,0,0]=4 244 B7R1.2 NC1COC(=O)C1 SC-34183 [0,0,0,1,0,0|2,0,0]=3 245 B7R1.2 N[C@@H]1COC(=O)C1 SC-71558 [0,0,0,1,0,0|2,0,0]=3 246 B7R1.2 N[C@H]1CNC(=O)C1 SC-52716 [0,0,0,1,0,0|3,0,0]=4 247 B7R1.2 O=C1C=C(O)CO1 SC-21646 [0,0,0,1,0,0|2,0,1]=4 248 B7R1.2 O=C1CC(O)CN1 SC-29049 [0,0,0,1,0,0|3,0,0]=4 249 B7R1.2 O=C1CCC(=O)C1 SC-15331 [0,0,0,1,0,0|3,0,0]=4 250 B7R1.2 O=C1CNC(=O)C1 SC-88883 [0,0,0,1,0,0|3,0,0]=4 251 B7R1.2 O=C1COC(=O)C1 SC-86968 [0,0,0,1,0,0|2,0,0]=3 252 B7R1.2 O=C1COC(=O)N1 SC-49693 [0,0,0,1,0,0|3,0,0]=4 253 B7R1.2 O=C1C[C@@H](O)CN1 SC-02616 [0,0,0,1,0,0|3,0,0]=4 254 B7R1.2 O=C1C[C@H](O)CN1 SC-13587 [0,0,0,1,0,0|3,0,0]=4 255 B7R1.2 O=C1C[C@H](O)CO1 SC-06559 [0,0,0,1,0,0|2,0,0]=3 256 B7R1.2 O=C1OCC(F)O1 SC-19199 [0,0,0,1,0,0|3,0,0]=4 257 B7R1.3 BrC1=CCCCC1 SC-69986 [0,0,0,1,0,0|3,0,0]=4 258 B7R1.3 CC1=CCCCC1 SC-99243 [0,0,0,1,0,0|3,0,0]=4 259 B7R1.3 CC1=CCCNC1 SC-82898 [0,0,0,1,0,0|3,0,0]=4 260 B7R1.3 CC1CNCCO1 SC-49158 [0,0,0,1,0,0|2,0,1]=4 261 B7R1.3 CC1CNCCO1 SC-82780 [0,0,0,1,0,0|2,0,1]=4 262 B7R1.3 CC1CNCCO1 SC-A3535 [0,0,0,1,0,0|2,0,1]=4 263 B7R1.3 C[C@@H]1CNCCO1 SC-43965 [0,0,0,1,0,0|2,0,1]=4 264 B7R1.3 C[C@@H]1CNCCO1 SC-88816 [0,0,0,1,0,0|2,0,1]=4 265 B7R1.3 C[C@H]1CNCCO1 SC-44479 [0,0,0,1,0,0|2,0,1]=4 266 B7R1.3 C[SiH]1CCCCO1 SC-91060 [0,0,0,1,0,0|2,1,0]=4 267 B7R1.3 O=C1C=CCCN1 SC-25185 [0,0,0,1,0,0|2,0,1]=4 268 B7R1.3 O=C1CCCCN1 SC-16274 [0,0,0,1,0,0|2,0,0]=3 269 B7R1.3 O=C1CCCCO1 SC-65111 [0,0,0,1,0,0|1,0,0]=2 270 B7R1.3 O=C1CCCNC1 SC-29391 [0,0,0,1,0,0|2,0,0]=3 271 B7R1.3 O=C1CCCNC1 SC-48015 [0,0,0,1,0,0|2,0,0]=3 272 B7R1.3 O=C1CCCOC1 SC-14944 [0,0,0,1,0,0|1,1,0]=3 273 B7R1.3 O=C1CCNCC1 SC-04379 [0,0,0,1,0,0|3,0,0]=4 274 B7R1.3 O=C1CCNCC1 SC-19352 [0,0,0,1,0,0|3,0,0]=4 275 B7R1.3 O=C1CCOCC1 SC-03251 [0,0,0,1,0,0|3,0,0]=4 276 B7R1.3 O=C1CCSCC1 SC-19697 [0,0,0,1,0,0|3,0,0]=4 277 B7R1.3 O=C1CNCCN1 SC-05365 [0,0,0,1,0,0|2,0,0]=3 278 B7R1.3 O=C1CNCCO1 SC-84883 [0,0,0,1,0,0|1,0,0]=2 279 B7R1.3 O=C1COCCN1 SC-24222 [0,0,0,1,0,0|1,1,0]=3 280 B7R1.3 O=C1CSCCN1 SC-28581 [0,0,0,1,0,0|1,0,0]=2 281 B7R1.3 OC1CCCCO1 SC-84303 [0,0,0,1,0,0|1,0,2]=4 282 B7R1.4 CC1=CCCC1=O SC-15856 [0,0,0,1,0,0|2,0,1]=4 283 B7R1.4 CC1CCCC1=O SC-89605 [0,0,0,1,0,0|2,0,0]=3 284 B7R1.4 CC1CCCC1=S SC-42934 [0,0,0,1,0,0|2,1,0]=4 285 B7R1.4 CC1CCNC1=O SC-21672 [0,0,0,1,0,0|3,0,0]=4 286 B7R1.4 CC1CCOC1=O SC-20996 [0,0,0,1,0,0|3,0,0]=4 287 B7R1.4 CN1CCNC1=O SC-89793 [0,0,0,1,0,0|3,0,0]=4 288 B7R1.4 O=C1CCCC1Br SC-70088 [0,0,0,1,0,0|3,0,0]=4 289 B7R1.4 O=C1CCCC1Cl SC-21538 [0,0,0,1,0,0|3,0,0]=4 290 B7R1.22 COC(=O)C1CO1 SC-18773 [0,0,0,1,0,0|0,1,0]=2 291 B7R1.22 NNC(=O)C1CC1 SC-B6986 [0,0,0,1,0,0|3,0,0]=4 292 B7R1.22 O=C(CBr)C1CC1 SC-20322 [0,0,0,1,0,0|3,0,0]=4 293 B7R1.25 COC1(C)CNC1 SC-50109 [0,0,0,1,0,0|2,0,1]=4 294 B4R0.1 C#CC(=O)O SC-46968 [2,0,0,0,0,0|0,0,2]=4 295 B4R0.1 C#CC(C)=O SC-77912 [2,0,0,0,0,0|0,0,2]=4 296 B4R0.1 C=C(C)CBr SC-50158 [2,0,0,0,0,0|2,0,0]=4 297 B4R0.1 C=C(C)CF SC-89300 [2,0,0,0,0,0|2,0,0]=4 298 B4R0.1 C=C(C)CN SC-43404 [2,0,0,0,0,0|2,0,0]=4 