0 B6R1.2 BrC1CCNC1 SC-24702 [0,0,0,0,0,0|2,0,1]=3 1 B6R1.2 BrC1CCOC1 SC-49709 [0,0,0,0,0,0|2,0,1]=3 2 B6R1.2 CC1=CCCC1 SC-46849 [0,0,0,0,0,0|1,0,1]=2 3 B6R1.2 CC1=CCCO1 SC-69814 [0,0,0,0,0,0|2,0,1]=3 4 B6R1.2 CC1=NCCC1 SC-07079 [0,0,0,0,0,0|2,0,0]=2 5 B6R1.2 CC1CCCN1 SC-89376 [0,0,0,0,0,0|2,0,1]=3 6 B6R1.2 CC1CCCN1 SC-A3822 [0,0,0,0,0,0|2,0,1]=3 7 B6R1.2 CC1CCNC1 SC-24125 [0,0,0,0,0,0|2,0,1]=3 8 B6R1.2 CC1CCNC1 SC-49333 [0,0,0,0,0,0|2,0,1]=3 9 B6R1.2 CN1CCCC1 SC-19022 [0,0,0,0,0,0|2,0,0]=2 10 B6R1.2 C[C@@H]1CCNC1 SC-23714 [0,0,0,0,0,0|2,0,1]=3 11 B6R1.2 C[C@@H]1CCNC1 SC-50232 [0,0,0,0,0,0|2,0,1]=3 12 B6R1.2 C[C@H]1CCCN1 SC-95860 [0,0,0,0,0,0|2,0,1]=3 13 B6R1.2 C[C@H]1CCNC1 SC-50233 [0,0,0,0,0,0|2,0,1]=3 14 B6R1.2 ClP1OCCO1 SC-09222 [0,0,0,0,0,0|4,0,0]=4 15 B6R1.2 FC1CCCC1 SC-09548 [0,0,0,0,0,0|1,0,1]=2 16 B6R1.2 FC1CCNC1 SC-28940 [0,0,0,0,0,0|2,0,1]=3 17 B6R1.2 F[C@H]1CCNC1 SC-43922 [0,0,0,0,0,0|2,0,1]=3 18 B6R1.2 NC1=NCCC1 SC-68430 [0,0,0,0,0,0|2,0,0]=2 19 B6R1.2 NC1=NCCO1 SC-89542 [0,0,0,0,0,0|3,0,0]=3 20 B6R1.2 NC1CC=CC1 SC-21605 [0,0,0,0,0,0|1,0,3]=4 21 B6R1.2 NC1CCCC1 SC-84758 [0,0,0,0,0,0|1,0,1]=2 22 B6R1.2 NC1CCNC1 SC-18208 [0,0,0,0,0,0|2,0,1]=3 23 B6R1.2 NC1CCNC1 SC-62350 [0,0,0,0,0,0|2,0,1]=3 24 B6R1.2 NC1CCOC1 SC-12746 [0,0,0,0,0,0|2,0,1]=3 25 B6R1.2 NC1CCOC1 SC-35465 [0,0,0,0,0,0|2,0,1]=3 26 B6R1.2 NN1CCCC1 SC-01559 [0,0,0,0,0,0|2,0,0]=2 27 B6R1.2 NN1CCCC1 SC-65336 [0,0,0,0,0,0|2,0,0]=2 28 B6R1.2 N[C@@H]1CCOC1 SC-14942 [0,0,0,0,0,0|2,0,1]=3 29 B6R1.2 N[C@@H]1CCOC1 SC-26567 [0,0,0,0,0,0|2,0,1]=3 30 B6R1.2 N[C@H]1CCOC1 SC-14943 [0,0,0,0,0,0|2,0,1]=3 31 B6R1.2 O=C1C=CCC1 SC-07348 [0,0,0,0,0,0|0,0,2]=2 32 B6R1.2 O=C1C=CCN1 SC-67116 [0,0,0,0,0,0|1,0,2]=3 33 B6R1.2 O=C1C=CCO1 SC-50260 [0,0,0,0,0,0|1,0,2]=3 34 B6R1.2 O=C1C=CSN1 SC-14961 [0,0,0,0,0,0|2,0,2]=4 35 