0 B5R0.1 C=C(C)OCC SC-18086 [0,0,0,0,0,0|1,0,3]=4 1 B5R0.1 C=COC(C)=O SC-79059 [0,0,0,0,0,0|2,0,2]=4 2 B5R0.1 CC(=O)\C=N/O SC-89466 [0,0,0,0,0,0|3,0,1]=4 3 B5R0.1 CC(=O)\C=N\O SC-68143 [0,0,0,0,0,0|3,0,1]=4 4 B5R0.1 CC(C)=CC#N SC-47932 [0,0,0,0,0,0|1,0,2]=3 5 B5R0.1 CC(C)=CC=O SC-00290 [0,0,0,0,0,0|1,0,1]=2 6 B5R0.1 CC(C)=CCBr SC-13678 [0,0,0,0,0,0|1,0,2]=3 7 B5R0.1 CC(C)=CCN SC-51952 [0,0,0,0,0,0|1,0,2]=3 8 B5R0.1 CC(C)=CCO SC-77150 [0,0,0,0,0,0|1,0,2]=3 9 B5R0.1 CC(N)CCO SC-82589 [0,0,0,0,0,0|2,0,2]=4 10 B5R0.1 CCCC(C)N SC-53929 [0,0,0,0,0,0|1,0,2]=3 11 B5R0.1 CCCC(C)O SC-03320 [0,0,0,0,0,0|1,0,2]=3 12 B5R0.1 CCNC(C)C SC-84122 [0,0,0,0,0,0|1,0,1]=2 13 B5R0.1 CCOC(C)=N SC-02547 [0,0,0,0,0,0|2,0,2]=4 14 B5R0.1 CCOC(C)=N SC-A3540 [0,0,0,0,0,0|2,0,2]=4 15 B5R0.1 CN(C)CC=O SC-51643 [0,0,0,0,0,0|2,0,1]=3 16 B5R0.1 CN(C)CCBr SC-21756 [0,0,0,0,0,0|2,0,2]=4 17 B5R0.1 CN(C)CCBr SC-27529 [0,0,0,0,0,0|2,0,2]=4 18 B5R0.1 CN(C)CCCl SC-18600 [0,0,0,0,0,0|2,0,2]=4 19 B5R0.1 CN(C)CCCl SC-47184 [0,0,0,0,0,0|2,0,2]=4 20 B5R0.1 CN(C)CCO SC-87330 [0,0,0,0,0,0|2,0,2]=4 21 B5R0.1 CNCC(F)F SC-34374 [0,0,0,0,0,0|3,0,1]=4 22 B5R0.1 COCC(C)N SC-48787 [0,0,0,0,0,0|2,0,1]=3 23 B5R0.1 COCC(C)O SC-00293 [0,0,0,0,0,0|2,0,1]=3 24 B5R0.1 COC[C@@H](C)N SC-47724 [0,0,0,0,0,0|2,0,1]=3 25 B5R0.1 COC[C@@H](C)O SC-04836 [0,0,0,0,0,0|2,0,1]=3 26 B5R0.1 CSCS(C)=O SC-87090 [0,0,0,0,0,0|3,0,1]=4 27 B5R0.1 CSNC(C)=O SC-28667 [0,0,0,0,0,0|3,0,1]=4 28 B5R0.1 C[C@@H](N)CCO SC-48293 [0,0,0,0,0,0|2,0,2]=4 29 B5R0.1 C[C@@H](O)CCO SC-05919 [0,0,0,0,0,0|2,0,2]=4 30 B5R0.1 C[C@H](O)CCO SC-02840 [0,0,0,0,0,0|2,0,2]=4 31 B5R0.1 C\C=C/C(=O)O SC-25924 [0,0,0,0,0,0|2,0,1]=3 32 B5R0.1 C\C=C/C(C)=O SC-48085 [0,0,0,0,0,0|1,0,1]=2 33 B5R0.1 C\C=C\B(O)O SC-15014 [0,0,0,0,0,0|3,0,0]=3 34 B5R0.1 C\C=C\C(=O)Cl SC-16256 [0,0,0,0,0,0|2,0,1]=3 35 B4R0.1 C#CC(C)N SC-52789 [1,0,0,0,0,0|1,0,2]=4 36 B4R0.1 C#CC(C)N SC-A2988 [1,0,0,0,0,0|1,0,2]=4 37 B4R0.1 C#CC(C)O SC-26644 [1,0,0,0,0,0|1,0,2]=4 38 B4R0.1 C=C(C)C=O SC-83411 [1,0,0,0,0,0|1,0,2]=4 39 B4R0.1 C=CC(=O)[O-] SC-19971 [1,0,0,0,0,0|2,0,1]=4 40 B4R0.1 C=CC(C)O SC-43661 [1,0,0,0,0,0|1,0,0]=2 41 B4R0.1 C=C[C@H](C)N SC-67439 [1,0,0,0,0,0|1,0,0]=2 42 B4R0.1 CC(=O)C=O SC-74380 [1,0,0,0,0,0|2,0,1]=4 43 B4R0.1 CC(Br)C#N SC-48220 [1,0,0,0,0,0|2,0,1]=4 44 B4R0.1 CC(Br)CO SC-A3571 [1,0,0,0,0,0|2,0,1]=4 45 B4R0.1 CC(C)=CBr SC-52196 [1,0,0,0,0,0|1,0,1]=3 46 B4R0.1 CC(C)=NN SC-92874 [1,0,0,0,0,0|2,0,1]=4 47 B4R0.1 CC(C)=NO SC-25907 [1,0,0,0,0,0|2,0,1]=4 48 B4R0.1 CC(C)NN SC-21077 [1,0,0,0,0,0|2,0,0]=3 49 B4R0.1 CC(C)NN SC-73657 [1,0,0,0,0,0|2,0,0]=3 50 B4R0.1 CC(C)NO SC-A3794 [1,0,0,0,0,0|2,0,0]=3 51 B4R0.1 CC(C)ON SC-87607 [1,0,0,0,0,0|2,0,0]=3 52 B4R0.1 CC(Cl)C#N SC-53702 [1,0,0,0,0,0|2,0,1]=4 53 B4R0.1 CC(N)C#N SC-92053 [1,0,0,0,0,0|2,0,1]=4 54 B4R0.1 CC(N)CO SC-18397 [1,0,0,0,0,0|2,0,1]=4 55 B4R0.1 CC(S)CS SC-A2768 [1,0,0,0,0,0|2,0,1]=4 56 B4R0.1 CCC(C)O SC-01234 [1,0,0,0,0,0|1,0,1]=3 57 B4R0.1 CC[C@H](C)N SC-81828 [1,0,0,0,0,0|1,0,1]=3 58 B4R0.1 CC[C@H](C)O SC-04418 [1,0,0,0,0,0|1,0,1]=3 59 B4R0.1 CNC(C)C SC-04732 [1,0,0,0,0,0|1,0,0]=2 60 B4R0.1 CNN(C)C SC-41461 [1,0,0,0,0,0|2,0,0]=3 61 B4R0.1 COC(Cl)Cl SC-04782 [1,0,0,0,0,0|3,0,0]=4 62 B4R0.1 C[C@@H](N)CN SC-08946 [1,0,0,0,0,0|2,0,1]=4 63 B4R0.1 C[C@@H](N)CO SC-03772 [1,0,0,0,0,0|2,0,1]=4 64 B4R0.1 C[C@@H](O)CN SC-03087 [1,0,0,0,0,0|2,0,1]=4 65 B4R0.1 C[C@@H](O)CO SC-04433 [1,0,0,0,0,0|2,0,1]=4 66 B4R0.1 C[C@H](Cl)CO SC-98590 [1,0,0,0,0,0|2,0,1]=4 67 B4R0.1 C[C@H](N)CN SC-08947 [1,0,0,0,0,0|2,0,1]=4 68 B4R0.1 C[C@H](N)CO SC-03066 [1,0,0,0,0,0|2,0,1]=4 69 B4R0.1 C[C@H](O)CCl SC-99597 [1,0,0,0,0,0|2,0,1]=4 70 B4R0.1 C[C@H](O)CN SC-03088 [1,0,0,0,0,0|2,0,1]=4 71 B4R0.1 C[C@H](O)CO SC-04434 [1,0,0,0,0,0|2,0,1]=4 72 B4R0.1 C\C=C(\C)Br SC-91379 [1,0,0,0,0,0|1,0,1]=3 73 B4R0.1 [C@@H](C)(O)C#C SC-47963 [1,0,0,0,0,0|1,0,2]=4 74 B4R0.1 [C@H](C)(O)C#C SC-47962 [1,0,0,0,0,0|1,0,2]=4 75 B4R0.2 C=CCCCl SC-90795 [1,0,0,0,0,0|1,0,2]=4 76 B4R0.2 C=CCCN SC-48242 [1,0,0,0,0,0|1,0,2]=4 77 B4R0.2 C=CCCN SC-52106 [1,0,0,0,0,0|1,0,2]=4 78 B4R0.2 C=CCCO SC-45284 [1,0,0,0,0,0|1,0,2]=4 79 B4R0.2 C=CCNC SC-05902 [1,0,0,0,0,0|1,0,2]=4 80 B4R0.2 C=CCSC SC-47211 [1,0,0,0,0,0|1,0,2]=4 81 B4R0.2 CC#CCBr SC-13862 [1,0,0,0,0,0|1,0,2]=4 82 B4R0.2 CC#CCO SC-17951 [1,0,0,0,0,0|1,0,2]=4 83 B4R0.2 CCCNC SC-27548 [1,0,0,0,0,0|1,0,1]=3 84 B4R0.2 CCN=C=O SC-11793 [1,0,0,0,0,0|2,0,1]=4 85 B4R0.2 CCN=C=S SC-46927 [1,0,0,0,0,0|2,0,1]=4 86 B4R0.2 CCOCC SC-73354 [1,0,0,0,0,0|1,0,1]=3 87 B4R0.2 CNCCBr SC-98001 [1,0,0,0,0,0|2,0,1]=4 88 B4R0.2 COCC=O SC-48883 [1,0,0,0,0,0|2,0,1]=4 89 B4R0.2 COCCCl SC-05903 [1,0,0,0,0,0|2,0,1]=4 90 B4R0.2 COCCN SC-22236 [1,0,0,0,0,0|2,0,1]=4 91 B4R0.2 CSCCCl SC-53991 [1,0,0,0,0,0|2,0,1]=4 92 B4R0.2 CSCCN SC-28443 [1,0,0,0,0,0|2,0,1]=4 93 B4R0.2 CSCCN SC-83550 [1,0,0,0,0,0|2,0,1]=4 94 B4R0.2 CSCCO SC-19276 [1,0,0,0,0,0|2,0,1]=4 95 B4R0.2 C\C=C/CO SC-69832 [1,0,0,0,0,0|1,0,0]=2 96 B4R0.2 C\C=C\CCl SC-22573 [1,0,0,0,0,0|1,0,0]=2 97 B4R0.2 C\C=C\CO SC-25521 [1,0,0,0,0,0|1,0,0]=2 98 B4R0.2 C\C=C\CO SC-69597 [1,0,0,0,0,0|1,0,0]=2 99 B4R0.2 C\C=C\OC SC-97407 [1,0,0,0,0,0|1,0,0]=2 100 B4R0.2 Cl\C=C\CCl SC-17396 [1,0,0,0,0,0|2,0,0]=3 101 B4R0.2 O=CCCCl SC-71322 [1,0,0,0,0,0|2,0,1]=4 102 B4R0.2 O=CCCO SC-52939 [1,0,0,0,0,0|2,0,1]=4 103 B6R0.1 CC[C@@H](N)COC SC-65714 [0,1,0,0,0,0|2,0,1]=4 104 B6R0.1 CC[C@H](N)COC SC-89974 [0,1,0,0,0,0|2,0,1]=4 105 B6R0.1 C\C=C\C(=O)OC SC-22589 [0,1,0,0,0,0|1,0,1]=3 106 B6R0.2 CC(=O)CC(C)=O SC-77723 [0,1,0,0,0,0|1,0,2]=4 107 B6R0.2 CC(=O)NC(C)C SC-A3057 [0,1,0,0,0,0|1,0,0]=2 108 B6R0.2 CC(=O)OC(C)C SC-25616 [0,1,0,0,0,0|1,0,0]=2 109 B6R0.2 CC(=O)\C=C(\C)N SC-89382 [0,1,0,0,0,0|1,0,1]=3 110 B6R0.2 CC(=O)\C=C(\C)O SC-20333 [0,1,0,0,0,0|1,0,1]=3 111 B6R0.2 CC(=O)\C=C(\C)O SC-67757 [0,1,0,0,0,0|1,0,1]=3 112 B6R0.2 CC(=O)\C=C(\C)[O-] SC-19412 [0,1,0,0,0,0|1,0,1]=3 113 B6R0.2 CC(C)=CC(=O)Cl SC-17934 [0,1,0,0,0,0|1,0,1]=3 114 B6R0.2 CC(C)=CC(=O)O SC-16257 [0,1,0,0,0,0|1,0,1]=3 115 B6R0.2 CC(C)CB(O)O SC-06923 [0,1,0,0,0,0|2,0,1]=4 116 B6R0.2 CC(C)NC(C)C SC-18336 [0,1,0,0,0,0|1,0,1]=3 117 B6R0.2 CC(C)OC(C)C SC-65190 [0,1,0,0,0,0|1,0,1]=3 118 B6R0.2 CC(Cl)CN(C)C SC-81232 [0,1,0,0,0,0|1,0,2]=4 119 B6R0.2 CC(Cl)OC(=O)Cl SC-13624 [0,1,0,0,0,0|3,0,0]=4 120 B6R0.2 CN(C)CC(N)=O SC-89197 [0,1,0,0,0,0|2,0,1]=4 121 B6R0.2 C[C@@H](N)CC(=O)O SC-10059 [0,1,0,0,0,0|2,0,1]=4 122 B6R0.2 C[C@@H](N)CC(=O)O SC-44142 [0,1,0,0,0,0|2,0,1]=4 123 B6R0.2 C[C@H](N)CC(=O)O SC-21979 [0,1,0,0,0,0|2,0,1]=4 124 B6R0.2 C[C@H](O)CC(=O)O SC-B3327 [0,1,0,0,0,0|2,0,1]=4 125 B6R0.2 C[S+](C)CC(=O)[O-] SC-72907 [0,1,0,0,0,0|2,0,1]=4 126 B6R0.2 C[SiH](C)N[SiH](C)C SC-68818 [0,1,0,0,0,0|1,2,0]=4 127 B6R0.2 C[SiH](C)O[SiH](C)C SC-92131 [0,1,0,0,0,0|1,2,0]=4 128 B6R0.3 CC(C)C(=N)NO SC-29781 [0,1,0,0,0,0|2,0,0]=3 129 B6R0.3 CC(C)C(=O)CBr SC-21776 [0,1,0,0,0,0|1,0,1]=3 130 B6R0.3 CC(C)C(=O)NN SC-82184 [0,1,0,0,0,0|2,0,0]=3 131 B6R0.3 CC(C)C(C)NN SC-41530 [0,1,0,0,0,0|2,0,1]=4 132 B6R0.3 CC(C)C(O)CN SC-34918 [0,1,0,0,0,0|1,0,2]=4 133 B6R0.3 CC(C)C(O)CN SC-A3426 [0,1,0,0,0,0|1,0,2]=4 134 B6R0.3 CC(C)[C@@H](N)CO SC-04448 [0,1,0,0,0,0|1,0,2]=4 135 B6R0.3 CC(C)[C@H](N)CO SC-02242 [0,1,0,0,0,0|1,0,2]=4 136 B6R0.3 CN(C)C(=O)CCl SC-25918 [0,1,0,0,0,0|2,0,1]=4 137 B6R0.3 CN(C)C(=O)CN SC-26411 [0,1,0,0,0,0|2,0,1]=4 138 B6R0.3 COC(=O)C(C)=O SC-15233 [0,1,0,0,0,0|2,0,1]=4 139 B6R0.3 COC(=O)C(C)Cl SC-18837 [0,1,0,0,0,0|2,0,0]=3 140 B6R0.3 COC(=O)C(C)N SC-09296 [0,1,0,0,0,0|2,0,0]=3 141 B6R0.3 COC(=O)C(C)N SC-54087 [0,1,0,0,0,0|2,0,0]=3 142 B6R0.3 COC(=O)C(C)O SC-01713 [0,1,0,0,0,0|2,0,0]=3 143 B6R0.3 COC(=O)[C@H](C)Cl SC-06555 [0,1,0,0,0,0|2,0,0]=3 144 B6R0.3 COC(=O)[C@H](C)N SC-09297 [0,1,0,0,0,0|2,0,0]=3 145 B6R0.3 COC(C)[C@@H](C)N SC-A2593 [0,1,0,0,0,0|2,0,1]=4 146 B6R0.4 CC(C)NCCCl SC-96276 [0,1,0,0,0,0|1,0,1]=3 147 B6R0.4 CC(C)OCCBr SC-50384 [0,1,0,0,0,0|1,0,1]=3 148 B6R0.4 CC\C=C\C(=O)O SC-92876 [0,1,0,0,0,0|2,0,1]=4 149 B6R0.4 CN(C)CCC=O SC-12823 [0,1,0,0,0,0|2,0,1]=4 150 B6R0.4 CN(C)CCCBr SC-12824 [0,1,0,0,0,0|1,0,2]=4 151 B6R0.4 CN(C)CCCBr SC-48972 [0,1,0,0,0,0|1,0,2]=4 152 B6R0.4 CN(C)CCCCl SC-18516 [0,1,0,0,0,0|1,0,2]=4 153 B6R0.4 CN(C)CCCCl SC-53120 [0,1,0,0,0,0|1,0,2]=4 154 B6R0.4 CN(C)\C=C\C#N SC-53543 [0,1,0,0,0,0|1,0,1]=3 155 B6R0.4 CNCCN(C)C SC-29103 [0,1,0,0,0,0|1,0,2]=4 156 B6R0.4 COCCN(C)C SC-21743 [0,1,0,0,0,0|1,0,2]=4 157 B6R0.4 CO\C=C\C(C)=O SC-71024 [0,1,0,0,0,0|1,0,1]=3 158 B6R0.4 O=C(O)\C=C\CBr SC-53654 [0,1,0,0,0,0|2,0,1]=4 159 B6R0.5 C=CC[P+](C)(C)C SC-95670 [0,1,0,0,0,0|1,0,2]=4 160 B6R0.5 C=CC[Si](C)(C)C SC-27741 [0,1,0,0,0,0|0,1,2]=4 161 B6R0.5 CC#C[Si](C)(C)C SC-47378 [0,1,0,0,0,0|0,1,2]=4 162 B6R0.5 CC(C)(C)CCCl SC-41626 [0,1,0,0,0,0|1,0,2]=4 163 B6R0.5 CC(C)(C)ON=O SC-15268 [0,1,0,0,0,0|3,0,0]=4 164 B6R0.5 CC(C)(N)CCO SC-89270 [0,1,0,0,0,0|1,0,2]=4 165 B6R0.5 CC(C)(O)CC#N SC-65608 [0,1,0,0,0,0|1,0,2]=4 166 B6R0.5 CC(C)(O)CCBr SC-A2798 [0,1,0,0,0,0|1,0,2]=4 167 B6R0.5 CC(C)(O)CCN SC-14242 [0,1,0,0,0,0|1,0,2]=4 168 B6R0.5 CC(C)(O)CCO SC-20680 [0,1,0,0,0,0|1,0,2]=4 169 B6R0.5 CCC[N+](C)(C)C SC-79778 [0,1,0,0,0,0|1,0,2]=4 170 B6R0.5 CCS[Si](C)(C)C SC-90297 [0,1,0,0,0,0|1,1,1]=4 171 B6R0.5 COC[P+](C)(C)C SC-95671 [0,1,0,0,0,0|2,0,1]=4 172 B6R0.5 C[SiH2]O[Si](C)(C)C SC-80489 [0,1,0,0,0,0|1,2,0]=4 173 B6R1.2 BrC1CCNC1 SC-24702 [0,0,0,1,0,0|2,0,1]=4 174 B6R1.2 BrC1CCOC1 SC-49709 [0,0,0,1,0,0|2,0,1]=4 175 B6R1.2 CC1=CC=CN1 SC-88412 [0,0,0,1,0,0|1,0,2]=4 176 B6R1.2 CC1=CC=NO1 SC-47380 [0,0,0,1,0,0|2,0,1]=4 177 B6R1.2 CC1=CCCC1 SC-46849 [0,0,0,1,0,0|0,0,2]=3 178 B6R1.2 CC1=CCCO1 SC-69814 [0,0,0,1,0,0|1,0,2]=4 179 B6R1.2 CC1=NCCC1 SC-07079 [0,0,0,1,0,0|1,0,2]=4 180 B6R1.2 CC1=NSC=C1 SC-89582 [0,0,0,1,0,0|2,0,1]=4 181 B6R1.2 CC1CCCN1 SC-89376 [0,0,0,1,0,0|1,0,1]=3 182 B6R1.2 CC1CCCN1 SC-A3822 [0,0,0,1,0,0|1,0,1]=3 183 B6R1.2 CC1CCNC1 SC-24125 [0,0,0,1,0,0|1,0,1]=3 184 B6R1.2 CC1CCNC1 SC-49333 [0,0,0,1,0,0|1,0,1]=3 185 B6R1.2 CN1C=CC=N1 SC-21037 [0,0,0,1,0,0|2,0,1]=4 186 B6R1.2 CN1C=CN=C1 SC-25626 [0,0,0,1,0,0|2,0,1]=4 187 B6R1.2 CN1C=CN=N1 SC-43779 [0,0,0,1,0,0|3,0,0]=4 188 B6R1.2 CN1CCCC1 SC-19022 [0,0,0,1,0,0|1,0,2]=4 189 B6R1.2 C[C@@H]1CCNC1 SC-23714 [0,0,0,1,0,0|1,0,1]=3 190 B6R1.2 C[C@@H]1CCNC1 SC-50232 [0,0,0,1,0,0|1,0,1]=3 191 B6R1.2 C[C@H]1CCCN1 SC-95860 [0,0,0,1,0,0|1,0,1]=3 192 B6R1.2 C[C@H]1CCNC1 SC-50233 [0,0,0,1,0,0|1,0,1]=3 193 B6R1.2 FC1CCCC1 SC-09548 [0,0,0,1,0,0|1,0,2]=4 194 B6R1.2 FC1CCNC1 SC-28940 [0,0,0,1,0,0|2,0,1]=4 195 B6R1.2 F[C@H]1CCNC1 SC-43922 [0,0,0,1,0,0|2,0,1]=4 196 B6R1.2 NC1CC=CC1 SC-21605 [0,0,0,1,0,0|1,0,2]=4 197 B6R1.2 NC1CCCC1 SC-84758 [0,0,0,1,0,0|1,0,2]=4 198 B6R1.2 NC1CCNC1 SC-18208 [0,0,0,1,0,0|2,0,1]=4 199 B6R1.2 NC1CCNC1 SC-62350 [0,0,0,1,0,0|2,0,1]=4 200 B6R1.2 NC1CCOC1 SC-12746 [0,0,0,1,0,0|2,0,1]=4 201 B6R1.2 NC1CCOC1 SC-35465 [0,0,0,1,0,0|2,0,1]=4 202 B6R1.2 N[C@@H]1CCOC1 SC-14942 [0,0,0,1,0,0|2,0,1]=4 203 B6R1.2 N[C@@H]1CCOC1 SC-26567 [0,0,0,1,0,0|2,0,1]=4 204 B6R1.2 N[C@H]1CCOC1 SC-14943 [0,0,0,1,0,0|2,0,1]=4 205 B6R1.2 O=C1C=CCC1 SC-07348 [0,0,0,1,0,0|1,0,1]=3 206 B6R1.2 O=C1C=CCN1 SC-67116 [0,0,0,1,0,0|2,0,1]=4 207 B6R1.2 O=C1C=CCO1 SC-50260 [0,0,0,1,0,0|2,0,1]=4 208 B6R1.2 OC1CC=CC1 SC-22908 [0,0,0,1,0,0|1,0,2]=4 209 B6R1.2 OC1CCCN1 SC-21341 [0,0,0,1,0,0|2,0,1]=4 210 B6R1.2 OC1CCNC1 SC-00623 [0,0,0,1,0,0|2,0,1]=4 211 B6R1.2 OC1CCNC1 SC-19629 [0,0,0,1,0,0|2,0,1]=4 212 B6R1.2 OC1CCNC1 SC-24957 [0,0,0,1,0,0|2,0,1]=4 213 B6R1.2 OC1CCNC1 SC-27708 [0,0,0,1,0,0|2,0,1]=4 214 B6R1.2 OC1CCOC1 SC-17875 [0,0,0,1,0,0|2,0,1]=4 215 B6R1.2 O[C@@H]1CCNC1 SC-00194 [0,0,0,1,0,0|2,0,1]=4 216 B6R1.2 O[C@@H]1CCNC1 SC-13984 [0,0,0,1,0,0|2,0,1]=4 217 B6R1.2 O[C@@H]1CCOC1 SC-07022 [0,0,0,1,0,0|2,0,1]=4 218 B6R1.2 O[C@H]1CCOC1 SC-08982 [0,0,0,1,0,0|2,0,1]=4 219 B6R1.2 O[C@H]1CCOC1 SC-50082 [0,0,0,1,0,0|2,0,1]=4 220 B6R1.2 [C@@H]1(C)CCCN1 SC-48604 [0,0,0,1,0,0|1,0,1]=3 221 B6R1.2 [C@H]1(O)CCNC1 SC-24229 [0,0,0,1,0,0|2,0,1]=4 222 B6R1.3 BrCCC1CC1 SC-52079 [0,0,0,1,0,0|1,0,2]=4 223 B6R1.3 CNCC1CC1 SC-47993 [0,0,0,1,0,0|1,0,1]=3 224 B6R1.3 COC[C@@H]1CO1 SC-09011 [0,0,0,1,0,0|2,0,1]=4 225 B6R1.3 COC[C@H]1CO1 SC-06042 [0,0,0,1,0,0|2,0,1]=4 226 B6R1.3 CSCC1CO1 SC-50532 [0,0,0,1,0,0|2,0,1]=4 227 B6R1.3 ICCC1CC1 SC-B7584 [0,0,0,1,0,0|1,0,2]=4 228 B6R1.3 N#CCC1CC1 SC-25467 [0,0,0,1,0,0|1,0,2]=4 229 