299 B4R0.1 C=C(C)CN SC-84159 [2,0,0,0,0,0|2,0,0]=4 300 B4R0.1 C=C(N)OC SC-01201 [2,0,0,0,0,0|1,0,1]=4 301 B4R0.1 CC(=O)CN SC-28532 [2,0,0,0,0,0|1,0,0]=3 302 B4R0.1 CC(=O)CN SC-89750 [2,0,0,0,0,0|1,0,0]=3 303 B4R0.1 CC(=O)NO SC-18498 [2,0,0,0,0,0|1,1,0]=4 304 B4R0.1 CC(S)CS SC-A2768 [2,0,0,0,0,0|0,1,1]=4 305 B4R0.1 CCB(O)O SC-04516 [2,0,0,0,0,0|1,0,1]=4 306 B4R0.1 CCC(=N)N SC-39291 [2,0,0,0,0,0|2,0,0]=4 307 B4R0.1 CCC(=N)N SC-53846 [2,0,0,0,0,0|2,0,0]=4 308 B4R0.1 CCC(=O)[O-] SC-47286 [2,0,0,0,0,0|0,0,1]=3 309 B4R0.1 CCC(C)O SC-01234 [2,0,0,0,0,0|0,0,2]=4 310 B4R0.1 CCC(N)=O SC-18213 [2,0,0,0,0,0|1,0,0]=3 311 B4R0.1 CCN(C)N SC-A4596 [2,0,0,0,0,0|2,0,0]=4 312 B4R0.1 CCS(=O)[O-] SC-20356 [2,0,0,0,0,0|1,0,1]=4 313 B4R0.1 CC[C@H](C)N SC-81828 [2,0,0,0,0,0|1,0,1]=4 314 B4R0.1 CC[C@H](C)N SC-A5647 [2,0,0,0,0,0|1,0,1]=4 315 B4R0.1 CC[C@H](C)O SC-04418 [2,0,0,0,0,0|0,0,2]=4 316 B4R0.1 COC(=N)N SC-46936 [2,0,0,0,0,0|2,0,0]=4 317 B4R0.1 COC(=N)N SC-65775 [2,0,0,0,0,0|2,0,0]=4 318 B4R0.1 CS[S+](C)C SC-09173 [2,0,0,0,0,0|2,0,0]=4 319 B4R0.1 C\C=C(\C)Br SC-91379 [2,0,0,0,0,0|1,0,1]=4 320 B4R0.1 NC(=O)CBr SC-17752 [2,0,0,0,0,0|2,0,0]=4 321 B4R0.1 NC(=O)CI SC-18913 [2,0,0,0,0,0|2,0,0]=4 322 B4R0.1 NC(=O)CO SC-26304 [2,0,0,0,0,0|1,1,0]=4 323 B4R0.1 NCC(=O)O SC-26815 [2,0,0,0,0,0|1,0,0]=3 324 B4R0.1 NCC(=O)O SC-26884 [2,0,0,0,0,0|1,0,0]=3 325 B4R0.1 NCC(N)=O SC-18427 [2,0,0,0,0,0|2,0,0]=4 326 B4R0.1 O=C(Cl)CBr SC-49267 [2,0,0,0,0,0|2,0,0]=4 327 B4R0.1 O=C(O)CBr SC-18211 [2,0,0,0,0,0|1,0,0]=3 328 B4R0.1 O=C(O)CI SC-57980 [2,0,0,0,0,0|1,0,0]=3 329 B4R0.1 O=C(O)CO SC-26092 [2,0,0,0,0,0|0,1,0]=3 330 B4R0.1 O=C(O)CO SC-85771 [2,0,0,0,0,0|0,1,0]=3 331 B4R0.1 O=C(O)CS SC-18319 [2,0,0,0,0,0|0,0,0]=2 332 B4R0.1 O=C([O-])CBr SC-50549 [2,0,0,0,0,0|1,0,1]=4 333 B4R0.1 O=C([O-])CI SC-80290 [2,0,0,0,0,0|1,0,1]=4 334 B4R0.1 O=C([O-])CO SC-89096 [2,0,0,0,0,0|0,1,1]=4 335 B4R0.1 O=CC(=O)O SC-18712 [2,0,0,0,0,0|0,1,1]=4 336 B4R0.1 O=CC(=O)O SC-25819 [2,0,0,0,0,0|0,1,1]=4 337 B4R0.2 C=CCNC SC-05902 [2,0,0,0,0,0|1,0,1]=4 338 B4R0.2 C=CCOC SC-62245 [2,0,0,0,0,0|0,1,1]=4 339 B4R0.2 C=CCSC SC-47211 [2,0,0,0,0,0|0,0,1]=3 340 B4R0.2 CCCNC SC-27548 [2,0,0,0,0,0|1,0,1]=4 341 B4R0.2 CCCSC SC-88233 [2,0,0,0,0,0|0,0,1]=3 342 B4R0.2 CCOCC SC-73354 [2,0,0,0,0,0|2,0,0]=4 343 B4R0.2 CC[NH2+]CC SC-20006 [2,0,0,0,0,0|2,0,0]=4 344 B4R0.2 CNCCO SC-26626 [2,0,0,0,0,0|1,0,1]=4 345 B4R0.2 COCC=O SC-48883 [2,0,0,0,0,0|0,1,0]=3 346 B4R0.2 COCCCl SC-05903 [2,0,0,0,0,0|1,0,1]=4 347 B4R0.2 COCCN SC-22236 [2,0,0,0,0,0|1,0,1]=4 348 B4R0.2 COCC[O-] SC-21117 [2,0,0,0,0,0|0,1,1]=4 349 B4R0.2 COCC[O-] SC-67452 [2,0,0,0,0,0|0,1,1]=4 350 B4R0.2 CSCCCl SC-53991 [2,0,0,0,0,0|1,0,1]=4 351 B4R0.2 CSCCN SC-28443 [2,0,0,0,0,0|1,0,1]=4 352 B4R0.2 CSCCN SC-40144 [2,0,0,0,0,0|1,0,1]=4 353 B4R0.2 CSCCN SC-83550 [2,0,0,0,0,0|1,0,1]=4 354 B4R0.2 CSCCO SC-19276 [2,0,0,0,0,0|0,0,1]=3 355 B4R0.2 C\C=C/CO SC-69832 [2,0,0,0,0,0|1,1,0]=4 356 B4R0.2 C\C=C\CO SC-25521 [2,0,0,0,0,0|1,1,0]=4 357 B4R0.2 C\C=C\CO SC-69597 [2,0,0,0,0,0|1,1,0]=4 358 B4R0.2 C\C=C\OC SC-97407 [2,0,0,0,0,0|0,0,1]=3 359 B4R0.2 O=CCCCl SC-71322 [2,0,0,0,0,0|2,0,0]=4 360 B4R0.2 O=CCCO SC-52939 [2,0,0,0,0,0|2,0,0]=4 361 B6R0.2 C=C(C)CC(=O)O SC-31698 [1,1,0,0,0,0|1,0,0]=3 362 B6R0.2 CC(=O)CC(=O)O SC-69749 [1,1,0,0,0,0|1,0,0]=3 363 B6R0.2 CC(=O)CC(C)=O SC-68118 [1,1,0,0,0,0|1,0,0]=3 364 B6R0.2 CC(=O)CC(C)=O SC-77723 [1,1,0,0,0,0|1,0,0]=3 365 B6R0.2 CC(=O)NC(C)C SC-A3057 [1,1,0,0,0,0|2,0,0]=4 366 B6R0.2 CC(=O)[CH-]C(C)=O SC-19438 [1,1,0,0,0,0|1,0,1]=4 367 B6R0.2 CC(=O)\C=C(\C)N SC-89382 [1,1,0,0,0,0|1,0,1]=4 368 B6R0.2 CC(=O)\C=C(\C)O SC-20333 [1,1,0,0,0,0|1,0,1]=4 369 B6R0.2 CC(=O)\C=C(\C)O SC-67757 [1,1,0,0,0,0|1,0,1]=4 370 B6R0.2 CC(C)=CC(=O)O SC-16257 [1,1,0,0,0,0|1,0,1]=4 371 B6R0.2 CC(O)CC(=O)[O-] SC-85388 [1,1,0,0,0,0|1,0,1]=4 372 B6R0.2 CN(C)CC(=O)Cl SC-48853 [1,1,0,0,0,0|2,0,0]=4 373 B6R0.2 CN(C)CC(=O)O SC-09555 [1,1,0,0,0,0|1,0,0]=3 374 B6R0.2 CN(C)CC(=O)O SC-51828 [1,1,0,0,0,0|1,0,0]=3 375 B6R0.2 CN(C)CC(N)=O SC-89197 [1,1,0,0,0,0|2,0,0]=4 376 B6R0.2 C[C@@H](N)CC(=O)O SC-10059 [1,1,0,0,0,0|1,0,0]=3 377 B6R0.2 C[C@@H](N)CC(=O)O SC-44142 [1,1,0,0,0,0|1,0,0]=3 378 B6R0.2 C[C@H](N)CC(=O)O SC-21979 [1,1,0,0,0,0|1,0,0]=3 379 B6R0.2 C[C@H](O)CC(=O)O SC-B3327 [1,1,0,0,0,0|1,0,0]=3 380 B6R0.2 C[S+](C)CC(=O)[O-] SC-72907 [1,1,0,0,0,0|0,0,2]=4 381 B6R0.2 O=C(O)CC(=O)O SC-77641 [1,1,0,0,0,0|2,0,0]=4 382 B6R0.3 C=CC(C)C(=O)O SC-65769 [1,1,0,0,0,0|1,0,1]=4 383 B6R0.3 C=CC(N)C(=O)O SC-83691 [1,1,0,0,0,0|1,0,1]=4 384 B6R0.3 C=C[C@H](N)C(=O)O SC-99216 [1,1,0,0,0,0|1,0,1]=4 385 B6R0.3 CC(C#N)C(=O)O SC-65741 [1,1,0,0,0,0|2,0,0]=4 386 B6R0.3 CC(CBr)C(=O)O SC-53016 [1,1,0,0,0,0|2,0,0]=4 387 B6R0.3 CC(CN)C(=O)O SC-10095 [1,1,0,0,0,0|2,0,0]=4 388 B6R0.3 CC(CN)C(=O)O SC-16443 [1,1,0,0,0,0|2,0,0]=4 389 B6R0.3 CCC(=O)C(=O)O SC-48634 [1,1,0,0,0,0|1,0,1]=4 390 B6R0.3 CCC(C)C(=O)O SC-22738 [1,1,0,0,0,0|1,0,0]=3 391 B6R0.3 CCC(Cl)C(=O)O SC-96228 [1,1,0,0,0,0|1,0,0]=3 392 B6R0.3 CCC(N)C(=O)O SC-25570 [1,1,0,0,0,0|1,0,0]=3 393 B6R0.3 CCC(N)C(N)=O SC-67619 [1,1,0,0,0,0|2,0,0]=4 394 B6R0.3 CCC(S)C(=O)O SC-90417 [1,1,0,0,0,0|1,0,0]=3 395 B6R0.3 CCN(C)C(C)=O SC-A3863 [1,1,0,0,0,0|2,0,0]=4 396 B6R0.3 CCN(O)C(C)=O SC-69302 [1,1,0,0,0,0|2,0,0]=4 397 B6R0.3 CC[C@@H](C)C(=O)O SC-92309 [1,1,0,0,0,0|1,0,0]=3 398 B6R0.3 CC[C@@H](Cl)C(=O)O SC-52915 [1,1,0,0,0,0|1,0,0]=3 399 B6R0.3 CC[C@@H](N)C(=O)O SC-10051 [1,1,0,0,0,0|1,0,0]=3 400 B6R0.3 CC[C@@H](O)C(=O)O SC-53865 [1,1,0,0,0,0|1,0,0]=3 401 B6R0.3 CC[C@H](N)C(=O)O SC-10052 [1,1,0,0,0,0|1,0,0]=3 402 B6R0.3 CC[C@H](N)C(N)=O SC-15825 [1,1,0,0,0,0|2,0,0]=4 403 B6R0.3 CC[C@H](O)C(=O)O SC-06416 [1,1,0,0,0,0|1,0,0]=3 404 B6R0.3 CN[C@H](C)C(=O)O SC-45134 [1,1,0,0,0,0|1,0,0]=3 405 B6R0.3 COC(C)C(=O)O SC-49776 [1,1,0,0,0,0|0,1,0]=3 406 B6R0.3 CON(C)C(C)=O SC-20924 [1,1,0,0,0,0|1,1,0]=4 407 B6R0.3 CO[C@@H](C)C(=O)O SC-89341 [1,1,0,0,0,0|0,1,0]=3 408 B6R0.3 CO[C@H](C)C(=O)O SC-A3340 [1,1,0,0,0,0|0,1,0]=3 409 B6R0.3 C[C@@H](CN)C(=O)O SC-69436 [1,1,0,0,0,0|2,0,0]=4 410 B6R0.3 C[C@H](CN)C(=O)O