B6R1.2 O=C1CC=NN1 SC-89969 [0,0,0,0,0,0|2,0,1]=3 36 B6R1.2 O=C1CCCN1 SC-85210 [0,0,0,0,0,0|1,0,0]=1 37 B6R1.2 O=C1CCNC1 SC-24328 [0,0,0,0,0,0|1,0,0]=1 38 B6R1.2 O=C1CCNC1 SC-50749 [0,0,0,0,0,0|1,0,0]=1 39 B6R1.2 O=C1CCNN1 SC-21405 [0,0,0,0,0,0|2,0,0]=2 40 B6R1.2 O=C1CCOC1 SC-21867 [0,0,0,0,0,0|1,0,0]=1 41 B6R1.2 O=C1N=CNN1 SC-15326 [0,0,0,0,0,0|3,0,1]=4 42 B6R1.2 O=C1NCCO1 SC-04833 [0,0,0,0,0,0|2,0,0]=2 43 B6R1.2 O=C1NCCS1 SC-27050 [0,0,0,0,0,0|2,0,0]=2 44 B6R1.2 O=C1OC=CO1 SC-15988 [0,0,0,0,0,0|2,0,2]=4 45 B6R1.2 O=S1OCCO1 SC-15793 [0,0,0,0,0,0|3,0,0]=3 46 B6R1.2 OC1=NNCC1 SC-23225 [0,0,0,0,0,0|2,0,1]=3 47 B6R1.2 OC1CC=CC1 SC-22908 [0,0,0,0,0,0|0,0,4]=4 48 B6R1.2 OC1CCCN1 SC-21341 [0,0,0,0,0,0|1,0,2]=3 49 B6R1.2 OC1CCNC1 SC-00623 [0,0,0,0,0,0|1,0,2]=3 50 B6R1.2 OC1CCNC1 SC-19629 [0,0,0,0,0,0|1,0,2]=3 51 B6R1.2 OC1CCNC1 SC-24957 [0,0,0,0,0,0|1,0,2]=3 52 B6R1.2 OC1CCNC1 SC-27708 [0,0,0,0,0,0|1,0,2]=3 53 B6R1.2 OC1CCOC1 SC-17875 [0,0,0,0,0,0|1,0,2]=3 54 B6R1.2 O[C@@H]1CCNC1 SC-00194 [0,0,0,0,0,0|1,0,2]=3 55 B6R1.2 O[C@@H]1CCNC1 SC-13984 [0,0,0,0,0,0|1,0,2]=3 56 B6R1.2 O[C@@H]1CCOC1 SC-07022 [0,0,0,0,0,0|1,0,2]=3 57 B6R1.2 O[C@@H]1CNOC1 SC-83248 [0,0,0,0,0,0|2,0,2]=4 58 B6R1.2 O[C@H]1CCOC1 SC-08982 [0,0,0,0,0,0|1,0,2]=3 59 B6R1.2 O[C@H]1CCOC1 SC-50082 [0,0,0,0,0,0|1,0,2]=3 60 B6R1.2 O[C@H]1CNOC1 SC-83247 [0,0,0,0,0,0|2,0,2]=4 61 B6R1.2 [C@@H]1(C)CCCN1 SC-48604 [0,0,0,0,0,0|2,0,1]=3 62 B6R1.2 [C@H]1(O)CCNC1 SC-24229 [0,0,0,0,0,0|1,0,2]=3 63 B5R1.1 C1=CCC=C1 SC-76630 [1,0,0,0,0,0|0,0,3]=4 64 B5R1.1 C1=CCCC1 SC-18920 [1,0,0,0,0,0|0,0,1]=2 65 B5R1.1 C1=CCOC1 SC-47076 [1,0,0,0,0,0|1,0,1]=3 66 B5R1.1 C1=CNCC1 SC-88946 [1,0,0,0,0,0|1,0,1]=3 67 B5R1.1 C1CSCN1 SC-91699 [1,0,0,0,0,0|2,0,0]=3 68 B5R1.1 [C-]1=CC=CC1 SC-15776 [1,0,0,0,0,0|0,0,3]=4 69 B7R1.1 BrCC1CCCC1 SC-04017 [0,1,0,0,0,0|1,0,1]=3 70 B7R1.1 BrCC1CCCO1 SC-00526 [0,1,0,0,0,0|2,0,1]=4 71 B7R1.1 C#CC1CCCC1 SC-82441 [0,1,0,0,0,0|1,0,1]=3 72 B7R1.1 CCC1CCCN1 SC-29181 [0,1,0,0,0,0|2,0,1]=4 73 B7R1.1 CNC1CCCC1 SC-52894 [0,1,0,0,0,0|1,0,1]=3 74 B7R1.1 CNC1CCCC1 SC-A3381 [0,1,0,0,0,0|1,0,1]=3 75 B7R1.1 CNC1CCOC1 SC-81912 [0,1,0,0,0,0|2,0,1]=4 76 B7R1.1 CN[C@@H]1CCOC1 SC-A2281 [0,1,0,0,0,0|2,0,1]=4 77 B7R1.1 COC1=NCCC1 SC-72634 [0,1,0,0,0,0|1,0,1]=3 78 B7R1.1 COC1CCNC1 SC-12454 [0,1,0,0,0,0|1,0,2]=4 79 B7R1.1 COC1CCNC1 SC-24177 [0,1,0,0,0,0|1,0,2]=4 80 B7R1.1 CO[C@@H]1CCNC1 SC-25526 [0,1,0,0,0,0|1,0,2]=4 81 B7R1.1 CO[C@@H]1CCNC1 SC-51990 [0,1,0,0,0,0|1,0,2]=4 82 B7R1.1 CO[C@H]1CCNC1 SC-25506 [0,1,0,0,0,0|1,0,2]=4 83 B7R1.1 ICC1CCOC1 SC-26534 [0,1,0,0,0,0|2,0,1]=4 84 B7R1.1 N#CC1CCCC1 SC-84423 [0,1,0,0,0,0|1,0,1]=3 85 B7R1.1 N#CC1CCCN1 SC-70822 [0,1,0,0,0,0|2,0,1]=4 86 B7R1.1 N#CC1CCNC1 SC-88576 [0,1,0,0,0,0|2,0,1]=4 87 B7R1.1 N#CC1CCOC1 SC-28637 [0,1,0,0,0,0|2,0,1]=4 88 B7R1.1 N#C[C@H]1CCCN1 SC-72638 [0,1,0,0,0,0|2,0,1]=4 89 B7R1.1 N#C[C@H]1CCNC1 SC-B8851 [0,1,0,0,0,0|2,0,1]=4 90 B7R1.1 NCC1CCCC1 SC-22285 [0,1,0,0,0,0|1,0,1]=3 91 B7R1.1 NCC1CCCC1 SC-25234 [0,1,0,0,0,0|1,0,1]=3 92 B7R1.1 NCC1CCCN1 SC-98158 [0,1,0,0,0,0|2,0,1]=4 93 B7R1.1 NCC1CCOC1 SC-12415 [0,1,0,0,0,0|2,0,1]=4 94 B7R1.1 NC[C@@H]1CCCO1 SC-28608 [0,1,0,0,0,0|2,0,1]=4 95 B7R1.1 NNC1CCCC1 SC-12771 [0,1,0,0,0,0|1,0,1]=3 96 B7R1.1 NNC1CCCC1 SC-62645 [0,1,0,0,0,0|1,0,1]=3 97 B7R1.1 O=CC1CCCC1 SC-21778 [0,1,0,0,0,0|0,0,1]=2 98 B7R1.1 O=CC1CCCC1 SC-44728 [0,1,0,0,0,0|0,0,1]=2 99 B7R1.1 O=CC1CCNC1 SC-85271 [0,1,0,0,0,0|1,0,1]=3 100 B7R1.1 OCC1CCCC1 SC-03842 [0,1,0,0,0,0|0,0,2]=3 101 B7R1.1 OCC1CCCN1 SC-12006 [0,1,0,0,0,0|1,0,2]=4 102 B7R1.1 OCC1CCCO1 SC-94849 [0,1,0,0,0,0|1,0,2]=4 103 B7R1.1 OCC1CCOC1 SC-21250 [0,1,0,0,0,0|1,0,2]=4 