0 B5R0.3 C#CC(O)CC SC-68723 [0,0,0,0,0,0|2,0,1]=3 1 B5R0.3 C=CC(Cl)CCl SC-A3373 [0,0,0,0,0,0|3,0,0]=3 2 B5R0.3 C=CC(O)C=C SC-20854 [0,0,0,0,0,0|2,0,2]=4 3 B5R0.3 C=CC(O)CBr SC-69913 [0,0,0,0,0,0|3,0,0]=3 4 B5R0.3 C=CC(O)CC SC-93539 [0,0,0,0,0,0|2,0,0]=2 5 B5R0.3 C=C[C@H](N)CO SC-88199 [0,0,0,0,0,0|3,0,0]=3 6 B5R0.3 CC(CCl)CBr SC-62287 [0,0,0,0,0,0|2,0,1]=3 7 B5R0.3 CC(CN)CCl SC-40011 [0,0,0,0,0,0|2,0,1]=3 8 B5R0.3 CC(CN)CN SC-50225 [0,0,0,0,0,0|2,0,1]=3 9 B5R0.3 CC(CO)CBr SC-35572 [0,0,0,0,0,0|1,0,2]=3 10 B5R0.3 CC(CO)CO SC-20510 [0,0,0,0,0,0|1,0,2]=3 11 B5R0.3 CCC(=O)CN SC-94912 [0,0,0,0,0,0|2,0,2]=4 12 B5R0.3 CCC(=O)NN SC-25039 [0,0,0,0,0,0|3,0,1]=4 13 B5R0.3 CCC(Br)CC SC-71668 [0,0,0,0,0,0|2,0,1]=3 14 B5R0.3 CCC(C)CO SC-08990 [0,0,0,0,0,0|0,0,2]=2 15 B5R0.3 CCC(C)NN SC-A5169 [0,0,0,0,0,0|2,0,0]=2 16 B5R0.3 CCC(N)C#N SC-20770 [0,0,0,0,0,0|2,0,1]=3 17 B5R0.3 CCC(N)C#N SC-70455 [0,0,0,0,0,0|2,0,1]=3 18 B5R0.3 CCC(N)CO SC-21072 [0,0,0,0,0,0|1,0,2]=3 19 B5R0.3 CCC(O)CC SC-62307 [0,0,0,0,0,0|2,0,1]=3 20 B5R0.3 CCC(O)CN SC-40219 [0,0,0,0,0,0|2,0,1]=3 21 B5R0.3 CCC(O)OC SC-25588 [0,0,0,0,0,0|3,0,0]=3 22 B5R0.3 CC[C@@H](N)CO SC-08957 [0,0,0,0,0,0|1,0,2]=3 23 B5R0.3 CC[PH](=O)CC SC-96905 [0,0,0,0,0,0|3,0,1]=4 24 B5R0.3 COC(C)CN SC-A4864 [0,0,0,0,0,0|2,0,1]=3 25 B5R0.3 COC(C)CO SC-97662 [0,0,0,0,0,0|1,0,2]=3 26 B5R0.3 CO[C@H](C)CO SC-71357 [0,0,0,0,0,0|1,0,2]=3 27 B5R0.3 C[C@@H](CO)CBr SC-82168 [0,0,0,0,0,0|1,0,2]=3 28 B5R0.3 NCC(Br)CBr SC-40146 [0,0,0,0,0,0|3,0,1]=4 29 B5R0.3 NCC(Cl)CCl SC-40268 [0,0,0,0,0,0|3,0,1]=4 30 B5R0.3 NCC(O)CO SC-15511 [0,0,0,0,0,0|2,0,2]=4 31 B5R0.3 NC[C@@H](O)CO SC-06146 [0,0,0,0,0,0|2,0,2]=4 32 B5R0.3 NC[C@H](O)CCl SC-89081 [0,0,0,0,0,0|3,0,1]=4 33 B5R0.3 NC[C@H](O)CO SC-45873 [0,0,0,0,0,0|2,0,2]=4 34 B5R0.3 O=CC(Br)C=O SC-24696 [0,0,0,0,0,0|2,0,1]=3 35 B5R0.3 O=CC(Cl)C=O SC-43728 [0,0,0,0,0,0|2,0,1]=3 36 B5R0.3 O=CC(O)CO SC-54496 [0,0,0,0,0,0|2,0,0]=2 37 B5R0.3 [C@H](N)(CC)CO SC-08958 [0,0,0,0,0,0|1,0,2]=3 38 B5R0.3 [C@H](O)(CN)CO SC-05739 [0,0,0,0,0,0|2,0,2]=4 39 B4R0.1 C#CC(C)=O SC-77912 [1,0,0,0,0,0|0,0,3]=4 40 B4R0.1 C#CC(C)N SC-52789 [1,0,0,0,0,0|1,0,2]=4 41 B4R0.1 C#CC(C)N SC-A2988 [1,0,0,0,0,0|1,0,2]=4 42 B4R0.1 C#CC(C)O SC-26644 [1,0,0,0,0,0|0,0,3]=4 43 B4R0.1 C=C(Br)CO SC-82232 [1,0,0,0,0,0|2,0,1]=4 44 B4R0.1 C=C(C)CBr SC-50158 [1,0,0,0,0,0|1,0,1]=3 45 B4R0.1 C=C(C)CF SC-89300 [1,0,0,0,0,0|1,0,1]=3 46 B4R0.1 C=C(C)CN SC-43404 [1,0,0,0,0,0|1,0,1]=3 47 B4R0.1 C=C(C)CN SC-84159 [1,0,0,0,0,0|1,0,1]=3 48 B4R0.1 C=C(N)OC SC-01201 [1,0,0,0,0,0|2,0,1]=4 49 B4R0.1 C=CC(C)Cl SC-53817 [1,0,0,0,0,0|2,0,0]=3 50 B4R0.1 C=CC(C)O SC-43661 [1,0,0,0,0,0|2,0,0]=3 51 B4R0.1 C=C[C@H](C)N SC-67439 [1,0,0,0,0,0|2,0,0]=3 52 B4R0.1 CC(=O)CN SC-28532 [1,0,0,0,0,0|1,0,1]=3 53 B4R0.1 CC(=O)CN SC-89750 [1,0,0,0,0,0|1,0,1]=3 54 B4R0.1 CC(=O)NO SC-18498 [1,0,0,0,0,0|2,0,1]=4 55 B4R0.1 CC(Br)C#N SC-48220 [1,0,0,0,0,0|2,0,1]=4 56 B4R0.1 CC(Br)CO SC-A3571 [1,0,0,0,0,0|2,0,0]=3 57 B4R0.1 CC(C)=CBr SC-52196 [1,0,0,0,0,0|1,0,1]=3 58 B4R0.1 CC(C)=C[Mg+] SC-73153 [1,0,0,0,0,0|1,0,1]=3 59 B4R0.1 CC(C)C[Mg+] SC-69019 [1,0,0,0,0,0|1,0,1]=3 60 B4R0.1 CC(C)NN SC-21077 [1,0,0,0,0,0|2,0,0]=3 61 B4R0.1 CC(C)NN SC-73657 [1,0,0,0,0,0|2,0,0]=3 62 B4R0.1 CC(C)NO SC-A3794 [1,0,0,0,0,0|1,0,1]=3 63 B4R0.1 CC(C)ON SC-87607 [1,0,0,0,0,0|2,0,0]=3 64 B4R0.1 CC(Cl)C#N SC-53702 [1,0,0,0,0,0|2,0,1]=4 65 B4R0.1 CC(Cl)CN SC-40273 [1,0,0,0,0,0|2,0,0]=3 66 B4R0.1 CC(N)C#N SC-92053 [1,0,0,0,0,0|2,0,1]=4 67 B4R0.1 CC(N)CO SC-18397 [1,0,0,0,0,0|2,0,0]=3 68 B4R0.1 CC(O)CCl SC-79372 [1,0,0,0,0,0|1,0,1]=3 69 B4R0.1 CC(S)CS SC-A2768 [1,0,0,0,0,0|1,1,0]=3 70 B4R0.1 CCB(O)O SC-04516 [1,0,0,0,0,0|2,0,1]=4 71 B4R0.1 CCC(=N)N SC-39291 [1,0,0,0,0,0|2,0,1]=4 72 B4R0.1 CCC(=N)N SC-53846 [1,0,0,0,0,0|2,0,1]=4 73 B4R0.1 CCC(=O)[O-] SC-47286 [1,0,0,0,0,0|1,0,1]=3 74 B4R0.1 CCC(C)O SC-01234 [1,0,0,0,0,0|0,0,1]=2 75 B4R0.1 CCC(N)=O SC-18213 [1,0,0,0,0,0|1,0,1]=3 76 B4R0.1 CCN(C)N SC-A4596 [1,0,0,0,0,0|2,0,0]=3 77 B4R0.1 CCS(=O)[O-] SC-20356 [1,0,0,0,0,0|2,0,0]=3 78 B4R0.1 CC[C@H](C)N SC-81828 [1,0,0,0,0,0|1,0,0]=2 79 B4R0.1 CC[C@H](C)N SC-A5647 [1,0,0,0,0,0|1,0,0]=2 80 B4R0.1 CC[C@H](C)O SC-04418 [1,0,0,0,0,0|0,0,1]=2 81 B4R0.1 CNC(C)C SC-04732 [1,0,0,0,0,0|1,0,1]=3 82 B4R0.1 CNN(C)C SC-41461 [1,0,0,0,0,0|2,0,1]=4 83 B4R0.1 COC(Cl)Cl SC-04782 [1,0,0,0,0,0|3,0,0]=4 84 B4R0.1 CS[S+](C)C SC-09173 [1,0,0,0,0,0|2,0,1]=4 85 B4R0.1 C[C@@H](N)CN SC-08946 [1,0,0,0,0,0|2,0,0]=3 86 B4R0.1 C[C@@H](O)CN SC-03087 [1,0,0,0,0,0|1,0,1]=3 87 B4R0.1 C[C@H](Cl)CO SC-98590 [1,0,0,0,0,0|2,0,0]=3 88 B4R0.1 C[C@H](N)C#N SC-A5839 [1,0,0,0,0,0|2,0,1]=4 89 B4R0.1 C[C@H](N)CN SC-08947 [1,0,0,0,0,0|2,0,0]=3 90 B4R0.1 C[C@H](O)CCl SC-99597 [1,0,0,0,0,0|1,0,1]=3 91 B4R0.1 C[C@H](O)CN SC-03088 [1,0,0,0,0,0|1,0,1]=3 92 B4R0.1 C[C@H](O)CO SC-04434 [1,0,0,0,0,0|1,0,1]=3 93 B4R0.1 C\C=C(\C)Br SC-91379 [1,0,0,0,0,0|1,0,2]=4 94 B4R0.1 FC(F)CBr SC-21856 [1,0,0,0,0,0|3,0,0]=4 95 B4R0.1 FC(F)CI SC-82530 [1,0,0,0,0,0|3,0,0]=4 96 B4R0.1 NC(=O)CBr SC-17752 [1,0,0,0,0,0|2,0,1]=4 97 B4R0.1 NC(=O)CI SC-18913 [1,0,0,0,0,0|2,0,1]=4 98 B4R0.1 NC(=O)CO SC-26304 [1,0,0,0,0,0|2,0,1]=4 99 B4R0.1 NCC(=O)O SC-26815 [1,0,0,0,0,0|2,0,1]=4 100 B4R0.1 NCC(=O)O SC-26884 [1,0,0,0,0,0|2,0,1]=4 101 B4R0.1 NCC(Br)Br SC-40061 [1,0,0,0,0,0|3,0,0]=4 102 B4R0.1 NCC(Cl)Cl SC-40282 [1,0,0,0,0,0|3,0,0]=4 103 B4R0.1 NCC(F)F SC-43926 [1,0,0,0,0,0|3,0,0]=4 104 B4R0.1 NCC(N)=O SC-18427 [1,0,0,0,0,0|2,0,1]=4 105 B4R0.1 O=C(Cl)CBr SC-49267 [1,0,0,0,0,0|2,0,1]=4 106 B4R0.1 O=C(O)CBr SC-18211 [1,0,0,0,0,0|2,0,1]=4 107 B4R0.1 O=C(O)CI SC-57980 [1,0,0,0,0,0|2,0,1]=4 108 B4R0.1 O=C(O)CO SC-26092 [1,0,0,0,0,0|2,0,1]=4 109 B4R0.1 O=C(O)CO SC-85771 [1,0,0,0,0,0|2,0,1]=4 110 B4R0.1 O=C(O)CS SC-18319 [1,0,0,0,0,0|2,0,1]=4 111 B4R0.1 O=C([O-])CBr SC-50549 [1,0,0,0,0,0|2,0,1]=4 112 B4R0.1 O=C([O-])CI SC-80290 [1,0,0,0,0,0|2,0,1]=4 113 B4R0.1 O=C([O-])CO SC-89096 [1,0,0,0,0,0|2,0,1]=4 114 B4R0.1 O=CC(=O)O SC-18712 [1,0,0,0,0,0|2,0,1]=4 115 B4R0.1 O=CC(=O)O SC-25819 [1,0,0,0,0,0|2,0,1]=4 116 B4R0.1 OCC(F)F SC-16815 [1,0,0,0,0,0|3,0,0]=4 117 B4R0.1 [C@@H](C)(O)C#C SC-47963 [1,0,0,0,0,0|0,0,3]=4 118 B4R0.1 [C@H](C)(O)C#C SC-47962 [1,0,0,0,0,0|0,0,3]=4 119 B4R0.2 BrCCCBr SC-79111 [1,0,0,0,0,0|2,0,1]=4 120 B4R0.2 C#CCCBr SC-52138 [1,0,0,0,0,0|2,0,1]=4 121 B4R0.2 C#CCCN SC-49547 [1,0,0,0,0,0|2,0,1]=4 122 B4R0.2 C#CCCN SC-86906 [1,0,0,0,0,0|2,0,1]=4 123 B4R0.2 C#CCCO SC-17773 [1,0,0,0,0,0|2,0,1]=4 124 B4R0.2 C#CCNC SC-87202 [1,0,0,0,0,0|2,0,1]=4 125 B4R0.2 C#COCC SC-26434 [1,0,0,0,0,0|2,0,1]=4 126 B4R0.2 C=CCCBr SC-17888 [1,0,0,0,0,0|2,0,0]=3 127 B4R0.2 C=CCCCl SC-90795 [1,0,0,0,0,0|2,0,0]=3 128 B4R0.2 C=CCCI SC-35810 [1,0,0,0,0,0|2,0,0]=3 129 B4R0.2 C=CCCN SC-48242 [1,0,0,0,0,0|2,0,0]=3 130 B4R0.2 C=CCCN SC-52106 [1,0,0,0,0,0|2,0,0]=3 131 B4R0.2 C=CCCO SC-45284 [1,0,0,0,0,0|2,0,0]=3 132 B4R0.2 C=CCNC SC-05902 [1,0,0,0,0,0|2,0,0]=3 133 B4R0.2 C=CCNN SC-54870 [1,0,0,0,0,0|3,0,0]=4 134 B4R0.2 C=CCOC SC-62245 [1,0,0,0,0,0|2,0,0]=3 135 B4R0.2 C=CCON SC-96333 [1,0,0,0,0,0|3,0,0]=4 136 B4R0.2 C=CCSC SC-47211 [1,0,0,0,0,0|2,0,0]=3 137 B4R0.2 C=COCC SC-22606 [1,0,0,0,0,0|2,0,0]=3 138 B4R0.2 CCCCBr SC-00326 [1,0,0,0,0,0|1,0,1]=3 