0 B5R0.3 C#CC(=O)OC SC-27849 [0,0,0,0,0,0|0,0,2]=2 1 B5R0.3 C=CC(Cl)CCl SC-A3373 [0,0,0,0,0,0|3,0,1]=4 2 B5R0.3 C=CC(O)C=C SC-20854 [0,0,0,0,0,0|1,0,3]=4 3 B5R0.3 C=CC(O)CC SC-93539 [0,0,0,0,0,0|1,0,2]=3 4 B5R0.3 C=C[C@H](N)CO SC-88199 [0,0,0,0,0,0|3,0,1]=4 5 B5R0.3 CCC(=O)NN SC-25039 [0,0,0,0,0,0|3,0,0]=3 6 B5R0.3 CC[PH](=O)CC SC-96905 [0,0,0,0,0,0|2,0,2]=4 7 B5R0.3 CC\C(N)=N\O SC-28960 [0,0,0,0,0,0|4,0,0]=4 8 B5R0.3 CNC(=O)CBr SC-27946 [0,0,0,0,0,0|2,0,1]=3 9 B5R0.3 CNC(=O)CN SC-47802 [0,0,0,0,0,0|2,0,1]=3 10 B5R0.3 CNC(=O)OC SC-97890 [0,0,0,0,0,0|1,0,1]=2 11 B5R0.3 COC(=O)C#N SC-49091 [0,0,0,0,0,0|1,0,1]=2 12 B5R0.3 COC(=O)CBr SC-15855 [0,0,0,0,0,0|1,0,1]=2 13 B5R0.3 COC(=O)CN SC-09571 [0,0,0,0,0,0|1,0,1]=2 14 B5R0.3 COC(=O)CN SC-49390 [0,0,0,0,0,0|1,0,1]=2 15 B5R0.3 COC(=O)CO SC-28291 [0,0,0,0,0,0|1,0,1]=2 16 B5R0.3 COC(=O)CS SC-54102 [0,0,0,0,0,0|1,0,1]=2 17 B5R0.3 COC(C)CN SC-A4864 [0,0,0,0,0,0|2,0,2]=4 18 B5R0.3 COS(=O)OC SC-25522 [0,0,0,0,0,0|2,0,1]=3 19 B5R0.3 CO[C@H](C)CO SC-71357 [0,0,0,0,0,0|2,0,2]=4 20 B5R0.3 CSC(=S)SC SC-19457 [0,0,0,0,0,0|1,2,1]=4 21 B5R0.3 CS\C(N)=N\N SC-47788 [0,0,0,0,0,0|3,1,0]=4 22 B5R0.3 NNC(=O)CO SC-83204 [0,0,0,0,0,0|3,0,1]=4 23 B5R0.3 O=C(CBr)CBr SC-99341 [0,0,0,0,0,0|3,0,1]=4 24 B5R0.3 O=C(CO)CO SC-07450 [0,0,0,0,0,0|3,0,1]=4 25 B4R0.1 C#CC(=O)O SC-46968 [1,0,0,0,0,0|0,0,2]=3 26 B4R0.1 C=C(Br)CBr SC-46621 [1,0,0,0,0,0|3,0,0]=4 27 B4R0.1 C=C(C)C=O SC-83411 [1,0,0,0,0,0|2,0,0]=3 28 B4R0.1 C=C(C)CBr SC-50158 [1,0,0,0,0,0|2,0,1]=4 29 B4R0.1 C=C(C)CF SC-89300 [1,0,0,0,0,0|2,0,1]=4 30 B4R0.1 C=C(C)CN SC-43404 [1,0,0,0,0,0|2,0,1]=4 31 B4R0.1 C=C(C)CN SC-84159 [1,0,0,0,0,0|2,0,1]=4 32 B4R0.1 C=CC(=O)[O-] SC-19971 [1,0,0,0,0,0|0,0,1]=2 33 B4R0.1 C=CC(C)O SC-43661 [1,0,0,0,0,0|0,0,2]=3 34 B4R0.1 C=C[C@H](C)N SC-67439 [1,0,0,0,0,0|1,0,1]=3 35 B4R0.1 CC(=O)C#N SC-51001 [1,0,0,0,0,0|1,0,1]=3 36 B4R0.1 CC(=O)C=O SC-74380 [1,0,0,0,0,0|1,0,0]=2 37 B4R0.1 CC(=O)CBr SC-20936 [1,0,0,0,0,0|1,0,1]=3 38 B4R0.1 CC(=O)CN SC-28532 [1,0,0,0,0,0|1,0,1]=3 39 B4R0.1 CC(=O)CN SC-89750 [1,0,0,0,0,0|1,0,1]=3 40 B4R0.1 CC(=O)NO SC-18498 [1,0,0,0,0,0|2,0,0]=3 41 B4R0.1 CC(C)=CBr SC-52196 [1,0,0,0,0,0|2,0,0]=3 42 B4R0.1 CC(C)=NN SC-92874 [1,0,0,0,0,0|3,0,0]=4 43 B4R0.1 CC(C)=NO SC-25907 [1,0,0,0,0,0|3,0,0]=4 44 B4R0.1 CCC(=N)N SC-53846 [1,0,0,0,0,0|3,0,0]=4 45 B4R0.1 CCC(=O)O SC-22887 [1,0,0,0,0,0|0,0,2]=3 46 B4R0.1 CCC(=O)[O-] SC-47286 [1,0,0,0,0,0|2,0,0]=3 47 B4R0.1 CCC(N)=O SC-18213 [1,0,0,0,0,0|2,0,0]=3 48 B4R0.1 CCS(=O)[O-] SC-20356 [1,0,0,0,0,0|3,0,0]=4 49 B4R0.1 CNC(=N)N SC-18775 [1,0,0,0,0,0|3,0,0]=4 50 B4R0.1 CNC(=N)N SC-78334 [1,0,0,0,0,0|3,0,0]=4 51 B4R0.1 CNC(N)=O SC-15862 [1,0,0,0,0,0|2,0,0]=3 52 B4R0.1 COC(Cl)Cl SC-04782 [1,0,0,0,0,0|2,0,1]=4 53 B4R0.1 COP(Cl)Cl SC-92048 [1,0,0,0,0,0|3,0,0]=4 54 B4R0.1 CSC(=N)N SC-97881 [1,0,0,0,0,0|2,1,0]=4 55 B4R0.1 C\C(N)=N\O SC-29589 [1,0,0,0,0,0|3,0,0]=4 56 B4R0.1 C\C=C(\C)Br SC-91379 [1,0,0,0,0,0|1,0,1]=3 57 B4R0.1 NC(=O)CBr SC-17752 [1,0,0,0,0,0|2,0,1]=4 58 B4R0.1 NC(=O)CI SC-18913 [1,0,0,0,0,0|2,0,1]=4 59 B4R0.1 NC(=O)NO SC-17803 [1,0,0,0,0,0|3,0,0]=4 60 B4R0.1 NCC(=O)O SC-26884 [1,0,0,0,0,0|1,0,1]=3 61 B4R0.1 NCC(N)=O SC-09567 [1,0,0,0,0,0|2,0,1]=4 62 B4R0.1 NCC(N)=O SC-18427 [1,0,0,0,0,0|2,0,1]=4 63 B4R0.1 NNC(N)=O SC-18463 [1,0,0,0,0,0|3,0,0]=4 64 B4R0.1 NNC(N)=O SC-47308 [1,0,0,0,0,0|3,0,0]=4 65 B4R0.1 O=C(Br)CBr SC-18428 [1,0,0,0,0,0|2,0,1]=4 66 B4R0.1 O=C(Cl)CBr SC-49267 [1,0,0,0,0,0|2,0,1]=4 67 B4R0.1 O=C(O)CBr SC-18211 [1,0,0,0,0,0|1,0,1]=3 68 B4R0.1 O=C(O)CO SC-23119 [1,0,0,0,0,0|1,0,1]=3 69 B4R0.1 O=C(O)CO SC-26092 [1,0,0,0,0,0|1,0,1]=3 70 B4R0.1 O=C([O-])CI SC-80290 [1,0,0,0,0,0|1,0,2]=4 71 B4R0.1 O=CC(=O)O SC-25819 [1,0,0,0,0,0|1,0,0]=2 72 B4R0.2 C=CCCCl SC-90795 [1,0,0,0,0,0|2,0,1]=4 73 B4R0.2 C=CCCN SC-48242 [1,0,0,0,0,0|2,0,1]=4 74 B4R0.2 C=CCCN SC-52106 [1,0,0,0,0,0|2,0,1]=4 75 B4R0.2 C=CCCO SC-45284 [1,0,0,0,0,0|2,0,1]=4 76 B4R0.2 C=CCNC SC-05902 [1,0,0,0,0,0|1,0,1]=3 77 B4R0.2 C=CCON SC-96333 [1,0,0,0,0,0|1,0,1]=3 78 B4R0.2 C=CCSC SC-47211 [1,0,0,0,0,0|0,1,1]=3 79 B4R0.2 COCC=O SC-48883 [1,0,0,0,0,0|1,0,1]=3 80 B4R0.2 COCCCl SC-05903 [1,0,0,0,0,0|1,0,2]=4 81 B4R0.2 COCCN SC-22236 [1,0,0,0,0,0|1,0,2]=4 82 B4R0.2 C\C=C/CO SC-69832 [1,0,0,0,0,0|2,0,1]=4 83 B4R0.2 C\C=C\CCl SC-22573 [1,0,0,0,0,0|2,0,1]=4 84 B4R0.2 C\C=C\CO SC-25521 [1,0,0,0,0,0|2,0,1]=4 85 B4R0.2 C\C=C\CO SC-69597 [1,0,0,0,0,0|2,0,1]=4 86 B4R0.2 C\C=C\OC SC-97407 [1,0,0,0,0,0|0,0,1]=2 87 B4R0.2 Cl\C=C\CCl SC-17396 [1,0,0,0,0,0|3,0,0]=4 88 B6R0.1 C#CC(=O)OCC SC-05846 [0,1,0,0,0,0|0,0,2]=3 89 B6R0.1 C#CCC(=O)OC SC-13148 [0,1,0,0,0,0|0,0,2]=3 90 B6R0.1 C=CC(=O)NCO SC-75438 [0,1,0,0,0,0|1,0,0]=2 91 B6R0.1 C=CCC(=O)OC SC-48829 [0,1,0,0,0,0|0,0,0]=1 92 B6R0.1 CC#CC(=O)OC SC-48510 [0,1,0,0,0,0|0,0,2]=3 93 B6R0.1 CCOC(=N)CCl SC-39703 [0,1,0,0,0,0|2,0,1]=4 94 B6R0.1 CCOC(=N)CCl SC-53117 [0,1,0,0,0,0|2,0,1]=4 95 B6R0.1 CCOC(=O)C#N SC-20120 [0,1,0,0,0,0|1,0,1]=3 96 B6R0.1 CCOC(=O)CBr SC-17870 [0,1,0,0,0,0|1,0,1]=3 97 B6R0.1 CCOC(=O)CCl SC-79310 [0,1,0,0,0,0|1,0,1]=3 98 B6R0.1 CCOC(=O)CN SC-09569 [0,1,0,0,0,0|1,0,1]=3 99 B6R0.1 CCOC(=O)CN SC-48652 [0,1,0,0,0,0|1,0,1]=3 100 B6R0.1 CCOC(=O)CO SC-50412 [0,1,0,0,0,0|1,0,1]=3 101 B6R0.1 CCOC(=O)CS SC-18381 [0,1,0,0,0,0|1,0,1]=3 102 B6R0.1 CCOC(=O)NN SC-50147 [0,1,0,0,0,0|2,0,0]=3 103 B6R0.1 CNC(=O)CC#N SC-97600 [0,1,0,0,0,0|1,0,2]=4 104 B6R0.1 CNCC(=O)OC SC-10432 [0,1,0,0,0,0|0,0,2]=3 105 B6R0.1 COC(=O)C#CBr SC-66291 [0,1,0,0,0,0|0,0,2]=3 106 B6R0.1 COC(=O)CC=O SC-53143 [0,1,0,0,0,0|0,0,1]=2 107 B6R0.1 COC(=O)CCBr SC-18677 [0,1,0,0,0,0|0,0,2]=3 108 B6R0.1 COC(=O)CCN SC-21486 [0,1,0,0,0,0|0,0,2]=3 109 B6R0.1 COC(=O)CCO SC-21690 [0,1,0,0,0,0|0,0,2]=3 110 B6R0.1 COC(=O)CSC SC-20536 [0,1,0,0,0,0|0,0,2]=3 111 B6R0.1 COC(=O)N=C=S SC-A2325 [0,1,0,0,0,0|1,0,1]=3 112 B6R0.1 COC(=O)OCCl SC-53303 [0,1,0,0,0,0|1,0,1]=3 113 B6R0.1 COCC(=O)NN SC-54001 [0,1,0,0,0,0|2,0,0]=3 114 B6R0.1 COCC(=O)OC SC-62202 [0,1,0,0,0,0|0,0,2]=3 115 B6R0.1 CO\C(C)=N\C#N SC-14025 [0,1,0,0,0,0|2,0,1]=4 116 B6R0.1 C\C=C\C(=O)OC SC-22589 [0,1,0,0,0,0|0,0,0]=1 117 B6R0.1 O=C(CCl)NCO SC-21590 [0,1,0,0,0,0|2,0,1]=4 118 B6R0.1 [C-]#[N+]CC(=O)OC SC-19522 [0,1,0,0,0,0|0,0,2]=3 119 B6R0.3 C=C(Br)C(=O)OC SC-86871 [0,1,0,0,0,0|0,0,0]=1 120 B6R0.3 C=C(Cl)C(=O)OC SC-97454 [0,1,0,0,0,0|0,0,0]=1 121 B6R0.3 C=C(F)C(=O)OC SC-44271 [0,1,0,0,0,0|0,0,0]=1 122 B6R0.3 CC(C)C(=O)CBr SC-21776 [0,1,0,0,0,0|2,0,1]=4 123 B6R0.3 CC(C)C(=O)NN SC-82184 [0,1,0,0,0,0|3,0,0]=4 124 B6R0.3 CN(C)C(=O)CCl SC-25918 [0,1,0,0,0,0|2,0,1]=4 125 B6R0.3 CN(C)C(=O)CN SC-26411 [0,1,0,0,0,0|2,0,1]=4 126 B6R0.3 COC(=O)C(=N)N SC-33258 [0,1,0,0,0,0|1,0,0]=2 127 B6R0.3 COC(=O)C(=O)Cl SC-27409 [0,1,0,0,0,0|1,0,0]=2 128 B6R0.3 COC(=O)C(C)=O SC-15233 [0,1,0,0,0,0|0,0,1]=2 129 B6R0.3 COC(=O)C(C)Cl