SC-90232 [1,1,0,0,0,0|2,0,0]=4 411 B6R0.3 C[C@H](CN)C(=O)O SC-A1203 [1,1,0,0,0,0|2,0,0]=4 412 B6R0.3 NC(CO)C(=O)O SC-09828 [1,1,0,0,0,0|2,0,0]=4 413 B6R0.3 NC(CS)C(=O)O SC-09428 [1,1,0,0,0,0|2,0,0]=4 414 B6R0.3 NCC(N)C(=O)O SC-12518 [1,1,0,0,0,0|2,0,0]=4 415 B6R0.3 NCC(O)C(=O)O SC-10335 [1,1,0,0,0,0|2,0,0]=4 416 B6R0.3 NC[C@@H](N)C(=O)O SC-10203 [1,1,0,0,0,0|2,0,0]=4 417 B6R0.3 NC[C@@H](O)C(=O)O SC-17253 [1,1,0,0,0,0|2,0,0]=4 418 B6R0.3 NC[C@H](N)C(=O)O SC-10204 [1,1,0,0,0,0|2,0,0]=4 419 B6R0.3 N[C@@H](CCl)C(=O)O SC-21241 [1,1,0,0,0,0|2,0,0]=4 420 B6R0.3 N[C@@H](CO)C(=O)O SC-09827 [1,1,0,0,0,0|2,0,0]=4 421 B6R0.3 N[C@@H](CS)C(=O)O SC-09426 [1,1,0,0,0,0|2,0,0]=4 422 B6R0.3 N[C@@H](CS)C(=O)O SC-45550 [1,1,0,0,0,0|2,0,0]=4 423 B6R0.3 O=C(O)C(O)CCl SC-83865 [1,1,0,0,0,0|2,0,0]=4 424 B6R0.3 O=C(O)C(O)CO SC-94999 [1,1,0,0,0,0|2,0,0]=4 425 B6R0.3 O=C(O)[C@@H](O)CCl SC-86856 [1,1,0,0,0,0|2,0,0]=4 426 B6R0.3 [C@@H](N)(CC)C(N)=O SC-49088 [1,1,0,0,0,0|2,0,0]=4 427 B6R0.3 [C@@H](N)(CS)C(=O)O SC-09427 [1,1,0,0,0,0|2,0,0]=4 428 B6R0.4 C#CCCC(=O)O SC-51038 [1,1,0,0,0,0|1,0,1]=4 429 B6R0.4 C#CCOC(C)=O SC-90220 [1,1,0,0,0,0|1,0,1]=4 430 B6R0.4 C=C(C)CCCBr SC-32900 [1,1,0,0,0,0|2,0,0]=4 431 B6R0.4 C=C(C)CCCO SC-14313 [1,1,0,0,0,0|2,0,0]=4 432 B6R0.4 C=C(C)CNCC SC-47240 [1,1,0,0,0,0|2,0,0]=4 433 B6R0.4 C=CCCC(=O)O SC-25836 [1,1,0,0,0,0|1,0,1]=4 434 B6R0.4 C=CCNC(C)=O SC-48071 [1,1,0,0,0,0|1,0,1]=4 435 B6R0.4 C=CNCC(=O)O SC-20808 [1,1,0,0,0,0|1,0,1]=4 436 B6R0.4 C=CNCC(=O)O SC-21370 [1,1,0,0,0,0|1,0,1]=4 437 B6R0.4 CC(=O)CCCBr SC-91341 [1,1,0,0,0,0|1,0,0]=3 438 B6R0.4 CC(=O)OCCO SC-95931 [1,1,0,0,0,0|2,0,0]=4 439 B6R0.4 CCCCC(=O)Cl SC-46867 [1,1,0,0,0,0|2,0,0]=4 440 B6R0.4 CC\C=C\C(=O)O SC-92876 [1,1,0,0,0,0|1,0,1]=4 441 B6R0.4 CNCCC(=O)O SC-27492 [1,1,0,0,0,0|1,0,0]=3 442 B6R0.4 CNCCC(=O)O SC-52914 [1,1,0,0,0,0|1,0,0]=3 443 B6R0.4 COCCC(=O)O SC-50255 [1,1,0,0,0,0|0,1,0]=3 444 B6R0.4 CO\C=C\C(C)=O SC-71024 [1,1,0,0,0,0|0,1,1]=4 445 B6R0.4 CSCCC(=O)O SC-96567 [1,1,0,0,0,0|0,0,0]=2 446 B6R0.4 C\C=C\CC(=O)O SC-10968 [1,1,0,0,0,0|1,0,0]=3 447 B6R0.4 N#CCCC(=O)O SC-49854 [1,1,0,0,0,0|1,0,1]=4 448 B6R0.4 NCCCC(=O)O SC-10045 [1,1,0,0,0,0|1,0,0]=3 449 B6R0.4 O=C(Cl)CCCBr SC-70369 [1,1,0,0,0,0|2,0,0]=4 450 B6R0.4 O=C(O)CCCBr SC-02994 [1,1,0,0,0,0|1,0,0]=3 451 B6R0.4 O=C(O)CCCCl SC-89723 [1,1,0,0,0,0|1,0,0]=3 452 B6R0.4 O=C(O)\C=C\CBr SC-53654 [1,1,0,0,0,0|1,0,1]=4 453 B6R0.5 CCCP(=O)(O)O SC-A3323 [1,1,0,0,0,0|2,0,0]=4 454 B6R0.5 CCCP(=O)(O)O SC-A5594 [1,1,0,0,0,0|2,0,0]=4 455 B6R0.5 CCCS(=O)(=O)O SC-80781 [1,1,0,0,0,0|2,0,0]=4 456 B6R0.5 CSCC(C)(C)N SC-50334 [1,1,0,0,0,0|1,0,1]=4 457 B6R0.6 CNCCCOC SC-51293 [1,1,0,0,0,0|1,0,1]=4 458 B6R0.6 CNCCCOC SC-A3034 [1,1,0,0,0,0|1,0,1]=4 459 B6R0.6 COCCCCCl SC-01876 [1,1,0,0,0,0|1,0,1]=4 460 B6R0.6 COCCCOC SC-47077 [1,1,0,0,0,0|0,1,1]=4 461 B6R0.6 C\C=C\CCCO SC-48265 [1,1,0,0,0,0|2,0,0]=4 462 B6R0.8 CCP(=O)(O)CC SC-96218 [1,1,0,0,0,0|2,0,0]=4 463 B6R0.8 COP(=O)(Cl)OC SC-96906 [1,1,0,0,0,0|1,1,0]=4 464 B6R0.9 CCB(CC)OC