0 B5R0.3 C#CC(O)CC SC-68723 [0,0,0,0,0,0|2,0,1]=3 1 B5R0.3 C=C(CCl)CCl SC-21050 [0,0,0,0,0,0|3,0,1]=4 2 B5R0.3 C=C(CO)CO SC-17984 [0,0,0,0,0,0|1,0,1]=2 3 B5R0.3 C=CC(Cl)CCl SC-A3373 [0,0,0,0,0,0|3,0,1]=4 4 B5R0.3 C=CC(O)C=C SC-20854 [0,0,0,0,0,0|2,0,2]=4 5 B5R0.3 C=CC(O)CC SC-93539 [0,0,0,0,0,0|2,0,1]=3 6 B5R0.3 C=C[C@H](N)CO SC-88199 [0,0,0,0,0,0|2,0,1]=3 7 B5R0.3 CC(CO)CBr SC-35572 [0,0,0,0,0,0|2,0,0]=2 8 B5R0.3 CCC(C)CO SC-08990 [0,0,0,0,0,0|2,0,0]=2 9 B5R0.3 CCC(N)CC SC-81736 [0,0,0,0,0,0|3,0,0]=3 10 B5R0.3 CCC(N)CO SC-21072 [0,0,0,0,0,0|2,0,0]=2 11 B5R0.3 CCC(O)CC SC-62307 [0,0,0,0,0,0|2,0,0]=2 12 B5R0.3 CC[PH](=O)CC SC-96905 [0,0,0,0,0,0|3,0,1]=4 13 B5R0.3 CC\C(N)=N\O SC-28960 [0,0,0,0,0,0|3,0,1]=4 14 B5R0.3 COC(=O)CO SC-28291 [0,0,0,0,0,0|2,0,2]=4 15 B5R0.3 COC(C)CN SC-A4864 [0,0,0,0,0,0|4,0,0]=4 16 B5R0.3 CO[C@H](C)CO SC-71357 [0,0,0,0,0,0|3,0,0]=3 17 B5R0.3 N#CC(Br)CBr SC-18603 [0,0,0,0,0,0|3,0,1]=4 18 B5R0.3 NC(CO)CO SC-16669 [0,0,0,0,0,0|1,0,0]=1 19 B5R0.3 NCC(O)CO SC-15511 [0,0,0,0,0,0|1,0,0]=1 20 B5R0.3 NC[C@@H](O)CO SC-06146 [0,0,0,0,0,0|1,0,0]=1 21 B5R0.3 NC[C@H](O)CCl SC-89081 [0,0,0,0,0,0|2,0,0]=2 22 B5R0.3 NNC(=O)CO SC-83204 [0,0,0,0,0,0|2,0,2]=4 23 B5R0.3 O=C(CBr)CBr SC-99341 [0,0,0,0,0,0|2,0,2]=4 24 B5R0.3 O=C(CO)CO SC-07450 [0,0,0,0,0,0|0,0,2]=2 25 B5R0.3 O=CC(O)CO SC-04830 [0,0,0,0,0,0|0,0,2]=2 26 B5R0.3 OCC(Br)CBr SC-75335 [0,0,0,0,0,0|2,0,0]=2 27 B5R0.3 OCC(O)CO SC-13789 [0,0,0,0,0,0|0,0,0]=0 28 B5R0.3 OC[C@@H](O)CCl SC-05423 [0,0,0,0,0,0|1,0,0]=1 29 B5R0.3 [C@H](N)(CC)CO SC-08958 [0,0,0,0,0,0|2,0,0]=2 30 B5R0.3 [C@H](O)(CN)CO SC-05739 [0,0,0,0,0,0|1,0,0]=1 31 B4R0.1 C#CC(C)N SC-52789 [1,0,0,0,0,0|2,0,1]=4 32 B4R0.1 C#CC(C)N SC-A2988 [1,0,0,0,0,0|2,0,1]=4 33 B4R0.1 C#CC(C)O SC-26644 [1,0,0,0,0,0|1,0,1]=3 34 B4R0.1 C=C(C)CBr SC-50158 [1,0,0,0,0,0|2,0,1]=4 35 B4R0.1 C=C(C)CF SC-89300 [1,0,0,0,0,0|2,0,1]=4 36 B4R0.1 C=C(C)CN SC-43404 [1,0,0,0,0,0|2,0,1]=4 37 B4R0.1 C=C(C)CN SC-84159 [1,0,0,0,0,0|2,0,1]=4 38 B4R0.1 C=CC(C)O SC-43661 [1,0,0,0,0,0|1,0,1]=3 39 B4R0.1 C=C[C@H](C)N SC-67439 [1,0,0,0,0,0|2,0,1]=4 40 B4R0.1 CC(=O)CBr SC-20936 [1,0,0,0,0,0|1,0,2]=4 41 B4R0.1 CC(=O)CN SC-28532 [1,0,0,0,0,0|1,0,2]=4 42 B4R0.1 CC(=O)CN SC-89750 [1,0,0,0,0,0|1,0,2]=4 43 B4R0.1 CC(=O)NO SC-18498 [1,0,0,0,0,0|1,0,2]=4 44 B4R0.1 CC(Br)C#N SC-48220 [1,0,0,0,0,0|2,0,1]=4 45 B4R0.1 CC(Br)CO SC-A3571 [1,0,0,0,0,0|1,0,0]=2 46 B4R0.1 CC(C)=NO SC-25907 [1,0,0,0,0,0|2,0,1]=4 47 B4R0.1 CC(C)NN SC-21077 [1,0,0,0,0,0|3,0,0]=4 48 B4R0.1 CC(C)NN SC-73657 [1,0,0,0,0,0|3,0,0]=4 49 B4R0.1 CC(C)NO SC-A3794 [1,0,0,0,0,0|2,0,0]=3 50 B4R0.1 CC(C)ON SC-87607 [1,0,0,0,0,0|3,0,0]=4 51 B4R0.1 CC(Cl)C#N SC-53702 [1,0,0,0,0,0|2,0,1]=4 52 B4R0.1 CC(N)C#N SC-92053 [1,0,0,0,0,0|2,0,1]=4 53 B4R0.1 CC(N)CO SC-18397 [1,0,0,0,0,0|1,0,0]=2 54 B4R0.1 CC(S)CS SC-A2768 [1,0,0,0,0,0|0,2,0]=3 55 B4R0.1 CCB(O)O SC-04516 [1,0,0,0,0,0|2,0,0]=3 56 B4R0.1 CCC(=O)O SC-22887 [1,0,0,0,0,0|1,0,2]=4 57 B4R0.1 CCC(C)O SC-01234 [1,0,0,0,0,0|1,0,0]=2 58 B4R0.1 CC[C@H](C)N SC-81828 [1,0,0,0,0,0|2,0,0]=3 59 B4R0.1 CC[C@H](C)O SC-04418 [1,0,0,0,0,0|1,0,0]=2 60 B4R0.1 CNC(C)C SC-04732 [1,0,0,0,0,0|3,0,0]=4 61 B4R0.1 C[C@@H](N)CN SC-08946 [1,0,0,0,0,0|2,0,0]=3 62 B4R0.1 C[C@@H](N)CO SC-03772 [1,0,0,0,0,0|1,0,0]=2 63 B4R0.1 C[C@@H](O)CN SC-03087 [1,0,0,0,0,0|1,0,0]=2 64 B4R0.1 C[C@@H](O)CO SC-04433 [1,0,0,0,0,0|0,0,0]=1 65 B4R0.1 C[C@H](Cl)CO SC-98590 [1,0,0,0,0,0|1,0,0]=2 66 B4R0.1 C[C@H](N)CN SC-08947 [1,0,0,0,0,0|2,0,0]=3 67 B4R0.1 C[C@H](N)CO SC-03066 [1,0,0,0,0,0|1,0,0]=2 68 B4R0.1 C[C@H](O)CCl SC-99597 [1,0,0,0,0,0|1,0,0]=2 69 B4R0.1 C[C@H](O)CN SC-03088 [1,0,0,0,0,0|1,0,0]=2 70 B4R0.1 