SC-18837 [0,1,0,0,0,0|0,0,2]=3 130 B6R0.3 COC(=O)C(C)N SC-09296 [0,1,0,0,0,0|0,0,2]=3 131 B6R0.3 COC(=O)C(C)N SC-54087 [0,1,0,0,0,0|0,0,2]=3 132 B6R0.3 COC(=O)C(C)O SC-01713 [0,1,0,0,0,0|0,0,2]=3 133 B6R0.3 COC(=O)[C@H](C)Cl SC-06555 [0,1,0,0,0,0|0,0,2]=3 134 B6R0.3 COC(=O)[C@H](C)N SC-09297 [0,1,0,0,0,0|0,0,2]=3 135 B6R0.3 COC(C)C(=O)O SC-49776 [0,1,0,0,0,0|2,0,1]=4 136 B6R0.3 CON(C)C(C)=O SC-20924 [0,1,0,0,0,0|2,0,1]=4 137 B6R0.3 CO[C@@H](C)C(=O)O SC-89341 [0,1,0,0,0,0|2,0,1]=4 138 B6R0.3 CO[C@H](C)C(=O)O SC-A3340 [0,1,0,0,0,0|2,0,1]=4 139 B6R0.3 O=C(O)C(=O)CBr SC-15238 [0,1,0,0,0,0|3,0,0]=4 140 B6R0.8 C=CS(=O)(=O)C=C SC-77399 [0,1,0,0,0,0|2,0,1]=4 141 B6R0.8 COP(=O)(Cl)OC SC-96906 [0,1,0,0,0,0|2,0,1]=4 142 B6R0.9 C=CC(OC)OC SC-27140 [0,1,0,0,0,0|0,0,2]=3 143 B6R1.2 BrC1=CC=CO1 SC-46529 [0,0,0,1,0,0|1,0,1]=3 144 B6R1.2 BrC1=COC=C1 SC-02537 [0,0,0,1,0,0|3,0,0]=4 145 B6R1.2 BrC1=CSC=C1 SC-07078 [0,0,0,1,0,0|3,0,0]=4 146 B6R1.2 BrC1=NNC=C1 SC-25384 [0,0,0,1,0,0|3,0,0]=4 147 B6R1.2 BrC1=NSC=C1 SC-53924 [0,0,0,1,0,0|3,0,0]=4 148 B6R1.2 CC1=CC=CN1 SC-88412 [0,0,0,1,0,0|2,0,1]=4 149 B6R1.2 CC1=CC=NO1 SC-47380 [0,0,0,1,0,0|2,0,0]=3 150 B6R1.2 CC1=CCCC1 SC-46849 [0,0,0,1,0,0|2,0,1]=4 151 B6R1.2 CC1=CCCO1 SC-69814 [0,0,0,1,0,0|1,0,1]=3 152 B6R1.2 CC1=NC=CO1 SC-94134 [0,0,0,1,0,0|2,0,1]=4 153 B6R1.2 CC1=NSC=C1 SC-89582 [0,0,0,1,0,0|3,0,0]=4 154 B6R1.2 ClC1=CC=NN1 SC-48488 [0,0,0,1,0,0|3,0,0]=4 155 B6R1.2 ClC1=CSC=C1 SC-45954 [0,0,0,1,0,0|3,0,0]=4 156 B6R1.2 IC1=CC=CO1 SC-99803 [0,0,0,1,0,0|1,0,1]=3 157 B6R1.2 IC1=CC=CS1 SC-46627 [0,0,0,1,0,0|1,1,1]=4 158 B6R1.2 NC1=CC=CN1 SC-20942 [0,0,0,1,0,0|2,0,1]=4 159 B6R1.2 NC1=CC=CO1 SC-21679 [0,0,0,1,0,0|1,0,1]=3 160 B6R1.2 NC1=CC=CS1 SC-21886 [0,0,0,1,0,0|1,1,1]=4 161 B6R1.2 NC1=CC=NN1 SC-69238 [0,0,0,1,0,0|3,0,0]=4 162 B6R1.2 NC1=CC=NO1 SC-66242 [0,0,0,1,0,0|2,0,0]=3 163 B6R1.2 NC1=CC=NS1 SC-15519 [0,0,0,1,0,0|2,1,0]=4 164 B6R1.2 NC1=CC=NS1 SC-A3255 [0,0,0,1,0,0|2,1,0]=4 165 B6R1.2 NC1=CN=CO1 SC-14976 [0,0,0,1,0,0|2,0,1]=4 166 B6R1.2 NC1=COC=C1 SC-21680 [0,0,0,1,0,0|3,0,0]=4 167 B6R1.2 NC1=CSC=C1 SC-21719 [0,0,0,1,0,0|3,0,0]=4 168 B6R1.2 NC1=CSC=C1 SC-21738 [0,0,0,1,0,0|3,0,0]=4 169 B6R1.2 NC1=CSC=C1 SC-95491 [0,0,0,1,0,0|3,0,0]=4 170 B6R1.2 NC1=NC=CO1 SC-26958 [0,0,0,1,0,0|2,0,1]=4 171 B6R1.2 NC1=NCCO1 SC-89542 [0,0,0,1,0,0|2,0,1]=4 172 B6R1.2 NC1=NNC=C1 SC-17957 [0,0,0,1,0,0|3,0,0]=4 173 B6R1.2 NC1=NOC=C1 SC-01736 [0,0,0,1,0,0|3,0,0]=4 174 B6R1.2 O=C1C=CCC1 SC-07348 [0,0,0,1,0,0|1,0,0]=2 175 B6R1.2 O=C1C=CCN1 SC-67116 [0,0,0,1,0,0|1,0,0]=2 176 B6R1.2 O=C1C=CCO1 SC-50260 [0,0,0,1,0,0|0,0,0]=1 177 B6R1.2 O=C1C=CSN1 SC-14961 [0,0,0,1,0,0|2,0,0]=3 178 B6R1.2 O=C1CC=NN1 SC-89969 [0,0,0,1,0,0|2,0,1]=4 179 B6R1.2 O=C1CCCN1 SC-85210 [0,0,0,1,0,0|1,0,2]=4 180 B6R1.2 O=C1CCNC1 SC-24328 [0,0,0,1,0,0|2,0,1]=4 181 B6R1.2 O=C1CCNC1 SC-50749 [0,0,0,1,0,0|2,0,1]=4 182 B6R1.2 O=C1CCNN1 SC-21405 [0,0,0,1,0,0|3,0,0]=4 183 B6R1.2 O=C1CCOC1 SC-21867 [0,0,0,1,0,0|2,0,1]=4 184 B6R1.2 O=C1N=CNN1 SC-15326 [0,0,0,1,0,0|3,0,0]=4 185 B6R1.2 O=C1NCCO1 SC-04833 [0,0,0,1,0,0|1,0,1]=3 186 B6R1.2 O=C1NCCS1 SC-27050 [0,0,0,1,0,0|1,1,1]=4 187 B6R1.2 O=C1OC=CO1 SC-15988 [0,0,0,1,0,0|1,0,1]=3 188 B6R1.2 O=S1OCCO1 SC-15793 [0,0,0,1,0,0|2,0,1]=4 189 B6R1.2 OC1=CC=NN1 SC-88403 [0,0,0,1,0,0|2,0,1]=4 190 B6R1.2 SC1=CC=CS1 SC-06762 [0,0,0,1,0,0|0,2,1]=4 191 B6R1.2 SC1=CSC=C1 SC-48067 [0,0,0,1,0,0|2,1,0]=4 192 B3R0.1 Br\C=C\Br SC-73800 [2,0,0,0,0,0|2,0,0]=4 193 B3R0.1 C=CCN SC-13610 [2,0,0,0,0,0|1,0,1]=4 194 B3R0.1 C=C[CH-]C SC-90438 [2,0,0,0,0,0|0,0,1]=3 195 B3R0.1 CNOC SC-17494 [2,0,0,0,0,0|1,0,1]=4 196 B3R0.1 CNOC SC-74340 [2,0,0,0,0,0|1,0,1]=4 197 B3R0.1 COCBr SC-13660 [2,0,0,0,0,0|1,0,1]=4 198 B3R0.1 C\C=C\Br SC-50117 [2,0,0,0,0,0|1,0,0]=3 199 B3R0.1 C\C=N\O SC-16388 [2,0,0,0,0,0|1,0,1]=4 200 B3R0.1 NNC=O SC-22540 [2,0,0,0,0,0|2,0,0]=4 201 B3R0.2 C=C(C)[Mg+] SC-70280 [2,0,0,0,0,0|1,0,0]=3 202 B3R0.2 CC(=N)N SC-19002 [2,0,0,0,0,0|2,0,0]=4 203 B3R0.2 CC(=O)O SC-16774 [2,0,0,0,0,0|0,0,1]=3 204 B3R0.2 CC(=O)O SC-27909 [2,0,0,0,0,0|0,0,1]=3 205 B3R0.2 CC(=O)[O-] SC-03583 [2,0,0,0,0,0|1,0,0]=3 206 B3R0.2 CC(=O)[O-] SC-12688 [2,0,0,0,0,0|1,0,0]=3 207 B3R0.2 CC(=O)[O-] SC-18918 [2,0,0,0,0,0|1,0,0]=3 208 B3R0.2 CC(=O)[O-] SC-18995 [2,0,0,0,0,0|1,0,0]=3 209 B3R0.2 CC(=O)[O-] SC-26584 [2,0,0,0,0,0|1,0,0]=3 210 B3R0.2 CC(=O)[O-] SC-46842 [2,0,0,0,0,0|1,0,0]=3 211 B3R0.2 CC(=O)[O-] SC-81401 [2,0,0,0,0,0|1,0,0]=3 212 B3R0.2 CC(=O)[O-] SC-88396 [2,0,0,0,0,0|1,0,0]=3 213 B3R0.2 CC(=O)[O-] SC-93306 [2,0,0,0,0,0|1,0,0]=3 214 B3R0.2 CC(N)=O SC-18410 [2,0,0,0,0,0|1,0,0]=3 215 B3R0.2 CC(N)=S SC-17261 [2,0,0,0,0,0|1,1,0]=4 216 B3R0.2 CC([O-])=S SC-15916 [2,0,0,0,0,0|1,0,1]=4 217 B3R0.2 CS(=O)[O-] SC-19511 [2,0,0,0,0,0|2,0,0]=4 218 B3R0.2 C[PH](C)=O SC-72909 [2,0,0,0,0,0|1,0,1]=4 219 B3R0.2 NC(N)=O SC-75453 [2,0,0,0,0,0|2,0,0]=4 220 B3R0.2 NC(N)=O SC-81784 [2,0,0,0,0,0|2,0,0]=4 221 B3R0.2 O=C(O)O SC-18529 [2,0,0,0,0,0|1,0,0]=3 222 B3R0.2 O=C([O-])O SC-80213 [2,0,0,0,0,0|1,0,0]=3 223 B3R0.2 O=C([O-])[O-] SC-97647 [2,0,0,0,0,0|1,0,1]=4 224 B5R0.1 C#CCC(=O)O SC-40344 [1,1,0,0,0,0|0,0,2]=4 225 B5R0.1 C=C(C)CCBr SC-26305 [1,1,0,0,0,0|2,0,0]=4 226 B5R0.1 C=C(C)OCC SC-18086 [1,1,0,0,0,0|1,0,0]=3 227 B5R0.1 C=CCC(=O)O SC-49093 [1,1,0,0,0,0|0,0,0]=2 228 B5R0.1 C=COC(C)=O SC-79059 [1,1,0,0,0,0|0,0,0]=2 229 B5R0.1 CC#CC(=O)O SC-76460 [1,1,0,0,0,0|0,0,2]=4 230 B5R0.1 CC(=O)CC#N SC-26510 [1,1,0,0,0,0|0,0,2]=4 231 B5R0.1 CC(=O)CCCl SC-21586 [1,1,0,0,0,0|0,0,2]=4 232 B5R0.1 CC(=O)CCO SC-65678 [1,1,0,0,0,0|0,0,2]=4 233 B5R0.1 CC(=O)OCBr SC-44237 [1,1,0,0,0,0|0,0,1]=3 234 B5R0.1 CC(=O)\C=N/O SC-89466 [1,1,0,0,0,0|1,0,0]=3 235 B5R0.1 CC(=O)\C=N\O SC-68143 [1,1,0,0,0,0|1,0,0]=3 236 B5R0.1 CC(C)=CC#N SC-47932 [1,1,0,0,0,0|1,0,1]=4 237 B5R0.1 CC(C)=CC=O SC-00290 [1,1,0,0,0,0|1,0,0]=3 238 B5R0.1 CC(C)=CCBr SC-13678 [1,1,0,0,0,0|1,0,1]=4 239 B5R0.1 CC(C)=CCN SC-51952 [1,1,0,0,0,0|1,0,1]=4 240 B5R0.1 CC(C)=CCO SC-77150 [1,1,0,0,0,0|1,0,1]=4 241 B5R0.1 CCCC(=O)Cl SC-18924 [1,1,0,0,0,0|2,0,0]=4 242 B5R0.1 CCCC(=O)[O-] SC-15718 [1,1,0,0,0,0|2,0,0]=4 243 B5R0.1 CCCC(N)=O SC-46377 [1,1,0,0,0,0|2,0,0]=4 244 B5R0.1 CCOC(=S)[S-] SC-62877 [1,1,0,0,0,0|1,1,0]=4 245 B5R0.1 CCOC(C)=N SC-02547 [1,1,0,0,0,0|1,0,1]=4 246 B5R0.1 CCOC(C)=N SC-A3540 [1,1,0,0,0,0|1,0,1]=4 247 B5R0.1 CCOC(N)=O SC-16133 [1,1,0,0,0,0|1,0,0]=3 248 B5R0.1 CNCC(=O)O SC-10425 [1,1,0,0,0,0|0,0,2]=4 249 B5R0.1 CNCC(N)=O SC-10429 [1,1,0,0,0,0|2,0,0]=4 250 B5R0.1 COCC(=N)N SC-41213 [1,1,0,0,0,0|2,0,0]=4 251 B5R0.1 COCC(=N)N SC-73218 [1,1,0,0,0,0|2,0,0]=4 252 B5R0.1 COCC(=O)Cl SC-27381 [1,1,0,0,0,0|1,0,0]=3 253 B5R0.1 CSNC(C)=O SC-28667 [1,1,0,0,0,0|0,1,1]=4 254 B5R0.1 C\C=C/C(=O)O SC-25924 [1,1,0,0,0,0|0,0,0]=2 255 B5R0.1 C\C=C/C(C)=O SC-48085 [1,1,0,0,0,0|0,0,0]=2 