SC-22792 [1,1,0,0,0,0|2,0,0]=4 465 B6R0.9 CCC(CN)OC SC-48021 [1,1,0,0,0,0|1,0,1]=4 466 B6R0.9 CCC(OC)OC SC-85699 [1,1,0,0,0,0|0,0,2]=4 467 B6R0.9 COC(C=O)OC SC-26054 [1,1,0,0,0,0|0,1,1]=4 468 B6R0.9 C\C=C(\C=O)CC SC-95172 [1,1,0,0,0,0|1,0,0]=3 469 B8R0.2 COC(=O)C(=O)C(C)Br SC-49692 [0,2,0,0,0,0|1,0,1]=4 470 B8R0.2 COC(=O)C(=O)C(C)C SC-26959 [0,2,0,0,0,0|1,0,1]=4 471 B8R0.2 COC(=O)C(Br)C(C)C SC-16269 [0,2,0,0,0,0|1,0,0]=3 472 B8R0.2 COC(=O)C(Cl)C(C)=O SC-49511 [0,2,0,0,0,0|1,0,0]=3 473 B8R0.2 COC(=O)C(N)C(C)O SC-09896 [0,2,0,0,0,0|1,0,0]=3 474 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O SC-67026 [0,2,0,0,0,0|1,0,0]=3 475 B8R0.2 COC(=O)[C@H](N)[C@@H](C)O SC-83393 [0,2,0,0,0,0|1,0,0]=3 476 B8R0.5 CCCC(=O)CC(C)C SC-99431 [0,2,0,0,0,0|2,0,0]=4 477 B8R0.5 CCOC(=O)C=C(C)C SC-49947 [0,2,0,0,0,0|1,0,1]=4 478 B8R0.5 CCOC(=O)CC(=N)N SC-14407 [0,2,0,0,0,0|2,0,0]=4 479 B8R0.5 CCOC(=O)CC(=N)N SC-49384 [0,2,0,0,0,0|2,0,0]=4 480 B8R0.5 CCOC(=O)CC(=O)O SC-17786 [0,2,0,0,0,0|2,0,0]=4 481 B8R0.5 CCOC(=O)CC(=O)[O-] SC-26967 [0,2,0,0,0,0|2,0,0]=4 482 B8R0.5 CCOC(=O)CC(C)=O SC-18922 [0,2,0,0,0,0|1,0,0]=3 483 B8R0.5 CCOC(=O)CC(C)N SC-35852 [0,2,0,0,0,0|1,0,0]=3 484 B8R0.5 CCOC(=O)CC(C)O SC-08980 [0,2,0,0,0,0|1,0,0]=3 485 B8R0.5 CCOC(=O)CC(C)O SC-93699 [0,2,0,0,0,0|1,0,0]=3 486 B8R0.5 CCOC(=O)CC(N)=S SC-88868 [0,2,0,0,0,0|2,0,0]=4 487 B8R0.5 CCOC(=O)CN(C)C SC-17425 [0,2,0,0,0,0|1,0,0]=3 488 B8R0.5 CCOC(=O)C[C@@H](C)O SC-08901 [0,2,0,0,0,0|1,0,0]=3 489 B8R0.5 CCOC(=O)C[C@H](C)N SC-A3124 [0,2,0,0,0,0|1,0,0]=3 490 B8R0.5 CCOC(=O)C[S+](C)C SC-43826 [0,2,0,0,0,0|0,0,1]=3 491 B8R0.5 CCOC(=O)OC(C)Cl SC-25939 [0,2,0,0,0,0|2,0,0]=4 492 B8R0.5 CCOC(=O)\C=C(\C)N SC-46838 [0,2,0,0,0,0|1,0,1]=4 493 B8R0.19 CCC(=O)CC(=O)CC SC-08086 [0,2,0,0,0,0|2,0,0]=4 494 B8R0.19 CN\C(C)=C/C(=O)OC SC-38289 [0,2,0,0,0,0|1,0,1]=4 495 B8R0.19 CN\C(C)=C/C(=O)OC SC-50211 [0,2,0,0,0,0|1,0,1]=4 496 B8R0.19 COC(=O)CC(O)CN SC-35083 [0,2,0,0,0,0|1,0,0]=3 497 B8R0.19 COC(=O)C[C@@H](O)CCl SC-08919 [0,2,0,0,0,0|1,0,0]=3 498 B8R0.19 COC(=O)OC(=O)OC SC-73412 [0,2,0,0,0,0|0,1,1]=4 499 B8R0.24 CNC(=O)CS(C)(=O)=O SC-02350 [0,2,0,0,0,0|1,0,1]=4 500 B8R0.24 COC(=O)CS(=O)(=O)Cl SC-86892 [0,2,0,0,0,0|1,0,1]=4 501 B8R0.1 CCC#CC(=O)OCC SC-70982 [0,2,0,0,0,0|1,0,1]=4 502 B8R0.1 CCOC(=N)CCCBr SC-59653 [0,2,0,0,0,0|2,0,0]=4 503 B8R0.1 CCOC(=N)CCCCl SC-39521 [0,2,0,0,0,0|2,0,0]=4 504 B8R0.1 CCOC(=N)CCCO SC-65481 [0,2,0,0,0,0|2,0,0]=4 505 B8R0.1 CCOC(=O)C#CCO SC-A5366 [0,2,0,0,0,0|1,0,1]=4 506 B8R0.1 CCOC(=O)CCCBr SC-03228 [0,2,0,0,0,0|1,0,0]=3 507 B8R0.1 CCOC(=O)CCCI SC-02708 [0,2,0,0,0,0|1,0,0]=3 508 B8R0.1 CCOC(=O)CCCN SC-87395 [0,2,0,0,0,0|1,0,0]=3 509 B8R0.1 CCOC(=O)CCCO SC-99324 [0,2,0,0,0,0|1,0,0]=3 510 B8R0.1 CCOC(=O)CCNC SC-47958 [0,2,0,0,0,0|1,0,0]=3 511 B8R0.1 CCOC(=O)CN=C=O SC-21480 [0,2,0,0,0,0|1,0,1]=4 512 B8R0.1 CCOC(=O)CN=C=S SC-44680 [0,2,0,0,0,0|1,0,1]=4 513 B8R0.1 CCOC(=O)CN=[N+]=[N-] SC-13270 [0,2,0,0,0,0|2,0,0]=4 514 B8R0.1 CCOC(=O)CNC=O SC-19934 [0,2,0,0,0,0|1,0,1]=4 515 B8R0.1 CCOC(=O)\C=C\CN