104 B7R1.1 OC[C@@H]1CCCN1 SC-02696 [0,1,0,0,0,0|1,0,2]=4 105 B7R1.1 OC[C@@H]1CCCN1 SC-48321 [0,1,0,0,0,0|1,0,2]=4 106 B7R1.1 OC[C@@H]1CCCO1 SC-20330 [0,1,0,0,0,0|1,0,2]=4 107 B7R1.1 OC[C@@H]1CCNC1 SC-48002 [0,1,0,0,0,0|1,0,2]=4 108 B7R1.1 OC[C@H]1CCCN1 SC-06270 [0,1,0,0,0,0|1,0,2]=4 109 B7R1.2 CC1=CC(=O)CC1 SC-18727 [0,1,0,0,0,0|0,0,2]=3 110 B7R1.2 CC1=CC(=O)OC1 SC-25541 [0,1,0,0,0,0|1,0,2]=4 111 B7R1.2 CC1CCC(=O)C1 SC-93748 [0,1,0,0,0,0|0,0,0]=1 112 B7R1.2 CC1CNC(=O)C1 SC-50248 [0,1,0,0,0,0|1,0,0]=2 113 B7R1.2 CC1COC(=O)C1 SC-60836 [0,1,0,0,0,0|1,0,0]=2 114 B7R1.2 CC1COC(=O)O1 SC-65189 [0,1,0,0,0,0|2,0,0]=3 115 B7R1.2 CN1CCC(N)C1 SC-48840 [0,1,0,0,0,0|2,0,0]=3 116 B7R1.2 CN1CC[C@@H](O)C1 SC-49684 [0,1,0,0,0,0|2,0,0]=3 117 B7R1.2 CN1CC[C@H](O)C1 SC-23905 [0,1,0,0,0,0|2,0,0]=3 118 B7R1.2 C[C@H]1COC(=O)N1 SC-51056 [0,1,0,0,0,0|2,0,0]=3 119 B7R1.2 C[C@H]1COC(=O)O1 SC-04943 [0,1,0,0,0,0|2,0,0]=3 120 B7R1.2 N=C1NC(=O)CS1 SC-69631 [0,1,0,0,0,0|2,0,1]=4 121 B7R1.2 NC1CCC(O)C1 SC-47773 [0,1,0,0,0,0|0,0,2]=3 122 B7R1.2 NC1CCC(O)C1 SC-47979 [0,1,0,0,0,0|0,0,2]=3 123 B7R1.2 NC1CCC(O)C1 SC-49660 [0,1,0,0,0,0|0,0,2]=3 124 B7R1.2 NC1CCC(O)C1 SC-51126 [0,1,0,0,0,0|0,0,2]=3 125 B7R1.2 NC1CCC(O)C1 SC-92977 [0,1,0,0,0,0|0,0,2]=3 126 B7R1.2 NC1CNC(=O)C1 SC-66063 [0,1,0,0,0,0|1,0,0]=2 127 B7R1.2 NC1COC(=O)C1 SC-34183 [0,1,0,0,0,0|1,0,0]=2 128 B7R1.2 N[C@@H]1CC[C@H](O)C1 SC-83316 [0,1,0,0,0,0|0,0,2]=3 129 B7R1.2 N[C@@H]1CNC(=O)C1 SC-A4379 [0,1,0,0,0,0|1,0,0]=2 130 B7R1.2 N[C@@H]1COC(=O)C1 SC-71558 [0,1,0,0,0,0|1,0,0]=2 131 B7R1.2 N[C@H]1CC[C@@H](O)C1 SC-42369 [0,1,0,0,0,0|0,0,2]=3 132 B7R1.2 N[C@H]1CC[C@@H](O)C1 SC-47775 [0,1,0,0,0,0|0,0,2]=3 133 B7R1.2 N[C@H]1CC[C@H](O)C1 SC-47774 [0,1,0,0,0,0|0,0,2]=3 134 B7R1.2 N[C@H]1CC[C@H](O)C1 SC-93243 [0,1,0,0,0,0|0,0,2]=3 135 B7R1.2 