256 B5R0.1 C\C=C\B(O)O SC-15014 [1,1,0,0,0,0|1,0,1]=4 257 B5R0.1 C\C=C\C(=O)Cl SC-16256 [1,1,0,0,0,0|1,0,0]=3 258 B5R0.1 N#CCC(=O)O SC-18648 [1,1,0,0,0,0|0,0,2]=4 259 B5R0.1 NCCC(=O)O SC-10014 [1,1,0,0,0,0|0,0,2]=4 260 B5R0.1 NCCC(N)=O SC-48688 [1,1,0,0,0,0|2,0,0]=4 261 B5R0.1 NCCC(N)=O SC-84499 [1,1,0,0,0,0|2,0,0]=4 262 B5R0.1 O=C(Cl)CCCl SC-16310 [1,1,0,0,0,0|2,0,0]=4 263 B5R0.1 O=C(O)CCBr SC-18441 [1,1,0,0,0,0|0,0,2]=4 264 B5R0.1 O=C(O)CCS SC-22642 [1,1,0,0,0,0|0,0,2]=4 265 B5R0.4 C=CS(=O)(=O)Cl SC-69716 [1,1,0,0,0,0|1,0,1]=4 266 B5R0.4 C=CS(C)(=O)=O SC-A3249 [1,1,0,0,0,0|1,0,0]=3 267 B5R0.4 C=C[Si](C)(C)C SC-24537 [1,1,0,0,0,0|1,1,0]=4 268 B5R0.4 COP(=O)(Cl)Cl SC-10249 [1,1,0,0,0,0|2,0,0]=4 269 B5R0.4 COS(=O)(=O)Cl SC-45138 [1,1,0,0,0,0|2,0,0]=4 270 B5R0.4 COS(C)(=O)=O SC-52027 [1,1,0,0,0,0|1,0,1]=4 271 B5R0.5 C=C(C)C(N)=O SC-74591 [1,1,0,0,0,0|1,0,0]=3 272 B5R0.5 C=C(F)C(=O)O SC-47473 [1,1,0,0,0,0|0,0,0]=2 273 B5R0.5 CC(=O)C(=O)O SC-17382 [1,1,0,0,0,0|0,0,1]=3 274 B5R0.5 CC(=O)C(=O)[O-] SC-17414 [1,1,0,0,0,0|1,0,0]=3 275 B5R0.5 CC(=O)C(C)C SC-18478 [1,1,0,0,0,0|0,0,2]=4 276 B5R0.5 CC(=O)C(C)Cl SC-46981 [1,1,0,0,0,0|0,0,2]=4 277 B5R0.5 CC(=O)C(C)S SC-17208 [1,1,0,0,0,0|0,0,2]=4 278 B5R0.5 CC(=O)C(F)F SC-99156 [1,1,0,0,0,0|1,0,1]=4 279 B5R0.5 CC(=O)N(C)C SC-54108 [1,1,0,0,0,0|1,0,1]=4 280 B5R0.5 CC(Br)C(N)=O SC-97497 [1,1,0,0,0,0|2,0,0]=4 281 B5R0.5 CC(F)C(=O)O SC-83429 [1,1,0,0,0,0|0,0,2]=4 282 B5R0.5 CC(N)C(=O)O SC-09271 [1,1,0,0,0,0|0,0,2]=4 283 B5R0.5 CC(N)C(N)=O SC-94219 [1,1,0,0,0,0|2,0,0]=4 284 B5R0.5 CC(O)C(=O)[O-] SC-19308 [1,1,0,0,0,0|2,0,0]=4 285 B5R0.5 CC(O)C(=O)[O-] SC-25623 [1,1,0,0,0,0|2,0,0]=4 286 B5R0.5 CC(O)C(=O)[O-] SC-75139 [1,1,0,0,0,0|2,0,0]=4 287 B5R0.5 CC(S)C(=O)O SC-74563 [1,1,0,0,0,0|0,0,2]=4 288 B5R0.5 CN(C)C(=O)Cl SC-15201 [1,1,0,0,0,0|2,0,0]=4 289 B5R0.5 C[C@@H](Br)C(=O)O SC-08843 [1,1,0,0,0,0|0,0,2]=4 290 B5R0.5 C[C@@H](Cl)C(=O)O SC-06610 [1,1,0,0,0,0|0,0,2]=4 291 B5R0.5 C[C@@H](N)C(=O)O SC-09270 [1,1,0,0,0,0|0,0,2]=4 292 B5R0.5 C[C@@H](N)C(N)=O SC-09289 [1,1,0,0,0,0|2,0,0]=4 293 B5R0.5 C[C@@H](O)C(N)=O SC-92873 [1,1,0,0,0,0|2,0,0]=4 294 B5R0.5 C[C@H](Cl)C(=O)O SC-03218 [1,1,0,0,0,0|0,0,2]=4 295 B5R0.5 C[C@H](N)C(=O)O SC-09272 [1,1,0,0,0,0|0,0,2]=4 296 B5R0.5 C[C@H](N)C(N)=O SC-03542 [1,1,0,0,0,0|2,0,0]=4 297 B5R0.5 C[C@H](O)C(N)=O SC-73228 [1,1,0,0,0,0|2,0,0]=4 298 B5R0.5 NC(=O)C(=O)[O-] SC-52623 [1,1,0,0,0,0|1,0,1]=4 299 B5R0.5 O=C(O)C(Cl)Cl SC-18205 [1,1,0,0,0,0|1,0,1]=4 300 B5R0.5 O=C(O)C(F)Br SC-49620 [1,1,0,0,0,0|1,0,1]=4 301 B5R0.5 O=C(O)C(F)F SC-25529 [1,1,0,0,0,0|1,0,1]=4 302 B5R0.5 O=C([O-])C(=O)[O-] SC-18408 [1,1,0,0,0,0|1,0,1]=4 303 B5R0.5 O=C([O-])C(=O)[O-] SC-20134 [1,1,0,0,0,0|1,0,1]=4 304 B5R0.5 O=C([O-])C(=O)[O-] SC-74359 [1,1,0,0,0,0|1,0,1]=4 305 B5R0.5 O=C([O-])C(=O)[O-] SC-A2542 [1,1,0,0,0,0|1,0,1]=4 306 B5R0.5 [2H]C(=O)N(C)C SC-97589 [1,1,0,0,0,0|2,0,0]=4 307 B5R0.5 [C@@H](C)(Br)C(=O)O SC-03475 [1,1,0,0,0,0|0,0,2]=4 308 B5R0.2 C=CCCCBr SC-47340 [1,1,0,0,0,0|1,0,1]=4 309 B5R0.2 C=CCCCN SC-28944 [1,1,0,0,0,0|1,0,1]=4 310 B5R0.2 C=CCCCO SC-78424 [1,1,0,0,0,0|1,0,1]=4 311 B5R0.2 C=CCSSC SC-87236 [1,1,0,0,0,0|0,1,1]=4 312 B5R0.2 C=COCCO SC-22660 [1,1,0,0,0,0|2,0,0]=4 313 B5R0.2 COCCC=O SC-85357 [1,1,0,0,0,0|0,0,2]=4 314 B5R0.2 C\C=C\OCC SC-89361 [1,1,0,0,0,0|0,0,1]=3 315 B7R0.2 C=CC(=O)NC(C)C SC-47047 [0,2,0,0,0,0|1,0,0]=3 316 B7R0.2 COC(=O)CC(=O)Cl