C[C@H](O)CO SC-04434 [1,0,0,0,0,0|0,0,0]=1 71 B4R0.1 C\C(N)=N\O SC-29589 [1,0,0,0,0,0|2,0,1]=4 72 B4R0.1 FC(F)CBr SC-21856 [1,0,0,0,0,0|3,0,0]=4 73 B4R0.1 FC(F)CI SC-82530 [1,0,0,0,0,0|3,0,0]=4 74 B4R0.1 N=C(N)CO SC-41719 [1,0,0,0,0,0|2,0,1]=4 75 B4R0.1 N=C(N)CO SC-50460 [1,0,0,0,0,0|2,0,1]=4 76 B4R0.1 NCC(=O)O SC-26884 [1,0,0,0,0,0|1,0,2]=4 77 B4R0.1 NCC(F)F SC-43926 [1,0,0,0,0,0|3,0,0]=4 78 B4R0.1 O=C(O)CBr SC-18211 [1,0,0,0,0,0|1,0,2]=4 79 B4R0.1 O=C(O)CO SC-23119 [1,0,0,0,0,0|0,0,2]=3 80 B4R0.1 O=C(O)CO SC-26092 [1,0,0,0,0,0|0,0,2]=3 81 B4R0.1 OCC(F)F SC-16815 [1,0,0,0,0,0|2,0,0]=3 82 B4R0.1 [C@@H](C)(O)C#C SC-47963 [1,0,0,0,0,0|1,0,1]=3 83 B4R0.1 [C@H](C)(O)C#C SC-47962 [1,0,0,0,0,0|1,0,1]=3 84 B4R0.2 BrCCCBr SC-79111 [1,0,0,0,0,0|2,0,0]=3 85 B4R0.2 C#CCCBr SC-52138 [1,0,0,0,0,0|2,0,1]=4 86 B4R0.2 C#CCCN SC-49547 [1,0,0,0,0,0|2,0,1]=4 87 B4R0.2 C#CCCO SC-17773 [1,0,0,0,0,0|1,0,1]=3 88 B4R0.2 C#CCNO SC-A2362 [1,0,0,0,0,0|2,0,1]=4 89 B4R0.2 C=CCCCl SC-90795 [1,0,0,0,0,0|2,0,1]=4 90 B4R0.2 C=CCCN SC-48242 [1,0,0,0,0,0|2,0,1]=4 91 B4R0.2 C=CCCN SC-52106 [1,0,0,0,0,0|2,0,1]=4 92 B4R0.2 C=CCCO SC-45284 [1,0,0,0,0,0|1,0,1]=3 93 B4R0.2 CC#CCO SC-17951 [1,0,0,0,0,0|1,0,2]=4 94 B4R0.2 CCCNC SC-27548 [1,0,0,0,0,0|3,0,0]=4 95 B4R0.2 CCOCC SC-73354 [1,0,0,0,0,0|3,0,0]=4 96 B4R0.2 CNCCBr SC-98001 [1,0,0,0,0,0|3,0,0]=4 97 B4R0.2 COCCCl SC-05903 [1,0,0,0,0,0|3,0,0]=4 98 B4R0.2 COCCN SC-22236 [1,0,0,0,0,0|3,0,0]=4 99 B4R0.2 CSCCCl SC-53991 [1,0,0,0,0,0|3,0,0]=4 100 B4R0.2 CSCCN SC-28443 [1,0,0,0,0,0|3,0,0]=4 101 B4R0.2 CSCCN SC-83550 [1,0,0,0,0,0|3,0,0]=4 102 B4R0.2 CSCCO SC-19276 [1,0,0,0,0,0|2,0,0]=3 103 B4R0.2 C\C=C/CO SC-69832 [1,0,0,0,0,0|1,0,2]=4 104 B4R0.2 C\C=C\CO SC-25521 [1,0,0,0,0,0|1,0,2]=4 105 B4R0.2 C\C=C\CO SC-69597 [1,0,0,0,0,0|1,0,2]=4 106 B4R0.2 ClCCCI SC-73683 [1,0,0,0,0,0|2,0,0]=3 107 B4R0.2 FCCCBr SC-49851 [1,0,0,0,0,0|2,0,0]=3 108 B4R0.2 FCCCI SC-84350 [1,0,0,0,0,0|2,0,0]=3 109 B4R0.2 ICCCI SC-89448 [1,0,0,0,0,0|2,0,0]=3 110 B4R0.2 N#CCCBr SC-46247 [1,0,0,0,0,0|2,0,1]=4 111 B4R0.2 NCCCBr SC-39593 [1,0,0,0,0,0|2,0,0]=3 112 B4R0.2 NCCCBr SC-48386 [1,0,0,0,0,0|2,0,0]=3 113 B4R0.2 NCCCCl SC-15218 [1,0,0,0,0,0|2,0,0]=3 114 B4R0.2 NCCCO SC-16407 [1,0,0,0,0,0|1,0,0]=2 115 B4R0.2 NCCCS SC-52748 [1,0,0,0,0,0|1,1,0]=3 116 B4R0.2 NNCCO SC-15469 [1,0,0,0,0,0|2,0,0]=3 117 B4R0.2 NOCCO SC-41192 [1,0,0,0,0,0|2,0,0]=3 118 B4R0.2 O=CCCCl SC-71322 [1,0,0,0,0,0|1,0,2]=4 119 B4R0.2 O=CCCO SC-52939 [1,0,0,0,0,0|0,0,2]=3 120 B4R0.2 OCCCBr SC-13514 [1,0,0,0,0,0|1,0,0]=2 121 B4R0.2 OCCCCl SC-15525 [1,0,0,0,0,0|1,0,0]=2 122 B4R0.2 OCCCF SC-24862 [1,0,0,0,0,0|1,0,0]=2 123 B4R0.2 OCCCI SC-65803 [1,0,0,0,0,0|1,0,0]=2 124 B4R0.2 OCCCO SC-25736 [1,0,0,0,0,0|0,0,0]=1 125 B4R0.2 SCCCS SC-17571 [1,0,0,0,0,0|0,2,0]=3 126 B6R0.1 CCOC(=O)CO SC-50412 [0,1,0,0,0,0|1,0,2]=4 127 B6R0.1 CC[C@@H](N)COC SC-65714 [0,1,0,0,0,0|2,0,0]=3 128 B6R0.1 CC[C@H](N)COC SC-89974 [0,1,0,0,0,0|2,0,0]=3 129 B6R0.1 N#CC[C@@H](O)CCl SC-08974 [0,1,0,0,0,0|2,0,0]=3 130 B6R0.1 N#CC[C@H](O)CCl SC-00699 [0,1,0,0,0,0|2,0,0]=3 131 B6R0.1 O=C(CCl)NCO SC-21590 [0,1,0,0,0,0|1,0,2]=4 132 B6R0.1 OCCC(O)CO SC-15322 [0,1,0,0,0,0|0,0,0]=1 133 B6R0.1 OCC[C@H](O)CO SC-08973 [0,1,0,0,0,0|0,0,0]=1 134 B6R0.3 CC(C)C(O)CN SC-34918 [0,1,0,0,0,0|2,0,0]=3 135 B6R0.3 CC(C)C(O)CN SC-A3426 [0,1,0,0,0,0|2,0,0]=3 136 B6R0.3 CC(C)[C@@H](N)CO SC-04448 [0,1,0,0,0,0|2,0,0]=3 137 B6R0.3 CC(C)[C@H](N)CO SC-02242 [0,1,0,0,0,0|2,0,0]=3 138 B6R0.3 CC(CBr)C(=O)O SC-53016 [0,1,0,0,0,0|2,0,1]=4 139 B6R0.3 CC(CN)C(=O)O SC-10095 [0,1,0,0,0,0|2,0,1]=4 140 B6R0.3 CC(CN)C(=O)O SC-16443 [0,1,0,0,0,0|2,0,1]=4 141 B6R0.3 CCC(F)C(=O)O SC-82839 [0,1,0,0,0,0|2,0,1]=4 142 B6R0.3 CCC(N)C(=O)O SC-25570 [0,1,0,0,0,0|2,0,1]=4 143 B6R0.3 CCC(S)C(=O)O SC-90417 [0,1,0,0,0,0|1,1,1]=4 144 B6R0.3 CC[C@@H](C)C(=O)O SC-92309 [0,1,0,0,0,0|2,0,1]=4 145 B6R0.3 CC[C@@H](N)C(=O)O SC-10051 [0,1,0,0,0,0|2,0,1]=4 146 B6R0.3 CC[C@@H](O)C(=O)O SC-53865 [0,1,0,0,0,0|1,0,1]=3 147 B6R0.3 CC[C@H](N)C(=O)O SC-10052 [0,1,0,0,0,0|2,0,1]=4 148 B6R0.3 C[C@@H](CN)C(=O)O SC-69436 [0,1,0,0,0,0|2,0,1]=4 149 B6R0.3 C[C@H](CN)C(=O)O SC-90232 [0,1,0,0,0,0|2,0,1]=4 150 B6R0.3 C[C@H](CN)C(=O)O SC-A1203 [0,1,0,0,0,0|2,0,1]=4 151 B6R0.3 NC(=O)[C@@H](N)CO SC-09855 [0,1,0,0,0,0|1,0,2]=4 152 B6R0.3 NC(CO)C(=O)O SC-09828 [0,1,0,0,0,0|1,0,1]=3 153 B6R0.3 NC(CS)C(=O)O SC-16429 [0,1,0,0,0,0|1,1,1]=4 154 B6R0.3 NCC(N)C(=O)O SC-12518 [0,1,0,0,0,0|2,0,1]=4 155 B6R0.3 NCC(N)C(=O)O SC-26817 [0,1,0,0,0,0|2,0,1]=4 156 B6R0.3 NCC(O)C(=O)O SC-10335 [0,1,0,0,0,0|1,0,1]=3 157 B6R0.3 NC[C@@H](N)C(=O)O SC-10203 [0,1,0,0,0,0|2,0,1]=4 158 B6R0.3 N[C@@H](CO)C(=O)O SC-09827 [0,1,0,0,0,0|1,0,1]=3 159 B6R0.3 N[C@@H](CS)C(=O)O SC-45550 [0,1,0,0,0,0|1,1,1]=4 160 B6R0.3 N[C@H](CO)C(=O)O SC-09826 [0,1,0,0,0,0|1,0,1]=3 161 B6R0.3 O=C(O)C(Br)CBr SC-26969 [0,1,0,0,0,0|2,0,1]=4 162 B6R0.3 O=C(O)C(O)CCl SC-83865 [0,1,0,0,0,0|1,0,1]=3 163 B6R0.3 [C@@H](N)(CS)C(=O)O SC-09427 [0,1,0,0,0,0|1,1,1]=4 164 B6R0.3 [C@@H](N)(CS)C(=O)O SC-09430 [0,1,0,0,0,0|1,1,1]=4 165 B6R0.3 [C@H](N)(CS)C(=O)O SC-09426 [0,1,0,0,0,0|1,1,1]=4 166 B6R0.8 CC(C)(CN)CO SC-65465 [0,1,0,0,0,0|2,0,0]=3 167 B6R0.8 CC(C)(CO)CBr SC-92906 [0,1,0,0,0,0|2,0,0]=3 168 B6R0.8 CC(N)(CO)CO SC-44686 [0,1,0,0,0,0|1,0,0]=2 169 B6R0.8 COC(C)(C)CO SC-90238 [0,1,0,0,0,0|3,0,0]=4 170 B6R0.8 NCC(F)(F)CO SC-A2137 [0,1,0,0,0,0|2,0,0]=3 171 B6R0.8 OCC(F)(F)CO SC-A2616 [0,1,0,0,0,0|1,0,0]=2 172 B6R0.9 CCB(CC)OC SC-22792 [0,1,0,0,0,0|3,0,0]=4 173 B6R0.9 CCC(OC)OC SC-85699 [0,1,0,0,0,0|3,0,0]=4 174 B6R0.9 COC(CBr)OC SC-25586 [0,1,0,0,0,0|3,0,0]=4 175 B6R0.9 COC(CCl)OC SC-23347 [0,1,0,0,0,0|3,0,0]=4 176 B6R0.9 COC(CN)OC SC-15365 [0,1,0,0,0,0|3,0,0]=4 177 B6R0.9 COC(CO)OC SC-71481 [0,1,0,0,0,0|2,0,0]=3 178 B6R0.9 OCC(CO)CO SC-43670 [0,1,0,0,0,0|0,0,0]=1 179 B6R1.2 BrC1CCNC1 SC-24702 [0,0,0,1,0,0|3,0,0]=4 180 B6R1.2 BrC1CCOC1 SC-49709 [0,0,0,1,0,0|2,0,0]=3 181 B6R1.2 CC1CCNC1 SC-24125 [0,0,0,1,0,0|3,0,0]=4 182 B6R1.2 CC1CCNC1 SC-49333 [0,0,0,1,0,0|3,0,0]=4 183 B6R1.2 C[C@@H]1CCNC1 SC-23714 [0,0,0,1,0,0|3,0,0]=4 184 B6R1.2 C[C@@H]1CCNC1 SC-50232 [0,0,0,1,0,0|3,0,0]=4 185 B6R1.2 C[C@H]1CCNC1 SC-50233 [0,0,0,1,0,0|3,0,0]=4 186 B6R1.2 FC1CCCC1 SC-09548 [0,0,0,1,0,0|3,0,0]=4 187 B6R1.2 FC1CCNC1 SC-28940 [0,0,0,1,0,0|3,0,0]=4 188 B6R1.2 F[C@H]1CCNC1 SC-43922 [0,0,0,1,0,0|3,0,0]=4 189 B6R1.2 NC1CC=CC1 SC-21605 [0,0,0,1,0,0|3,0,0]=4 190 B6R1.2 NC1CCCC1 SC-84758 [0,0,0,1,0,0|3,0,0]=4 191 B6R1.2 NC1CCNC1 SC-18208 [0,0,0,1,0,0|3,0,0]=4 192 B6R1.2 NC1CCNC1 SC-62350 [0,0,0,1,0,0|3,0,0]=4 193 B6R1.2 NC1CCOC1 SC-12746 [0,0,0,1,0,0|2,0,0]=3 194 B6R1.2 NC1CCOC1 SC-35465 [0,0,0,1,0,0|2,0,0]=3 195 B6R1.2 N[C@@H]1CCOC1 SC-14942 [0,0,0,1,0,0|2,0,0]=3 196 B6R1.2 N[C@@H]1CCOC1 SC-26567 [0,0,0,1,0,0|2,0,0]=3 197 B6R1.2 N[C@H]1CCOC1 SC-14943 [0,0,0,1,0,0|2,0,0]=3 198 B6R1.2 O=C1CCOC1 SC-21867 [0,0,0,1,0,0|1,0,2]=4 199 B6R1.2 OC1CC=CC1 SC-22908 [0,0,0,1,0,0|2,0,0]=3 200 B6R1.2 OC1CCCN1 SC-21341 [0,0,0,1,0,0|3,0,0]=4 201 B6R1.2 OC1CCNC1 SC-00623 [0,0,0,1,0,0|2,0,0]=3 202 B6R1.2 OC1CCNC1 SC-19629 [0,0,0,1,0,0|2,0,0]=3 203 B6R1.2 OC1CCNC1 SC-24957 [0,0,0,1,0,0|2,0,0]=3 204 B6R1.2 OC1CCNC1 SC-27708 [0,0,0,1,0,0|2,0,0]=3 205 B6R1.2 OC1CCOC1 SC-17875 [0,0,0,1,0,0|1,0,0]=2 206 B6R1.2 O[C@@H]1CCNC1 SC-00194 [0,0,0,1,0,0|2,0,0]=3 207 B6R1.2 O[C@@H]1CCNC1 SC-13984 [0,0,0,1,0,0|2,0,0]=3 208 B6R1.2 O[C@@H]1CCOC1 SC-07022 [0,0,0,1,0,0|1,0,0]=2 209 B6R1.2 O[C@@H]1CNOC1 SC-83248 [0,0,0,1,0,0|1,0,0]=2 210 B6R1.2 O[C@H]1CCOC1 SC-08982 [0,0,0,1,0,0|1,0,0]=2 211 B6R1.2 O[C@H]1CCOC1 SC-50082 [0,0,0,1,0,0|1,0,0]=2 212 B6R1.2 O[C@H]1CNOC1 SC-83247 [0,0,0,1,0,0|1,0,0]=2 213 B6R1.2 [C@H]1(O)CCNC1 SC-24229 [0,0,0,1,0,0|2,0,0]=3 214 B6R1.6 BrCC1CCC1 SC-17177 [0,0,0,1,0,0|3,0,0]=4 215 B6R1.6 BrCC1COC1 SC-88668 [0,0,0,1,0,0|2,0,0]=3 216 B6R1.6 ICC1CCC1 SC-B3939 [0,0,0,1,0,0|3,0,0]=4 217 B6R1.6 ICC1COC1 SC-52174 [0,0,0,1,0,0|2,0,0]=3 218 B6R1.6 NCC1CCC1 SC-12470 [0,0,0,1,0,0|3,0,0]=4 219 B6R1.6 NCC1CCC1 SC-22241 [0,0,0,1,0,0|3,0,0]=4 220 B6R1.6 NCC1CCC1 SC-A4294 [0,0,0,1,0,0|3,0,0]=4 221 B6R1.6 NCC1COC1 SC-48246 [0,0,0,1,0,0|2,0,0]=3 222 B6R1.6 O=CC1COC1 SC-65750 [0,0,0,1,0,0|1,0,2]=4 223 B6R1.6 OCC1CCC1 SC-16736 [0,0,0,1,0,0|2,0,0]=3 224 B6R1.6 OCC1CCO1 SC-48256 [0,0,0,1,0,0|1,0,0]=2 225 B6R1.6 OCC1CNC1 SC-12744 [0,0,0,1,0,0|2,0,0]=3 226 B6R1.6 OCC1CNC1 SC-49233 [0,0,0,1,0,0|2,0,0]=3 227 B6R1.6 OCC1COC1 SC-48581 [0,0,0,1,0,0|1,0,0]=2 228 B6R1.7 CC1(CO)CC1 SC-54558 [0,0,0,1,0,0|2,0,0]=3 229 B6R1.7 NC1(CO)CC1 SC-21613 [0,0,0,1,0,0|2,0,0]=3 230 B6R1.7 NC1(CO)CC1 SC-52621 [0,0,0,1,0,0|2,0,0]=3 231 B6R1.7 NCC1(O)CC1 SC-49870 [0,0,0,1,0,0|2,0,0]=3 232 B3R0.1 CCC[Zn+] SC-92929 [2,0,0,0,0,0|1,0,0]=3 233 B3R0.1 CCNN SC-47438 [2,0,0,0,0,0|2,0,0]=4 234 B3R0.1 CCNN SC-88458 [2,0,0,0,0,0|2,0,0]=4 235 B3R0.1 CCNO SC-82856 [2,0,0,0,0,0|1,0,0]=3 236 B3R0.1 CCO[NH3+] SC-76549 [2,0,0,0,0,0|2,0,0]=4 237 B3R0.1 COCBr SC-13660 [2,0,0,0,0,0|2,0,0]=4 238 B3R0.1 C\C=N\O SC-16388 [2,0,0,0,0,0|1,0,1]=4 239 B3R0.1 ClCCBr SC-16459 [2,0,0,0,0,0|2,0,0]=4 240 B3R0.1 ClCCI SC-93145 [2,0,0,0,0,0|2,0,0]=4 241 B3R0.1 FCCBr SC-16577 [2,0,0,0,0,0|2,0,0]=4 242 B3R0.1 NCCBr SC-11569 [2,0,0,0,0,0|2,0,0]=4 243 B3R0.1 NCCCl SC-15450 [2,0,0,0,0,0|2,0,0]=4 244 B3R0.1 NCCCl SC-40145 [2,0,0,0,0,0|2,0,0]=4 245 B3R0.1 NCCF SC-66629 [2,0,0,0,0,0|2,0,0]=4 246 B3R0.1 NCCF SC-89351 [2,0,0,0,0,0|2,0,0]=4 247 B3R0.1 OCCBr SC-26949 [2,0,0,0,0,0|1,0,0]=3 248 B3R0.1 OCCF SC-22570 [2,0,0,0,0,0|1,0,0]=3 249 B3R0.1 OCCI SC-46883 [2,0,0,0,0,0|1,0,0]=3 250 B3R0.1 OCCO SC-A3578 [2,0,0,0,0,0|0,0,0]=2 251 B3R0.1 SCCS SC-27058 [2,0,0,0,0,0|0,2,0]=4 252 B3R0.2 CB(O)O SC-00749 [2,0,0,0,0,0|1,0,0]=3 253 B3R0.2 CC(=O)O SC-16774 [2,0,0,0,0,0|0,0,2]=4 254 B3R0.2 CC(=O)O SC-27909 [2,0,0,0,0,0|0,0,2]=4 255 B3R0.2 CC(C)[O-] SC-43831 [2,0,0,0,0,0|0,0,1]=3 256 B3R0.2 CC(C)[O-] SC-94197 [2,0,0,0,0,0|0,0,1]=3 257 B3R0.2 CN(C)C SC-46902 [2,0,0,0,0,0|2,0,0]=4 258 B3R0.2 C[PH](C)=O SC-72909 [2,0,0,0,0,0|1,0,1]=4 259 B3R0.2 C[S+](C)C SC-68838 [2,0,0,0,0,0|2,0,0]=4 260 B3R0.2 C[S+](C)C SC-97925 [2,0,0,0,0,0|2,0,0]=4 261 B3R0.2 O=C(O)O SC-18529 [2,0,0,0,0,0|0,0,2]=4 262 B5R0.1 CC(=O)CCO SC-65678 [1,1,0,0,0,0|0,0,2]=4 263 B5R0.1 CC(C)=CCO SC-77150 [1,1,0,0,0,0|1,0,1]=4 264 B5R0.1 CC(N)CCO SC-82589 [1,1,0,0,0,0|1,0,0]=3 265 B5R0.1 CCCB(O)O SC-47544 [1,1,0,0,0,0|2,0,0]=4 266 B5R0.1 CCCC(C)N SC-53929 [1,1,0,0,0,0|2,0,0]=4 267 B5R0.1 CCCC(C)O SC-03320 [1,1,0,0,0,0|1,0,0]=3 268 B5R0.1 CCNC(C)C SC-84122 [1,1,0,0,0,0|2,0,0]=4 269 B5R0.1 CN(C)CCO SC-87330 [1,1,0,0,0,0|2,0,0]=4 270 B5R0.1 COCC(C)N SC-48787 [1,1,0,0,0,0|1,0,0]=3 271 B5R0.1 COCC(C)O SC-00293 [1,1,0,0,0,0|0,0,0]=2 272 B5R0.1 COC[C@@H](C)N SC-47724 [1,1,0,0,0,0|1,0,0]=3 273 B5R0.1 COC[C@@H](C)O SC-04836 [1,1,0,0,0,0|0,0,0]=2 274 B5R0.1 C[C@@H](N)CCO SC-48293 [1,1,0,0,0,0|1,0,0]=3 275 B5R0.1 C[C@@H](O)CCO SC-05919 [1,1,0,0,0,0|0,0,0]=2 276 B5R0.1 C[C@H](O)CCO SC-02840 [1,1,0,0,0,0|0,0,0]=2 277 B5R0.4 C#CC(C)(C)O SC-26729 [1,1,0,0,0,0|1,0,1]=4 278 B5R0.4 