B6R1.3 NCCC1CC1 SC-14247 [0,0,0,1,0,0|1,0,2]=4 230 B6R1.3 NCCC1CC1 SC-99606 [0,0,0,1,0,0|1,0,2]=4 231 B6R1.3 NNCC1CC1 SC-67047 [0,0,0,1,0,0|2,0,1]=4 232 B6R1.3 NOCC1CC1 SC-14038 [0,0,0,1,0,0|2,0,1]=4 233 B6R1.3 O=C=NC1CC1 SC-49054 [0,0,0,1,0,0|2,0,1]=4 234 B6R1.3 OCCC1CC1 SC-48582 [0,0,0,1,0,0|1,0,2]=4 235 B6R1.3 OCCC1CC1 SC-48583 [0,0,0,1,0,0|1,0,2]=4 236 B6R1.3 S=C=NC1CC1 SC-88590 [0,0,0,1,0,0|2,0,1]=4 237 B6R1.5 CN1CC(N)C1 SC-48566 [0,0,0,1,0,0|2,0,1]=4 238 B6R1.5 CN1CC(N)C1 SC-96394 [0,0,0,1,0,0|2,0,1]=4 239 B6R1.5 CN1CC(N)C1 SC-98163 [0,0,0,1,0,0|2,0,1]=4 240 B6R1.5 CN1CC(O)C1 SC-92160 [0,0,0,1,0,0|2,0,1]=4 241 B6R1.5 NC1CC(=O)C1 SC-50311 [0,0,0,1,0,0|2,0,1]=4 242 B6R1.5 NC1CC(=O)C1 SC-67476 [0,0,0,1,0,0|2,0,1]=4 243 B6R1.10 CC1(C)CNC1 SC-05287 [0,0,0,1,0,0|1,0,1]=3 244 B6R1.10 CC1(N)CCC1 SC-38385 [0,0,0,1,0,0|1,0,2]=4 245 B6R1.10 CC1(N)CCC1 SC-82175 [0,0,0,1,0,0|1,0,2]=4 246 B6R1.10 CC1(N)COC1 SC-25578 [0,0,0,1,0,0|2,0,1]=4 247 B6R1.10 CC1(O)CNC1 SC-43430 [0,0,0,1,0,0|2,0,1]=4 248 B6R1.11 CC(C)C1CO1 SC-72443 [0,0,0,1,0,0|1,0,1]=3 249 B6R1.11 CC(O)C1CC1 SC-19615 [0,0,0,1,0,0|1,0,2]=4 250 B6R1.11 CN(C)C1CC1 SC-00873 [0,0,0,1,0,0|1,0,2]=4 251 B6R1.11 C[C@@H](N)C1CC1 SC-83564 [0,0,0,1,0,0|1,0,2]=4 252 B6R1.11 C[C@H](N)C1CC1 SC-87033 [0,0,0,1,0,0|1,0,2]=4 253 B3R0.1 Br\C=C\Br SC-73800 [2,0,0,0,0,0|2,0,0]=4 254 B3R0.1 C=CCN SC-13610 [2,0,0,0,0,0|1,0,0]=3 255 B3R0.1 C=C[CH-]C SC-90438 [2,0,0,0,0,0|0,0,1]=3 256 B3R0.1 CCC[Zn+] SC-92929 [2,0,0,0,0,0|1,0,1]=4 257 B3R0.1 CCNN SC-47438 [2,0,0,0,0,0|2,0,0]=4 258 B3R0.1 CCNN SC-88458 [2,0,0,0,0,0|2,0,0]=4 259 B3R0.1 CCNO SC-82856 [2,0,0,0,0,0|2,0,0]=4 260 B3R0.1 CCO[NH3+] SC-76549 [2,0,0,0,0,0|2,0,0]=4 261 B3R0.1 CNNC SC-92981 [2,0,0,0,0,0|2,0,0]=4 262 B3R0.1 CNOC SC-17494 [2,0,0,0,0,0|2,0,0]=4 263 B3R0.1 CNOC SC-74340 [2,0,0,0,0,0|2,0,0]=4 264 B3R0.1 COCBr SC-13660 [2,0,0,0,0,0|2,0,0]=4 265 B3R0.1 C\C=C\Br SC-50117 [2,0,0,0,0,0|1,0,0]=3 266 B3R0.1 C\C=N\O SC-16388 [2,0,0,0,0,0|2,0,0]=4 267 B3R0.2 C=C(C)[Mg+] SC-70280 [2,0,0,0,0,0|1,0,1]=4 268 B3R0.2 CC(C)[O-] SC-43831 [2,0,0,0,0,0|1,0,0]=3 269 B3R0.2 CC(C)[O-] SC-94197 [2,0,0,0,0,0|1,0,0]=3 270 B3R0.2 CN(C)C SC-46902 [2,0,0,0,0,0|1,0,0]=3 271 B3R0.2 C[PH](C)=O SC-72909 [2,0,0,0,0,0|2,0,0]=4 272 B3R0.2 C[S+](C)C SC-68838 [2,0,0,0,0,0|1,0,0]=3 273 B3R0.2 C[S+](C)C SC-97925 [2,0,0,0,0,0|1,0,0]=3 274 B5R0.3 C=CC(Cl)CCl SC-A3373 [1,1,0,0,0,0|1,0,0]=3 275 B5R0.3 C=CC(O)C=C SC-20854 [1,1,0,0,0,0|1,0,1]=4 276 B5R0.3 C=CC(O)CC SC-93539 [1,1,0,0,0,0|1,0,0]=3 277 B5R0.3 C=C[C@H](N)CO SC-88199 [1,1,0,0,0,0|1,0,0]=3 278 B5R0.3 CC(CO)CBr SC-35572 [1,1,0,0,0,0|1,0,1]=4 279 B5R0.3 CCC(C)CO SC-08990 [1,1,0,0,0,0|0,0,1]=3 280 B5R0.3 CCC(N)CC SC-81736 [1,1,0,0,0,0|1,0,1]=4 281 B5R0.3 CCC(N)CO SC-21072 [1,1,0,0,0,0|1,0,1]=4 282 B5R0.3 CCC(O)CC SC-62307 [1,1,0,0,0,0|1,0,1]=4 283 B5R0.3 COC(C)CN SC-A4864 [1,1,0,0,0,0|1,0,0]=3 284 B5R0.3 CO[C@H](C)CO SC-71357 [1,1,0,0,0,0|1,0,0]=3 285 B5R0.3 O=CC(O)CO SC-04830 [1,1,0,0,0,0|2,0,0]=4 286 B5R0.3 [C@H](N)(CC)CO SC-08958 [1,1,0,0,0,0|1,0,1]=4 287 B5R0.4 C#CC(C)(C)C SC-22664 [1,1,0,0,0,0|0,0,2]=4 288 B5R0.4 C#CC(C)(C)N SC-16037 [1,1,0,0,0,0|0,0,2]=4 289 B5R0.4 C#CC(C)(C)O SC-26729 [1,1,0,0,0,0|0,0,2]=4 290 B5R0.4 C=CC(F)(F)Br SC-17077 [1,1,0,0,0,0|2,0,0]=4 291 B5R0.4 C=CS(C)(=O)=O SC-A3249 [1,1,0,0,0,0|2,0,0]=4 292 B5R0.4 C=C[Si](C)(C)C SC-24537 [1,1,0,0,0,0|0,1,0]=3 293 B5R0.4 CC(C)(Br)C#N SC-99785 [1,1,0,0,0,0|1,0,1]=4 294 B5R0.4 CC(C)(Br)CBr SC-97871 [1,1,0,0,0,0|1,0,1]=4 295 B5R0.4 CC(C)(C)C#N SC-77544 [1,1,0,0,0,0|1,0,1]=4 296 B5R0.4 CC(C)(C)C=O SC-05938 [1,1,0,0,0,0|1,0,0]=3 297 B5R0.4 CC(C)(C)CBr SC-24158 [1,1,0,0,0,0|1,0,1]=4 298 B5R0.4 CC(C)(C)CCl SC-48963 [1,1,0,0,0,0|1,0,1]=4 299 B5R0.4 CC(C)(C)CN SC-97733 [1,1,0,0,0,0|1,0,1]=4 300 B5R0.4 CC(C)(C)CO SC-27689 [1,1,0,0,0,0|1,0,1]=4 301 B5R0.4 CC(C)(C)NN SC-18273 [1,1,0,0,0,0|2,0,0]=4 302 B5R0.4 CC(C)(C)NO SC-44932 [1,1,0,0,0,0|2,0,0]=4 303 B5R0.4 CC(C)(C)ON SC-05608 [1,1,0,0,0,0|2,0,0]=4 304 B5R0.4 CC(C)(F)CBr SC-84038 [1,1,0,0,0,0|1,0,1]=4 305 B5R0.4 CC(C)(F)CO SC-14344 [1,1,0,0,0,0|1,0,1]=4 306 