139 B4R0.2 CCCCI SC-05211 [1,0,0,0,0,0|1,0,1]=3 140 B4R0.2 CCCC[O-] SC-22164 [1,0,0,0,0,0|0,0,2]=3 141 B4R0.2 CCCNC SC-27548 [1,0,0,0,0,0|2,0,0]=3 142 B4R0.2 CCCNN SC-66226 [1,0,0,0,0,0|2,0,0]=3 143 B4R0.2 CCCNN SC-88572 [1,0,0,0,0,0|2,0,0]=3 144 B4R0.2 CCCNN SC-A5919 [1,0,0,0,0,0|2,0,0]=3 145 B4R0.2 CCCSC SC-88233 [1,0,0,0,0,0|2,0,0]=3 146 B4R0.2 CCN=C=O SC-11793 [1,0,0,0,0,0|1,0,1]=3 147 B4R0.2 CCOC=N SC-52423 [1,0,0,0,0,0|2,0,0]=3 148 B4R0.2 CCOCC SC-73354 [1,0,0,0,0,0|2,0,1]=4 149 B4R0.2 CC[NH2+]CC SC-20006 [1,0,0,0,0,0|2,0,1]=4 150 B4R0.2 CNCC#N SC-13788 [1,0,0,0,0,0|2,0,1]=4 151 B4R0.2 CNCCBr SC-98001 [1,0,0,0,0,0|2,0,1]=4 152 B4R0.2 CNCCO SC-26626 [1,0,0,0,0,0|1,0,2]=4 153 B4R0.2 COCC=O SC-48883 [1,0,0,0,0,0|1,0,0]=2 154 B4R0.2 COCCCl SC-05903 [1,0,0,0,0,0|2,0,1]=4 155 B4R0.2 COCCN SC-22236 [1,0,0,0,0,0|2,0,1]=4 156 B4R0.2 COCC[O-] SC-21117 [1,0,0,0,0,0|1,0,2]=4 157 B4R0.2 COCC[O-] SC-67452 [1,0,0,0,0,0|1,0,2]=4 158 B4R0.2 CSCCCl SC-53991 [1,0,0,0,0,0|2,0,1]=4 159 B4R0.2 CSCCN SC-28443 [1,0,0,0,0,0|2,0,1]=4 160 B4R0.2 CSCCN SC-40144 [1,0,0,0,0,0|2,0,1]=4 161 B4R0.2 CSCCN SC-83550 [1,0,0,0,0,0|2,0,1]=4 162 B4R0.2 CSCCO SC-19276 [1,0,0,0,0,0|1,0,2]=4 163 B4R0.2 C[SH+]CCCl SC-53966 [1,0,0,0,0,0|2,0,1]=4 164 B4R0.2 C\C=C/CO SC-69832 [1,0,0,0,0,0|2,0,1]=4 165 B4R0.2 C\C=C\CO SC-25521 [1,0,0,0,0,0|2,0,1]=4 166 B4R0.2 C\C=C\CO SC-69597 [1,0,0,0,0,0|2,0,1]=4 167 B4R0.2 C\C=C\OC SC-97407 [1,0,0,0,0,0|2,0,1]=4 168 B4R0.2 ClCCCBr SC-19098 [1,0,0,0,0,0|2,0,1]=4 169 B4R0.2 ClCCCI SC-73683 [1,0,0,0,0,0|2,0,1]=4 170 B4R0.2 Cl\C=C\CCl SC-17396 [1,0,0,0,0,0|2,0,1]=4 171 B4R0.2 FCCCBr SC-49851 [1,0,0,0,0,0|2,0,1]=4 172 B4R0.2 FCCCF SC-62358 [1,0,0,0,0,0|2,0,1]=4 173 B4R0.2 FCCCI SC-84350 [1,0,0,0,0,0|2,0,1]=4 174 B4R0.2 ICCCI SC-89448 [1,0,0,0,0,0|2,0,1]=4 175 B4R0.2 N#CCCBr SC-46247 [1,0,0,0,0,0|2,0,1]=4 176 B4R0.2 N#CCCN SC-15686 [1,0,0,0,0,0|2,0,1]=4 177 B4R0.2 N#CCCS SC-66276 [1,0,0,0,0,0|2,0,1]=4 178 B4R0.2 NCCCBr SC-39593 [1,0,0,0,0,0|2,0,1]=4 179 B4R0.2 NCCCBr SC-48386 [1,0,0,0,0,0|2,0,1]=4 180 B4R0.2 NCCCCl SC-40009 [1,0,0,0,0,0|2,0,1]=4 181 B4R0.2 NCCCN SC-16220 [1,0,0,0,0,0|2,0,1]=4 182 B4R0.2 NCCCS SC-52748 [1,0,0,0,0,0|1,1,1]=4 183 B4R0.2 NNCCO SC-15469 [1,0,0,0,0,0|3,0,0]=4 184 B4R0.2 NOCCO SC-41192 [1,0,0,0,0,0|3,0,0]=4 185 B4R0.2 O=CCCCl SC-71322 [1,0,0,0,0,0|1,0,0]=2 186 B4R0.2 O=CCCO SC-52939 [1,0,0,0,0,0|1,0,0]=2 187 B4R0.2 O=C[N-]C=O SC-93635 [1,0,0,0,0,0|2,0,1]=4 188 B4R0.2 OCCCBr SC-13514 [1,0,0,0,0,0|1,0,2]=4 189 B4R0.2 OCCCCl SC-15525 [1,0,0,0,0,0|1,0,2]=4 190 B4R0.2 OCCCF SC-24862 [1,0,0,0,0,0|1,0,2]=4 191 B4R0.2 OCCCI SC-65803 [1,0,0,0,0,0|1,0,2]=4 192 B4R0.2 OCCCS SC-96391 [1,0,0,0,0,0|1,0,2]=4 193 B4R0.2 SCCCS SC-17571 [1,0,0,0,0,0|1,1,1]=4 194 B6R0.1 C=CC[C@@H](O)CCl SC-30233 [0,1,0,0,0,0|3,0,0]=4 195 B6R0.1 C=CC[C@H](O)CCl SC-31067 [0,1,0,0,0,0|3,0,0]=4 196 B6R0.1 CCC(O)COC SC-95930 [0,1,0,0,0,0|1,0,2]=4 197 B6R0.1 CCCC(Br)CC SC-87780 [0,1,0,0,0,0|2,0,1]=4 198 B6R0.1 CCCC(C)NN SC-38965 [0,1,0,0,0,0|2,0,0]=3 199 B6R0.1 CCCC(O)CN SC-35839 [0,1,0,0,0,0|2,0,1]=4 200 B6R0.1 CCNC(C)CN SC-29669 [0,1,0,0,0,0|1,0,1]=3 201 B6R0.1 CCOC(=O)C=O SC-25704 [0,1,0,0,0,0|1,0,1]=3 202 B6R0.1 CC[C@@H](N)COC SC-48788 [0,1,0,0,0,0|1,0,2]=4 203 B6R0.1 CC[C@@H](N)COC SC-65714 [0,1,0,0,0,0|1,0,2]=4 204 B6R0.1 CC[C@H](N)COC SC-48789 [0,1,0,0,0,0|1,0,2]=4 205 B6R0.1 CC[C@H](N)COC SC-89974 [0,1,0,0,0,0|1,0,2]=4 206 B6R0.1 CN(CO)CCO SC-42099 [0,1,0,0,0,0|1,0,2]=4 207 B6R0.1 COC(=O)CC=O SC-53143 [0,1,0,0,0,0|2,0,1]=4 208 B6R0.1 CSCC(C)NN SC-14209 [0,1,0,0,0,0|2,0,0]=3 209 B6R0.1 CSCC(N)CO SC-69757 [0,1,0,0,0,0|1,0,2]=4 210 B6R0.1 OCCC(O)CO SC-15322 [0,1,0,0,0,0|1,0,2]=4 211 B6R0.3 C=C(CBr)C(=O)O SC-94127 [0,1,0,0,0,0|1,0,2]=4 212 B6R0.3 C=C(I)[C@H](C)CI SC-68491 [0,1,0,0,0,0|2,0,0]=3 213 B6R0.3 C=CC(C)C(=O)O SC-65769 [0,1,0,0,0,0|0,0,2]=3 214 B6R0.3 C=CC(N)C(=O)O SC-83691 [0,1,0,0,0,0|1,0,2]=4 215 B6R0.3 C=CN(C)C(C)=O SC-24783 [0,1,0,0,0,0|1,0,2]=4 216 B6R0.3 C=C[C@H](N)C(=O)O SC-99216 [0,1,0,0,0,0|1,0,2]=4 217 B6R0.3 CC(=O)C(=O)CBr SC-66140 [0,1,0,0,0,0|2,0,1]=4 218 B6R0.3 CC(C#N)C(=O)O SC-65741 [0,1,0,0,0,0|1,0,1]=3 219 B6R0.3 CC(C)C(C)NN SC-41530 [0,1,0,0,0,0|2,0,0]=3 220 B6R0.3 CC(C)C(O)CN SC-34918 [0,1,0,0,0,0|2,0,1]=4 221 B6R0.3 CC(C)C(O)CN SC-A3273 [0,1,0,0,0,0|2,0,1]=4 222 B6R0.3 CC(C)C(O)CN SC-A3426 [0,1,0,0,0,0|2,0,1]=4 223 B6R0.3 CC(C)[C@@H](N)CO SC-04448 [0,1,0,0,0,0|1,0,2]=4 224 B6R0.3 CC(C)[C@H](N)CO SC-02242 [0,1,0,0,0,0|1,0,2]=4 225 B6R0.3 CC(CBr)C(=O)O SC-53016 [0,1,0,0,0,0|1,0,0]=2 226 B6R0.3 CC(CN)C(=O)O SC-10095 [0,1,0,0,0,0|1,0,0]=2 227 B6R0.3 CC(CN)C(=O)O SC-16443 [0,1,0,0,0,0|1,0,0]=2 228 B6R0.3 CC(CN)N(C)C SC-29496 [0,1,0,0,0,0|2,0,1]=4 229 B6R0.3 CCC(=O)C(=O)O SC-48634 [0,1,0,0,0,0|1,0,1]=3 230 B6R0.3 CCC(C)C(=N)N SC-40567 [0,1,0,0,0,0|1,0,0]=2 231 B6R0.3 CCC(C)C(=O)O SC-22738 [0,1,0,0,0,0|0,0,0]=1 232 B6R0.3 CCC(Cl)C(=O)O SC-96228 [0,1,0,0,0,0|1,0,0]=2 233 B6R0.3 CCC(N)C(=O)O SC-25570 [0,1,0,0,0,0|1,0,0]=2 234 B6R0.3 CCC(N)C(N)=O SC-67619 [0,1,0,0,0,0|1,0,0]=2 235 B6R0.3 CCC(O)C(=N)N SC-41904 [0,1,0,0,0,0|2,0,0]=3 236 B6R0.3 CCC(S)C(=O)O SC-90417 [0,1,0,0,0,0|1,0,0]=2 237 B6R0.3 CCN(C)C(=O)Cl SC-18616 [0,1,0,0,0,0|1,0,0]=2 238 B6R0.3 CCN(C)C(C)=O SC-A3863 [0,1,0,0,0,0|1,0,0]=2 239 B6R0.3 CCN(O)C(C)=O SC-69302 [0,1,0,0,0,0|2,0,0]=3 240 B6R0.3 CC[C@@H](C)C(=O)O SC-92309 [0,1,0,0,0,0|0,0,0]=1 241 B6R0.3 CC[C@@H](Cl)C(=O)O SC-52915 [0,1,0,0,0,0|1,0,0]=2 242 B6R0.3 CC[C@@H](N)C(=O)O SC-10051 [0,1,0,0,0,0|1,0,0]=2 243 B6R0.3 CC[C@@H](O)C(=O)O SC-53865 [0,1,0,0,0,0|1,0,0]=2 244 B6R0.3 CC[C@H](N)C(=O)O SC-10052 [0,1,0,0,0,0|1,0,0]=2 245 B6R0.3 CC[C@H](N)C(N)=O SC-15825 [0,1,0,0,0,0|1,0,0]=2 246 B6R0.3 CC[C@H](O)C(=O)O SC-06416 [0,1,0,0,0,0|1,0,0]=2 247 B6R0.3 CN(N=O)C(N)=O SC-19817 [0,1,0,0,0,0|3,0,0]=4 248 B6R0.3 CN[C@H](C)C(=O)O SC-45134 [0,1,0,0,0,0|1,0,0]=2 249 B6R0.3 COC(=O)C(=O)Cl SC-27409 [0,1,0,0,0,0|2,0,1]=4 250 B6R0.3 COC(C)C(=O)O SC-49776 [0,1,0,0,0,0|1,0,0]=2 251 B6R0.3 COC(C)[C@@H](C)N SC-A2593 [0,1,0,0,0,0|2,0,0]=3 252 B6R0.3 CON(C)C(C)=O SC-20924 [0,1,0,0,0,0|2,0,0]=3 253 B6R0.3 CO[C@@H](C)C(=O)O SC-89341 [0,1,0,0,0,0|1,0,0]=2 254 B6R0.3 CO[C@H](C)C(=O)O SC-A3340 [0,1,0,0,0,0|1,0,0]=2 255 B6R0.3 C[C@@H](CN)C(=O)O SC-69436 [0,1,0,0,0,0|1,0,0]=2 256 B6R0.3 C[C@H](CN)C(=O)O SC-90232 [0,1,0,0,0,0|1,0,0]=2 257 B6R0.3 C[C@H](CN)C(=O)O SC-A1203 [0,1,0,0,0,0|1,0,0]=2 258 B6R0.3 C[C@H](O)[C@@H](N)CO SC-54023 [0,1,0,0,0,0|1,0,2]=4 259 B6R0.3 N#CC(N)C(N)=O SC-12334 [0,1,0,0,0,0|2,0,1]=4 260 B6R0.3 NC(=O)C(N)CO SC-53653 [0,1,0,0,0,0|2,0,0]=3 261 B6R0.3 NC(=O)[C@@H](N)CO SC-09855 [0,1,0,0,0,0|2,0,0]=3 262 B6R0.3 NC(CO)C(=O)O SC-09828 [0,1,0,0,0,0|2,0,0]=3 263 B6R0.3 NC(CS)C(=O)O SC-09428 [0,1,0,0,0,0|2,0,0]=3 264 B6R0.3 NCC(N)C(=O)O SC-12518 [0,1,0,0,0,0|2,0,0]=3 265 B6R0.3 NCC(O)C(=O)O SC-10335 [0,1,0,0,0,0|2,0,0]=3 266 B6R0.3 NC[C@@H](N)C(=O)O SC-10203 [0,1,0,0,0,0|2,0,0]=3 267 B6R0.3 NC[C@@H](O)C(=O)O SC-17253 [0,1,0,0,0,0|2,0,0]=3 268 B6R0.3 NC[C@H](N)C(=O)O SC-10204 [0,1,0,0,0,0|2,0,0]=3 269 B6R0.3 N[C@@H](CCl)C(=O)O SC-21241 [0,1,0,0,0,0|2,0,0]=3 270 B6R0.3 N[C@@H](CO)C(=O)O SC-09827 [0,1,0,0,0,0|2,0,0]=3 271 B6R0.3 N[C@@H](CS)C(=O)O SC-09426 [0,1,0,0,0,0|2,0,0]=3 272 B6R0.3 N[C@@H](CS)C(=O)O SC-45550 [0,1,0,0,0,0|2,0,0]=3 273 B6R0.3 O=C(O)C(=O)CBr SC-15238 [0,1,0,0,0,0|2,0,1]=4 274 B6R0.3 O=C(O)C(O)CCl SC-83865 [0,1,0,0,0,0|2,0,0]=3 275 B6R0.3 O=C(O)C(O)CO SC-94999 [0,1,0,0,0,0|2,0,0]=3 276 B6R0.3 O=C(O)[C@@H](O)CCl SC-86856 [0,1,0,0,0,0|2,0,0]=3 277 B6R0.3 [C@@H](N)(CC)C(N)=O SC-49088 [0,1,0,0,0,0|1,0,0]=2 278 B6R0.3 [C@@H](N)(CS)C(=O)O SC-09427 [0,1,0,0,0,0|2,0,0]=3 279 B6R0.8 C#CC(C)(O)C=C SC-17989 [0,1,0,0,0,0|1,0,2]=4 280 B6R0.8 CC(C)(CN)CO SC-65465 [0,1,0,0,0,0|1,0,2]=4 281 B6R0.8 CC(C)(CO)CBr SC-92906 [0,1,0,0,0,0|1,0,2]=4 282 B6R0.8 CC(N)(CO)CO SC-44686 [0,1,0,0,0,0|1,0,2]=4 283 B6R0.8 CCC(C)(C)NC SC-88210 [0,1,0,0,0,0|2,0,0]=3 284 B6R0.8 CCC(C)(N)C#N SC-89513 [0,1,0,0,0,0|1,0,1]=3 285 B6R0.8 COC(C)(C)CBr SC-48585 [0,1,0,0,0,0|2,0,1]=4 286 B6R0.8 COC(C)(C)CN SC-47790 [0,1,0,0,0,0|2,0,1]=4 287 B6R0.8 COC(C)(C)CN SC-A5424 [0,1,0,0,0,0|2,0,1]=4 288 B6R0.8 COC(C)(C)CO SC-90238 [0,1,0,0,0,0|1,0,2]=4 289 B6R0.8 [C-]#[N+]C(C)(C)CC SC-92914 [0,1,0,0,0,0|2,0,0]=3 290 B6R0.9 C=CC(OC)OC SC-27140 [0,1,0,0,0,0|2,0,0]=3 291 B6R0.9 CCB(CC)OC SC-22792 [0,1,0,0,0,0|2,0,1]=4 292 B6R0.9 CCC(CC)CI SC-66031 [0,1,0,0,0,0|1,0,1]=3 293 B6R0.9 CCC(CC)NN SC-38843 [0,1,0,0,0,0|2,0,0]=3 294 B6R0.9 CCC(CN)OC SC-48021 [0,1,0,0,0,0|1,0,1]=3 295 B6R0.9 CCC(OC)OC SC-85699 [0,1,0,0,0,0|2,0,0]=3 296 B6R0.9 CCN(CC)CC SC-65212 [0,1,0,0,0,0|2,0,1]=4 297 B6R0.9 CC[BH-](CC)CC SC-95040 [0,1,0,0,0,0|2,0,1]=4 298 B6R0.9 CC[O+](CC)CC SC-03905 [0,1,0,0,0,0|2,0,1]=4 299 B6R0.9 CC[SiH](CC)CC SC-15975 [0,1,0,0,0,0|1,1,1]=4 300 B6R0.9 COC(C=O)OC SC-26054 [0,1,0,0,0,0|1,0,0]=2 301 B6R0.9 COC(CBr)OC SC-25586 [0,1,0,0,0,0|2,0,1]=4 302 B6R0.9 COC(CO)OC SC-71481 [0,1,0,0,0,0|1,0,2]=4 303 B6R0.9 C\C=C(\C=O)CC SC-95172 [0,1,0,0,0,0|0,0,1]=2 304 B6R0.9 O=CC(C=O)C=O SC-26200 [0,1,0,0,0,0|1,0,2]=4 305 B6R0.9 OCC(CO)CO SC-43670 [0,1,0,0,0,0|1,0,2]=4 306 B6R1.2 BrC1CCNC1 SC-24702 [0,0,0,1,0,0|2,0,1]=4 307 B6R1.2 BrC1CCOC1 SC-49709 [0,0,0,1,0,0|1,0,2]=4 308 B6R1.2 CC1=CC=CC1 SC-22441 [0,0,0,1,0,0|1,0,2]=4 309 B6R1.2 CC1=CCCO1 SC-69814 [0,0,0,1,0,0|2,0,1]=4 310 B6R1.2 CC1=NCCC1 SC-07079 [0,0,0,1,0,0|2,0,1]=4 311 B6R1.2 CC1CCCN1 SC-89376 [0,0,0,1,0,0|2,0,0]=3 312 B6R1.2 CC1CCCN1 SC-A3822 [0,0,0,1,0,0|2,0,0]=3 313 B6R1.2 CC1CCCO1 SC-18056 [0,0,0,1,0,0|2,0,0]=3 314 B6R1.2 CC1CCNC1 SC-49333 [0,0,0,1,0,0|1,0,1]=3 315 B6R1.2 CC1CCOC1 SC-48311 [0,0,0,1,0,0|0,0,2]=3 316 B6R1.2 CN1CCCC1 SC-19022 [0,0,0,1,0,0|2,0,1]=4 317 B6R1.2 C[C@@H]1CCNC1 SC-23714 [0,0,0,1,0,0|1,0,1]=3 318 B6R1.2 C[C@@H]1CCNC1 SC-50232 [0,0,0,1,0,0|1,0,1]=3 319 B6R1.2 C[C@H]1CCCN1 SC-95860 [0,0,0,1,0,0|2,0,0]=3 320 B6R1.2 C[C@H]1CCCN1 SC-95861 [0,0,0,1,0,0|2,0,0]=3 321 B6R1.2 C[C@H]1CCNC1 SC-23913 [0,0,0,1,0,0|1,0,1]=3 322 B6R1.2 C[C@H]1CCNC1 SC-50233 [0,0,0,1,0,0|1,0,1]=3 323 B6R1.2 ClC1CCOC1 SC-47840 [0,0,0,1,0,0|1,0,2]=4 324 B6R1.2 FC1CCCC1 SC-09548 [0,0,0,1,0,0|2,0,1]=4 325 B6R1.2 FC1CCNC1 SC-28940 [0,0,0,1,0,0|2,0,1]=4 326 B6R1.2 F[C@H]1CCNC1 SC-43922 [0,0,0,1,0,0|2,0,1]=4 327 B6R1.2 NC1CCCC1 SC-84758 [0,0,0,1,0,0|2,0,1]=4 328 B6R1.2 NC1CCNC1 SC-62350 [0,0,0,1,0,0|2,0,1]=4 329 B6R1.2 NC1CCOC1 SC-12746 [0,0,0,1,0,0|1,0,2]=4 330 B6R1.2 NC1CCOC1 SC-35465 [0,0,0,1,0,0|1,0,2]=4 331 B6R1.2 N[C@@H]1CCOC1 SC-14942 [0,0,0,1,0,0|1,0,2]=4 332 B6R1.2 N[C@@H]1CCOC1 SC-26567 [0,0,0,1,0,0|1,0,2]=4 333 B6R1.2 N[C@H]1CCOC1 SC-14943 [0,0,0,1,0,0|1,0,2]=4 334 B6R1.2 N[C@H]1CCOC1 SC-46187 [0,0,0,1,0,0|1,0,2]=4 335 B6R1.2 O=C1C=CCC1 SC-07348 [0,0,0,1,0,0|2,0,1]=4 336 B6R1.2 OC1CCCN1 SC-21341 [0,0,0,1,0,0|3,0,0]=4 337 B6R1.2 OC1CCNC1 SC-00623 [0,0,0,1,0,0|2,0,1]=4 338 B6R1.2 OC1CCNC1 SC-24957 [0,0,0,1,0,0|2,0,1]=4 339 B6R1.2 OC1CCNC1 SC-27708 [0,0,0,1,0,0|2,0,1]=4 340 B6R1.2 OC1CCOC1 SC-17875 [0,0,0,1,0,0|1,0,2]=4 341 B6R1.2 OC1CCSC1 SC-53391 [0,0,0,1,0,0|1,1,1]=4 342 B6R1.2 O[C@@H]1CCNC1 SC-00194 [0,0,0,1,0,0|2,0,1]=4 343 B6R1.2 O[C@@H]1CCNC1 SC-13984 [0,0,0,1,0,0|2,0,1]=4 344 B6R1.2 O[C@@H]1CCOC1 SC-07022 [0,0,0,1,0,0|1,0,2]=4 345 B6R1.2 O[C@H]1CCOC1 SC-08982 [0,0,0,1,0,0|1,0,2]=4 346 B6R1.2 O[C@H]1CCOC1 SC-50082 [0,0,0,1,0,0|1,0,2]=4 347 B6R1.2 S=C1C=CCC1 SC-42975 [0,0,0,1,0,0|2,0,1]=4 348 B6R1.2 [C@@H]1(C)CCCN1 SC-48604 [0,0,0,1,0,0|2,0,0]=3 349 B6R1.2 [C@@H]1(N)CCNC1 SC-00476 [0,0,0,1,0,0|2,0,1]=4 350 B6R1.2 [C@H]1(O)CCNC1 SC-24229 [0,0,0,1,0,0|2,0,1]=4 351 B6R1.2 [Mg+]C1CCCC1 SC-69021 [0,0,0,1,0,0|2,0,1]=4 352 B6R1.4 BrC1=C(Br)CC1 SC-25505 [0,0,0,1,0,0|2,0,1]=4 353 B6R1.6 BrCC1CCC1 SC-17177 [0,0,0,1,0,0|1,0,1]=3 354 B6R1.6 BrCC1COC1 SC-88668 [0,0,0,1,0,0|1,0,2]=4 355 B6R1.6 C#CC1COC1 SC-A6059 [0,0,0,1,0,0|2,0,1]=4 356 B6R1.6 CNC1CCC1 SC-48003 [0,0,0,1,0,0|2,0,0]=3 357 B6R1.6 CNC1CNC1 SC-92061 [0,0,0,1,0,0|2,0,1]=4 358 B6R1.6 CNC1CNC1 SC-B7329 [0,0,0,1,0,0|2,0,1]=4 359 B6R1.6 COC1CNC1 SC-13154 [0,0,0,1,0,0|2,0,1]=4 360 B6R1.6 COC1COC1 SC-52729 [0,0,0,1,0,0|1,0,2]=4 361 B6R1.6 ICC1CCC1 SC-B3939 [0,0,0,1,0,0|1,0,1]=3 362 B6R1.6 ICC1CCO1 SC-48435 [0,0,0,1,0,0|2,0,1]=4 363 B6R1.6 ICC1COC1 SC-52174 [0,0,0,1,0,0|1,0,2]=4 364 B6R1.6 N#CC1CCC1 SC-43622 [0,0,0,1,0,0|1,0,1]=3 365 B6R1.6 NCC1CCC1 SC-12470 [0,0,0,1,0,0|1,0,1]=3 366 B6R1.6 NCC1CCC1 SC-22241 [0,0,0,1,0,0|1,0,1]=3 367 B6R1.6 NCC1CCC1 SC-A4294 [0,0,0,1,0,0|1,0,1]=3 368 B6R1.6 NCC1COC1 SC-48246 [0,0,0,1,0,0|1,0,2]=4 369 B6R1.6 NNC1CCC1 SC-12374 [0,0,0,1,0,0|2,0,0]=3 370 B6R1.6 NNC1CCC1 SC-12770 [0,0,0,1,0,0|2,0,0]=3 371 B6R1.6 NNC1CCC1 SC-72265 [0,0,0,1,0,0|2,0,0]=3 372 B6R1.6 O=CC1CCC1 SC-14218 [0,0,0,1,0,0|0,0,0]=1 373 B6R1.6 O=CC1COC1 SC-65750 [0,0,0,1,0,0|1,0,0]=2 374 B6R1.6 OCC1CCC1 SC-16736 [0,0,0,1,0,0|0,0,2]=3 375 B6R1.6 OCC1CCO1 SC-48256 [0,0,0,1,0,0|1,0,2]=4 376 B6R1.6 OCC1CNC1 SC-12744 [0,0,0,1,0,0|1,0,2]=4 377 B6R1.6 OCC1CNC1 SC-49233 [0,0,0,1,0,0|1,0,2]=4 378 B6R1.6 OC[C@H]1CCN1 SC-66733 [0,0,0,1,0,0|1,0,2]=4 379 B6R1.7 C#CC1(N)CC1 SC-A3277 [0,0,0,1,0,0|2,0,1]=4 380 B6R1.7 C#CC1(N)CC1 SC-B7653 [0,0,0,1,0,0|2,0,1]=4 381 B6R1.7 CC1(CCl)CC1 SC-48356 [0,0,0,1,0,0|1,0,1]=3 382 B6R1.7 CC1(CO)CC1 SC-54558 [0,0,0,1,0,0|0,0,2]=3 383 B6R1.7 N#CC1(N)CC1 SC-25117 [0,0,0,1,0,0|2,0,1]=4 384 B6R1.7 N#CC1(N)CC1 SC-69834 [0,0,0,1,0,0|2,0,1]=4 385 B6R1.7 NC1(CO)CC1 SC-21613 [0,0,0,1,0,0|1,0,2]=4 386 B6R1.7 NC1(CO)CC1 SC-35705 [0,0,0,1,0,0|1,0,2]=4 387 B6R1.7 NC1(CO)CC1 SC-52621 [0,0,0,1,0,0|1,0,2]=4 388 B6R1.7 NCC1(N)CC1 SC-53132 [0,0,0,1,0,0|2,0,1]=4 389 B6R1.7 NCC1(O)CC1 SC-49870 [0,0,0,1,0,0|2,0,1]=4 390 B6R1.7 OCC1(F)CC1 SC-69311 [0,0,0,1,0,0|1,0,2]=4 391 B6R1.7 OCC1(O)CC1 SC-A5661 [0,0,0,1,0,0|1,0,2]=4 392 B3R0.1 C#CC=O SC-84418 [2,0,0,0,0,0|0,0,2]=4 393 B3R0.1 C=CCI SC-66060 [2,0,0,0,0,0|1,0,1]=4 394 B3R0.1 C=CCN SC-13610 [2,0,0,0,0,0|1,0,1]=4 395 B3R0.1 C=CCN SC-20038 [2,0,0,0,0,0|1,0,1]=4 396 B3R0.1 C=C[CH-]C SC-90438 [2,0,0,0,0,0|0,0,2]=4 397 B3R0.1 CCNN SC-47438 [2,0,0,0,0,0|2,0,0]=4 398 B3R0.1 CCNN SC-88458 [2,0,0,0,0,0|2,0,0]=4 399 B3R0.1 CCNN SC-A4376 [2,0,0,0,0,0|2,0,0]=4 400 B3R0.1 CCO[NH3+] SC-76549 [2,0,0,0,0,0|2,0,0]=4 401 B3R0.1 CNOC SC-17494 [2,0,0,0,0,0|2,0,0]=4 402 B3R0.1 CNOC SC-74340 [2,0,0,0,0,0|2,0,0]=4 403 B3R0.1 COCBr SC-13660 [2,0,0,0,0,0|2,0,0]=4 404 B3R0.1 CSCCl SC-21599 [2,0,0,0,0,0|2,0,0]=4 405 B3R0.1 C\C=C\Br SC-50117 [2,0,0,0,0,0|1,0,1]=4 