O=C1C=C(O)CO1 SC-21646 [0,1,0,0,0,0|1,0,2]=4 136 B7R1.2 O=C1CC(O)CN1 SC-29049 [0,1,0,0,0,0|1,0,0]=2 137 B7R1.2 O=C1CCC(=O)C1 SC-15331 [0,1,0,0,0,0|0,0,1]=2 138 B7R1.2 O=C1CCC(=O)N1 SC-26697 [0,1,0,0,0,0|1,0,1]=3 139 B7R1.2 O=C1CNC(=O)C1 SC-88883 [0,1,0,0,0,0|1,0,1]=3 140 B7R1.2 O=C1CNC(=O)O1 SC-21301 [0,1,0,0,0,0|2,0,1]=4 141 B7R1.2 O=C1COC(=O)C1 SC-86968 [0,1,0,0,0,0|1,0,1]=3 142 B7R1.2 O=C1COC(=O)N1 SC-49693 [0,1,0,0,0,0|2,0,1]=4 143 B7R1.2 O=C1CSC(=O)N1 SC-17499 [0,1,0,0,0,0|2,0,1]=4 144 B7R1.2 O=C1C[C@@H](O)CN1 SC-02616 [0,1,0,0,0,0|1,0,0]=2 145 B7R1.2 O=C1C[C@H](O)CN1 SC-13587 [0,1,0,0,0,0|1,0,0]=2 146 B7R1.2 O=C1C[C@H](O)CO1 SC-06559 [0,1,0,0,0,0|1,0,0]=2 147 B7R1.4 C=C1CCOC1=O SC-19579 [0,1,0,0,0,0|1,0,1]=3 148 B7R1.4 CC1=CCCC1=O SC-15856 [0,1,0,0,0,0|0,0,2]=3 149 B7R1.4 CC1CCCC1=O SC-89605 [0,1,0,0,0,0|0,0,0]=1 150 B7R1.4 CC1CCNC1=O SC-21672 [0,1,0,0,0,0|1,0,0]=2 151 B7R1.4 CC1CCOC1=O SC-20996 [0,1,0,0,0,0|1,0,0]=2 152 B7R1.4 CN1CCNC1=O SC-89793 [0,1,0,0,0,0|2,0,0]=3 153 B7R1.4 F[C@@H]1CNC[C@H]1F SC-89287 [0,1,0,0,0,0|2,0,1]=4 154 B7R1.4 NC1CCCC1O SC-21764 [0,1,0,0,0,0|0,0,2]=3 155 B7R1.4 NC1CCNC1=O SC-13910 [0,1,0,0,0,0|1,0,0]=2 156 B7R1.4 NC1CCNC1=O SC-53072 [0,1,0,0,0,0|1,0,0]=2 157 B7R1.4 N[C@@H]1CCNC1=O SC-65959 [0,1,0,0,0,0|1,0,0]=2 158 B7R1.4 N[C@@H]1CCNC1=O SC-A2225 [0,1,0,0,0,0|1,0,0]=2 159 B7R1.4 N[C@@H]1CCOC1=O SC-28003 [0,1,0,0,0,0|1,0,0]=2 160 B7R1.4 N[C@@H]1COC[C@@H]1N SC-33569 [0,1,0,0,0,0|2,0,1]=4 161 B7R1.4 N[C@H]1CCC[C@@H]1O SC-27686 [0,1,0,0,0,0|0,0,2]=3 162 B7R1.4 N[C@H]1CCC[C@H]1N SC-83490 [0,1,0,0,0,0|1,0,1]=3 163 B7R1.4 N[C@H]1CCNC1=O SC-96457 [0,1,0,0,0,0|1,0,0]=2 164 B7R1.4 N[C@H]1CCOC1=O SC-01385 [0,1,0,0,0,0|1,0,0]=2 165 B7R1.4 N[C@H]1CCOC1=O SC-28113 [0,1,0,0,0,0|1,0,0]=2 166 B7R1.4 N[C@H]1COC[C@@H]1O SC-44041 [0,1,0,0,0,0|1,0,2]=4 