SC-83092 [0,2,0,0,0,0|1,0,1]=4 516 B8R0.3 C#CCC(N)C(=O)OC SC-32576 [0,2,0,0,0,0|1,0,1]=4 517 B8R0.3 C=CCC(N)C(=O)OC SC-A2429 [0,2,0,0,0,0|1,0,1]=4 518 B8R0.3 C=CC[C@@H](N)C(=O)OC SC-69286 [0,2,0,0,0,0|1,0,1]=4 519 B8R0.3 C=CC[C@H](O)C(=O)OC SC-14277 [0,2,0,0,0,0|1,0,1]=4 520 B8R0.3 CCCC(N)C(=O)OC SC-10383 [0,2,0,0,0,0|1,0,0]=3 521 B8R0.3 CCOC(=O)C(=O)CC SC-46250 [0,2,0,0,0,0|1,0,1]=4 522 B8R0.3 CCOC(=O)C(C)C#N SC-48632 [0,2,0,0,0,0|2,0,0]=4 523 B8R0.3 CCOC(=O)C(C)C=O SC-31347 [0,2,0,0,0,0|2,0,0]=4 524 B8R0.3 CCOC(=O)C(C)CN SC-48372 [0,2,0,0,0,0|2,0,0]=4 525 B8R0.3 CCOC(=O)C(C)CN SC-51616 [0,2,0,0,0,0|2,0,0]=4 526 B8R0.3 CCOC(=O)C(Cl)C=O SC-14294 [0,2,0,0,0,0|2,0,0]=4 527 B8R0.3 CCOC(=O)C(N)C#N SC-25385 [0,2,0,0,0,0|2,0,0]=4 528 B8R0.3 CCOC(=O)C(N)CC SC-42327 [0,2,0,0,0,0|1,0,0]=3 529 B8R0.3 CCOC(=O)C(N)CN SC-40715 [0,2,0,0,0,0|2,0,0]=4 530 B8R0.3 CCOC(=O)C(N)CS SC-42056 [0,2,0,0,0,0|2,0,0]=4 531 B8R0.3 CCOC(=O)C(O)CC SC-84233 [0,2,0,0,0,0|1,0,0]=3 532 B8R0.3 CCOC(=O)C(O)CCl SC-43823 [0,2,0,0,0,0|2,0,0]=4 533 B8R0.3 CCOC(=O)[C@@H](N)CS SC-09469 [0,2,0,0,0,0|2,0,0]=4 534 B8R0.3 CCOC(=O)[C@H](N)CCl SC-42236 [0,2,0,0,0,0|2,0,0]=4 535 B8R0.3 CCOC(=O)[C@H](N)CO SC-09860 [0,2,0,0,0,0|2,0,0]=4 536 B8R0.3 COC(=O)C(Br)CCBr SC-22210 [0,2,0,0,0,0|1,0,0]=3 537 B8R0.3 COC(=O)C(C)N=C=O SC-09019 [0,2,0,0,0,0|1,0,1]=4 538 B8R0.3 [C@H](N)(CO)C(=O)OCC SC-09861 [0,2,0,0,0,0|2,0,0]=4 539 B8R0.6 CCCSCC(=O)OC SC-44744 [0,2,0,0,0,0|0,0,0]=2 540 B8R0.6 CNCCCC(=O)NC SC-51967 [0,2,0,0,0,0|2,0,0]=4 541 B8R0.6 COC(=O)CCCCBr SC-66180 [0,2,0,0,0,0|1,0,0]=3 542 B8R0.9 COC(=O)CCC(=O)Cl SC-13608 [0,2,0,0,0,0|1,0,1]=4 543 B8R0.9 COC(=O)CCC(C)=O SC-74448 [0,2,0,0,0,0|1,0,0]=3 544 B8R0.9 COC(=O)CCC(N)=O SC-88449 [0,2,0,0,0,0|1,0,1]=4 545 B8R0.9 COC(=O)CCS(=O)[O-] SC-49113 [0,2,0,0,0,0|1,0,1]=4 546 B8R0.9 COC(=O)CNC(C)=O SC-66088 [0,2,0,0,0,0|1,0,0]=3 547 B8R0.9 COC(=O)NCC(=O)O SC-01599 [0,2,0,0,0,0|2,0,0]=4 548 B8R0.25 CCCCP(=O)(Cl)OC SC-51926 [0,2,0,0,0,0|2,0,0]=4 549 B8R0.13 COC(=O)C(C)(C)C#N SC-02973 [0,2,0,0,0,0|2,0,0]=4 550 B8R0.13 COC(=O)C(C)(C)C=O SC-A4659 [0,2,0,0,0,0|2,0,0]=4 551 B8R0.13 COC(=O)C(C)(C)CN SC-01782 [0,2,0,0,0,0|2,0,0]=4 552 B8R0.13 COC(=O)C(C)(C)CO SC-52372 [0,2,0,0,0,0|2,0,0]=4 553 B8R0.13 COC(=O)C(C)(C)NN SC-48978 [0,2,0,0,0,0|2,0,0]=4 554 B8R0.20 COC(=O)C(CBr)CBr SC-45863 [0,2,0,0,0,0|2,0,0]=4 555 B8R0.20 COC(=O)C(OC)OC SC-52858 [0,2,0,0,0,0|0,1,0]=3 556 B6R1.2 CC1=NCCC1 SC-07079 [1,0,0,1,0,0|2,0,0]=4 557 B6R1.2 O=C1C=CCC1 SC-07348 [1,0,0,1,0,0|1,0,1]=4 558 B6R1.2 O=C1C=CCO1 SC-50260 [1,0,0,1,0,0|1,0,1]=4 559 B6R1.2 O=C1CC=CC1 SC-44733 [1,0,0,1,0,0|1,0,1]=4 560 B6R1.2 O=C1CCCN1 SC-85210 [1,0,0,1,0,0|2,0,0]=4 561 B6R1.2 O=C1CCNC1 SC-24328 [1,0,0,1,0,0|1,0,0]=3 562 B6R1.2 O=C1CCNC1 SC-50749 [1,0,0,1,0,0|1,0,0]=3 563 B6R1.2 O=C1CCNN1 SC-21405 [1,0,0,1,0,0|2,0,0]=4 564 B6R1.2 O=C1CCOC1 SC-21867 [1,0,0,1,0,0|0,1,0]=3 565 B6R1.2 OC1CCSC1 SC-53391 [1,0,0,1,0,0|0,0,2]=4 566 B6R1.3 CSCC1CO1 SC-50532 [1,0,0,1,0,0|0,0,2]=4 567 B6R1.5 NC1CC(=O)C1 SC-50311 [1,0,0,1,0,0|2,0,0]=4 568 B6R1.5 NC1CC(=O)C1 SC-67476 [1,0,0,1,0,0|2,0,0]=4 569 B6R1.5 O=C1CC(Br)C1 SC-67930 [1,0,0,1,0,0|2,0,0]=4 570 B6R1.11 CC(=O)C1CO1 SC-70647 [1,0,0,1,0,0|0,1,0]=3 571 B6R1.11 CC(=S)C1CC1 SC-42755 [1,0,0,1,0,0|1,1,0]=4 572 B6R1.11 NC(=O)C1CC1 SC-92415 [1,0,0,1,0,0|2,0,0]=4 573 B6R1.11 O=C(Cl)C1CC1 SC-19263 [1,0,0,1,0,0|2,0,0]=4 574 B6R1.11 O=C(O)C1CC1 SC-22620 [1,0,0,1,0,0|1,0,0]=3 575 B6R1.11 O=C(O)C1CO1 SC-83949 [1,0,0,1,0,0|0,1,0]=3 576 B6R1.11 O=C(O)C1CS1 SC-70775 [1,0,0,1,0,0|0,0,0]=2 577 B6R1.1 C1=CCNCC1 SC-83515 [1,0,0,1,0,0|2,0,0]=4 578 B6R1.1 C1=COCCC1 SC-00342 [1,0,0,1,0,0|1,0,1]=4 579 B6R1.1 C1CCONC1 SC-82296 [1,0,0,1,0,0|2,0,0]=4 580 B6R1.1 C1COCCN1 SC-19184 [1,0,0,1,0,0|1,0,1]=4 581 B6R1.1 C1CSCCS1 SC-49306 [1,0,0,1,0,0|0,1,1]=4 582 B6R1.1 C1CSCSC1 SC-46192 [1,0,0,1,0,0|2,0,0]=4 583 B6R1.6 COC1CNC1 SC-13154 [1,0,0,1,0,0|1,0,1]=4 584 B6R1.6 COC1COC1 SC-52729 [1,0,0,1,0,0|0,1,1]=4 585 B8R1.1 C=CC1COC(=O)O1 SC-15987 [0,1,0,1,0,0|1,0,1]=4 586 B8R1.1 O=C1C=C(CBr)CO1 SC-27326 [0,1,0,1,0,0|1,0,1]=4 587 B8R1.1 O=C1CC(CO)CN1 SC-66045 [0,1,0,1,0,0|2,0,0]=4 588 B8R1.1 O=C1N[C@@H](CO)CO1 SC-33166 [0,1,0,1,0,0|2,0,0]=4 589 B8R1.1 O=C1N[C@H](CO)CO1 SC-33358 [0,1,0,1,0,0|2,0,0]=4 590 B8R1.4 CC1CC(=O)CCN1 SC-14913 [0,1,0,1,0,0|2,0,0]=4 591 B8R1.4 CC1CC(=O)CCN1 SC-26346 [0,1,0,1,0,0|2,0,0]=4 592 B8R1.4 CC1CC(=O)CCO1 SC-43658 [0,1,0,1,0,0|2,0,0]=4 593 B8R1.4 CC1CCCC(=O)N1 SC-90092 [0,1,0,1,0,0|2,0,0]=4 594 B8R1.4 CC1CCNC(=O)C1 SC-65553 [0,1,0,1,0,0|2,0,0]=4 595 B8R1.4 CC1CNCC(=O)N1 SC-68745 [0,1,0,1,0,0|2,0,0]=4 596 B8R1.4 CN1CCCC(=O)C1 SC-88063 [0,1,0,1,0,0|2,0,0]=4 597 B8R1.4 CN1CCNC(=O)C1 SC-43594 [0,1,0,1,0,0|2,0,0]=4 598 B8R1.4 C[C@H]1CCCC(=O)N1 SC-51761 [0,1,0,1,0,0|2,0,0]=4 599 B8R1.4 C[C@H]1COCC(=O)N1 SC-82343 [0,1,0,1,0,0|1,1,0]=4 600 B8R1.4 NC1CCCC(=O)C1 SC-82662 [0,1,0,1,0,0|2,0,0]=4 601 B8R1.4 NC1CCNC(=O)C1 SC-86171 [0,1,0,1,0,0|2,0,0]=4 602 B8R1.4 O=C1CC(O)CCN1 SC-14921 [0,1,0,1,0,0|2,0,0]=4 603 B8R1.4 O=C1CC(O)CCN1 SC-26449 [0,1,0,1,0,0|2,0,0]=4 604 B8R1.4 O=C1CCCC(=O)C1 SC-16085 [0,1,0,1,0,0|2,0,0]=4 605 B8R1.4 O=C1COCC(=O)C1 SC-21917 [0,1,0,1,0,0|2,0,0]=4 606 B8R1.4 O=C1COCC(=O)O1 SC-26890 [0,1,0,1,0,0|0,1,1]=4 607 B8R1.4 O=C1CSCC(=O)C1 SC-21904 [0,1,0,1,0,0|1,0,1]=4 608 B8R1.18 CC1=C(C)OC(=O)O1 SC-03997 [0,1,0,1,0,0|2,0,0]=4 609 B8R1.18 CC1=CC(=O)OC1O SC-47793 [0,1,0,1,0,0|1,0,1]=4 610 B8R1.18 CC1CC(=O)OC1=O SC-97577 [0,1,0,1,0,0|1,0,1]=4 611 B8R1.18 CC1OC(=O)OC1C SC-21491 [0,1,0,1,0,0|2,0,0]=4 612 B8R1.18 CN1CC(N)CC1=O SC-B8397 [0,1,0,1,0,0|2,0,0]=4 613 B8R1.40 COC(=O)CC1CC1 SC-93890 [0,1,0,1,0,0|1,0,0]=3 614 B8R1.51 CC1(C)CNC(=O)C1 SC-70558 [0,1,0,1,0,0|2,0,0]=4 615 B8R1.83 COC(=O)[C@@H]1O[C@H]1C SC-49429 [0,1,0,1,0,0|0,1,0]=3 616 B8R1.2 COC1=CCCCC1 SC-28269 [0,1,0,1,0,0|2,0,0]=4 617 B8R1.2 COC1=NCCCC1 SC-21460 [0,1,0,1,0,0|2,0,0]=4 618 B8R1.2 O=CC1=CCCCC1 SC-49393 [0,1,0,1,0,0|2,0,0]=4 619 B8R1.3 CC1=CCC(=O)CC1 SC-83877 [0,1,0,1,0,0|2,0,0]=4 620 B8R1.3 CC1CCC(=O)CC1 SC-27685 [0,1,0,1,0,0|2,0,0]=4 621 