SC-16087 [0,2,0,0,0,0|0,0,1]=3 317 B7R0.2 COC(=O)CC(=O)O SC-21351 [0,2,0,0,0,0|0,0,1]=3 318 B7R0.2 COC(=O)CC(C)Br SC-67097 [0,2,0,0,0,0|0,0,2]=4 319 B7R0.2 COC(=O)C[C@@H](C)N SC-88822 [0,2,0,0,0,0|0,0,2]=4 320 B7R0.2 COC(=O)C[C@@H](C)N SC-A1096 [0,2,0,0,0,0|0,0,2]=4 321 B7R0.2 COC(=O)C[N+](=O)[O-] SC-21869 [0,2,0,0,0,0|1,0,1]=4 322 B7R0.3 C#CCCC(=O)OC SC-92252 [0,2,0,0,0,0|0,0,2]=4 323 B7R0.3 C=CCOC(=O)C=C SC-19356 [0,2,0,0,0,0|0,0,0]=2 324 B7R0.3 C=CCOC(=O)CCl SC-95960 [0,2,0,0,0,0|1,0,1]=4 325 B7R0.3 C=CCOC(=O)OC SC-82329 [0,2,0,0,0,0|0,0,0]=2 326 B7R0.3 COC(=O)C#CCO SC-48272 [0,2,0,0,0,0|0,0,2]=4 327 B7R0.3 COC(=O)CCC=O SC-47529 [0,2,0,0,0,0|0,0,1]=3 328 B7R0.3 COC(=O)CCCCl SC-15079 [0,2,0,0,0,0|0,0,2]=4 329 B7R0.3 COC(=O)CN=C=O SC-49023 [0,2,0,0,0,0|0,0,2]=4 330 B7R0.3 COC(=O)CN=[N+]=[N-] SC-96313 [0,2,0,0,0,0|1,0,1]=4 331 B7R0.3 COC(=O)\C=C\CBr SC-17676 [0,2,0,0,0,0|0,0,0]=2 332 B7R0.3 COC(=O)\C=C\CBr SC-49570 [0,2,0,0,0,0|0,0,0]=2 333 B7R0.3 COCCC(=O)OC SC-46379 [0,2,0,0,0,0|0,0,2]=4 334 B7R0.3 CO\C=C\C(=O)OC SC-90792 [0,2,0,0,0,0|0,0,0]=2 335 B7R0.3 [C-]#[N+]CCC(=O)OC SC-88998 [0,2,0,0,0,0|0,0,2]=4 336 B7R0.5 CC(C)C(=O)OCCl SC-92989 [0,2,0,0,0,0|0,0,2]=4 337 B7R0.5 CCOC(=O)C(=N)N SC-32236 [0,2,0,0,0,0|1,0,0]=3 338 B7R0.5 CCOC(=O)C(=O)Cl SC-26882 [0,2,0,0,0,0|1,0,0]=3 339 B7R0.5 CCOC(=O)C(=O)O SC-26569 [0,2,0,0,0,0|1,0,0]=3 340 B7R0.5 CCOC(=O)C(=O)[O-] SC-73549 [0,2,0,0,0,0|1,0,0]=3 341 B7R0.5 CCOC(=O)C(C)=O SC-15232 [0,2,0,0,0,0|0,0,1]=3 342 B7R0.5 CCOC(=O)C(C)Br SC-27136 [0,2,0,0,0,0|0,0,2]=4 343 B7R0.5 CCOC(=O)C(C)Cl SC-13657 [0,2,0,0,0,0|0,0,2]=4 344 B7R0.5 CCOC(=O)C(C)F SC-75945 [0,2,0,0,0,0|0,0,2]=4 345 B7R0.5 CCOC(=O)C(C)N SC-09294 [0,2,0,0,0,0|0,0,2]=4 346 B7R0.5 CCOC(=O)C(C)N SC-13100 [0,2,0,0,0,0|0,0,2]=4 347 B7R0.5 CCOC(=O)C(C)N SC-15274 [0,2,0,0,0,0|0,0,2]=4 348 B7R0.5 CCOC(=O)C(F)Br SC-22765 [0,2,0,0,0,0|1,0,1]=4 349 B7R0.5 CCOC(=O)C(N)=S SC-23134 [0,2,0,0,0,0|1,0,0]=3 350 B7R0.5 CCOC(=O)N(C)C SC-88157 [0,2,0,0,0,0|1,0,1]=4 351 B7R0.5 CCOC(=O)[C@@H](C)O SC-15791 [0,2,0,0,0,0|0,0,2]=4 352 B7R0.7 CC#CC(=O)OCC SC-54369 [0,2,0,0,0,0|0,0,2]=4 353 B7R0.7 CCOC(=O)C=[N+]=[N-] SC-25567 [0,2,0,0,0,0|1,0,0]=3 354 B7R0.7 CCOC(=O)CC#N SC-22643 [0,2,0,0,0,0|0,0,2]=4 355 B7R0.7 CCOC(=O)CC=O SC-14726 [0,2,0,0,0,0|0,0,1]=3 356 B7R0.7 CCOC(=O)CCI SC-02730 [0,2,0,0,0,0|0,0,2]=4 357 B7R0.7 CCOC(=O)CCN SC-83852 [0,2,0,0,0,0|0,0,2]=4 358 B7R0.7 CCOC(=O)CCO SC-43709 [0,2,0,0,0,0|0,0,2]=4 359 B7R0.7 CCOC(=O)CCS SC-44443 [0,2,0,0,0,0|0,0,2]=4 360 B7R0.7 CCOC(=O)CNN SC-06315 [0,2,0,0,0,0|1,0,1]=4 361 B7R0.7 CCOC(=O)N=C=S SC-27157 [0,2,0,0,0,0|1,0,1]=4 362 B7R0.7 CCOC(=O)OCC SC-25934 [0,2,0,0,0,0|0,0,2]=4 363 B7R0.7 CCOC(=O)OCCl SC-35252 [0,2,0,0,0,0|0,0,2]=4 364 B7R0.7 CCOC(=O)\C=C\[O-] SC-71247 [0,2,0,0,0,0|0,0,0]=2 365 B7R0.7 COCC(=O)COC SC-43684 [0,2,0,0,0,0|0,0,2]=4 366 B7R0.7 [C-]#[N+]CC(=O)OCC SC-03259 [0,2,0,0,0,0|0,0,2]=4 367 B7R0.10 C=C(CO)C(=O)OC SC-53992 [0,2,0,0,0,0|0,0,0]=2 368 B7R0.10 CC[C@@H](O)C(=O)OC SC-49455 [0,2,0,0,0,0|0,0,2]=4 369 B7R0.10 CC[C@H](N)C(=O)OC SC-33322 [0,2,0,0,0,0|0,0,2]=4 370 B7R0.10 CC[C@H](N)C(=O)OC SC-91370 [0,2,0,0,0,0|0,0,2]=4 371 B7R0.10 CNC(C)C(=O)OC SC-82127 [0,2,0,0,0,0|0,0,2]=4 372 B7R0.10 CN[C@@H](C)C(=O)OC SC-84501 [0,2,0,0,0,0|0,0,2]=4 373 B7R0.10 COC(=O)C(=O)CBr SC-15244 [0,2,0,0,0,0|0,0,1]=3 374 B7R0.10 COC(=O)C(Br)CO SC-87315 [0,2,0,0,0,0|0,0,2]=4 