406 B3R0.1 FCCBr SC-16577 [2,0,0,0,0,0|2,0,0]=4 407 B3R0.1 FCCF SC-58115 [2,0,0,0,0,0|2,0,0]=4 408 B3R0.1 ICCI SC-90216 [2,0,0,0,0,0|2,0,0]=4 409 B3R0.1 NCCBr SC-11569 [2,0,0,0,0,0|2,0,0]=4 410 B3R0.1 NCCF SC-66629 [2,0,0,0,0,0|2,0,0]=4 411 B3R0.1 NCCF SC-89351 [2,0,0,0,0,0|2,0,0]=4 412 B3R0.1 NCCI SC-40010 [2,0,0,0,0,0|2,0,0]=4 413 B3R0.1 NNC=O SC-22540 [2,0,0,0,0,0|2,0,0]=4 414 B3R0.1 OCCBr SC-26949 [2,0,0,0,0,0|1,0,1]=4 415 B3R0.1 OCCF SC-22570 [2,0,0,0,0,0|1,0,1]=4 416 B3R0.1 OCCI SC-46883 [2,0,0,0,0,0|1,0,1]=4 417 B3R0.1 OCCO SC-A3578 [2,0,0,0,0,0|1,0,1]=4 418 B3R0.1 [Li]CCC SC-50170 [2,0,0,0,0,0|1,0,0]=3 419 B3R0.2 C=C(C)Br SC-25629 [2,0,0,0,0,0|1,0,1]=4 420 B3R0.2 CC(=O)O SC-16774 [2,0,0,0,0,0|1,0,1]=4 421 B3R0.2 CC(=O)O SC-18360 [2,0,0,0,0,0|1,0,1]=4 422 B3R0.2 CC(=O)O SC-27909 [2,0,0,0,0,0|1,0,1]=4 423 B3R0.2 CC(=O)[O-] SC-03583 [2,0,0,0,0,0|1,0,1]=4 424 B3R0.2 CC(=O)[O-] SC-12688 [2,0,0,0,0,0|1,0,1]=4 425 B3R0.2 CC(=O)[O-] SC-18482 [2,0,0,0,0,0|1,0,1]=4 426 B3R0.2 CC(=O)[O-] SC-18918 [2,0,0,0,0,0|1,0,1]=4 427 B3R0.2 CC(=O)[O-] SC-25242 [2,0,0,0,0,0|1,0,1]=4 428 B3R0.2 CC(=O)[O-] SC-26584 [2,0,0,0,0,0|1,0,1]=4 429 B3R0.2 CC(=O)[O-] SC-27311 [2,0,0,0,0,0|1,0,1]=4 430 B3R0.2 CC(=O)[O-] SC-46842 [2,0,0,0,0,0|1,0,1]=4 431 B3R0.2 CC(=O)[O-] SC-81149 [2,0,0,0,0,0|1,0,1]=4 432 B3R0.2 CC(=O)[O-] SC-81401 [2,0,0,0,0,0|1,0,1]=4 433 B3R0.2 CC(=O)[O-] SC-93306 [2,0,0,0,0,0|1,0,1]=4 434 B3R0.2 CC(C)=O SC-20986 [2,0,0,0,0,0|0,0,1]=3 435 B3R0.2 CC(C)[Mg+] SC-53842 [2,0,0,0,0,0|1,0,0]=3 436 B3R0.2 CC(C)[O-] SC-15122 [2,0,0,0,0,0|0,0,1]=3 437 B3R0.2 CC(C)[O-] SC-25162 [2,0,0,0,0,0|0,0,1]=3 438 B3R0.2 CC(C)[O-] SC-43831 [2,0,0,0,0,0|0,0,1]=3 439 B3R0.2 CC(C)[O-] SC-94197 [2,0,0,0,0,0|0,0,1]=3 440 B3R0.2 CC(N)=O SC-18410 [2,0,0,0,0,0|1,0,1]=4 441 B3R0.2 CN(C)Br SC-53113 [2,0,0,0,0,0|2,0,0]=4 442 B3R0.2 CN(C)Cl SC-43613 [2,0,0,0,0,0|2,0,0]=4 443 B3R0.2 CS(=O)[O-] SC-19511 [2,0,0,0,0,0|2,0,0]=4 444 B3R0.2 C[PH](C)=O SC-72909 [2,0,0,0,0,0|1,0,0]=3 445 B3R0.2 C[S+](C)Br SC-73660 [2,0,0,0,0,0|2,0,0]=4 446 B3R0.2 C[S+](C)C SC-68838 [2,0,0,0,0,0|1,0,1]=4 447 B3R0.2 C[S+](C)C SC-97925 [2,0,0,0,0,0|1,0,1]=4 448 B3R0.2 C[SnH2+](C)C SC-49273 [2,0,0,0,0,0|1,0,1]=4 449 B5R0.1 C=C(C)CCBr SC-26305 [1,1,0,0,0,0|0,0,1]=3 450 B5R0.1 C=C(C)CCI SC-35692 [1,1,0,0,0,0|0,0,1]=3 451 B5R0.1 C=C(C)CCO SC-28771 [1,1,0,0,0,0|0,0,1]=3 452 B5R0.1 C=CCC(C)O SC-49226 [1,1,0,0,0,0|0,0,2]=4 453 B5R0.1 C=CC[C@H](C)O SC-70432 [1,1,0,0,0,0|0,0,2]=4 454 B5R0.1 CC(=O)C=C=O SC-76855 [1,1,0,0,0,0|1,0,1]=4 455 B5R0.1 CC(=O)CC#N SC-26510 [1,1,0,0,0,0|0,0,2]=4 456 B5R0.1 CC(=O)CCCl SC-21586 [1,1,0,0,0,0|0,0,1]=3 457 B5R0.1 CC(=O)CCO SC-65678 [1,1,0,0,0,0|0,0,1]=3 458 B5R0.1 CC(=O)NCO SC-19774 [1,1,0,0,0,0|1,0,1]=4 459 B5R0.1 CC(=O)OCBr SC-44237 [1,1,0,0,0,0|1,0,1]=4 460 B5R0.1 CC(=O)OCCl SC-47539 [1,1,0,0,0,0|1,0,1]=4 461 B5R0.1 CC(Br)CCN SC-40141 [1,1,0,0,0,0|1,0,0]=3 462 B5R0.1 CC(C)=CC#N SC-47932 [1,1,0,0,0,0|1,0,1]=4 463 B5R0.1 CC(C)=CC=O SC-00290 [1,1,0,0,0,0|0,0,1]=3 464 B5R0.1 CC(C)=CCBr SC-13678 [1,1,0,0,0,0|1,0,1]=4 465 B5R0.1 CC(C)=CCBr SC-61636 [1,1,0,0,0,0|1,0,1]=4 466 B5R0.1 CC(C)=CCCl SC-16279 [1,1,0,0,0,0|1,0,1]=4 467 B5R0.1 CC(C)=CCN SC-51952 [1,1,0,0,0,0|1,0,1]=4 468 B5R0.1 CC(C)CNN SC-A4531 [1,1,0,0,0,0|1,0,1]=4 469 B5R0.1 CC(C)N=C=O SC-22633 [1,1,0,0,0,0|0,0,1]=3 470 B5R0.1 CC(N)CCN SC-66926 [1,1,0,0,0,0|1,0,0]=3 471 B5R0.1 CC(N)CCO SC-82589 [1,1,0,0,0,0|1,0,0]=3 472 B5R0.1 CCCC(=O)[O-] SC-15718 [1,1,0,0,0,0|1,0,1]=4 473 B5R0.1 CCCC(C)N SC-53929 [1,1,0,0,0,0|1,0,0]=3 474 B5R0.1 CCCC(C)O SC-03320 [1,1,0,0,0,0|0,0,1]=3 475 B5R0.1 CCC[C@@H](C)N SC-A6013 [1,1,0,0,0,0|1,0,0]=3 476 B5R0.1 CCC[C@@H](C)N SC-A6071 [1,1,0,0,0,0|1,0,0]=3 477 B5R0.1 CCC[C@H](C)N SC-A6072 [1,1,0,0,0,0|1,0,0]=3 478 B5R0.1 CCNC(C)C SC-84122 [1,1,0,0,0,0|0,0,1]=3 479 B5R0.1 CCOC(C)=N SC-02547 [1,1,0,0,0,0|1,0,1]=4 480 B5R0.1 CCOC(C)=N SC-A3540 [1,1,0,0,0,0|1,0,1]=4 481 B5R0.1 CN(C)CC=O SC-51643 [1,1,0,0,0,0|1,0,0]=3 482 B5R0.1 CN(C)CC=O SC-88142 [1,1,0,0,0,0|1,0,0]=3 483 B5R0.1 CN(C)CCBr SC-21756 [1,1,0,0,0,0|1,0,1]=4 484 B5R0.1 CN(C)CCBr SC-27529 [1,1,0,0,0,0|1,0,1]=4 485 B5R0.1 CN(C)CCCl SC-18600 [1,1,0,0,0,0|1,0,1]=4 486 B5R0.1 CN(C)CCCl SC-47184 [1,1,0,0,0,0|1,0,1]=4 487 B5R0.1 CN(C)CCO SC-87330 [1,1,0,0,0,0|1,0,1]=4 488 B5R0.1 CNCC(C)N SC-66085 [1,1,0,0,0,0|1,0,0]=3 489 B5R0.1 CNCC(F)F SC-34374 [1,1,0,0,0,0|2,0,0]=4 490 B5R0.1 CNCC(N)=O SC-10429 [1,1,0,0,0,0|1,0,1]=4 491 B5R0.1 COCC(=O)Cl SC-27381 [1,1,0,0,0,0|1,0,1]=4 492 B5R0.1 COCC(C)=S SC-42217 [1,1,0,0,0,0|0,1,1]=4 493 B5R0.1 COCC(C)N SC-48787 [1,1,0,0,0,0|1,0,0]=3 494 B5R0.1 COC[C@@H](C)N SC-47724 [1,1,0,0,0,0|1,0,0]=3 495 B5R0.1 COC[C@@H](C)O SC-04836 [1,1,0,0,0,0|0,0,1]=3 496 B5R0.1 COC[C@H](C)N SC-51779 [1,1,0,0,0,0|1,0,0]=3 497 B5R0.1 CS(=O)CCN SC-89327 [1,1,0,0,0,0|1,0,0]=3 498 B5R0.1 CSCC(N)=O SC-27108 [1,1,0,0,0,0|1,0,1]=4 499 B5R0.1 CSCS(C)=O SC-87090 [1,1,0,0,0,0|1,0,0]=3 500 B5R0.1 CSNC(C)=O SC-28667 [1,1,0,0,0,0|1,0,1]=4 501 B5R0.1 C[C@@H](N)CCO SC-48293 [1,1,0,0,0,0|1,0,0]=3 502 B5R0.1 C[C@@H](O)CCO SC-05919 [1,1,0,0,0,0|0,0,1]=3 503 B5R0.1 C[C@H](N)CCO SC-88699 [1,1,0,0,0,0|1,0,0]=3 504 B5R0.1 C[C@H](O)CCO SC-02840 [1,1,0,0,0,0|0,0,1]=3 505 B5R0.1 C\C=C/C(C)=O SC-48085 [1,1,0,0,0,0|0,0,2]=4 506 B5R0.1 NCCC(F)F SC-89198 [1,1,0,0,0,0|2,0,0]=4 507 B5R0.1 NCCC(N)=O SC-48688 [1,1,0,0,0,0|1,0,1]=4 508 B5R0.1 NCCC(N)=O SC-84499 [1,1,0,0,0,0|1,0,1]=4 509 B5R0.1 O=C(Cl)CCCl SC-16310 [1,1,0,0,0,0|1,0,1]=4 510 B5R0.1 O=C(O)CCF SC-53145 [1,1,0,0,0,0|1,0,1]=4 511 B5R0.1 O=C(O)CCS SC-22642 [1,1,0,0,0,0|1,0,1]=4 512 B5R0.1 O=[N+]([O-])CCO SC-22550 [1,1,0,0,0,0|2,0,0]=4 513 B5R0.4 C#CC(C)(C)C SC-22664 [1,1,0,0,0,0|1,0,1]=4 514 B5R0.4 C#CC(C)(C)N SC-16037 [1,1,0,0,0,0|1,0,1]=4 515 B5R0.4 C#CC(C)(C)O SC-26729 [1,1,0,0,0,0|1,0,1]=4 516 B5R0.4 C=CC(C)(C)N SC-36956 [1,1,0,0,0,0|1,0,0]=3 517 B5R0.4 C=C[Si](C)(C)C SC-24537 [1,1,0,0,0,0|1,1,0]=4 518 B5R0.4 C=C[Si](C)(C)Cl SC-21357 [1,1,0,0,0,0|1,1,0]=4 519 B5R0.4 CC(C)(Br)C#N SC-99785 [1,1,0,0,0,0|1,0,1]=4 520 B5R0.4 CC(C)(Br)CBr SC-97871 [1,1,0,0,0,0|1,0,1]=4 521 B5R0.4 CC(C)(C)C#N SC-77544 [1,1,0,0,0,0|1,0,1]=4 522 B5R0.4 CC(C)(C)C=O SC-05938 [1,1,0,0,0,0|0,0,0]=2 523 B5R0.4 CC(C)(C)CBr SC-24158 [1,1,0,0,0,0|1,0,1]=4 524 B5R0.4 CC(C)(C)CCl SC-48963 [1,1,0,0,0,0|1,0,1]=4 525 B5R0.4 CC(C)(C)CN SC-22562 [1,1,0,0,0,0|1,0,1]=4 526 B5R0.4 CC(C)(C)CN SC-97733 [1,1,0,0,0,0|1,0,1]=4 527 B5R0.4 CC(C)(C)CO SC-27689 [1,1,0,0,0,0|0,0,2]=4 528 B5R0.4 CC(C)(C)NO SC-44932 [1,1,0,0,0,0|1,0,1]=4 529 B5R0.4 CC(C)(C)ON SC-05608 [1,1,0,0,0,0|2,0,0]=4 530 B5R0.4 CC(C)(F)CBr SC-84038 [1,1,0,0,0,0|1,0,1]=4 531 B5R0.4 CC(C)(F)CO SC-14344 [1,1,0,0,0,0|0,0,2]=4 532 B5R0.4 CC(C)(N)C#N SC-14060 [1,1,0,0,0,0|1,0,1]=4 533 B5R0.4 CC(C)(N)CF SC-90380 [1,1,0,0,0,0|1,0,1]=4 534 B5R0.4 CC(C)(N)CO SC-00654 [1,1,0,0,0,0|0,0,2]=4 535 B5R0.4 CC(C)(O)CBr SC-69889 [1,1,0,0,0,0|1,0,1]=4 536 B5R0.4 CC(C)(O)CCl SC-05342 [1,1,0,0,0,0|1,0,1]=4 537 B5R0.4 CC(C)(O)CN SC-14245 [1,1,0,0,0,0|1,0,1]=4 538 B5R0.4 CC(C)(O)CO SC-93601 [1,1,0,0,0,0|0,0,2]=4 539 B5R0.4 CC(C)(S)CN SC-19650 [1,1,0,0,0,0|1,0,1]=4 540 B5R0.4 CC(F)(F)CN SC-49451 [1,1,0,0,0,0|2,0,0]=4 541 B5R0.4 CC(F)(F)CN SC-70960 [1,1,0,0,0,0|2,0,0]=4 542 B5R0.4 CC(F)(F)CO SC-21322 [1,1,0,0,0,0|2,0,0]=4 543 B5R0.4 CCC(C)(C)I SC-70421 [1,1,0,0,0,0|0,0,1]=3 544 B5R0.4 CCC(C)(C)O SC-62305 [1,1,0,0,0,0|0,0,1]=3 545 B5R0.4 CCC(Cl)(Cl)Cl SC-76666 [1,1,0,0,0,0|2,0,0]=4 546 B5R0.4 CCS(=O)(=O)Cl SC-25371 [1,1,0,0,0,0|2,0,0]=4 547 B5R0.4 CCS(N)(=O)=O SC-18888 [1,1,0,0,0,0|2,0,0]=4 548 B5R0.4 CC[N+](C)(C)[O-] SC-20985 [1,1,0,0,0,0|1,0,1]=4 549 B5R0.4 COS(C)(=O)=O SC-52027 [1,1,0,0,0,0|2,0,0]=4 550 B5R0.4 CSS(C)(=O)=O SC-24153 [1,1,0,0,0,0|2,0,0]=4 551 B5R0.4 O=CC(F)(F)F SC-13064 [1,1,0,0,0,0|2,0,0]=4 552 B5R0.4 O=CC(F)(F)F SC-13065 [1,1,0,0,0,0|2,0,0]=4 553 B5R0.4 O=CC(F)(F)F SC-50081 [1,1,0,0,0,0|2,0,0]=4 554 B5R0.4 [C-]#[N+]C(C)(C)C SC-78147 [1,1,0,0,0,0|2,0,0]=4 555 B5R0.5 C=C(C)C(N)=O SC-74591 [1,1,0,0,0,0|0,0,2]=4 556 B5R0.5 CC(=O)C(=O)[O-] SC-26010 [1,1,0,0,0,0|1,0,1]=4 557 B5R0.5 CC(=O)C(C)Br SC-44476 [1,1,0,0,0,0|0,0,1]=3 558 B5R0.5 CC(=O)C(C)Cl SC-46981 [1,1,0,0,0,0|0,0,1]=3 559 B5R0.5 CC(=O)C(C)S SC-17208 [1,1,0,0,0,0|0,0,1]=3 560 B5R0.5 CC(=O)C(F)F SC-99156 [1,1,0,0,0,0|1,0,1]=4 561 B5R0.5 CC(=O)N(C)C SC-54108 [1,1,0,0,0,0|1,0,0]=3 562 B5R0.5 CC(=S)C(C)S SC-42614 [1,1,0,0,0,0|0,1,1]=4 563 B5R0.5 CC(Br)C(N)=O SC-97497 [1,1,0,0,0,0|1,0,0]=3 564 B5R0.5 CC(C)=C(C)C SC-26845 [1,1,0,0,0,0|1,0,1]=4 565 B5R0.5 CC(C)B(O)O SC-66620 [1,1,0,0,0,0|1,0,1]=4 566 B5R0.5 CC(C)C(=N)N SC-13079 [1,1,0,0,0,0|1,0,0]=3 567 B5R0.5 CC(C)C(C)N SC-27570 [1,1,0,0,0,0|0,0,1]=3 568 B5R0.5 CC(Cl)C(=N)N SC-39558 [1,1,0,0,0,0|2,0,0]=4 569 B5R0.5 CC(Cl)C(Cl)Cl SC-25006 [1,1,0,0,0,0|2,0,0]=4 570 B5R0.5 CC(Cl)C(N)=O SC-50401 [1,1,0,0,0,0|1,0,0]=3 571 B5R0.5 CC(F)C(=O)O SC-83429 [1,1,0,0,0,0|1,0,0]=3 572 B5R0.5 CC(N)C(=O)O SC-09271 [1,1,0,0,0,0|1,0,0]=3 573 B5R0.5 CC(N)C(N)=O SC-94219 [1,1,0,0,0,0|1,0,0]=3 574 B5R0.5 CC(O)C(=O)O SC-20005 [1,1,0,0,0,0|1,0,0]=3 575 B5R0.5 CC(O)C(=O)[O-] SC-15837 [1,1,0,0,0,0|1,0,0]=3 576 B5R0.5 CC(O)C(=O)[O-] SC-18033 [1,1,0,0,0,0|1,0,0]=3 577 B5R0.5 CC(O)C(=O)[O-] SC-19308 [1,1,0,0,0,0|1,0,0]=3 578 B5R0.5 CC(O)C(=O)[O-] SC-46260 [1,1,0,0,0,0|1,0,0]=3 579 B5R0.5 CC(O)C(C)O SC-08971 [1,1,0,0,0,0|0,0,1]=3 580 B5R0.5 CC(O)C(C)O SC-81338 [1,1,0,0,0,0|0,0,1]=3 581 B5R0.5 CN(C)C(=O)Cl SC-15201 [1,1,0,0,0,0|1,0,0]=3 582 B5R0.5 CN(C)C(=S)Cl SC-15756 [1,1,0,0,0,0|1,1,0]=4 583 B5R0.5 CN(C)C(N)=S SC-A2077 [1,1,0,0,0,0|1,1,0]=4 584 B5R0.5 C[C@@H](Br)C(=O)O SC-08843 [1,1,0,0,0,0|1,0,0]=3 585 B5R0.5 C[C@@H](Cl)C(=O)O SC-06610 [1,1,0,0,0,0|1,0,0]=3 586 B5R0.5 C[C@@H](N)C(N)=O SC-09289 [1,1,0,0,0,0|1,0,0]=3 587 B5R0.5 C[C@@H](O)C(N)=O SC-92873 [1,1,0,0,0,0|1,0,0]=3 588 B5R0.5 C[C@H](Cl)C(=O)O SC-03218 [1,1,0,0,0,0|1,0,0]=3 589 B5R0.5 C[C@H](N)C(N)=O SC-03542 [1,1,0,0,0,0|1,0,0]=3 590 B5R0.5 C[C@H](O)C(N)=O SC-73228 [1,1,0,0,0,0|1,0,0]=3 591 B5R0.5 C[C@H](O)[C@H](C)O SC-08972 [1,1,0,0,0,0|0,0,1]=3 592 B5R0.5 NC(=O)C(F)F SC-A2453 [1,1,0,0,0,0|2,0,0]=4 593 B5R0.5 O=C(O)C(F)Br SC-49620 [1,1,0,0,0,0|2,0,0]=4 594 B5R0.5 O=C([O-])C(Cl)Cl SC-15953 [1,1,0,0,0,0|2,0,0]=4 595 B5R0.5 [2H]C(=O)N(C)C SC-97589 [1,1,0,0,0,0|1,0,0]=3 596 B5R0.5 [C@@H](C)(N)C(N)=O SC-22084 [1,1,0,0,0,0|1,0,0]=3 597 B5R0.2 C#CCCCI SC-A2786 [1,1,0,0,0,0|1,0,1]=4 598 B5R0.2 C#CCCCN SC-48603 [1,1,0,0,0,0|1,0,1]=4 599 B5R0.2 C#CCCCN SC-99931 [1,1,0,0,0,0|1,0,1]=4 600 B5R0.2 C=CCCC#N SC-71297 [1,1,0,0,0,0|1,0,1]=4 601 B5R0.2 C=CCCC=C SC-91437 [1,1,0,0,0,0|1,0,1]=4 602 B5R0.2 C=CCCCBr SC-47340 [1,1,0,0,0,0|1,0,0]=3 603 B5R0.2 C=CCCCN SC-28944 [1,1,0,0,0,0|1,0,0]=3 604 B5R0.2 C=CCCCN SC-91892 [1,1,0,0,0,0|1,0,0]=3 605 B5R0.2 C=CCCCO SC-78424 [1,1,0,0,0,0|1,0,0]=3 606 B5R0.2 C=CCSSC SC-87236 [1,1,0,0,0,0|2,0,0]=4 607 B5R0.2 C=COCCC SC-13613 [1,1,0,0,0,0|1,0,0]=3 608 B5R0.2 CC#CCC=O SC-89818 [1,1,0,0,0,0|0,0,1]=3 609 B5R0.2 CCCCNN SC-68008 [1,1,0,0,0,0|1,0,1]=4 610 B5R0.2 CCCN=C=S SC-74675 [1,1,0,0,0,0|0,1,1]=4 611 B5R0.2 CCCNCC SC-02236 [1,1,0,0,0,0|1,0,1]=4 612 B5R0.2 CCSCCBr SC-16797 [1,1,0,0,0,0|1,0,1]=4 613 B5R0.2 CCSCCCl SC-43710 [1,1,0,0,0,0|1,0,1]=4 614 B5R0.2 CCSCCN SC-65401 [1,1,0,0,0,0|1,0,1]=4 615 B5R0.2 CNCCCCl SC-96339 [1,1,0,0,0,0|1,0,1]=4 616 B5R0.2 CNCCCO SC-94106 [1,1,0,0,0,0|0,0,2]=4 617 B5R0.2 CNCCNC SC-19090 [1,1,0,0,0,0|2,0,0]=4 618 B5R0.2 CNCCSC SC-74374 [1,1,0,0,0,0|2,0,0]=4 619 B5R0.2 CNCCSC SC-83575 [1,1,0,0,0,0|2,0,0]=4 620 B5R0.2 COCCC=O SC-85357 [1,1,0,0,0,0|0,0,0]=2 621 B5R0.2 COCCCBr SC-20920 [1,1,0,0,0,0|1,0,1]=4 622 B5R0.2 COCCNN SC-53129 [1,1,0,0,0,0|2,0,0]=4 623 B5R0.2 COCCNN SC-70814 [1,1,0,0,0,0|2,0,0]=4 624 B5R0.2 COCCOC SC-16461 [1,1,0,0,0,0|2,0,0]=4 625 B5R0.2 FCCCCBr SC-43880 [1,1,0,0,0,0|1,0,1]=4 626 B5R0.2 N#CCCCBr SC-20060 [1,1,0,0,0,0|1,0,1]=4 627 B5R0.2 NCCCCBr SC-39791 [1,1,0,0,0,0|1,0,1]=4 628 B5R0.2 NCCCCCl SC-14246 [1,1,0,0,0,0|1,0,1]=4 629 B5R0.2 NCCCCF SC-25718 [1,1,0,0,0,0|1,0,1]=4 630 B5R0.2 NCCCCN SC-20919 [1,1,0,0,0,0|1,0,1]=4 631 B5R0.2 NCCCCO SC-48186 [1,1,0,0,0,0|0,0,2]=4 632 B5R0.2 O=C=NCCBr SC-82407 [1,1,0,0,0,0|1,0,1]=4 633 B5R0.2 O=C=NCCCl SC-13627 [1,1,0,0,0,0|1,0,1]=4 634 B5R0.2 O=CCCC=O SC-13455 [1,1,0,0,0,0|0,0,1]=3 635 B5R0.2 O=CCCCBr SC-69595 [1,1,0,0,0,0|0,0,0]=2 636 B5R0.2 OCCCCBr SC-12645 [1,1,0,0,0,0|0,0,2]=4 637 B5R0.2 OCCCCCl SC-23109 [1,1,0,0,0,0|0,0,2]=4 638 B7R0.2 CC(=O)OC(Br)CBr SC-14499 [0,2,0,0,0,0|2,0,0]=4 639 B7R0.2 CC(C)CC(C)NN SC-38647 [0,2,0,0,0,0|2,0,0]=4 640 B7R0.2 CC(CCl)CN(C)C SC-49474 [0,2,0,0,0,0|1,0,1]=4 641 B7R0.2 CC(CO)CN(C)C SC-49500 [0,2,0,0,0,0|0,0,2]=4 642 B7R0.2 CCC(=O)OC(C)=O SC-96821 [0,2,0,0,0,0|1,0,1]=4 643 B7R0.2 CCC(C)OC(=O)Cl SC-69084 [0,2,0,0,0,0|0,0,0]=2 644 B7R0.2 CCC(N)CC(=O)O SC-59260 [0,2,0,0,0,0|1,0,0]=3 645 B7R0.2 CCC(O)CC(C)=O SC-92943 [0,2,0,0,0,0|1,0,0]=3 646 B7R0.2 C\C(C=O)=C/N(C)C SC-93331 [0,2,0,0,0,0|0,0,2]=4 647 B7R0.2 NCC(O)CC(=O)O SC-50844 [0,2,0,0,0,0|2,0,0]=4 648 B7R0.2 NC[C@@H](O)CC(=O)O SC-04302 [0,2,0,0,0,0|2,0,0]=4 649 B7R0.2 N[C@H](CO)CC(=O)O SC-72100 [0,2,0,0,0,0|2,0,0]=4 650 B7R0.3 CC(CCCO)NN SC-14213 [0,2,0,0,0,0|2,0,0]=4 651 B7R0.3 CCSCC(C)NN SC-14211 [0,2,0,0,0,0|2,0,0]=4 652 B7R0.3 CSCCC(C)NN SC-38760 [0,2,0,0,0,0|2,0,0]=4 653 B7R0.5 C#CCC(N)C(=O)O SC-70414 [0,2,0,0,0,0|1,0,1]=4 654 B7R0.5 C#CC[C@@H](N)C(=O)O SC-A2980 [0,2,0,0,0,0|1,0,1]=4 655 B7R0.5 C=CCC(N)C(=O)O SC-10031 [0,2,0,0,0,0|1,0,1]=4 656 B7R0.5 C=CCC(N)C(=O)O SC-10032 [0,2,0,0,0,0|1,0,1]=4 657 B7R0.5 C=CCC(N)C(=O)O SC-14116 [0,2,0,0,0,0|1,0,1]=4 658 B7R0.5 C=CC[C@@H](N)C(=O)O SC-25316 [0,2,0,0,0,0|1,0,1]=4 659 B7R0.5 C=CC[C@H](N)C(=O)O SC-14143 [0,2,0,0,0,0|1,0,1]=4 660 B7R0.5 CCCC(Br)C(=O)O SC-27020 [0,2,0,0,0,0|1,0,0]=3 661 B7R0.5 CCC[C@@H](C)C(=O)O SC-43566 [0,2,0,0,0,0|0,0,0]=2 662 B7R0.5 CCC[C@H](C)C(=O)O SC-67603 [0,2,0,0,0,0|0,0,0]=2 663 B7R0.5 CCC[C@H](N)C(=O)O SC-06139 [0,2,0,0,0,0|1,0,0]=3 664 B7R0.5 CCC[C@H](O)C(=O)O SC-21948 [0,2,0,0,0,0|1,0,0]=3 665 B7R0.5 CCOC(=O)C(=O)Cl SC-26882 [0,2,0,0,0,0|1,0,1]=4 666 B7R0.5 CCOC(=O)C(=O)O SC-26569 [0,2,0,0,0,0|1,0,1]=4 667 B7R0.5 CCOC(=O)C(=O)[O-] SC-73549 [0,2,0,0,0,0|1,0,1]=4 668 B7R0.5 CCOC(=O)C(C)=O SC-15232 [0,2,0,0,0,0|1,0,1]=4 669 B7R0.5 CCOC(=O)C(N)=O SC-20979 [0,2,0,0,0,0|1,0,1]=4 670 B7R0.5 CC\C=C(/C)C(=O)O SC-62297 [0,2,0,0,0,0|0,0,1]=3 671 B7R0.5 COCC(N)C(=O)O SC-43930 [0,2,0,0,0,0|1,0,0]=3 672 