B8R1.3 CN1CCC(=O)CC1 SC-01124 [0,1,0,1,0,0|2,0,0]=4 622 B8R1.3 NC1CCC(=O)CC1 SC-51421 [0,1,0,1,0,0|2,0,0]=4 623 B8R1.3 NC1CCC(=O)CC1 SC-94303 [0,1,0,1,0,0|2,0,0]=4 624 B8R1.3 N[C@H]1CCC(=O)NC1 SC-A3084 [0,1,0,1,0,0|2,0,0]=4 625 B8R1.3 O=C1CCC(Br)CC1 SC-97780 [0,1,0,1,0,0|2,0,0]=4 626 B8R1.3 O=C1CCC(O)CC1 SC-22101 [0,1,0,1,0,0|2,0,0]=4 627 B8R1.3 O=C1CCC(O)CN1 SC-14920 [0,1,0,1,0,0|2,0,0]=4 628 B8R1.3 O=C1CC[C@@H](O)CN1 SC-69872 [0,1,0,1,0,0|2,0,0]=4 629 B8R1.3 O=C1CC[C@H](O)CN1 SC-69873 [0,1,0,1,0,0|2,0,0]=4 630 B8R1.3 O=C1COC(=O)CO1 SC-86894 [0,1,0,1,0,0|0,1,1]=4 631 B8R1.5 CC1CCCCC1=O SC-20428 [0,1,0,1,0,0|2,0,0]=4 632 B8R1.5 CC1CCCNC1=O SC-53234 [0,1,0,1,0,0|2,0,0]=4 633 B8R1.5 CC1CNCCC1=O SC-16093 [0,1,0,1,0,0|2,0,0]=4 634 B8R1.5 CN1CCNCC1=O SC-23480 [0,1,0,1,0,0|2,0,0]=4 635 B8R1.5 C[C@H]1NCCNC1=O SC-05130 [0,1,0,1,0,0|2,0,0]=4 636 B8R1.5 NC1CCCCC1=O SC-22252 [0,1,0,1,0,0|2,0,0]=4 637 B8R1.5 NC1CCCCC1=O SC-45445 [0,1,0,1,0,0|2,0,0]=4 638 B8R1.5 NC1CCCCC1=O SC-84826 [0,1,0,1,0,0|2,0,0]=4 639 B8R1.5 NC1CCCNC1=O SC-14514 [0,1,0,1,0,0|2,0,0]=4 640 B8R1.5 NN1CCCCC1=O SC-21321 [0,1,0,1,0,0|2,0,0]=4 641 B8R1.5 N[C@@H]1CCCNC1=O SC-48796 [0,1,0,1,0,0|2,0,0]=4 642 B8R1.5 N[C@H]1CCCNC1=O SC-14826 [0,1,0,1,0,0|2,0,0]=4 643 B8R1.5 N[C@H]1CCCNC1=O SC-27263 [0,1,0,1,0,0|2,0,0]=4 644 B8R1.5 O=C1CCCCC1=O SC-46435 [0,1,0,1,0,0|2,0,0]=4 645 B8R1.5 O=C1CCCCC1Br SC-86496 [0,1,0,1,0,0|2,0,0]=4 646 B8R1.5 O=C1CCCCC1Cl SC-20977 [0,1,0,1,0,0|2,0,0]=4 647 B8R1.5 O=C1CCCCC1O SC-49144 [0,1,0,1,0,0|2,0,0]=4 648 B8R1.5 O=C1NCCCC1O SC-14922 [0,1,0,1,0,0|2,0,0]=4 649 B8R1.22 O=C1C=CCCCC1 SC-99582 [0,1,0,1,0,0|2,0,0]=4 650 B8R1.22 O=C1CCCNCC1 SC-20974 [0,1,0,1,0,0|2,0,0]=4 651 B8R1.22 O=C1CCNCCN1 SC-05951 [0,1,0,1,0,0|2,0,0]=4 652 B8R1.22 O=C1CCNCCN1 SC-21923 [0,1,0,1,0,0|2,0,0]=4 653 B8R1.22 O=C1CNCCCN1 SC-21981 [0,1,0,1,0,0|2,0,0]=4 654 B8R1.38 COC(=O)C1CCC1 SC-53197 [0,1,0,1,0,0|1,0,0]=3 655 B8R1.38 COC(=O)C1CCN1 SC-65847 [0,1,0,1,0,0|1,0,0]=3 656 B8R1.38 COC(=O)C1CNC1 SC-12674 [0,1,0,1,0,0|1,0,0]=3 657 B8R1.38 COC(=O)C1CNC1 SC-12778 [0,1,0,1,0,0|1,0,0]=3 658 B8R1.50 CN1C(=O)CCC1O SC-88414 [0,1,0,1,0,0|2,0,0]=4 659 B8R1.50 CN1C(=O)CSC1=S SC-49581 [0,1,0,1,0,0|1,0,1]=4 660 B8R1.19 CC1(C)CCCC1=O SC-65127 [0,1,0,1,0,0|2,0,0]=4 661 B8R1.37 CCOC(=N)C1CC1 SC-12466 [0,1,0,1,0,0|2,0,0]=4 662 B8R1.37 CCOC(=N)C1CC1 SC-67732 [0,1,0,1,0,0|2,0,0]=4 663 B8R1.37 CCOC(=O)C1CC1 SC-27163 [0,1,0,1,0,0|1,0,0]=3 664 B8R1.37 CCOC(=O)C1CO1 SC-74138 [0,1,0,1,0,0|0,1,0]=3 665 B8R1.54 CC(Br)C(=O)C1CC1 SC-B7707 [0,1,0,1,0,0|2,0,0]=4 666 B8R1.11 O=C1CCCN1CBr SC-45741 [0,1,0,1,0,0|2,0,0]=4 667 B8R1.11 O=C1CCCN1CCl SC-61208 [0,1,0,1,0,0|2,0,0]=4 668 B8R1.39 COC(=O)C1(C)CC1 SC-94041 [0,1,0,1,0,0|1,0,0]=3 669 B8R1.39 COC(=O)C1(C)CO1 SC-90627 [0,1,0,1,0,0|0,1,0]=3 670 B8R1.39 COC(=O)C1(N)CC1 SC-27643 [0,1,0,1,0,0|1,0,0]=3 671 B8R1.39 COC(=O)C1(N)CC1 SC-47489 [0,1,0,1,0,0|1,0,0]=3 672 B8R1.39 COC(=O)C1(O)CC1 SC-52477 [0,1,0,1,0,0|1,0,0]=3 673 B8R1.72 O=S1(=O)CCCCO1 SC-15335 [0,1,0,1,0,0|2,0,0]=4