CC(C)(Br)CBr SC-97871 [1,1,0,0,0,0|2,0,0]=4 279 B5R0.4 CC(C)(C)CBr SC-24158 [1,1,0,0,0,0|2,0,0]=4 280 B5R0.4 CC(C)(C)CCl SC-48963 [1,1,0,0,0,0|2,0,0]=4 281 B5R0.4 CC(C)(C)CN SC-97733 [1,1,0,0,0,0|2,0,0]=4 282 B5R0.4 CC(C)(C)CO SC-27689 [1,1,0,0,0,0|1,0,0]=3 283 B5R0.4 CC(C)(C)NO SC-44932 [1,1,0,0,0,0|2,0,0]=4 284 B5R0.4 CC(C)(F)CBr SC-84038 [1,1,0,0,0,0|2,0,0]=4 285 B5R0.4 CC(C)(F)CO SC-14344 [1,1,0,0,0,0|1,0,0]=3 286 B5R0.4 CC(C)(N)CF SC-90380 [1,1,0,0,0,0|2,0,0]=4 287 B5R0.4 CC(C)(N)CN SC-47310 [1,1,0,0,0,0|2,0,0]=4 288 B5R0.4 CC(C)(N)CO SC-00654 [1,1,0,0,0,0|1,0,0]=3 289 B5R0.4 CC(C)(O)CBr SC-69889 [1,1,0,0,0,0|1,0,0]=3 290 B5R0.4 CC(C)(O)CCl SC-05342 [1,1,0,0,0,0|1,0,0]=3 291 B5R0.4 CC(C)(O)CN SC-14245 [1,1,0,0,0,0|1,0,0]=3 292 B5R0.4 CC(C)(O)CO SC-93601 [1,1,0,0,0,0|0,0,0]=2 293 B5R0.4 CC(F)(F)CN SC-49451 [1,1,0,0,0,0|2,0,0]=4 294 B5R0.4 CC(F)(F)CN SC-70960 [1,1,0,0,0,0|2,0,0]=4 295 B5R0.4 CC(F)(F)CO SC-21322 [1,1,0,0,0,0|1,0,0]=3 296 B5R0.4 CCC(C)(C)[O-] SC-25920 [1,1,0,0,0,0|1,0,1]=4 297 B5R0.4 NCP(=O)(O)O SC-86885 [1,1,0,0,0,0|2,0,0]=4 298 B5R0.5 CC(C)B(O)O SC-66620 [1,1,0,0,0,0|2,0,0]=4 299 B5R0.5 CC(Cl)C(Cl)Cl SC-25006 [1,1,0,0,0,0|2,0,0]=4 300 B5R0.5 CC(F)C(=O)O SC-83429 [1,1,0,0,0,0|1,0,1]=4 301 B5R0.5 CC(N)C(=O)O SC-09271 [1,1,0,0,0,0|1,0,1]=4 302 B5R0.5 CC(O)C(=O)[O-] SC-19308 [1,1,0,0,0,0|0,0,2]=4 303 B5R0.5 CC(O)C(=O)[O-] SC-25623 [1,1,0,0,0,0|0,0,2]=4 304 B5R0.5 CC(O)C(=O)[O-] SC-75139 [1,1,0,0,0,0|0,0,2]=4 305 B5R0.5 CC(O)C(C)O SC-08971 [1,1,0,0,0,0|0,0,0]=2 306 B5R0.5 CC(O)C(C)O SC-08972 [1,1,0,0,0,0|0,0,0]=2 307 B5R0.5 CC(O)C(C)O SC-81338 [1,1,0,0,0,0|0,0,0]=2 308 B5R0.5 CC(S)C(=O)O SC-74563 [1,1,0,0,0,0|0,1,1]=4 309 B5R0.5 C[C@@H](Br)C(=O)O SC-08843 [1,1,0,0,0,0|1,0,1]=4 310 B5R0.5 C[C@@H](Cl)C(=O)O SC-06610 [1,1,0,0,0,0|1,0,1]=4 311 B5R0.5 C[C@@H](N)C(=O)O SC-09270 [1,1,0,0,0,0|1,0,1]=4 312 B5R0.5 C[C@@H](O)C(N)=O SC-92873 [1,1,0,0,0,0|0,0,2]=4 313 B5R0.5 C[C@H](Cl)C(=O)O SC-03218 [1,1,0,0,0,0|1,0,1]=4 314 B5R0.5 C[C@H](N)C(=O)O SC-09272 [1,1,0,0,0,0|1,0,1]=4 315 B5R0.5 C[C@H](O)C(N)=O SC-73228 [1,1,0,0,0,0|0,0,2]=4 316 B5R0.5 OB(O)B(O)O SC-53118 [1,1,0,0,0,0|2,0,0]=4 317 B5R0.5 [C@@H](C)(Br)C(=O)O SC-03475 [1,1,0,0,0,0|1,0,1]=4 318 B5R0.2 C#CCCCCl SC-46678 [1,1,0,0,0,0|2,0,0]=4 319 B5R0.2 C#CCCCI SC-A2786 [1,1,0,0,0,0|2,0,0]=4 320 B5R0.2 C#CCCCN SC-48603 [1,1,0,0,0,0|2,0,0]=4 321 B5R0.2 C#CCCCN SC-99931 [1,1,0,0,0,0|2,0,0]=4 322 B5R0.2 C=CCCCBr SC-47340 [1,1,0,0,0,0|2,0,0]=4 323 B5R0.2 C=CCCCN SC-28944 [1,1,0,0,0,0|2,0,0]=4 324 B5R0.2 C=CCCCO SC-78424 [1,1,0,0,0,0|1,0,0]=3 325 B5R0.2 C=COCCO SC-22660 [1,1,0,0,0,0|1,0,1]=4 326 B5R0.2 CCCCNN SC-68008 [1,1,0,0,0,0|2,0,0]=4 327 B5R0.2 CCSCCCl SC-43710 [1,1,0,0,0,0|2,0,0]=4 328 B5R0.2 CNCCCO SC-94106 [1,1,0,0,0,0|1,0,0]=3 329 B5R0.2 CNCCOC SC-15056 [1,1,0,0,0,0|2,0,0]=4 330 B5R0.2 COCCC=O SC-85357 [1,1,0,0,0,0|0,0,2]=4 331 B5R0.2 COCCCBr SC-20920 [1,1,0,0,0,0|1,0,0]=3 332 B5R0.2 COCCNN SC-53129 [1,1,0,0,0,0|2,0,0]=4 333 B5R0.2 COCCNN SC-70814 [1,1,0,0,0,0|2,0,0]=4 334 B5R0.2 ClCCCCBr SC-17538 [1,1,0,0,0,0|2,0,0]=4 335 B5R0.2 FCCCCBr SC-43880 [1,1,0,0,0,0|2,0,0]=4 336 B5R0.2 ICCCCI SC-69402 [1,1,0,0,0,0|2,0,0]=4 337 B5R0.2 N#CCCCBr SC-20060 [1,1,0,0,0,0|2,0,0]=4 338 B5R0.2 N#CCCCCl SC-16423 [1,1,0,0,0,0|2,0,0]=4 339 B5R0.2 NCCCCCl SC-14246 [1,1,0,0,0,0|2,0,0]=4 340 B5R0.2 NCCCCN SC-20919 [1,1,0,0,0,0|2,0,0]=4 341 B5R0.2 NCCCCO SC-48186 [1,1,0,0,0,0|1,0,0]=3 342 B5R0.2 O=CCCCBr SC-69595 [1,1,0,0,0,0|1,0,1]=4 343 B5R0.2 OCCCCBr SC-12645 [1,1,0,0,0,0|1,0,0]=3 344 B5R0.2 OCCCCCl SC-23109 [1,1,0,0,0,0|1,0,0]=3 345 B5R0.2 OC\C=C/CO SC-27134 [1,1,0,0,0,0|0,0,1]=3 346 B5R0.2 OC\C=C\CBr