B7R0.5 COC[C@@H](N)C(=O)O SC-44175 [0,2,0,0,0,0|1,0,0]=3 673 B7R0.5 COC[C@@H](N)C(=O)O SC-52821 [0,2,0,0,0,0|1,0,0]=3 674 B7R0.5 COC[C@H](N)C(=O)O SC-26107 [0,2,0,0,0,0|1,0,0]=3 675 B7R0.5 COC[C@H](N)C(=O)O SC-47929 [0,2,0,0,0,0|1,0,0]=3 676 B7R0.5 NC(CCO)C(=O)O SC-10290 [0,2,0,0,0,0|1,0,0]=3 677 B7R0.5 NCCC(N)C(=O)O SC-10146 [0,2,0,0,0,0|1,0,0]=3 678 B7R0.5 NCCC(N)C(=O)O SC-20723 [0,2,0,0,0,0|1,0,0]=3 679 B7R0.5 NCCC(N)C(=O)O SC-23452 [0,2,0,0,0,0|1,0,0]=3 680 B7R0.5 NCCC(N)C(=O)O SC-25055 [0,2,0,0,0,0|1,0,0]=3 681 B7R0.5 NCCC(O)C(=O)O SC-16245 [0,2,0,0,0,0|1,0,0]=3 682 B7R0.5 NCC[C@@H](O)C(=O)O SC-26595 [0,2,0,0,0,0|1,0,0]=3 683 B7R0.5 NCC[C@H](N)C(=O)O SC-10144 [0,2,0,0,0,0|1,0,0]=3 684 B7R0.5 N[C@@H](CCO)C(=O)O SC-10291 [0,2,0,0,0,0|1,0,0]=3 685 B7R0.5 O=C(Cl)C(Br)CCBr SC-13450 [0,2,0,0,0,0|1,0,0]=3 686 B7R0.7 CC(CCO)CCO SC-15062 [0,2,0,0,0,0|0,0,2]=4 687 B7R0.7 CCCC(C)CNN SC-42603 [0,2,0,0,0,0|1,0,1]=4 688 B7R0.7 CCOC(=O)CC=O SC-14726 [0,2,0,0,0,0|1,0,1]=4 689 B7R0.7 CCOC(C)OCC SC-48313 [0,2,0,0,0,0|1,0,1]=4 690 B7R0.7 COCC(C)COC SC-66246 [0,2,0,0,0,0|0,0,2]=4 691 B7R0.10 CC(CCl)C(C)CCl SC-98133 [0,2,0,0,0,0|1,0,1]=4 692 B7R0.10 CC(CN)[C@H](N)CO SC-54106 [0,2,0,0,0,0|1,0,1]=4 693 B7R0.10 CCC(=O)C(=O)OC SC-27261 [0,2,0,0,0,0|1,0,1]=4 694 B7R0.10 CCC(C)C(C)NN SC-38614 [0,2,0,0,0,0|1,0,1]=4 695 B7R0.10 CC[C@@H](O)C(=O)OC SC-49455 [0,2,0,0,0,0|1,0,0]=3 696 B7R0.10 CC[C@H](N)C(=O)OC SC-33322 [0,2,0,0,0,0|1,0,0]=3 697 B7R0.10 CC[C@H](N)C(=O)OC SC-91370 [0,2,0,0,0,0|1,0,0]=3 698 B7R0.10 CNC(C)C(=O)OC SC-82127 [0,2,0,0,0,0|1,0,0]=3 699 B7R0.10 CN[C@@H](C)C(=O)OC SC-84501 [0,2,0,0,0,0|1,0,0]=3 700 B7R0.10 CN[C@@H](C)C(=O)OC SC-A4993 [0,2,0,0,0,0|1,0,0]=3 701 B7R0.10 COC(=O)C(Br)CO SC-87315 [0,2,0,0,0,0|2,0,0]=4 702 B7R0.10 COC(=O)C(Br)SC SC-83274 [0,2,0,0,0,0|2,0,0]=4 703 B7R0.10 COC(=O)C(C)CN SC-53925 [0,2,0,0,0,0|1,0,0]=3 704 B7R0.10 COC(=O)C(C)CO SC-08906 [0,2,0,0,0,0|1,0,0]=3 705 B7R0.10 COC(=O)C(C)CO SC-08907 [0,2,0,0,0,0|1,0,0]=3 706 B7R0.10 COC(=O)C(C)OC SC-92649 [0,2,0,0,0,0|1,0,0]=3 707 B7R0.10 COC(=O)C(Cl)C=O SC-53173 [0,2,0,0,0,0|1,0,1]=4 708 B7R0.10 COC(=O)C(Cl)CCl SC-48264 [0,2,0,0,0,0|2,0,0]=4 709 B7R0.10 COC(=O)C(N)CO SC-09862 [0,2,0,0,0,0|2,0,0]=4 710 B7R0.10 COC(=O)C(N)CO SC-51728 [0,2,0,0,0,0|2,0,0]=4 711 B7R0.10 COC(=O)[C@@H](C)CBr SC-08853 [0,2,0,0,0,0|1,0,0]=3 712 B7R0.10 COC(=O)[C@@H](N)CO SC-88547 [0,2,0,0,0,0|2,0,0]=4 713 B7R0.10 COC(=O)[C@@H](N)CS SC-22400 [0,2,0,0,0,0|2,0,0]=4 714 B7R0.10 COC(=O)[C@@H](O)CO SC-44674 [0,2,0,0,0,0|2,0,0]=4 715 B7R0.10 COC(=O)[C@H](C)CBr SC-08854 [0,2,0,0,0,0|1,0,0]=3 716 B7R0.10 COC(=O)[C@H](N)CCl SC-44813 [0,2,0,0,0,0|2,0,0]=4 717 B7R0.10 COC(=O)[C@H](N)CO SC-21448 [0,2,0,0,0,0|2,0,0]=4 718 B7R0.10 COC(=O)[C@H](N)CS SC-95830 [0,2,0,0,0,0|2,0,0]=4 719 B7R0.10 CON(C)C(=O)CBr SC-33609 [0,2,0,0,0,0|2,0,0]=4 720 B7R0.10 CON(C)C(=O)CCl SC-21890 [0,2,0,0,0,0|2,0,0]=4 721 B7R0.10 CON(C)C(=O)CI SC-29719 [0,2,0,0,0,0|2,0,0]=4 722 B7R0.10 N[C@@H](CCl)C(=O)NO SC-22009 [0,2,0,0,0,0|2,0,0]=4 723 B7R0.10 O=CC(O)C(O)C=O SC-74089 [0,2,0,0,0,0|1,0,1]=4 724 B7R0.11 CCCC(C)(Br)CBr SC-94098 [0,2,0,0,0,0|1,0,1]=4 725 B7R0.11 COCC(C)(C)CN SC-49388 [0,2,0,0,0,0|1,0,1]=4 726 B7R0.12 CCC(CC)CNN SC-59903 [0,2,0,0,0,0|1,0,1]=4 727 B7R0.12 CCNC(CC)CN SC-29936 [0,2,0,0,0,0|1,0,1]=4 728 B7R0.12 COC(CCBr)OC SC-15080 [0,2,0,0,0,0|2,0,0]=4 729 B7R0.12 COC(CCN)OC SC-40178 [0,2,0,0,0,0|2,0,0]=4 730 B7R0.12 COCC(OC)OC SC-73556 [0,2,0,0,0,0|2,0,0]=4 731 B7R0.13 C=CC(C)(C)C(=O)O SC-72463 [0,2,0,0,0,0|0,0,2]=4 732 B7R0.13 CC(C)(C#N)C(=O)O SC-65742 [0,2,0,0,0,0|1,0,1]=4 733 B7R0.13 CC(C)(CF)C(=O)O SC-91781 [0,2,0,0,0,0|1,0,0]=3 734 B7R0.13 CC(C)(CN)C(N)=O SC-23041 [0,2,0,0,0,0|1,0,0]=3 735 B7R0.13 CC(C)(CO)[N+](=O)[O-] SC-74270 [0,2,0,0,0,0|2,0,0]=4 736 B7R0.13 CC(N)(CO)C(=O)O SC-73786 [0,2,0,0,0,0|1,0,0]=3 737 B7R0.13 CC(O)(CBr)C(=O)O SC-58676 [0,2,0,0,0,0|1,0,0]=3 738 B7R0.13 CCC(C)(C)C(=O)O SC-15366 [0,2,0,0,0,0|0,0,0]=2 739 B7R0.13 CCC(F)(F)C(=O)O SC-06365 [0,2,0,0,0,0|1,0,0]=3 740 B7R0.13 CC[C@](C)(N)C(=O)O SC-85117 [0,2,0,0,0,0|0,0,0]=2 741 B7R0.13 COC(C)(C)C(=O)O SC-49777 [0,2,0,0,0,0|1,0,0]=3 742 B7R0.13 C[C@](N)(CO)C(=O)O SC-10360 [0,2,0,0,0,0|1,0,0]=3 743 B7R0.13 C[C@](O)(CBr)C(=O)O SC-23641 [0,2,0,0,0,0|1,0,0]=3 744 B7R0.13 NCC(F)(F)C(=O)O SC-22061 [0,2,0,0,0,0|2,0,0]=4 745 B7R0.13 NCC(F)(F)C(=O)O SC-51906 [0,2,0,0,0,0|2,0,0]=4 746 B7R0.14 CC(C)(C)C(=O)C=O SC-33489 [0,2,0,0,0,0|1,0,1]=4 747 B7R0.15 CCC(CN)N(C)C SC-29729 [0,2,0,0,0,0|1,0,1]=4 748 B7R0.15 CCC(NN)C(C)C SC-39162 [0,2,0,0,0,0|2,0,0]=4 749 B7R0.15 CCN(CC)C(=O)Cl SC-74686 [0,2,0,0,0,0|1,0,0]=3 750 B7R0.15 CCN(CC)C(=S)[S-] SC-62397 [0,2,0,0,0,0|1,1,0]=4 751 B7R0.15 CCN(N=O)C(C)C SC-A4248 [0,2,0,0,0,0|2,0,0]=4 752 B7R0.15 CNC(CO)C(=O)O SC-26706 [0,2,0,0,0,0|1,0,0]=3 753 B7R0.15 COC(OC)C(=N)N SC-40005 [0,2,0,0,0,0|2,0,0]=4 754 B7R0.15 COC(OC)[C@@H](C)O SC-70217 [0,2,0,0,0,0|2,0,0]=4 755 B7R0.15 O=C(O)C(CBr)CBr SC-16780 [0,2,0,0,0,0|1,0,0]=3 756 B7R0.15 O=C(O)C(CF)CF SC-41163 [0,2,0,0,0,0|1,0,0]=3 757 B7R0.15 O=C(O)[C@H](CO)NP SC-A4575 [0,2,0,0,0,0|2,0,0]=4 758 B7R0.15 [C@@H](CO)(NC)C(=O)O SC-20914 [0,2,0,0,0,0|1,0,0]=3 759 B7R0.16 CC(=O)C(C)C(C)=O SC-08152 [0,2,0,0,0,0|0,0,1]=3 760 B7R0.16 CC(C(=O)O)C(=O)O SC-16059 [0,2,0,0,0,0|1,0,1]=4 761 B7R0.16 CC(C)C(=O)C(=O)O SC-27422 [0,2,0,0,0,0|1,0,1]=4 762 B7R0.16 CC(C)C(=O)C(=O)[O-] SC-13686 [0,2,0,0,0,0|1,0,1]=4 763 B7R0.16 CC(C)C(N)C(=O)O SC-09985 [0,2,0,0,0,0|1,0,0]=3 764 B7R0.16 CC(C)C(O)C(=O)O SC-08874 [0,2,0,0,0,0|1,0,0]=3 765 B7R0.16 CC(C)C(O)C(=O)O SC-A2103 [0,2,0,0,0,0|1,0,0]=3 766 B7R0.16 CC(C)[C@@H](O)C(=O)O SC-01716 [0,2,0,0,0,0|1,0,0]=3 767 B7R0.16 CC(C)[C@H](N)C(N)=O SC-19666 [0,2,0,0,0,0|1,0,0]=3 768 B7R0.16 CC(N)C(N)C(=O)O SC-10139 [0,2,0,0,0,0|1,0,0]=3 769 B7R0.16 CC(O)C(C)[N+](=O)[O-] SC-18769 [0,2,0,0,0,0|1,0,0]=3 770 B7R0.16 CC(O)C(N)C(=O)O SC-09869 [0,2,0,0,0,0|1,0,0]=3 771 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O SC-09868 [0,2,0,0,0,0|1,0,0]=3 772 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O SC-09866 [0,2,0,0,0,0|1,0,0]=3 773 B7R0.16 C[C@@H](O)[C@H](N)C(N)=O SC-09895 [0,2,0,0,0,0|1,0,0]=3 774 B7R0.16 C[C@H](O)C(N)C(=O)O SC-46538 [0,2,0,0,0,0|1,0,0]=3 775 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O SC-09865 [0,2,0,0,0,0|1,0,0]=3 776 B7R0.16 [C@@H](Cl)(C(=O)O)C(C)C SC-03021 [0,2,0,0,0,0|1,0,0]=3 777 B7R0.18 COC(C)(C=O)OC SC-05972 [0,2,0,0,0,0|1,0,0]=3 778 B5R1.2 BrC1CCC1 SC-50402 [1,0,0,1,0,0|1,0,0]=3 779 B5R1.2 CC1CCN1 SC-70091 [1,0,0,1,0,0|1,0,0]=3 780 B5R1.2 CC1CCN1 SC-A3607 [1,0,0,1,0,0|1,0,0]=3 781 B5R1.2 CC1CCN1 SC-A3960 [1,0,0,1,0,0|1,0,0]=3 782 B5R1.2 CC1CNC1 SC-50429 [1,0,0,1,0,0|1,0,1]=4 783 B5R1.2 C[C@H]1CCN1 SC-A4620 [1,0,0,1,0,0|1,0,0]=3 784 B5R1.2 ClC1CNC1 SC-43920 [1,0,0,1,0,0|2,0,0]=4 785 B5R1.2 FC1CNC1 SC-47665 [1,0,0,1,0,0|2,0,0]=4 786 B5R1.2 FC1CNC1 SC-51742 [1,0,0,1,0,0|2,0,0]=4 787 B5R1.2 IC1CCC1 SC-92367 [1,0,0,1,0,0|1,0,0]=3 788 B5R1.2 IC1COC1 SC-43780 [1,0,0,1,0,0|2,0,0]=4 789 B5R1.2 NC1CCC1 SC-16775 [1,0,0,1,0,0|1,0,0]=3 790 B5R1.2 NC1CCC1 SC-20422 [1,0,0,1,0,0|1,0,0]=3 791 B5R1.2 NC1CCC1 SC-43562 [1,0,0,1,0,0|1,0,0]=3 792 B5R1.2 NC1CNC1 SC-82511 [1,0,0,1,0,0|2,0,0]=4 