B5R0.4 CC(C)(N)C#N SC-14060 [1,1,0,0,0,0|1,0,1]=4 307 B5R0.4 CC(C)(N)CF SC-90380 [1,1,0,0,0,0|1,0,1]=4 308 B5R0.4 CC(C)(N)CN SC-47310 [1,1,0,0,0,0|1,0,1]=4 309 B5R0.4 CC(C)(N)CO SC-00654 [1,1,0,0,0,0|1,0,1]=4 310 B5R0.4 CC(C)(O)CBr SC-69889 [1,1,0,0,0,0|1,0,1]=4 311 B5R0.4 CC(C)(O)CCl SC-05342 [1,1,0,0,0,0|1,0,1]=4 312 B5R0.4 CC(C)(O)CN SC-14245 [1,1,0,0,0,0|1,0,1]=4 313 B5R0.4 CC(C)(O)CO SC-93601 [1,1,0,0,0,0|1,0,1]=4 314 B5R0.4 CCC(C)(C)[O-] SC-25920 [1,1,0,0,0,0|0,0,1]=3 315 B5R0.4 CO[Si](C)(C)C SC-36829 [1,1,0,0,0,0|1,1,0]=4 316 B5R0.4 CO[Si](C)(C)Cl SC-67305 [1,1,0,0,0,0|1,1,0]=4 317 B5R0.4 [C-]#[N+]C(C)(C)C SC-78147 [1,1,0,0,0,0|1,0,1]=4 318 B5R0.5 CC(=O)C(C)C SC-18478 [1,1,0,0,0,0|0,0,0]=2 319 B5R0.5 CC(=O)C(C)Cl SC-46981 [1,1,0,0,0,0|1,0,0]=3 320 B5R0.5 CC(=O)C(C)S SC-17208 [1,1,0,0,0,0|1,0,0]=3 321 B5R0.5 CC(=O)C(F)F SC-99156 [1,1,0,0,0,0|2,0,0]=4 322 B5R0.5 CC(=O)N(C)C SC-54108 [1,1,0,0,0,0|1,0,0]=3 323 B5R0.5 CC(Br)C(N)=O SC-97497 [1,1,0,0,0,0|2,0,0]=4 324 B5R0.5 CC(C)B(O)O SC-66620 [1,1,0,0,0,0|2,0,0]=4 325 B5R0.5 CC(C)C(=N)N SC-13079 [1,1,0,0,0,0|1,0,0]=3 326 B5R0.5 CC(C)N(C)C SC-90248 [1,1,0,0,0,0|1,0,0]=3 327 B5R0.5 CC(F)C(=O)O SC-83429 [1,1,0,0,0,0|2,0,0]=4 328 B5R0.5 CC(N)C(=O)O SC-09271 [1,1,0,0,0,0|2,0,0]=4 329 B5R0.5 CC(N)C(N)=O SC-94219 [1,1,0,0,0,0|2,0,0]=4 330 B5R0.5 CC(O)C(=O)[O-] SC-19308 [1,1,0,0,0,0|2,0,0]=4 331 B5R0.5 CC(O)C(=O)[O-] SC-25623 [1,1,0,0,0,0|2,0,0]=4 332 B5R0.5 CC(O)C(=O)[O-] SC-75139 [1,1,0,0,0,0|2,0,0]=4 333 B5R0.5 CC(O)C(C)O SC-08971 [1,1,0,0,0,0|1,0,1]=4 334 B5R0.5 CC(O)C(C)O SC-08972 [1,1,0,0,0,0|1,0,1]=4 335 B5R0.5 CC(O)C(C)O SC-81338 [1,1,0,0,0,0|1,0,1]=4 336 B5R0.5 CC(S)C(=O)O SC-74563 [1,1,0,0,0,0|2,0,0]=4 337 B5R0.5 CN(C)C(=O)Cl SC-15201 [1,1,0,0,0,0|2,0,0]=4 338 B5R0.5 CN(C)C(=S)Cl SC-15756 [1,1,0,0,0,0|2,0,0]=4 339 B5R0.5 CN(C)C(N)=S SC-A2077 [1,1,0,0,0,0|2,0,0]=4 340 B5R0.5 C[C@@H](Br)C(=O)O SC-08843 [1,1,0,0,0,0|2,0,0]=4 341 B5R0.5 C[C@@H](Cl)C(=O)O SC-06610 [1,1,0,0,0,0|2,0,0]=4 342 B5R0.5 C[C@@H](N)C(=O)O SC-09270 [1,1,0,0,0,0|2,0,0]=4 343 B5R0.5 C[C@@H](N)C(N)=O SC-09289 [1,1,0,0,0,0|2,0,0]=4 344 B5R0.5 C[C@@H](O)C(N)=O SC-92873 [1,1,0,0,0,0|2,0,0]=4 345 B5R0.5 C[C@H](Cl)C(=O)O SC-03218 [1,1,0,0,0,0|2,0,0]=4 346 B5R0.5 C[C@H](N)C(=O)O SC-09272 [1,1,0,0,0,0|2,0,0]=4 347 B5R0.5 C[C@H](N)C(N)=O SC-03542 [1,1,0,0,0,0|2,0,0]=4 348 B5R0.5 C[C@H](O)C(N)=O SC-73228 [1,1,0,0,0,0|2,0,0]=4 349 B5R0.5 [2H]C(=O)N(C)C SC-97589 [1,1,0,0,0,0|2,0,0]=4 350 B5R0.5 [C@@H](C)(Br)C(=O)O SC-03475 [1,1,0,0,0,0|2,0,0]=4 351 B5R0.2 BrC\C=C\CBr SC-06854 [1,1,0,0,0,0|1,0,0]=3 352 B5R0.2 C=CCCCBr SC-47340 [1,1,0,0,0,0|0,0,2]=4 353 B5R0.2 C=CCCCN SC-28944 [1,1,0,0,0,0|0,0,2]=4 354 B5R0.2 C=CCCCO SC-78424 [1,1,0,0,0,0|0,0,2]=4 355 B5R0.2 C=COCCO SC-22660 [1,1,0,0,0,0|1,0,1]=4 356 B5R0.2 CCC#CCBr SC-B0289 [1,1,0,0,0,0|0,0,2]=4 357 B5R0.2 CCSCCCl SC-43710 [1,1,0,0,0,0|1,0,1]=4 358 B5R0.2 CNCCCO SC-94106 [1,1,0,0,0,0|1,0,1]=4 359 B5R0.2 CNCCNC SC-19090 [1,1,0,0,0,0|1,0,1]=4 360 B5R0.2 CNCCOC SC-15056 [1,1,0,0,0,0|1,0,1]=4 361 B5R0.2 CNCCSC SC-74374 [1,1,0,0,0,0|1,0,1]=4 362 B5R0.2 CNCCSC SC-83575 [1,1,0,0,0,0|1,0,1]=4 363 B5R0.2 COCCC=O SC-85357 [1,1,0,0,0,0|1,0,1]=4 364 B5R0.2 COCCCBr SC-20920 [1,1,0,0,0,0|1,0,1]=4 365 B5R0.2 C\C=C\OCC SC-89361 [1,1,0,0,0,0|0,0,0]=2 366 B5R0.2 ClC\C=C\CCl SC-72167 [1,1,0,0,0,0|1,0,0]=3 367 B5R0.2 O=CCCCBr SC-69595 [1,1,0,0,0,0|1,0,1]=4 368 B5R0.2 OC\C=C/CO SC-27134 [1,1,0,0,0,0|1,0,0]=3 369 B5R0.2 OC\C=C\CBr SC-36162 [1,1,0,0,0,0|1,0,0]=3 370 B5R0.2 OC\C=C\CO SC-82263 [1,1,0,0,0,0|1,0,0]=3 371 B7R0.2 C=CC(=O)NC(C)C SC-47047 [0,2,0,0,0,0|0,0,1]=3 372 B7R0.2 CC(C)C[C@@H](N)CO SC-15764 [0,2,0,0,0,0|0,0,2]=4 373 B7R0.2 CC(C)C[C@H](N)CO SC-08985 [0,2,0,0,0,0|0,0,2]=4 374 B7R0.2 CC(C)NC(=O)CBr SC-02491 [0,2,0,0,0,0|1,0,0]=3 375 B7R0.2 CCC(C)CC(=O)O SC-19132 [0,2,0,0,0,0|1,0,1]=4 376 B7R0.2 CCC(O)CC(C)=O SC-92943 [0,2,0,0,0,0|1,0,1]=4 377 B7R0.2 COC(=O)CC(C)Br SC-67097 [0,2,0,0,0,0|1,0,1]=4 378 B7R0.2 COC(=O)C[C@@H](C)N SC-88822 [0,2,0,0,0,0|1,0,1]=4 379 B7R0.2 COC(=O)C[C@@H](C)N SC-A1096 [0,2,0,0,0,0|1,0,1]=4 380 B7R0.2 