167 B7R1.4 O=C1CCCC1Cl SC-21538 [0,1,0,0,0,0|0,0,0]=1 168 B7R1.4 O=C1NCCC1O SC-26159 [0,1,0,0,0,0|1,0,0]=2 169 B7R1.4 O=C1NCC[C@H]1O SC-87526 [0,1,0,0,0,0|1,0,0]=2 170 B7R1.4 O=C1OCCC1Br SC-15437 [0,1,0,0,0,0|1,0,0]=2 171 B7R1.4 O[C@@H]1CCC[C@H]1O SC-A2623 [0,1,0,0,0,0|0,0,2]=3 172 B7R1.4 [C@@H]1(N)CCC[C@H]1O SC-16146 [0,1,0,0,0,0|0,0,2]=3 173 B7R1.4 [C@H]1(N)CCC[C@H]1O SC-25435 [0,1,0,0,0,0|0,0,2]=3 174 B7R1.14 CC1(C)CCCN1 SC-89406 [0,1,0,0,0,0|2,0,1]=4 175 B7R1.14 CC1(C)CCNC1 SC-B8345 [0,1,0,0,0,0|2,0,1]=4 176 B7R1.14 CC1(O)CCNC1 SC-65706 [0,1,0,0,0,0|1,0,2]=4 177 B7R1.14 C[C@]1(O)CCNC1 SC-91785 [0,1,0,0,0,0|1,0,2]=4 178 B7R1.14 ClC1(Cl)CCCC1 SC-51368 [0,1,0,0,0,0|1,0,1]=3 179 B7R1.14 FC1(F)CCNC1 SC-01510 [0,1,0,0,0,0|2,0,1]=4 180 B7R1.14 FC1(F)CCNC1 SC-85141 [0,1,0,0,0,0|2,0,1]=4 181 B7R1.14 O=S1(=O)CC=CC1 SC-08168 [0,1,0,0,0,0|1,0,2]=4 182 B7R1.14 O=S1(=O)CCCC1 SC-46369 [0,1,0,0,0,0|1,0,0]=2 183 B7R1.14 O=S1(=O)CCCN1 SC-82164 [0,1,0,0,0,0|2,0,0]=3 184 B7R1.14 O=S1(=O)CCCO1 SC-17901 [0,1,0,0,0,0|2,0,0]=3 185 B7R1.14 O=S1(=O)OCCO1 SC-15792 [0,1,0,0,0,0|3,0,0]=4 186 B5R0.1 C#CCC(=O)O SC-40344 [0,0,1,0,0,0|1,0,2]=4 187 B5R0.1 C=C(C)CCBr SC-26305 [0,0,1,0,0,0|2,0,0]=3 188 B5R0.1 C=C(C)OCC SC-18086 [0,0,1,0,0,0|2,0,0]=3 189 B5R0.1 C=CCC(=O)O SC-49093 [0,0,1,0,0,0|1,0,2]=4 190 B5R0.1 C=COC(C)=O SC-79059 [0,0,1,0,0,0|1,0,2]=4 191 B5R0.1 CC#CC(=O)O SC-76460 [0,0,1,0,0,0|1,0,2]=4 192 B5R0.1 CC(=O)CC#N SC-26510 [0,0,1,0,0,0|1,0,1]=3 193 B5R0.1 CC(=O)CCCl SC-21586 [0,0,1,0,0,0|1,0,0]=2 194 B5R0.1 CC(=O)CCO SC-65678 [0,0,1,0,0,0|1,0,0]=2 195 B5R0.1 CC(=O)OCBr SC-44237 [0,0,1,0,0,0|2,0,0]=3 196 B5R0.1 CC(=O)\C=N/O SC-89466 [0,0,1,0,0,0|2,0,1]=4 197 B5R0.1 CC(=O)\C=N\O SC-68143 [0,0,1,0,0,0|2,0,1]=4 198 B5R0.1 CC(C)=CCBr SC-13678 [0,0,1,0,0,0|2,0,1]=4 199 B5R0.1 CC(C)=CCN