SC-36162 [1,1,0,0,0,0|1,0,1]=4 347 B5R0.2 OC\C=C\CO SC-82263 [1,1,0,0,0,0|0,0,1]=3 348 B5R0.2 [N-]=[N+]=NCCO SC-88730 [1,1,0,0,0,0|2,0,0]=4 349 B7R0.2 CC(C)C[C@@H](N)CO SC-15764 [0,2,0,0,0,0|2,0,0]=4 350 B7R0.2 CC(C)C[C@H](N)CO SC-08985 [0,2,0,0,0,0|2,0,0]=4 351 B7R0.2 CCC(C)CC(=O)O SC-19132 [0,2,0,0,0,0|2,0,0]=4 352 B7R0.2 CCC(N)CC(=O)O SC-59260 [0,2,0,0,0,0|2,0,0]=4 353 B7R0.2 CCC(O)CC(C)=O SC-92943 [0,2,0,0,0,0|1,0,1]=4 354 B7R0.2 NCC(O)CC(=O)O SC-50844 [0,2,0,0,0,0|1,0,0]=3 355 B7R0.2 N[C@H](CO)CC(=O)O SC-72100 [0,2,0,0,0,0|1,0,0]=3 356 B7R0.3 CCCCC(O)CO SC-74356 [0,2,0,0,0,0|1,0,0]=3 357 B7R0.3 CCOCC(O)CO SC-90419 [0,2,0,0,0,0|0,0,0]=2 358 B7R0.5 COC[C@@H](N)C(=O)O SC-52821 [0,2,0,0,0,0|1,0,1]=4 359 B7R0.5 COC[C@H](N)C(=O)O SC-26107 [0,2,0,0,0,0|1,0,1]=4 360 B7R0.5 COC[C@H](N)C(=O)O SC-47929 [0,2,0,0,0,0|1,0,1]=4 361 B7R0.5 NC(CCO)C(=O)O SC-10290 [0,2,0,0,0,0|1,0,1]=4 362 B7R0.5 N[C@@H](CCO)C(=O)O SC-10291 [0,2,0,0,0,0|1,0,1]=4 363 B7R0.5 N[C@H](CCO)C(=O)O SC-10292 [0,2,0,0,0,0|1,0,1]=4 364 B7R0.7 CC(CCO)CCO SC-15062 [0,2,0,0,0,0|1,0,0]=3 365 B7R0.7 CCC[C@H](N)CCO SC-A3499 [0,2,0,0,0,0|2,0,0]=4 366 B7R0.7 CN(CCO)CCO SC-56199 [0,2,0,0,0,0|2,0,0]=4 367 B7R0.7 COCC(=O)COC SC-43684 [0,2,0,0,0,0|0,0,2]=4 368 B7R0.7 COCC(O)COC SC-65162 [0,2,0,0,0,0|0,0,0]=2 369 B7R0.10 CC(CN)[C@H](N)CO SC-54106 [0,2,0,0,0,0|2,0,0]=4 370 B7R0.10 CC[C@@H](O)C(=O)OC SC-49455 [0,2,0,0,0,0|1,0,1]=4 371 B7R0.10 CC[C@H](C)[C@H](N)CO SC-08984 [0,2,0,0,0,0|2,0,0]=4 372 B7R0.10 COC(=O)C(Br)CO SC-87315 [0,2,0,0,0,0|1,0,1]=4 373 B7R0.10 COC(=O)C(C)CO SC-08906 [0,2,0,0,0,0|1,0,1]=4 374 B7R0.10 COC(=O)C(C)CO SC-08907 [0,2,0,0,0,0|1,0,1]=4 375 B7R0.10 COC(=O)C(N)CO SC-09862 [0,2,0,0,0,0|1,0,1]=4 376 B7R0.10 COC(=O)C(N)CO SC-51728 [0,2,0,0,0,0|1,0,1]=4 377 B7R0.10 COC(=O)[C@@H](O)CO SC-44674 [0,2,0,0,0,0|0,0,1]=3 378 B7R0.10 COC(=O)[C@H](N)CO SC-21448 [0,2,0,0,0,0|1,0,1]=4 379 B7R0.10 O=CC(O)C(O)C=O SC-74089 [0,2,0,0,0,0|0,0,2]=4 380 B7R0.10 OC(CS)C(O)CS SC-15337 [0,2,0,0,0,0|0,1,0]=3 381 B7R0.10 [C@H](O)(CO)[C@H](O)CO SC-11315 [0,2,0,0,0,0|0,0,0]=2 382 B7R0.12 COCC(OC)OC SC-73556 [0,2,0,0,0,0|2,0,0]=4 383 B7R0.13 OCC(F)(F)C(F)F SC-17453 [0,2,0,0,0,0|2,0,0]=4 384 B7R0.14 CC(C)(C)C(N)CO SC-92545 [0,2,0,0,0,0|2,0,0]=4 385 B7R0.14 CC(C)(C)C(O)CBr SC-90410 [0,2,0,0,0,0|2,0,0]=4 386 B7R0.14 CC(C)(O)[C@H](F)CN SC-91611 [0,2,0,0,0,0|2,0,0]=4 387 B7R0.14 NC(CO)C(F)(F)F SC-14737 [0,2,0,0,0,0|2,0,0]=4 388 B7R0.14 NC(CO)C(F)(F)F SC-48374 [0,2,0,0,0,0|2,0,0]=4 389 B7R0.14 NCC(O)C(F)(F)F SC-21158 [0,2,0,0,0,0|2,0,0]=4 390 B7R0.14 [C@H](N)(CO)C(C)(C)C SC-26207 [0,2,0,0,0,0|2,0,0]=4 391 B7R0.15 CNC(CO)C(=O)O SC-26706 [0,2,0,0,0,0|1,0,1]=4 392 B7R0.15 O=C(O)C(CBr)CBr SC-16780 [0,2,0,0,0,0|2,0,0]=4 393 B7R0.15 O=C(O)C(CF)CF SC-41163 [0,2,0,0,0,0|2,0,0]=4 394 B7R0.15 [C@@H](CO)(NC)C(=O)O SC-20914 [0,2,0,0,0,0|1,0,1]=4 395 B7R0.16 CC(C)C(O)C(=O)O SC-A2103 [0,2,0,0,0,0|1,0,1]=4 396 B7R0.16 CC(C)[C@@H](O)C(=O)O SC-01716 [0,2,0,0,0,0|1,0,1]=4 397 B7R0.16 CC(O)C(N)C(=O)O SC-09869 [0,2,0,0,0,0|1,0,1]=4 398 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O SC-09868 [0,2,0,0,0,0|1,0,1]=4 399 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O SC-09866 [0,2,0,0,0,0|1,0,1]=4 400 B7R0.16 C[C@H](O)C(N)C(=O)O SC-46538 [0,2,0,0,0,0|1,0,1]=4 401 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O SC-09865 [0,2,0,0,0,0|1,0,1]=4 402 B7R0.16 O=C(O)C(O)C(=O)O SC-70695 [0,2,0,0,0,0|0,0,2]=4 403 B7R0.18 CC(CO)(CO)CO SC-27687 [0,2,0,0,0,0|0,0,0]=2 404 B7R0.18 NC(CO)(CO)CO SC-46286 [0,2,0,0,0,0|0,0,0]=2 405 B5R1.2 BrC1CCC1 SC-50402 [1,0,0,1,0,0|2,0,0]=4 406 B5R1.2 CC1CCN1 SC-70091 [1,0,0,1,0,0|2,0,0]=4 