793 B5R1.2 NC1COC1 SC-20809 [1,0,0,1,0,0|2,0,0]=4 794 B5R1.2 O=C1CCC1 SC-00523 [1,0,0,1,0,0|0,0,1]=3 795 B5R1.2 O=C1CCN1 SC-44172 [1,0,0,1,0,0|1,0,1]=4 796 B5R1.2 O=C1CNC1 SC-26093 [1,0,0,1,0,0|1,0,1]=4 797 B5R1.2 O=C1CNC1 SC-48283 [1,0,0,1,0,0|1,0,1]=4 798 B5R1.2 O=C1COC1 SC-21889 [1,0,0,1,0,0|1,0,1]=4 799 B5R1.2 OC1CCC1 SC-26944 [1,0,0,1,0,0|0,0,1]=3 800 B5R1.2 OC1CNC1 SC-04637 [1,0,0,1,0,0|1,0,1]=4 801 B5R1.2 OC1CNC1 SC-19998 [1,0,0,1,0,0|1,0,1]=4 802 B5R1.2 OC1COC1 SC-25466 [1,0,0,1,0,0|1,0,1]=4 803 B5R1.2 OC1CSC1 SC-36448 [1,0,0,1,0,0|1,0,1]=4 804 B5R1.2 SC1COC1 SC-B7217 [1,0,0,1,0,0|1,1,0]=4 805 B5R1.3 BrCC1CC1 SC-16841 [1,0,0,1,0,0|1,0,1]=4 806 B5R1.3 BrCC1CO1 SC-25640 [1,0,0,1,0,0|1,0,1]=4 807 B5R1.3 C#CC1CC1 SC-22635 [1,0,0,1,0,0|1,0,1]=4 808 B5R1.3 C=CC1CO1 SC-72377 [1,0,0,1,0,0|2,0,0]=4 809 B5R1.3 CC[C@@H]1CO1 SC-52802 [1,0,0,1,0,0|0,0,1]=3 810 B5R1.3 CC[C@H]1CO1 SC-21973 [1,0,0,1,0,0|0,0,1]=3 811 B5R1.3 CNC1CC1 SC-21879 [1,0,0,1,0,0|1,0,1]=4 812 B5R1.3 CNC1CC1 SC-33957 [1,0,0,1,0,0|1,0,1]=4 813 B5R1.3 ClCC1CC1 SC-27742 [1,0,0,1,0,0|1,0,1]=4 814 B5R1.3 ClC[C@@H]1CO1 SC-06234 [1,0,0,1,0,0|1,0,1]=4 815 B5R1.3 ClC[C@H]1CO1 SC-04973 [1,0,0,1,0,0|1,0,1]=4 816 B5R1.3 FCC1CO1 SC-91371 [1,0,0,1,0,0|1,0,1]=4 817 B5R1.3 NCC1CC1 SC-16854 [1,0,0,1,0,0|1,0,1]=4 818 B5R1.3 NCC1CC1 SC-95616 [1,0,0,1,0,0|1,0,1]=4 819 B5R1.3 NNC1CC1 SC-65163 [1,0,0,1,0,0|2,0,0]=4 820 B5R1.3 NNC1CC1 SC-68908 [1,0,0,1,0,0|2,0,0]=4 821 B5R1.3 NNC1CC1 SC-A3090 [1,0,0,1,0,0|2,0,0]=4 822 B5R1.3 NOC1CC1 SC-84445 [1,0,0,1,0,0|2,0,0]=4 823 B5R1.3 O=CC1CC1 SC-18902 [1,0,0,1,0,0|0,0,0]=2 824 B5R1.3 OCC1CS1 SC-70773 [1,0,0,1,0,0|1,1,0]=4 825 B5R1.3 OC[C@@H]1CO1 SC-05422 [1,0,0,1,0,0|1,0,1]=4 826 B5R1.3 OC[C@H]1CO1 SC-05653 [1,0,0,1,0,0|1,0,1]=4 827 B5R1.4 CC1CC1N SC-88485 [1,0,0,1,0,0|1,0,0]=3 828 B5R1.4 NC1CC1F SC-88258 [1,0,0,1,0,0|2,0,0]=4 829 B5R1.5 CC1(N)CC1 SC-43846 [1,0,0,1,0,0|1,0,0]=3 830 B5R1.5 CC1(N)CC1 SC-69791 [1,0,0,1,0,0|1,0,0]=3 831 B5R1.5 CC1(O)CC1 SC-53761 [1,0,0,1,0,0|0,0,1]=3 832 B5R1.1 C1=CCCC1 SC-18920 [1,0,0,1,0,0|1,0,0]=3 833 B5R1.1 C1=CCOC1 SC-47076 [1,0,0,1,0,0|2,0,0]=4 834 B5R1.1 C1=CNCC1 SC-88946 [1,0,0,1,0,0|1,0,1]=4 835 B7R1.1 BrCC1CCCC1 SC-04017 [0,1,0,1,0,0|1,0,1]=4 836 B7R1.1 BrCC1CCOC1 SC-13106 [0,1,0,1,0,0|0,0,2]=4 837 B7R1.1 C#CC1CCCC1 SC-52548 [0,1,0,1,0,0|1,0,1]=4 838 B7R1.1 C#CC1CCCC1 SC-82441 [0,1,0,1,0,0|1,0,1]=4 839 B7R1.1 CCC1CCCN1 SC-29181 [0,1,0,1,0,0|1,0,1]=4 840 B7R1.1 CNC1CCCC1 SC-52894 [0,1,0,1,0,0|1,0,1]=4 841 B7R1.1 CNC1CCCC1 SC-A3381 [0,1,0,1,0,0|1,0,1]=4 842 B7R1.1 CNC1CCOC1 SC-81912 [0,1,0,1,0,0|0,0,2]=4 843 B7R1.1 CN[C@@H]1CCOC1 SC-A2281 [0,1,0,1,0,0|0,0,2]=4 844 B7R1.1 CN[C@H]1CCNC1 SC-08954 [0,1,0,1,0,0|1,0,1]=4 845 B7R1.1 COC1CCNC1 SC-12454 [0,1,0,1,0,0|1,0,1]=4 846 B7R1.1 COC1CCNC1 SC-24177 [0,1,0,1,0,0|1,0,1]=4 847 B7R1.1 CO[C@@H]1CCNC1 SC-25526 [0,1,0,1,0,0|1,0,1]=4 848 B7R1.1 CO[C@@H]1CCNC1 SC-51990 [0,1,0,1,0,0|1,0,1]=4 849 B7R1.1 CO[C@H]1CCNC1 SC-25506 [0,1,0,1,0,0|1,0,1]=4 850 B7R1.1 CO[C@H]1CCNC1 SC-51991 [0,1,0,1,0,0|1,0,1]=4 851 B7R1.1 ClCC1CCCC1 SC-52756 [0,1,0,1,0,0|1,0,1]=4 852 B7R1.1 ICC1CCCC1 SC-19498 [0,1,0,1,0,0|1,0,1]=4 853 B7R1.1 ICC1CCOC1 SC-26534 [0,1,0,1,0,0|0,0,2]=4 854 B7R1.1 N#CC1CCCC1 SC-84423 [0,1,0,1,0,0|1,0,1]=4 855 B7R1.1 N#CC1CCCN1 SC-70822 [0,1,0,1,0,0|1,0,1]=4 856 B7R1.1 N#CC1CCNC1 SC-88576 [0,1,0,1,0,0|1,0,1]=4 857 B7R1.1 N#CC1CCNC1 SC-B6885 [0,1,0,1,0,0|1,0,1]=4 858 B7R1.1 N#CC1CCOC1 SC-28637 [0,1,0,1,0,0|1,0,1]=4 859 B7R1.1 N#C[C@@H]1CCCN1 SC-52275 [0,1,0,1,0,0|1,0,1]=4 860 B7R1.1 N#C[C@H]1CCCN1 SC-72638 [0,1,0,1,0,0|1,0,1]=4 861 B7R1.1 N#C[C@H]1CCNC1 SC-B8851 [0,1,0,1,0,0|1,0,1]=4 862 B7R1.1 NCC1CCCC1 SC-22285 [0,1,0,1,0,0|1,0,1]=4 863 B7R1.1 NCC1CCCC1 SC-25234 [0,1,0,1,0,0|1,0,1]=4 864 B7R1.1 NCC1CCCN1 SC-98158 [0,1,0,1,0,0|1,0,1]=4 865 B7R1.1 NCC1CCOC1 SC-12415 [0,1,0,1,0,0|0,0,2]=4 866 B7R1.1 NCC1CCOC1 SC-35383 [0,1,0,1,0,0|0,0,2]=4 867 B7R1.1 NC[C@@H]1CCCO1 SC-28608 [0,1,0,1,0,0|1,0,1]=4 868 B7R1.1 NC[C@H]1CCCO1 SC-06512 [0,1,0,1,0,0|1,0,1]=4 869 B7R1.1 NNC1CCCC1 SC-12771 [0,1,0,1,0,0|2,0,0]=4 870 B7R1.1 NNC1CCCC1 SC-62645 [0,1,0,1,0,0|2,0,0]=4 871 B7R1.1 NNC1CCSC1 SC-59920 [0,1,0,1,0,0|2,0,0]=4 872 B7R1.1 O=CC1CCCC1 SC-21778 [0,1,0,1,0,0|0,0,0]=2 873 B7R1.1 O=CC1CCCC1 SC-44728 [0,1,0,1,0,0|0,0,0]=2 874 B7R1.1 O=CC1CCNC1 SC-85271 [0,1,0,1,0,0|0,0,0]=2 875 B7R1.1 O=CC1CCOC1 SC-29081 [0,1,0,1,0,0|0,0,0]=2 876 B7R1.1 OCC1C=CCN1 SC-92889 [0,1,0,1,0,0|2,0,0]=4 877 B7R1.1 OCC1CC=CC1 SC-45771 [0,1,0,1,0,0|2,0,0]=4 878 B7R1.1 OCC1CCCC1 SC-03842 [0,1,0,1,0,0|0,0,2]=4 879 B7R1.1 OCC1CCCN1 SC-12006 [0,1,0,1,0,0|0,0,2]=4 880 B7R1.1 OCC1CCCO1 SC-94849 [0,1,0,1,0,0|0,0,2]=4 881 B7R1.1 OCC1CCNC1 SC-19805 [0,1,0,1,0,0|0,0,2]=4 882 B7R1.1 OCC1CCOC1 SC-21250 [0,1,0,1,0,0|0,0,2]=4 883 B7R1.1 OC[C@@H]1CCCN1 SC-48321 [0,1,0,1,0,0|0,0,2]=4 884 B7R1.1 OC[C@@H]1CCCO1 SC-20330 [0,1,0,1,0,0|0,0,2]=4 885 B7R1.1 OC[C@@H]1CCCO1 SC-68774 [0,1,0,1,0,0|0,0,2]=4 886 B7R1.1 OC[C@@H]1CCNC1 SC-48002 [0,1,0,1,0,0|0,0,2]=4 887 B7R1.1 OC[C@H]1CCNC1 SC-47992 [0,1,0,1,0,0|0,0,2]=4 888 B7R1.2 CC1=CC(=O)CC1 SC-18727 [0,1,0,1,0,0|0,0,1]=3 889 B7R1.2 CC1=CC(=O)OC1 SC-25541 [0,1,0,1,0,0|1,0,1]=4 890 B7R1.2 CC1CCC(=O)C1 SC-93748 [0,1,0,1,0,0|0,0,0]=2 891 B7R1.2 CC1CCC(=O)N1 SC-89347 [0,1,0,1,0,0|0,0,0]=2 892 B7R1.2 CC1CCC(C)N1 SC-21525 [0,1,0,1,0,0|1,0,1]=4 893 B7R1.2 CC1CNC(=O)C1 SC-50248 [0,1,0,1,0,0|1,0,0]=3 894 B7R1.2 CC1CNC(=O)N1 SC-65644 [0,1,0,1,0,0|1,0,0]=3 895 B7R1.2 CC1CNC(C)C1 SC-69891 [0,1,0,1,0,0|1,0,1]=4 896 B7R1.2 CC1COC(=O)C1 SC-60836 [0,1,0,1,0,0|1,0,0]=3 897 B7R1.2 C[C@@H]1CCC(=O)O1 SC-65777 [0,1,0,1,0,0|0,0,0]=2 898 B7R1.2 C[C@@H]1COC(=O)C1 SC-45465 [0,1,0,1,0,0|1,0,0]=3 899 B7R1.2 C[C@@H]1COC(=O)N1 SC-43641 [0,1,0,1,0,0|1,0,0]=3 900 B7R1.2 C[C@@H]1COC(=O)N1 SC-51055 [0,1,0,1,0,0|1,0,0]=3 901 B7R1.2 C[C@@H]1CSC(=S)N1 SC-49654 [0,1,0,1,0,0|1,1,0]=4 902 B7R1.2 C[C@@H]1C[C@H](O)CN1 SC-51782 [0,1,0,1,0,0|2,0,0]=4 903 B7R1.2 C[C@H]1CCC(=O)O1 SC-86851 [0,1,0,1,0,0|0,0,0]=2 904 B7R1.2 C[C@H]1CC[C@H](C)N1 SC-A5167 [0,1,0,1,0,0|1,0,1]=4 905 B7R1.2 C[C@H]1COC(=O)N1 SC-51056 [0,1,0,1,0,0|1,0,0]=3 906 B7R1.2 C[C@H]1COC(=O)O1 SC-04943 [0,1,0,1,0,0|1,0,0]=3 907 B7R1.2 NC1CNC(=O)C1 SC-66063 [0,1,0,1,0,0|2,0,0]=4 908 B7R1.2 NC1COC(=O)C1 SC-34183 [0,1,0,1,0,0|2,0,0]=4 909 B7R1.2 N[C@@H]1COC(=O)C1 SC-71558 [0,1,0,1,0,0|2,0,0]=4 910 B7R1.2 N[C@H]1CNC(=O)C1 SC-52716 [0,1,0,1,0,0|2,0,0]=4 911 B7R1.2 O=C1CC(O)CN1 SC-29049 [0,1,0,1,0,0|2,0,0]=4 912 B7R1.2 O=C1CCC(=O)C1 SC-15331 [0,1,0,1,0,0|1,0,1]=4 913 B7R1.2 O=C1CCC(Cl)O1 SC-69818 [0,1,0,1,0,0|1,0,0]=3 914 B7R1.2 O=C1C[C@@H](O)CN1 SC-02616 [0,1,0,1,0,0|2,0,0]=4 915 B7R1.2 O=C1C[C@H](O)CN1 SC-13587 [0,1,0,1,0,0|2,0,0]=4 916 B7R1.2 O=C1C[C@H](O)CO1 SC-06559 [0,1,0,1,0,0|2,0,0]=4 917 B7R1.2 O=C1OCC(F)O1 SC-19199 [0,1,0,1,0,0|2,0,0]=4 918 B7R1.3 CC1=CCCCC1 SC-99243 [0,1,0,1,0,0|1,0,1]=4 919 B7R1.3 CC1=CCCNC1 SC-82898 [0,1,0,1,0,0|1,0,1]=4 920 B7R1.3 CC1=CCNCC1 SC-B8899 [0,1,0,1,0,0|1,0,1]=4 921 B7R1.3 CC1CCCCC1 SC-79075 [0,1,0,1,0,0|1,0,1]=4 922 B7R1.3 CC1CNCCO1 SC-49158 [0,1,0,1,0,0|1,0,1]=4 923 B7R1.3 CC1CNCCO1 SC-82780 [0,1,0,1,0,0|1,0,1]=4 924 B7R1.3 CC1CNCCO1 SC-A3535 [0,1,0,1,0,0|1,0,1]=4 925 B7R1.3 