C\C(C=O)=C/N(C)C SC-93331 [0,2,0,0,0,0|1,0,0]=3 381 B7R0.3 COC(=O)\C=C\CBr SC-17676 [0,2,0,0,0,0|1,0,1]=4 382 B7R0.3 COC(=O)\C=C\CBr SC-49570 [0,2,0,0,0,0|1,0,1]=4 383 B7R0.3 CO\C=C\C(=O)OC SC-90792 [0,2,0,0,0,0|1,0,1]=4 384 B7R0.5 CC(C)C(=O)CC#N SC-26894 [0,2,0,0,0,0|0,0,2]=4 385 B7R0.5 CC(C)C(=O)OCCl SC-92989 [0,2,0,0,0,0|1,0,0]=3 386 B7R0.5 CCNC(=O)[C@H](C)O SC-12514 [0,2,0,0,0,0|1,0,1]=4 387 B7R0.5 CCOC(=O)C(C)Br SC-27136 [0,2,0,0,0,0|1,0,1]=4 388 B7R0.5 CCOC(=O)C(C)Cl SC-13657 [0,2,0,0,0,0|1,0,1]=4 389 B7R0.5 CCOC(=O)C(C)F SC-75945 [0,2,0,0,0,0|1,0,1]=4 390 B7R0.5 CCOC(=O)C(C)N SC-09294 [0,2,0,0,0,0|1,0,1]=4 391 B7R0.5 CCOC(=O)C(C)N SC-13100 [0,2,0,0,0,0|1,0,1]=4 392 B7R0.5 CCOC(=O)C(C)N SC-15274 [0,2,0,0,0,0|1,0,1]=4 393 B7R0.5 CCOC(=O)N(C)C SC-88157 [0,2,0,0,0,0|1,0,1]=4 394 B7R0.5 CCOC(=O)[C@@H](C)O SC-15791 [0,2,0,0,0,0|1,0,1]=4 395 B7R0.5 CNCC(=O)N(C)C SC-A2871 [0,2,0,0,0,0|1,0,1]=4 396 B7R0.7 CCOC(C)OCC SC-48313 [0,2,0,0,0,0|1,0,1]=4 397 B7R0.7 CCOC(C)OCC SC-76677 [0,2,0,0,0,0|1,0,1]=4 398 B7R0.10 CC[C@@H](O)C(=O)OC SC-49455 [0,2,0,0,0,0|2,0,0]=4 399 B7R0.10 CC[C@H](N)C(=O)OC SC-33322 [0,2,0,0,0,0|2,0,0]=4 400 B7R0.10 CC[C@H](N)C(=O)OC SC-91370 [0,2,0,0,0,0|2,0,0]=4 401 B7R0.10 CNC(C)C(=O)OC SC-82127 [0,2,0,0,0,0|1,0,0]=3 402 B7R0.10 CN[C@@H](C)C(=O)OC SC-84501 [0,2,0,0,0,0|1,0,0]=3 403 B7R0.10 COC(=O)C(Br)CO SC-87315 [0,2,0,0,0,0|2,0,0]=4 404 B7R0.10 COC(=O)C(Br)SC SC-83274 [0,2,0,0,0,0|2,0,0]=4 405 B7R0.10 COC(=O)C(C)CN SC-53925 [0,2,0,0,0,0|1,0,0]=3 406 B7R0.10 COC(=O)C(C)CO SC-08906 [0,2,0,0,0,0|1,0,0]=3 407 B7R0.10 COC(=O)C(C)CO SC-08907 [0,2,0,0,0,0|1,0,0]=3 408 B7R0.10 COC(=O)C(C)OC SC-92649 [0,2,0,0,0,0|1,0,0]=3 409 B7R0.10 COC(=O)C(Cl)CCl SC-48264 [0,2,0,0,0,0|2,0,0]=4 410 B7R0.10 COC(=O)C(N)CO SC-09862 [0,2,0,0,0,0|2,0,0]=4 411 B7R0.10 COC(=O)C(N)CO SC-51728 [0,2,0,0,0,0|2,0,0]=4 412 B7R0.10 COC(=O)[C@@H](C)CBr SC-08853 [0,2,0,0,0,0|1,0,0]=3 413 B7R0.10 COC(=O)[C@@H](N)CS SC-22400 [0,2,0,0,0,0|2,0,0]=4 414 B7R0.10 COC(=O)[C@@H](O)CO SC-44674 [0,2,0,0,0,0|2,0,0]=4 415 B7R0.10 COC(=O)[C@H](N)CCl SC-44813 [0,2,0,0,0,0|2,0,0]=4 416 B7R0.10 COC(=O)[C@H](N)CO SC-21448 [0,2,0,0,0,0|2,0,0]=4 417 B7R0.10 COC(=O)[C@H](N)CS SC-95830 [0,2,0,0,0,0|2,0,0]=4 418 B7R0.10 C\C=C(/Br)C(=O)OC SC-89362 [0,2,0,0,0,0|1,0,1]=4 419 B7R0.11 CCCC(C)(Br)CBr SC-94098 [0,2,0,0,0,0|0,0,2]=4 420 B7R0.12 CNCC(OC)OC SC-26635 [0,2,0,0,0,0|1,0,1]=4 421 B7R0.12 COCC(OC)OC SC-73556 [0,2,0,0,0,0|1,0,1]=4 422 B7R0.9 CC(=O)CC(C)(C)S SC-82919 [0,2,0,0,0,0|0,0,1]=3 423 B7R0.9 CC(=O)N[Si](C)(C)C SC-10615 [0,2,0,0,0,0|1,1,0]=4 424 B7R0.9 CC(=O)OC(C)(C)C SC-22684 [0,2,0,0,0,0|1,0,0]=3 425 B7R0.9 CC(C)(C)OC(N)=O SC-44399 [0,2,0,0,0,0|2,0,0]=4 426 B7R0.9 CC(C)(N)CC(=O)O SC-43668 [0,2,0,0,0,0|1,0,1]=4 427 B7R0.9 CC(C)(O)CC(=O)[O-] SC-17999 [0,2,0,0,0,0|1,0,1]=4 428 B7R0.9 CN(C)CC(C)(C)O SC-48956 [0,2,0,0,0,0|1,0,1]=4 429 B7R0.16 CC(C)C(=O)C(=O)O SC-27422 [0,2,0,0,0,0|1,0,0]=3 430 B7R0.16 CC(C)C(=O)C(=O)[O-] SC-13686 [0,2,0,0,0,0|1,0,0]=3 431 B7R0.16 CC(C)C(Br)C(=O)O SC-26681 [0,2,0,0,0,0|1,0,1]=4 432 B7R0.16 CC(C)C(N)C(=O)O SC-09983 [0,2,0,0,0,0|1,0,1]=4 433 B7R0.16 CC(C)C(N)C(=O)O SC-09984 [0,2,0,0,0,0|1,0,1]=4 434 B7R0.16 CC(C)C(N)C(=O)O SC-09985 [0,2,0,0,0,0|1,0,1]=4 435 B7R0.16 CC(C)C(O)C(=O)O SC-A2103 [0,2,0,0,0,0|1,0,1]=4 436 B7R0.16 CC(C)[C@@H](O)C(=O)O SC-01716 [0,2,0,0,0,0|1,0,1]=4 437 B7R0.16 CC(C)[C@H](N)C(N)=O SC-19666 [0,2,0,0,0,0|1,0,1]=4 438 B7R0.16 CC(C)[SiH](Cl)C(C)C SC-75667 [0,2,0,0,0,0|0,1,1]=4 439 B7R0.16 CN(C)C(=O)N(C)C SC-18367 [0,2,0,0,0,0|2,0,0]=4 440 B7R0.16 CN(C)C(Cl)=[N+](C)C SC-05525 [0,2,0,0,0,0|2,0,0]=4 441 B7R0.16 CN(C)C(Cl)=[N+](C)C SC-68014 [0,2,0,0,0,0|2,0,0]=4 442 B7R0.14 CC(C)(C)C(=O)CBr SC-15347 [0,2,0,0,0,0|1,0,1]=4 443 B7R0.14 CC(C)(C)C(=O)CCl SC-26808 [0,2,0,0,0,0|1,0,1]=4 444 B7R0.14 CC(C)(C)C(=O)CN SC-14097 [0,2,0,0,0,0|1,0,1]=4 445 B7R0.14 COC(=O)C(C)(C)Br SC-13472 [0,2,0,0,0,0|1,0,0]=3 446 B7R0.14 COC(=O)C(C)(C)F SC-27575 [0,2,0,0,0,0|1,0,0]=3 447 B7R0.14 COC(=O)C(C)(C)N SC-53222 [0,2,0,0,0,0|1,0,0]=3 448 B7R0.4 CCC\C=C\C(C)=O SC-49007 [0,2,0,0,0,0|1,0,1]=4 