407 B5R1.2 CC1CCN1 SC-A3607 [1,0,0,1,0,0|2,0,0]=4 408 B5R1.2 CC1CCN1 SC-A3960 [1,0,0,1,0,0|2,0,0]=4 409 B5R1.2 CC1CNC1 SC-50429 [1,0,0,1,0,0|2,0,0]=4 410 B5R1.2 FC1CNC1 SC-47665 [1,0,0,1,0,0|2,0,0]=4 411 B5R1.2 FC1CNC1 SC-51742 [1,0,0,1,0,0|2,0,0]=4 412 B5R1.2 IC1CCC1 SC-92367 [1,0,0,1,0,0|2,0,0]=4 413 B5R1.2 IC1COC1 SC-43780 [1,0,0,1,0,0|1,0,0]=3 414 B5R1.2 NC1CCC1 SC-20422 [1,0,0,1,0,0|2,0,0]=4 415 B5R1.2 NC1CNC1 SC-82511 [1,0,0,1,0,0|2,0,0]=4 416 B5R1.2 NC1COC1 SC-20809 [1,0,0,1,0,0|1,0,0]=3 417 B5R1.2 O=C1COC1 SC-21889 [1,0,0,1,0,0|0,0,2]=4 418 B5R1.2 OC1CNC1 SC-04637 [1,0,0,1,0,0|1,0,0]=3 419 B5R1.2 OC1CNC1 SC-19998 [1,0,0,1,0,0|1,0,0]=3 420 B5R1.2 OC1COC1 SC-25466 [1,0,0,1,0,0|0,0,0]=2 421 B5R1.2 OC1CSC1 SC-36448 [1,0,0,1,0,0|0,1,0]=3 422 B5R1.2 SC1COC1 SC-B7217 [1,0,0,1,0,0|0,1,0]=3 423 B5R1.3 BrCC1CC1 SC-16841 [1,0,0,1,0,0|2,0,0]=4 424 B5R1.3 C=CC1CO1 SC-72377 [1,0,0,1,0,0|1,0,1]=4 425 B5R1.3 CC[C@@H]1CO1 SC-52802 [1,0,0,1,0,0|1,0,0]=3 426 B5R1.3 ClCC1CC1 SC-27742 [1,0,0,1,0,0|2,0,0]=4 427 B5R1.3 ClC[C@@H]1CO1 SC-06234 [1,0,0,1,0,0|1,0,0]=3 428 B5R1.3 ClC[C@H]1CO1 SC-04973 [1,0,0,1,0,0|1,0,0]=3 429 B5R1.3 FCC1CO1 SC-91371 [1,0,0,1,0,0|1,0,0]=3 430 B5R1.3 NCC1CC1 SC-16854 [1,0,0,1,0,0|2,0,0]=4 431 B5R1.3 NCC1CC1 SC-95616 [1,0,0,1,0,0|2,0,0]=4 432 B5R1.3 OCC1CC1 SC-02886 [1,0,0,1,0,0|1,0,0]=3 433 B5R1.3 OCC1CO1 SC-18485 [1,0,0,1,0,0|0,0,0]=2 434 B5R1.3 OC[C@@H]1CO1 SC-05422 [1,0,0,1,0,0|0,0,0]=2 435 B5R1.3 OC[C@H]1CO1 SC-05653 [1,0,0,1,0,0|0,0,0]=2 436 B5R1.4 NC1CC1F SC-88258 [1,0,0,1,0,0|2,0,0]=4 437 B5R1.5 CC1(C)CO1 SC-77899 [1,0,0,1,0,0|1,0,0]=3 438 B5R1.5 CC1(N)CC1 SC-43846 [1,0,0,1,0,0|2,0,0]=4 439 B5R1.5 CC1(N)CC1 SC-69791 [1,0,0,1,0,0|2,0,0]=4 440 B5R1.1 C1=CCCC1 SC-18920 [1,0,0,1,0,0|2,0,0]=4 441 B7R1.1 BrCC1CCCO1 SC-00526 [0,1,0,1,0,0|2,0,0]=4 442 B7R1.1 CNC1CCOC1 SC-81912 [0,1,0,1,0,0|2,0,0]=4 443 B7R1.1 CN[C@@H]1CCOC1 SC-A2281 [0,1,0,1,0,0|2,0,0]=4 444 B7R1.1 COC1CCNC1 SC-12454 [0,1,0,1,0,0|2,0,0]=4 445 B7R1.1 COC1CCNC1 SC-24177 [0,1,0,1,0,0|2,0,0]=4 446 B7R1.1 CO[C@@H]1CCNC1 SC-25526 [0,1,0,1,0,0|2,0,0]=4 447 B7R1.1 CO[C@@H]1CCNC1 SC-51990 [0,1,0,1,0,0|2,0,0]=4 448 B7R1.1 CO[C@H]1CCNC1 SC-25506 [0,1,0,1,0,0|2,0,0]=4 449 B7R1.1 ICC1CCOC1 SC-26534 [0,1,0,1,0,0|2,0,0]=4 450 B7R1.1 N#CC1CCOC1 SC-28637 [0,1,0,1,0,0|2,0,0]=4 451 B7R1.1 NCC1CCOC1 SC-12415 [0,1,0,1,0,0|2,0,0]=4 452 B7R1.1 NC[C@@H]1CCCO1 SC-28608 [0,1,0,1,0,0|2,0,0]=4 453 B7R1.1 OCC1C=CCN1 SC-92889 [0,1,0,1,0,0|2,0,0]=4 454 B7R1.1 OCC1CC=CC1 SC-45771 [0,1,0,1,0,0|2,0,0]=4 455 B7R1.1 OCC1CCCC1 SC-03842 [0,1,0,1,0,0|2,0,0]=4 456 B7R1.1 OCC1CCCN1 SC-12006 [0,1,0,1,0,0|2,0,0]=4 457 B7R1.1 OCC1CCCO1 SC-94849 [0,1,0,1,0,0|1,0,0]=3 458 B7R1.1 OCC1CCOC1 SC-21250 [0,1,0,1,0,0|1,0,0]=3 459 B7R1.1 OC[C@@H]1CCCN1 SC-02696 [0,1,0,1,0,0|2,0,0]=4 460 B7R1.1 OC[C@@H]1CCCN1 SC-48321 [0,1,0,1,0,0|2,0,0]=4 461 B7R1.1 OC[C@@H]1CCCO1 SC-20330 [0,1,0,1,0,0|1,0,0]=3 462 B7R1.1 OC[C@@H]1CCNC1 SC-48002 [0,1,0,1,0,0|2,0,0]=4 463 B7R1.1 OC[C@H]1CCCN1 SC-06270 [0,1,0,1,0,0|2,0,0]=4 464 B7R1.2 CC1COC(=O)C1 SC-60836 [0,1,0,1,0,0|1,0,1]=4 465 B7R1.2 CN1CC[C@@H](O)C1 SC-49684 [0,1,0,1,0,0|2,0,0]=4 466 B7R1.2 CN1CC[C@H](O)C1 SC-23905 [0,1,0,1,0,0|2,0,0]=4 467 B7R1.2 NC1CCC(O)C1 SC-47773 [0,1,0,1,0,0|2,0,0]=4 468 B7R1.2 NC1CCC(O)C1 SC-47979 [0,1,0,1,0,0|2,0,0]=4 469 B7R1.2 NC1CCC(O)C1 SC-49660 [0,1,0,1,0,0|2,0,0]=4 470 B7R1.2 NC1CCC(O)C1 SC-51126 [0,1,0,1,0,0|2,0,0]=4 471 B7R1.2 NC1CCC(O)C1 SC-92977 [0,1,0,1,0,0|2,0,0]=4 472 B7R1.2 NC1COC(=O)C1 SC-34183 [0,1,0,1,0,0|1,0,1]=4 473 B7R1.2 N[C@@H]1CC[C@H](O)C1 SC-83316 [0,1,0,1,0,0|2,0,0]=4 474 B7R1.2 N[C@@H]1COC(=O)C1 SC-71558 [0,1,0,1,0,0|1,0,1]=4 475 