375 B7R0.10 COC(=O)C(Br)SC SC-83274 [0,2,0,0,0,0|0,0,2]=4 376 B7R0.10 COC(=O)C(C)CN SC-53925 [0,2,0,0,0,0|0,0,2]=4 377 B7R0.10 COC(=O)C(C)CO SC-08906 [0,2,0,0,0,0|0,0,2]=4 378 B7R0.10 COC(=O)C(C)CO SC-08907 [0,2,0,0,0,0|0,0,2]=4 379 B7R0.10 COC(=O)C(C)OC SC-92649 [0,2,0,0,0,0|0,0,2]=4 380 B7R0.10 COC(=O)C(Cl)C=O SC-53173 [0,2,0,0,0,0|0,0,1]=3 381 B7R0.10 COC(=O)C(Cl)CCl SC-48264 [0,2,0,0,0,0|0,0,2]=4 382 B7R0.10 COC(=O)C(N)CO SC-09862 [0,2,0,0,0,0|0,0,2]=4 383 B7R0.10 COC(=O)C(N)CO SC-51728 [0,2,0,0,0,0|0,0,2]=4 384 B7R0.10 COC(=O)[C@@H](C)CBr SC-08853 [0,2,0,0,0,0|0,0,2]=4 385 B7R0.10 COC(=O)[C@@H](N)CS SC-22400 [0,2,0,0,0,0|0,0,2]=4 386 B7R0.10 COC(=O)[C@@H](O)CO SC-44674 [0,2,0,0,0,0|0,0,2]=4 387 B7R0.10 COC(=O)[C@H](N)CCl SC-44813 [0,2,0,0,0,0|0,0,2]=4 388 B7R0.10 COC(=O)[C@H](N)CO SC-21448 [0,2,0,0,0,0|0,0,2]=4 389 B7R0.10 COC(=O)[C@H](N)CS SC-95830 [0,2,0,0,0,0|0,0,2]=4 390 B7R0.10 CON(C)C(=O)CCl SC-21890 [0,2,0,0,0,0|1,0,1]=4 391 B7R0.10 CON(C)C(=O)CF SC-14324 [0,2,0,0,0,0|1,0,1]=4 392 B7R0.10 C\C=C(/Br)C(=O)OC SC-89362 [0,2,0,0,0,0|0,0,0]=2 393 B7R0.14 COC(=O)C(C)(C)Br SC-13472 [0,2,0,0,0,0|0,0,2]=4 394 B7R0.14 COC(=O)C(C)(C)F SC-27575 [0,2,0,0,0,0|0,0,2]=4 395 B7R0.14 COC(=O)C(C)(C)N SC-53222 [0,2,0,0,0,0|0,0,2]=4 396 B7R0.14 COC(=O)C(F)(F)Cl SC-57896 [0,2,0,0,0,0|1,0,1]=4 397 B7R0.14 COC(=O)C(F)(F)F SC-26744 [0,2,0,0,0,0|1,0,1]=4 398 B7R0.16 CC(C)C(=O)C(=O)O SC-27422 [0,2,0,0,0,0|2,0,0]=4 399 B7R0.16 CC(C)C(=O)C(=O)[O-] SC-13686 [0,2,0,0,0,0|2,0,0]=4 400 B7R0.18 C=CP(=O)(OC)OC SC-48461 [0,2,0,0,0,0|1,0,0]=3 401 B5R1.2 O=C1CCC1 SC-00523 [1,0,0,1,0,0|0,0,2]=4 402 B5R1.2 O=C1CCN1 SC-44172 [1,0,0,1,0,0|1,0,1]=4 403 B5R1.2 O=C1CNC1 SC-48283 [1,0,0,1,0,0|1,0,1]=4 404 B5R1.2 O=C1COC1 SC-21889 [1,0,0,1,0,0|1,0,1]=4 405 B5R1.3 C=CC1CO1 SC-72377 [1,0,0,1,0,0|0,0,2]=4 406 B5R1.1 C1=CCC=C1 SC-76630 [1,0,0,1,0,0|1,0,0]=3 407 B5R1.1 C1=CCCC1 SC-18920 [1,0,0,1,0,0|1,0,1]=4 408 B5R1.1 C1=CCOC1 SC-47076 [1,0,0,1,0,0|0,0,1]=3 409 B5R1.1 C1=CNC=C1 SC-16214 [1,0,0,1,0,0|1,0,1]=4 410 B5R1.1 C1=CNCC1 SC-88946 [1,0,0,1,0,0|1,0,1]=4 411 B5R1.1 C1=CNN=C1 SC-15930 [1,0,0,1,0,0|2,0,0]=4 412 B5R1.1 C1=CON=C1 SC-03143 [1,0,0,1,0,0|1,0,0]=3 413 B5R1.1 C1=CSN=C1 SC-45492 [1,0,0,1,0,0|1,1,0]=4 414 B5R1.1 [C-]1=CC=CC1 SC-15776 [1,0,0,1,0,0|1,0,0]=3 415 B7R1.1 BrCC1=CC=NO1 SC-48455 [0,1,0,1,0,0|2,0,0]=4 416 B7R1.1 CCC1=CNC=N1 SC-83668 [0,1,0,1,0,0|2,0,0]=4 417 B7R1.1 COC1=CC=CS1 SC-44790 [0,1,0,1,0,0|0,1,0]=3 418 B7R1.1 COC1=CNN=C1 SC-92038 [0,1,0,1,0,0|2,0,0]=4 419 B7R1.1 COC1=CSC=C1 SC-44608 [0,1,0,1,0,0|0,1,0]=3 420 B7R1.1 CSC1=NC=CN1 SC-A2747 [0,1,0,1,0,0|1,1,0]=4 421 B7R1.1 N#CC1=CC=CO1 SC-70368 [0,1,0,1,0,0|1,0,1]=4 422 B7R1.1 NCC1=CC=NO1 SC-67270 [0,1,0,1,0,0|2,0,0]=4 423 B7R1.1 O=CC1=CC=CN1 SC-00019 [0,1,0,1,0,0|1,0,1]=4 424 B7R1.1 O=CC1=CC=CN1 SC-29059 [0,1,0,1,0,0|1,0,1]=4 425 B7R1.1 O=CC1=CC=NN1 SC-21602 [0,1,0,1,0,0|2,0,0]=4 426 B7R1.1 O=CC1=CC=NN1 SC-87756 [0,1,0,1,0,0|2,0,0]=4 427 B7R1.1 O=CC1=CC=NO1 SC-26223 [0,1,0,1,0,0|1,0,0]=3 428 B7R1.1 O=CC1=CN=CO1 SC-91872 [0,1,0,1,0,0|1,0,1]=4 429 B7R1.1 O=CC1=CNC=C1 SC-12905 [0,1,0,1,0,0|2,0,0]=4 430 B7R1.1 O=CC1=COC=C1 SC-04839 [0,1,0,1,0,0|2,0,0]=4 431 B7R1.1 O=CC1=CSC=C1 SC-04841 [0,1,0,1,0,0|2,0,0]=4 432 B7R1.1 O=CC1=NC=CO1 SC-14503 [0,1,0,1,0,0|1,0,1]=4 433 B7R1.1 O=CC1=NOC=C1 SC-83871 [0,1,0,1,0,0|2,0,0]=4 434 B7R1.2 BrC1=CC=C(Br)O1 SC-48308 [0,1,0,1,0,0|1,0,1]=4 435 B7R1.2 CC1=CC(=O)CC1 SC-18727 [0,1,0,1,0,0|1,0,0]=3 436 B7R1.2 CC1=CC(=O)OC1 SC-25541 [0,1,0,1,0,0|0,0,0]=2 437 B7R1.2 CC1=CC(C)=NO1 SC-03263 [0,1,0,1,0,0|2,0,0]=4 438 B7R1.2 CC1=CC(N)=NO1 SC-00263 [0,1,0,1,0,0|2,0,0]=4 439 B7R1.2 CC1=CC(O)=NO1 SC-00002 [0,1,0,1,0,0|2,0,0]=4 440 B7R1.2 CC1=CC=C(Br)O1 SC-66940 [0,1,0,1,0,0|1,0,0]=3 441 B7R1.2 CC1=CC=C(I)S1 SC-45125 [0,1,0,1,0,0|1,1,0]=4 442 B7R1.2 CC1=NOC(N)=C1 SC-86759 [0,1,0,1,0,0|2,0,0]=4 443 B7R1.2 CC1COC(=O)C1 SC-60836 [0,1,0,1,0,0|0,0,2]=4 444 B7R1.2 CC1COC(=O)O1 SC-65189 [0,1,0,1,0,0|0,0,2]=4 445 B7R1.2 CN1C=CC(=O)N1 SC-98976 [0,1,0,1,0,0|1,0,0]=3 446 B7R1.2 CN1C=CC(Br)=N1 SC-25115 [0,1,0,1,0,0|2,0,0]=4 447 B7R1.2 CN1C=CC(I)=N1 SC-19729 [0,1,0,1,0,0|2,0,0]=4 448 B7R1.2 CN1C=CC(N)=N1 SC-02055 [0,1,0,1,0,0|2,0,0]=4 449 B7R1.2 C[C@H]1COC(=O)N1 SC-51056 [0,1,0,1,0,0|0,0,2]=4 450 B7R1.2 C[C@H]1COC(=O)O1 SC-04943 [0,1,0,1,0,0|0,0,2]=4 451 B7R1.2 NC1COC(=O)C1 SC-34183 [0,1,0,1,0,0|0,0,2]=4 452 B7R1.2 N[C@@H]1COC(=O)C1 SC-71558 [0,1,0,1,0,0|0,0,2]=4 453 B7R1.2 O=C1C=C(O)CO1 SC-21646 [0,1,0,1,0,0|0,0,0]=2 454 B7R1.2 O=C1C=CC(=O)N1 SC-15117 [0,1,0,1,0,0|1,0,1]=4 455 B7R1.2 O=C1CCC(=O)C1 SC-15331 [0,1,0,1,0,0|1,0,1]=4 456 B7R1.2 O=C1CCC(=O)N1 SC-26697 [0,1,0,1,0,0|2,0,0]=4 457 B7R1.2 O=C1CNC(=O)C1 SC-88883 [0,1,0,1,0,0|1,0,1]=4 458 B7R1.2 O=C1CNC(=O)O1 SC-21301 [0,1,0,1,0,0|2,0,0]=4 459 B7R1.2 O=C1COC(=O)C1 SC-86968 [0,1,0,1,0,0|0,0,1]=3 460 B7R1.2 O=C1COC(=O)N1 SC-49693 [0,1,0,1,0,0|1,0,0]=3 461 B7R1.2 O=C1CSC(=O)N1 SC-17499 [0,1,0,1,0,0|1,1,0]=4 462 B7R1.2 O=C1C[C@H](O)CO1 SC-06559 [0,1,0,1,0,0|0,0,2]=4 463 B7R1.3 O=C1C=CC=NN1 SC-04871 [0,1,0,1,0,0|1,0,1]=4 464 B7R1.3 O=C1C=CCCN1 SC-25185 [0,1,0,1,0,0|1,0,0]=3 465 B7R1.3 O=C1C=CCCO1 SC-50374 [0,1,0,1,0,0|0,0,0]=2 466 B7R1.3 O=C1CCCCO1 SC-65111 [0,1,0,1,0,0|0,0,2]=4 467 B7R1.3 O=C1CCCOC1 SC-14944 [0,1,0,1,0,0|0,0,2]=4 468 B7R1.3 O=C1CNCCO1 SC-84883 [0,1,0,1,0,0|0,0,2]=4 469 B7R1.3 O=C1COCCN1 SC-24222 [0,1,0,1,0,0|1,0,1]=4 470 B7R1.3 O=C1N=CC=CN1 SC-14287 [0,1,0,1,0,0|1,0,1]=4 471 B7R1.4 C=C1CCOC1=O SC-19579 [0,1,0,1,0,0|0,0,0]=2 472 B7R1.4 CC1=C(Br)C=NO1 SC-A3829 [0,1,0,1,0,0|2,0,0]=4 473 B7R1.4 CC1=C(Br)SC=C1 SC-01071 [0,1,0,1,0,0|2,0,0]=4 474 B7R1.4 CC1=CCCC1=O SC-15856 [0,1,0,1,0,0|1,0,0]=3 475 B7R1.4 CC1=CSC=C1Br SC-27440 [0,1,0,1,0,0|2,0,0]=4 476 B7R1.4 CC1=NC=CN1C SC-79883 [0,1,0,1,0,0|2,0,0]=4 477 B7R1.4 CC1CCOC1=O SC-20996 [0,1,0,1,0,0|0,0,2]=4 478 B7R1.4 CN1C=CN=C1Br SC-01576 [0,1,0,1,0,0|2,0,0]=4 479 B7R1.4 CN1C=CN=C1N SC-47907 [0,1,0,1,0,0|2,0,0]=4 480 B7R1.4 CN1C=CN=C1N SC-66894 [0,1,0,1,0,0|2,0,0]=4 481 B7R1.4 CN1C=CNC1=O SC-A3114 [0,1,0,1,0,0|1,0,0]=3 482 B7R1.4 CN1C=CNC1=S SC-81519 [0,1,0,1,0,0|1,1,0]=4 483 B7R1.4 CN1C=NC=C1Br SC-00018 [0,1,0,1,0,0|2,0,0]=4 484 B7R1.4 CN1C=NC=C1I SC-93188 [0,1,0,1,0,0|2,0,0]=4 485 B7R1.4 CN1N=CC=C1I SC-48948 [0,1,0,1,0,0|2,0,0]=4 486 B7R1.4 CN1N=CC=C1N SC-00524 [0,1,0,1,0,0|2,0,0]=4 487 B7R1.4 CN1N=CC=C1O SC-91361 [0,1,0,1,0,0|1,0,1]=4 488 B7R1.4 N[C@@H]1CCOC1=O SC-28003 [0,1,0,1,0,0|0,0,2]=4 489 B7R1.4 N[C@H]1CCOC1=O SC-01385 [0,1,0,1,0,0|0,0,2]=4 490 B7R1.4 N[C@H]1CCOC1=O SC-28113 [0,1,0,1,0,0|0,0,2]=4 491 B7R1.4 O=C1OCCC1Br SC-15437 [0,1,0,1,0,0|0,0,2]=4 492 B7R1.22 COC(=O)C1CC1 SC-16131 [0,1,0,1,0,0|0,0,2]=4 493 B7R1.14 CP1(=O)C=CCO1 SC-93562 [0,1,0,1,0,0|1,0,0]=3 494 B7R1.14 O=S1(=O)C=CCO1 SC-86633 [0,1,0,1,0,0|1,0,0]=3