CC1COCCN1 SC-49161 [0,1,0,1,0,0|0,0,2]=4 926 B7R1.3 CC1OCCCO1 SC-49961 [0,1,0,1,0,0|2,0,0]=4 927 B7R1.3 CN1CC=CCC1 SC-20668 [0,1,0,1,0,0|2,0,0]=4 928 B7R1.3 C[C@@H]1CNCCO1 SC-43965 [0,1,0,1,0,0|1,0,1]=4 929 B7R1.3 C[C@@H]1CNCCO1 SC-88816 [0,1,0,1,0,0|1,0,1]=4 930 B7R1.3 C[C@@H]1COCCN1 SC-53986 [0,1,0,1,0,0|0,0,2]=4 931 B7R1.3 C[C@@H]1COCCN1 SC-53994 [0,1,0,1,0,0|0,0,2]=4 932 B7R1.3 C[C@H]1CCCCN1 SC-77306 [0,1,0,1,0,0|1,0,1]=4 933 B7R1.3 C[C@H]1CCCNC1 SC-99949 [0,1,0,1,0,0|1,0,1]=4 934 B7R1.3 C[C@H]1CCCNC1 SC-A5624 [0,1,0,1,0,0|1,0,1]=4 935 B7R1.3 C[C@H]1CNCCO1 SC-44479 [0,1,0,1,0,0|1,0,1]=4 936 B7R1.3 C[C@H]1COCCN1 SC-21564 [0,1,0,1,0,0|0,0,2]=4 937 B7R1.3 C[C@H]1COCCN1 SC-69967 [0,1,0,1,0,0|0,0,2]=4 938 B7R1.3 OC1C=CCCC1 SC-21514 [0,1,0,1,0,0|2,0,0]=4 939 B7R1.3 OC1CC=CCC1 SC-87372 [0,1,0,1,0,0|2,0,0]=4 940 B7R1.4 C=C1CCOC1=O SC-19579 [0,1,0,1,0,0|0,0,2]=4 941 B7R1.4 CC1=CCCC1=O SC-15856 [0,1,0,1,0,0|0,0,1]=3 942 B7R1.4 CC1CCCC1=O SC-89605 [0,1,0,1,0,0|0,0,0]=2 943 B7R1.4 CC1CCCC1=S SC-42934 [0,1,0,1,0,0|0,1,0]=3 944 B7R1.4 CC1CCCC1N SC-71052 [0,1,0,1,0,0|1,0,1]=4 945 B7R1.4 CC1CCNC1=O SC-21672 [0,1,0,1,0,0|0,0,0]=2 946 B7R1.4 CC1CCOC1=O SC-20996 [0,1,0,1,0,0|0,0,0]=2 947 B7R1.4 CC1SCCC1=S SC-42506 [0,1,0,1,0,0|0,1,0]=3 948 B7R1.4 CN1CCNC1=O SC-89793 [0,1,0,1,0,0|1,0,0]=3 949 B7R1.4 C[C@H]1CNC[C@@H]1O SC-A5707 [0,1,0,1,0,0|0,0,2]=4 950 B7R1.4 NC1CCNC1=O SC-13910 [0,1,0,1,0,0|1,0,0]=3 951 B7R1.4 NC1CCNC1=O SC-48795 [0,1,0,1,0,0|1,0,0]=3 952 B7R1.4 NC1CCNC1=O SC-51089 [0,1,0,1,0,0|1,0,0]=3 953 B7R1.4 NC1CCNC1=O SC-53072 [0,1,0,1,0,0|1,0,0]=3 954 B7R1.4 NC1CONC1=O SC-06256 [0,1,0,1,0,0|2,0,0]=4 955 B7R1.4 NC1CONC1=O SC-11124 [0,1,0,1,0,0|2,0,0]=4 956 B7R1.4 N[C@@H]1CCNC1=O SC-65959 [0,1,0,1,0,0|1,0,0]=3 957 B7R1.4 N[C@@H]1CCNC1=O SC-A2225 [0,1,0,1,0,0|1,0,0]=3 958 B7R1.4 N[C@@H]1CCOC1=O SC-28003 [0,1,0,1,0,0|1,0,0]=3 959 B7R1.4 N[C@H]1CCNC1=O SC-96457 [0,1,0,1,0,0|1,0,0]=3 960 B7R1.4 N[C@H]1CCOC1=O SC-01385 [0,1,0,1,0,0|1,0,0]=3 961 B7R1.4 N[C@H]1CCOC1=O SC-28113 [0,1,0,1,0,0|1,0,0]=3 962 B7R1.4 N[C@H]1CCOC1=O SC-51606 [0,1,0,1,0,0|1,0,0]=3 963 B7R1.4 O=C1CCC=C1Br SC-49478 [0,1,0,1,0,0|1,0,1]=4 964 B7R1.4 O=C1CCCC1Br SC-70088 [0,1,0,1,0,0|1,0,0]=3 965 B7R1.4 O=C1CCCC1Cl SC-21538 [0,1,0,1,0,0|1,0,0]=3 966 B7R1.4 O=C1NCCC1O SC-26159 [0,1,0,1,0,0|1,0,0]=3 967 B7R1.4 O=C1NCC[C@@H]1O SC-21960 [0,1,0,1,0,0|1,0,0]=3 968 B7R1.4 O=C1NCC[C@H]1O SC-87526 [0,1,0,1,0,0|1,0,0]=3 969 B7R1.4 O=C1OCC[C@@H]1O SC-14306 [0,1,0,1,0,0|1,0,0]=3 970 B7R1.4 O=C1OCC[C@H]1O SC-08904 [0,1,0,1,0,0|1,0,0]=3 971 B7R1.4 S=C1CCCC1Cl SC-42320 [0,1,0,1,0,0|1,1,0]=4 972 B7R1.5 CC1CC1CNN SC-60063 [0,1,0,1,0,0|1,0,1]=4 973 B7R1.6 CCNC1CNC1 SC-70012 [0,1,0,1,0,0|1,0,1]=4 974 B7R1.6 CCNC1COC1 SC-B8590 [0,1,0,1,0,0|0,0,2]=4 975 B7R1.6 CCOC1CNC1 SC-28573 [0,1,0,1,0,0|1,0,1]=4 976 B7R1.6 CCOC1CNC1 SC-48702 [0,1,0,1,0,0|1,0,1]=4 977 B7R1.6 CNCC1COC1 SC-82720 [0,1,0,1,0,0|0,0,2]=4 978 B7R1.6 COCC1CNC1 SC-89956 [0,1,0,1,0,0|1,0,1]=4 979 B7R1.6 COCC1CNC1 SC-A4983 [0,1,0,1,0,0|1,0,1]=4 980 B7R1.6 N#CCC1CCC1 SC-39102 [0,1,0,1,0,0|1,0,1]=4 981 B7R1.6 NCCC1CCC1 SC-B8576 [0,1,0,1,0,0|1,0,1]=4 982 B7R1.6 NCCC1COC1 SC-49992 [0,1,0,1,0,0|0,0,2]=4 983 B7R1.6 NNCC1CCC1 SC-12830 [0,1,0,1,0,0|1,0,1]=4 984 B7R1.6 OCCC1COC1 SC-53429 [0,1,0,1,0,0|0,0,2]=4 985 B7R1.10 CN1CC(CN)C1 SC-21131 [0,1,0,1,0,0|1,0,1]=4 986 B7R1.10 CN1CC(CO)C1 SC-B6906 [0,1,0,1,0,0|0,0,2]=4 987 B7R1.10 COC1CC(O)C1 SC-A4338 [0,1,0,1,0,0|2,0,0]=4 988 B7R1.10 N#CC1CC(=O)C1 SC-66164 [0,1,0,1,0,0|1,0,1]=4 989 B7R1.10 N#CC1CC(O)C1 SC-82674 [0,1,0,1,0,0|1,0,1]=4 990 B7R1.10 NC[C@H]1C[C@H](O)C1 SC-52884 [0,1,0,1,0,0|1,0,1]=4 991 B7R1.10 NC[C@H]1C[C@H](O)C1 SC-B7170 [0,1,0,1,0,0|1,0,1]=4 992 B7R1.10 O=C1CC(CBr)C1 SC-B8597 [0,1,0,1,0,0|1,0,0]=3 993 B7R1.10 O=C1CC(CO)C1 SC-86648 [0,1,0,1,0,0|1,0,0]=3 994 B7R1.10 O=C1CN(CCl)C1 SC-39185 [0,1,0,1,0,0|2,0,0]=4 995 B7R1.10 OCC1CC(F)C1 SC-25285 [0,1,0,1,0,0|0,0,2]=4 996 B7R1.22 CC(NN)C1CC1 SC-39260 [0,1,0,1,0,0|2,0,0]=4 997 B7R1.25 CC1(CBr)COC1 SC-50266 [0,1,0,1,0,0|1,0,1]=4 998 B7R1.25 CC1(CO)CNC1 SC-67286 [0,1,0,1,0,0|0,0,2]=4 999 B7R1.25 CC1(CO)COC1 SC-27080 [0,1,0,1,0,0|0,0,2]=4 1000 B7R1.25 COC1(C)CNC1 SC-50109 [0,1,0,1,0,0|2,0,0]=4 1001 B7R1.25 N#CC1(N)CCC1 SC-A4652 [0,1,0,1,0,0|1,0,1]=4 1002 B7R1.25 NC1(CO)CCC1 SC-17718 [0,1,0,1,0,0|0,0,2]=4 1003 B7R1.25 NC1(CO)CCC1 SC-B7244 [0,1,0,1,0,0|0,0,2]=4 1004 B7R1.25 NCC1(N)CCC1 SC-53140 [0,1,0,1,0,0|1,0,1]=4 1005 B7R1.25 NCC1(O)CCC1 SC-44159 [0,1,0,1,0,0|1,0,1]=4 1006 B7R1.12 CC1CC1C(=O)Cl SC-60998 [0,1,0,1,0,0|0,0,0]=2 1007 B7R1.12 CC1CC1C(=O)O SC-71058 [0,1,0,1,0,0|0,0,0]=2 1008 B7R1.12 O=C(O)C1CC1F SC-85228 [0,1,0,1,0,0|1,0,0]=3 1009 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F SC-83847 [0,1,0,1,0,0|1,0,0]=3 1010 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F SC-A4679 [0,1,0,1,0,0|1,0,0]=3 1011 B7R1.12 O=C(O)[C@H]1C[C@H]1F SC-72913 [0,1,0,1,0,0|1,0,0]=3 1012 B7R1.18 CC(=O)C1CCC1 SC-74316 [0,1,0,1,0,0|0,0,0]=2 1013 B7R1.18 CC(O)C1CCC1 SC-22088 [0,1,0,1,0,0|0,0,2]=4 1014 B7R1.18 N=C(N)C1CCC1 SC-12460 [0,1,0,1,0,0|1,0,0]=3 1015 B7R1.18 N=C(N)C1CCC1 SC-B8182 [0,1,0,1,0,0|1,0,0]=3 1016 B7R1.18 NC(=O)[C@H]1CCN1 SC-42709 [0,1,0,1,0,0|1,0,0]=3 1017 B7R1.18 O=C(Cl)C1CCC1 SC-46657 [0,1,0,1,0,0|0,0,0]=2 1018 B7R1.18 O=C(O)C1CCC1 SC-17776 [0,1,0,1,0,0|0,0,0]=2 1019 B7R1.18 O=C(O)C1CCN1 SC-53260 [0,1,0,1,0,0|1,0,0]=3 1020 B7R1.18 O=C(O)C1CCO1 SC-22549 [0,1,0,1,0,0|1,0,0]=3 1021 B7R1.18 O=C(O)C1COC1 SC-48326 [0,1,0,1,0,0|1,0,0]=3 1022 B7R1.18 O=C(O)[C@H]1CCN1 SC-24616 [0,1,0,1,0,0|1,0,0]=3 1023 B7R1.18 OB(O)C1CCC1 SC-21363 [0,1,0,1,0,0|1,0,1]=4 1024 B7R1.19 CC(=O)C1(C)CC1 SC-47849 [0,1,0,1,0,0|0,0,0]=2 1025 B7R1.19 CC(=O)C1(F)CC1 SC-83098 [0,1,0,1,0,0|1,0,0]=3 1026 B7R1.19 CC1(C(=O)Cl)CC1 SC-45726 [0,1,0,1,0,0|0,0,0]=2 1027 B7R1.19 CC1(C(=O)O)CC1 SC-21186 [0,1,0,1,0,0|0,0,0]=2 1028 B7R1.19 CC1(C(=O)O)CO1 SC-A2140 [0,1,0,1,0,0|1,0,0]=3 1029 B7R1.19 NC1(C(=O)O)CC1 SC-11059 [0,1,0,1,0,0|1,0,0]=3 1030 B7R1.19 NC1(C(=O)O)CC1 SC-21274 [0,1,0,1,0,0|1,0,0]=3 1031 B7R1.19 O=C(O)C1(Cl)CC1 SC-49481 [0,1,0,1,0,0|1,0,0]=3 1032 B7R1.19 O=C(O)C1(F)CC1 SC-49577 [0,1,0,1,0,0|1,0,0]=3 1033 B7R1.19 O=C(O)C1(O)CC1 SC-19780 [0,1,0,1,0,0|1,0,0]=3 1034 B7R1.14 CC1(C)CCCN1 SC-89406 [0,1,0,1,0,0|2,0,0]=4 1035 B7R1.14 CC1(C)CCNC1 SC-B8345 [0,1,0,1,0,0|1,0,1]=4 1036 B7R1.14 CC1(N)CCCC1 SC-38076 [0,1,0,1,0,0|1,0,1]=4 1037 B7R1.14 CC1(N)CCOC1 SC-B8497 [0,1,0,1,0,0|0,0,2]=4 1038 B7R1.14 CC1(O)CCCC1 SC-26720 [0,1,0,1,0,0|1,0,1]=4 1039 B7R1.14 CC1(O)CCNC1 SC-65706 [0,1,0,1,0,0|1,0,1]=4 1040 B7R1.14 C[C@@]1(O)CCNC1 SC-91289 [0,1,0,1,0,0|1,0,1]=4 1041 B7R1.14 C[C@]1(O)CCNC1 SC-91785 [0,1,0,1,0,0|1,0,1]=4 1042 B7R1.29 BrCC1(CBr)CC1 SC-A5457 [0,1,0,1,0,0|1,0,1]=4 1043 B7R1.29 C#CC1(CO)CC1 SC-B7711 [0,1,0,1,0,0|1,0,1]=4 1044 B7R1.29 N#CC1(CN)CC1 SC-A3161 [0,1,0,1,0,0|1,0,1]=4 1045 B7R1.29 N#CC1(CO)CC1 SC-44481 [0,1,0,1,0,0|1,0,1]=4 1046 B7R1.29 NCC1(CO)CC1 SC-89064 [0,1,0,1,0,0|0,0,2]=4 1047 B7R1.29 NCC1(CO)CC1 SC-A3139 [0,1,0,1,0,0|0,0,2]=4 1048 B7R2.13 C1CC2CC2N1 SC-A3242 [0,0,0,2,0,0|1,0,1]=4 1049 B7R2.13 C1NCC2CC12 SC-29300 [0,0,0,2,0,0|1,0,1]=4 1050 B7R2.13 C1NCC2CC12 SC-88257 [0,0,0,2,0,0|1,0,1]=4