B7R1.2 N[C@H]1CC[C@@H](O)C1 SC-42369 [0,1,0,1,0,0|2,0,0]=4 476 B7R1.2 N[C@H]1CC[C@@H](O)C1 SC-47775 [0,1,0,1,0,0|2,0,0]=4 477 B7R1.2 N[C@H]1CC[C@H](O)C1 SC-47774 [0,1,0,1,0,0|2,0,0]=4 478 B7R1.2 N[C@H]1CC[C@H](O)C1 SC-93243 [0,1,0,1,0,0|2,0,0]=4 479 B7R1.2 O=C1CC(O)CN1 SC-29049 [0,1,0,1,0,0|1,0,1]=4 480 B7R1.2 O=C1C[C@@H](O)CN1 SC-02616 [0,1,0,1,0,0|1,0,1]=4 481 B7R1.2 O=C1C[C@H](O)CN1 SC-13587 [0,1,0,1,0,0|1,0,1]=4 482 B7R1.2 O=C1C[C@H](O)CO1 SC-06559 [0,1,0,1,0,0|0,0,1]=3 483 B7R1.3 BrC1CCCOC1 SC-43426 [0,1,0,1,0,0|2,0,0]=4 484 B7R1.3 BrC1CCOCC1 SC-27394 [0,1,0,1,0,0|2,0,0]=4 485 B7R1.3 CC1COCCN1 SC-49161 [0,1,0,1,0,0|2,0,0]=4 486 B7R1.3 C[C@@H]1COCCN1 SC-53994 [0,1,0,1,0,0|2,0,0]=4 487 B7R1.3 C[C@H]1COCCN1 SC-21564 [0,1,0,1,0,0|2,0,0]=4 488 B7R1.3 C[C@H]1COCCN1 SC-69967 [0,1,0,1,0,0|2,0,0]=4 489 B7R1.3 IC1CCOCC1 SC-98886 [0,1,0,1,0,0|2,0,0]=4 490 B7R1.3 NC1CCCOC1 SC-35742 [0,1,0,1,0,0|2,0,0]=4 491 B7R1.3 NC1CCCOC1 SC-49332 [0,1,0,1,0,0|2,0,0]=4 492 B7R1.3 NC1CCOCC1 SC-03529 [0,1,0,1,0,0|2,0,0]=4 493 B7R1.3 NC1CCOCC1 SC-04006 [0,1,0,1,0,0|2,0,0]=4 494 B7R1.3 N[C@@H]1CCCOC1 SC-71639 [0,1,0,1,0,0|2,0,0]=4 495 B7R1.3 N[C@@H]1CCCOC1 SC-96408 [0,1,0,1,0,0|2,0,0]=4 496 B7R1.3 N[C@H]1CCCOC1 SC-94110 [0,1,0,1,0,0|2,0,0]=4 497 B7R1.3 OC1CC=CCC1 SC-87372 [0,1,0,1,0,0|2,0,0]=4 498 B7R1.3 OC1CCCCO1 SC-84303 [0,1,0,1,0,0|2,0,0]=4 499 B7R1.3 OC1CCCNC1 SC-06262 [0,1,0,1,0,0|2,0,0]=4 500 B7R1.3 OC1CCCNC1 SC-47771 [0,1,0,1,0,0|2,0,0]=4 501 B7R1.3 OC1CCCOC1 SC-19794 [0,1,0,1,0,0|1,0,0]=3 502 B7R1.3 OC1CCCOC1 SC-35801 [0,1,0,1,0,0|1,0,0]=3 503 B7R1.3 OC1CCNCC1 SC-05165 [0,1,0,1,0,0|2,0,0]=4 504 B7R1.3 OC1CCOCC1 SC-02372 [0,1,0,1,0,0|1,0,0]=3 505 B7R1.3 OC1CCSCC1 SC-35917 [0,1,0,1,0,0|1,1,0]=4 506 B7R1.3 O[C@@H]1CCCNC1 SC-12564 [0,1,0,1,0,0|2,0,0]=4 507 B7R1.3 O[C@H]1CCCNC1 SC-19802 [0,1,0,1,0,0|2,0,0]=4 508 B7R1.3 SC1CCOCC1 SC-47759 [0,1,0,1,0,0|1,1,0]=4 509 B7R1.4 NC1CCCC1O SC-21764 [0,1,0,1,0,0|2,0,0]=4 510 B7R1.4 N[C@@H]1COC[C@@H]1N SC-33569 [0,1,0,1,0,0|2,0,0]=4 511 B7R1.4 N[C@H]1CCC[C@@H]1O SC-27686 [0,1,0,1,0,0|2,0,0]=4 512 B7R1.4 N[C@H]1COC[C@@H]1O SC-44041 [0,1,0,1,0,0|1,0,0]=3 513 B7R1.4 O[C@@H]1CCC[C@H]1O SC-A2623 [0,1,0,1,0,0|1,0,0]=3 514 B7R1.4 [C@@H]1(N)CCC[C@H]1O SC-16146 [0,1,0,1,0,0|2,0,0]=4 515 B7R1.4 [C@H]1(N)CCC[C@H]1O SC-25435 [0,1,0,1,0,0|2,0,0]=4 516 B7R1.6 CNCC1COC1 SC-82720 [0,1,0,1,0,0|2,0,0]=4 517 B7R1.6 NCCC1COC1 SC-49992 [0,1,0,1,0,0|2,0,0]=4 518 B7R1.6 OCCC1COC1 SC-53429 [0,1,0,1,0,0|1,0,0]=3 519 B7R1.10 O=C1CC(CO)C1 SC-86648 [0,1,0,1,0,0|1,0,1]=4 520 B7R1.21 COCC1(N)CC1 SC-94843 [0,1,0,1,0,0|2,0,0]=4 521 B7R1.22 NCC(O)C1CC1 SC-21038 [0,1,0,1,0,0|2,0,0]=4 522 B7R1.25 CC1(CO)COC1 SC-27080 [0,1,0,1,0,0|1,0,0]=3 523 B7R1.25 FC1(CBr)COC1 SC-A4004 [0,1,0,1,0,0|2,0,0]=4 524 B7R1.25 NC1(CO)CCC1 SC-17718 [0,1,0,1,0,0|2,0,0]=4 525 B7R1.25 NC1(CO)CCC1 SC-B7244 [0,1,0,1,0,0|2,0,0]=4 526 B7R1.25 NC1(CO)COC1 SC-43365 [0,1,0,1,0,0|1,0,0]=3 527 B7R1.25 NCC1(O)CCC1 SC-44159 [0,1,0,1,0,0|2,0,0]=4 528 B7R1.25 OCC1(F)COC1 SC-52804 [0,1,0,1,0,0|1,0,0]=3 529 B7R1.18 CC(O)C1CCC1 SC-22088 [0,1,0,1,0,0|2,0,0]=4 530 B7R1.18 O=C(O)C1CCO1 SC-22549 [0,1,0,1,0,0|1,0,1]=4 531 B7R1.19 CC1(C(=O)O)CO1 SC-A2140 [0,1,0,1,0,0|1,0,1]=4 532 B7R1.19 O=C(O)C1(O)CC1 SC-19780 [0,1,0,1,0,0|1,0,1]=4 533 B7R1.14 CC1(O)CCNC1 SC-65706 [0,1,0,1,0,0|2,0,0]=4 534 B7R1.14 C[C@]1(O)CCNC1 SC-91785 [0,1,0,1,0,0|2,0,0]=4 535 B7R1.29 N#CC1(CO)CC1 SC-44481 [0,1,0,1,0,0|2,0,0]=4 536 B7R1.29 NCC1(CO)CC1 SC-89064 [0,1,0,1,0,0|2,0,0]=4 537 B7R1.29 NCC1(CO)CC1 SC-A3139 [0,1,0,1,0,0|2,0,0]=4 538 B7R1.29 OCC1(CO)CC1 SC-13840 [0,1,0,1,0,0|1,0,0]=3 539 B7R2.13 C1CC2OC2C1 SC-15327 [0,0,0,2,0,0|2,0,0]=4