449 B7R0.6 CC(=O)OCC(C)C SC-25600 [0,2,0,0,0,0|0,0,1]=3 450 B7R0.6 CC(=O)\C=C\N(C)C SC-92543 [0,2,0,0,0,0|1,0,0]=3 451 B7R0.6 CC(C)CCC(=O)O SC-57917 [0,2,0,0,0,0|1,0,1]=4 452 B7R0.6 CC(C)CNC(N)=S SC-88305 [0,2,0,0,0,0|1,0,1]=4 453 B7R0.6 CC(C)OCC(=O)O SC-88240 [0,2,0,0,0,0|1,0,1]=4 454 B7R0.6 CN(C)\C=C\[N+](=O)[O-] SC-16745 [0,2,0,0,0,0|2,0,0]=4 455 B7R0.8 CCNCC(C)(C)O SC-97759 [0,2,0,0,0,0|0,0,2]=4 456 B7R0.8 C[Si](C)(C)\C=C\CO SC-86258 [0,2,0,0,0,0|0,1,0]=3 457 B7R0.8 OC\C=C/C(F)(F)F SC-A4877 [0,2,0,0,0,0|2,0,0]=4 458 B7R0.8 OC\C=C\C(F)(F)F SC-45918 [0,2,0,0,0,0|2,0,0]=4 459 B5R1.2 BrC1CCC1 SC-50402 [1,0,0,1,0,0|1,0,1]=4 460 B5R1.2 CC1CCN1 SC-70091 [1,0,0,1,0,0|1,0,0]=3 461 B5R1.2 CC1CCN1 SC-A3607 [1,0,0,1,0,0|1,0,0]=3 462 B5R1.2 CC1CCN1 SC-A3960 [1,0,0,1,0,0|1,0,0]=3 463 B5R1.2 CC1CNC1 SC-50429 [1,0,0,1,0,0|1,0,1]=4 464 B5R1.2 IC1CCC1 SC-92367 [1,0,0,1,0,0|1,0,1]=4 465 B5R1.2 NC1CCC1 SC-20422 [1,0,0,1,0,0|1,0,1]=4 466 B5R1.3 BrCC1CC1 SC-16841 [1,0,0,1,0,0|1,0,1]=4 467 B5R1.3 C#CC1CC1 SC-22635 [1,0,0,1,0,0|0,0,2]=4 468 B5R1.3 C=CC1CO1 SC-72377 [1,0,0,1,0,0|1,0,0]=3 469 B5R1.3 CC[C@@H]1CO1 SC-52802 [1,0,0,1,0,0|1,0,1]=4 470 B5R1.3 ClCC1CC1 SC-27742 [1,0,0,1,0,0|1,0,1]=4 471 B5R1.3 N#CC1CC1 SC-17549 [1,0,0,1,0,0|1,0,1]=4 472 B5R1.3 NCC1CC1 SC-16854 [1,0,0,1,0,0|1,0,1]=4 473 B5R1.3 NCC1CC1 SC-95616 [1,0,0,1,0,0|1,0,1]=4 474 B5R1.3 NNC1CC1 SC-65163 [1,0,0,1,0,0|2,0,0]=4 475 B5R1.3 NNC1CC1 SC-68908 [1,0,0,1,0,0|2,0,0]=4 476 B5R1.3 NNC1CC1 SC-A3090 [1,0,0,1,0,0|2,0,0]=4 477 B5R1.3 NOC1CC1 SC-84445 [1,0,0,1,0,0|2,0,0]=4 478 B5R1.3 O=CC1CC1 SC-18902 [1,0,0,1,0,0|1,0,0]=3 479 B5R1.3 OCC1CC1 SC-02886 [1,0,0,1,0,0|1,0,1]=4 480 B5R1.5 CC1(C)CO1 SC-77899 [1,0,0,1,0,0|1,0,0]=3 481 B5R1.5 CC1(N)CC1 SC-43846 [1,0,0,1,0,0|1,0,1]=4 482 B5R1.5 CC1(N)CC1 SC-69791 [1,0,0,1,0,0|1,0,1]=4 483 B5R1.1 C1=CCC=C1 SC-76630 [1,0,0,1,0,0|0,0,2]=4 484 B5R1.1 C1=CCCC1 SC-18920 [1,0,0,1,0,0|0,0,0]=2 485 B5R1.1 C1=CCOC1 SC-47076 [1,0,0,1,0,0|1,0,0]=3 486 B5R1.1 C1=CNCC1 SC-88946 [1,0,0,1,0,0|1,0,0]=3 487 B5R1.1 [C-]1=CC=CC1 SC-15776 [1,0,0,1,0,0|0,0,2]=4 488 B7R1.1 BrCC1CCCC1 SC-04017 [0,1,0,1,0,0|0,0,2]=4 489 B7R1.1 BrCC1CCCO1 SC-00526 [0,1,0,1,0,0|1,0,1]=4 490 B7R1.1 CCC1CCCN1 SC-29181 [0,1,0,1,0,0|1,0,1]=4 491 B7R1.1 CNC1CCCC1 SC-52894 [0,1,0,1,0,0|0,0,2]=4 492 B7R1.1 CNC1CCCC1 SC-A3381 [0,1,0,1,0,0|0,0,2]=4 493 B7R1.1 CNC1CCOC1 SC-81912 [0,1,0,1,0,0|1,0,1]=4 494 B7R1.1 CN[C@@H]1CCOC1 SC-A2281 [0,1,0,1,0,0|1,0,1]=4 495 B7R1.1 COC1CCNC1 SC-12454 [0,1,0,1,0,0|1,0,1]=4 496 B7R1.1 COC1CCNC1 SC-24177 [0,1,0,1,0,0|1,0,1]=4 497 B7R1.1 CO[C@@H]1CCNC1 SC-25526 [0,1,0,1,0,0|1,0,1]=4 498 B7R1.1 CO[C@@H]1CCNC1 SC-51990 [0,1,0,1,0,0|1,0,1]=4 499 B7R1.1 CO[C@H]1CCNC1 SC-25506 [0,1,0,1,0,0|1,0,1]=4 500 B7R1.1 ICC1CCOC1 SC-26534 [0,1,0,1,0,0|1,0,1]=4 501 B7R1.1 NCC1CCCC1 SC-22285 [0,1,0,1,0,0|0,0,2]=4 502 B7R1.1 NCC1CCCC1 SC-25234 [0,1,0,1,0,0|0,0,2]=4 503 B7R1.1 NCC1CCCN1 SC-98158 [0,1,0,1,0,0|1,0,1]=4 504 B7R1.1 NCC1CCOC1 SC-12415 [0,1,0,1,0,0|1,0,1]=4 505 B7R1.1 NC[C@@H]1CCCO1 SC-28608 [0,1,0,1,0,0|1,0,1]=4 506 B7R1.1 OCC1C=CCN1 SC-92889 [0,1,0,1,0,0|1,0,0]=3 507 B7R1.1 OCC1CC=CC1 SC-45771 [0,1,0,1,0,0|0,0,2]=4 508 B7R1.1 OCC1CCCC1 SC-03842 [0,1,0,1,0,0|0,0,2]=4 509 B7R1.1 OCC1CCCN1 SC-12006 [0,1,0,1,0,0|1,0,1]=4 510 B7R1.1 OCC1CCCO1 SC-94849 [0,1,0,1,0,0|1,0,1]=4 511 B7R1.1 OCC1CCOC1 SC-21250 [0,1,0,1,0,0|1,0,1]=4 512 B7R1.1 OC[C@@H]1CCCN1 SC-02696 [0,1,0,1,0,0|1,0,1]=4 513 B7R1.1 OC[C@@H]1CCCN1 SC-48321 [0,1,0,1,0,0|1,0,1]=4 514 B7R1.1 OC[C@@H]1CCCO1 SC-20330 [0,1,0,1,0,0|1,0,1]=4 515 B7R1.1 OC[C@@H]1CCNC1 SC-48002 [0,1,0,1,0,0|1,0,1]=4 516 B7R1.1 OC[C@H]1CCCN1 SC-06270 [0,1,0,1,0,0|1,0,1]=4 517 B7R1.2 CC1=CC(=O)CC1 SC-18727 [0,1,0,1,0,0|0,0,1]=3 518 B7R1.2 CC1=CC(=O)OC1 SC-25541 [0,1,0,1,0,0|1,0,1]=4 519 B7R1.2 CC1=CC(C)=NN1 SC-22787 [0,1,0,1,0,0|1,0,1]=4 520 B7R1.2 CC1=CC(C)=NO1 SC-03263 [0,1,0,1,0,0|1,0,1]=4 521 B7R1.2 CC1=CNC(C)=C1 SC-77541 [0,1,0,1,0,0|0,0,2]=4 522 B7R1.2 CC1=CNC(C)=N1 SC-75359 [0,1,0,1,0,0|1,0,1]=4 523 B7R1.2 CC1=CSC(C)=C1 SC-81879 [0,1,0,1,0,0|0,0,2]=4 524 B7R1.2 CC1=CSC(C)=N1 SC-05201 [0,1,0,1,0,0|1,0,1]=4 525 B7R1.2 CC1CCC(=O)C1 SC-93748 [0,1,0,1,0,0|0,0,1]=3 526 B7R1.2 CC1CNC(=O)C1 SC-50248 [0,1,0,1,0,0|1,0,1]=4 527 B7R1.2 CC1COC(=O)C1 SC-60836 [0,1,0,1,0,0|1,0,1]=4 528 B7R1.2 CC1COC(=O)O1 SC-65189 [0,1,0,1,0,0|2,0,0]=4 529 B7R1.2 CN1C=C[N+](C)=C1 SC-83530 [0,1,0,1,0,0|1,0,1]=4 530 B7R1.2 C[C@H]1COC(=O)N1 SC-51056 [0,1,0,1,0,0|2,0,0]=4 531 B7R1.2 C[C@H]1COC(=O)O1 SC-04943 [0,1,0,1,0,0|2,0,0]=4 532 B7R1.3 CC1=CCCCC1 SC-99243 [0,1,0,1,0,0|0,0,2]=4 533 B7R1.3 CC1=CCCNC1 SC-82898 [0,1,0,1,0,0|0,0,2]=4 534 B7R1.3 CC1=CCNCC1 SC-B8899 [0,1,0,1,0,0|0,0,2]=4 535 B7R1.3 CC1CCCCC1 SC-79075 [0,1,0,1,0,0|0,0,2]=4 536 B7R1.3 CC1CCCNC1 SC-46299 [0,1,0,1,0,0|0,0,2]=4 537 B7R1.3 CC1CCNCC1 SC-05890 [0,1,0,1,0,0|0,0,2]=4 538 B7R1.3 CC1CNCCO1 SC-49158 [0,1,0,1,0,0|1,0,1]=4 539 B7R1.3 CC1CNCCO1 SC-82780 [0,1,0,1,0,0|1,0,1]=4 540 B7R1.3 CC1CNCCO1 SC-A3535 [0,1,0,1,0,0|1,0,1]=4 541 B7R1.3 CC1COCCN1 SC-49161 [0,1,0,1,0,0|1,0,1]=4 542 B7R1.3 C[C@@H]1CNCCO1 SC-43965 [0,1,0,1,0,0|1,0,1]=4 543 B7R1.3 C[C@@H]1CNCCO1 SC-88816 [0,1,0,1,0,0|1,0,1]=4 544 B7R1.3 C[C@@H]1COCCN1 SC-53994 [0,1,0,1,0,0|1,0,1]=4 545 B7R1.3 C[C@H]1CCCNC1 SC-99949 [0,1,0,1,0,0|0,0,2]=4 546 B7R1.3 C[C@H]1CNCCO1 SC-44479 [0,1,0,1,0,0|1,0,1]=4 547 B7R1.3 C[C@H]1COCCN1 SC-21564 [0,1,0,1,0,0|1,0,1]=4 548 B7R1.3 C[C@H]1COCCN1 SC-69967 [0,1,0,1,0,0|1,0,1]=4 549 B7R1.3 O=C1C=CCCN1 SC-25185 [0,1,0,1,0,0|1,0,1]=4 550 B7R1.3 O=C1C=CCCO1 SC-50374 [0,1,0,1,0,0|1,0,1]=4 551 B7R1.3 OC1CC=CCC1 SC-87372 [0,1,0,1,0,0|1,0,0]=3 552 B7R1.3 [C@H]1(C)CNCCN1 SC-16783 [0,1,0,1,0,0|1,0,1]=4 553 B7R1.4 CC1=CCCC1=O SC-15856 [0,1,0,1,0,0|1,0,1]=4 554 B7R1.4 CC1=NC=CN1C SC-79883 [0,1,0,1,0,0|2,0,0]=4 555 B7R1.4 CC1CCCC1=O SC-89605 [0,1,0,1,0,0|0,0,1]=3 556 B7R1.4 CC1CCNC1=O SC-21672 [0,1,0,1,0,0|1,0,0]=3 557 B7R1.4 CC1CCOC1=O SC-20996 [0,1,0,1,0,0|1,0,0]=3 558 B7R1.4 CN1CCNC1=O SC-89793 [0,1,0,1,0,0|2,0,0]=4 559 B7R1.4 NC1CCNC1=O SC-13910 [0,1,0,1,0,0|2,0,0]=4 560 B7R1.4 NC1CCNC1=O SC-53072 [0,1,0,1,0,0|2,0,0]=4 561 B7R1.4 N[C@@H]1CCNC1=O SC-65959 [0,1,0,1,0,0|2,0,0]=4 562 B7R1.4 N[C@@H]1CCNC1=O SC-A2225 [0,1,0,1,0,0|2,0,0]=4 563 B7R1.4 N[C@@H]1CCOC1=O SC-28003 [0,1,0,1,0,0|2,0,0]=4 564 B7R1.4 N[C@H]1CCNC1=O SC-96457 [0,1,0,1,0,0|2,0,0]=4 565 B7R1.4 N[C@H]1CCOC1=O SC-01385 [0,1,0,1,0,0|2,0,0]=4 566 B7R1.4 N[C@H]1CCOC1=O SC-28113 [0,1,0,1,0,0|2,0,0]=4 567 B7R1.4 O=C1CCCC1Cl SC-21538 [0,1,0,1,0,0|1,0,1]=4 568 B7R1.4 O=C1NCCC1O SC-26159 [0,1,0,1,0,0|2,0,0]=4 569 B7R1.4 O=C1NCC[C@H]1O SC-87526 [0,1,0,1,0,0|2,0,0]=4 570 B7R1.4 O=C1OCCC1Br SC-15437 [0,1,0,1,0,0|2,0,0]=4 571 B7R1.6 CCOC1CNC1 SC-28573 [0,1,0,1,0,0|1,0,1]=4 572 B7R1.6 CCOC1CNC1 SC-48702 [0,1,0,1,0,0|1,0,1]=4 573 B7R1.6 CNCC1COC1 SC-82720 [0,1,0,1,0,0|1,0,1]=4 574 B7R1.10 CN1CC(CN)C1 SC-21131 [0,1,0,1,0,0|1,0,1]=4 575 B7R1.10 O=C1CC(CO)C1 SC-86648 [0,1,0,1,0,0|1,0,1]=4 576 B7R1.21 COCC1(N)CC1 SC-94843 [0,1,0,1,0,0|1,0,1]=4 577 B7R1.22 COC(=O)C1CC1 SC-16131 [0,1,0,1,0,0|1,0,0]=3 578 B7R1.22 NNC(=O)C1CC1 SC-B6986 [0,1,0,1,0,0|2,0,0]=4 579 B7R1.22 N\C(=N/O)C1CC1 SC-23549 [0,1,0,1,0,0|2,0,0]=4 580 B7R1.22 O=C(CBr)C1CC1 SC-20322 [0,1,0,1,0,0|1,0,1]=4 581 B7R1.25 CC1(CO)COC1 SC-27080 [0,1,0,1,0,0|1,0,1]=4 582 B7R1.25 COC1(C)CNC1 SC-50109 [0,1,0,1,0,0|1,0,1]=4 583 B7R1.20 CC(=O)CC1CC1 SC-21396 [0,1,0,1,0,0|0,0,1]=3 584 B7R1.20 NC(=O)NC1CC1 SC-84633 [0,1,0,1,0,0|2,0,0]=4 585 B7R1.20 O=C(O)CC1CC1 SC-13938 [0,1,0,1,0,0|1,0,1]=4 586 B7R1.7 CC\C=C\[C@H]1CO1 SC-A2838 [0,1,0,1,0,0|1,0,0]=3 587 B7R1.14 CC1(C)CCCN1 SC-89406 [0,1,0,1,0,0|0,0,2]=4 588 B7R1.14 CC1(C)CCNC1 SC-B8345 [0,1,0,1,0,0|0,0,2]=4 589 B7R1.14 CC1(C)COC=N1 SC-69344 [0,1,0,1,0,0|1,0,0]=3 590 B7R1.14 CC1(C)COCN1 SC-A4039 [0,1,0,1,0,0|1,0,1]=4 591 B7R1.14 CC1(C)NCCS1 SC-13595 [0,1,0,1,0,0|1,0,1]=4 592 B7R1.14 CC1(O)CCNC1 SC-65706 [0,1,0,1,0,0|1,0,1]=4 593 B7R1.14 CP1(=O)C=CCO1 SC-93562 [0,1,0,1,0,0|2,0,0]=4 594 B7R1.14 C[C@]1(O)CCNC1 SC-91785 [0,1,0,1,0,0|1,0,1]=4 595 B7R1.26 CC(C)(N)C1CC1 SC-A2814 [0,1,0,1,0,0|0,0,2]=4 596 B7R2.13 C1CC2CC2N1 SC-A3242 [0,0,0,2,0,0|1,0,1]=4 597 B7R2.13 C1NCC2CC12 SC-88257 [0,0,0,2,0,0|1,0,1]=4