SC-51952 [0,0,1,0,0,0|2,0,1]=4 200 B5R0.1 CC(C)=CCO SC-77150 [0,0,1,0,0,0|2,0,1]=4 201 B5R0.1 CC(N)CCO SC-82589 [0,0,1,0,0,0|2,0,1]=4 202 B5R0.1 CCCB(O)O SC-47544 [0,0,1,0,0,0|2,0,1]=4 203 B5R0.1 CCCC(=N)N SC-19347 [0,0,1,0,0,0|2,0,0]=3 204 B5R0.1 CCCC(=O)Cl SC-18924 [0,0,1,0,0,0|1,0,0]=2 205 B5R0.1 CCCC(=O)[O-] SC-15718 [0,0,1,0,0,0|1,0,0]=2 206 B5R0.1 CCCC(C)N SC-53929 [0,0,1,0,0,0|1,0,1]=3 207 B5R0.1 CCCC(C)O SC-03320 [0,0,1,0,0,0|0,0,2]=3 208 B5R0.1 CCCC(N)=O SC-46377 [0,0,1,0,0,0|1,0,0]=2 209 B5R0.1 CCN=C(N)N SC-15057 [0,0,1,0,0,0|3,0,0]=4 210 B5R0.1 CCNC(C)C SC-84122 [0,0,1,0,0,0|2,0,1]=4 211 B5R0.1 CCOC(=S)[S-] SC-62877 [0,0,1,0,0,0|2,1,0]=4 212 B5R0.1 CCOC(C)=N SC-02547 [0,0,1,0,0,0|2,0,0]=3 213 B5R0.1 CCOC(C)=N SC-A3540 [0,0,1,0,0,0|2,0,0]=3 214 B5R0.1 CCOC(N)=O SC-16133 [0,0,1,0,0,0|2,0,0]=3 215 B5R0.1 CCSC(=N)N SC-20585 [0,0,1,0,0,0|3,0,0]=4 216 B5R0.1 CCSC(=N)N SC-53442 [0,0,1,0,0,0|3,0,0]=4 217 B5R0.1 CN(C)CCBr SC-21756 [0,0,1,0,0,0|3,0,0]=4 218 B5R0.1 CN(C)CCBr SC-27529 [0,0,1,0,0,0|3,0,0]=4 219 B5R0.1 CN(C)CCCl SC-18600 [0,0,1,0,0,0|3,0,0]=4 220 B5R0.1 CN(C)CCCl SC-47184 [0,0,1,0,0,0|3,0,0]=4 221 B5R0.1 CN(C)CCO SC-87330 [0,0,1,0,0,0|3,0,0]=4 222 B5R0.1 CNCC(=O)O SC-10425 [0,0,1,0,0,0|2,0,0]=3 223 B5R0.1 CNCC(N)=O SC-10429 [0,0,1,0,0,0|2,0,0]=3 224 B5R0.1 COCC(=N)N SC-41213 [0,0,1,0,0,0|3,0,0]=4 225 B5R0.1 COCC(=N)N SC-73218 [0,0,1,0,0,0|3,0,0]=4 226 B5R0.1 COCC(=O)Cl SC-27381 [0,0,1,0,0,0|2,0,0]=3 227 B5R0.1 COCC(C)N SC-48787 [0,0,1,0,0,0|2,0,1]=4 228 B5R0.1 COCC(C)O SC-00293 [0,0,1,0,0,0|1,0,2]=4 229 B5R0.1 COC[C@@H](C)N SC-47724 [0,0,1,0,0,0|2,0,1]=4 230 B5R0.1 COC[C@@H](C)O SC-04836 [0,0,1,0,0,0|1,0,2]=4 231 B5R0.1 CS(=O)CCN SC-89327 [0,0,1,0,0,0|2,0,0]=3 232 B5R0.1 CSCS(C)=O SC-87090 [0,0,1,0,0,0|2,0,0]=3 233 B5R0.1 CSNC(C)=O SC-28667 [0,0,1,0,0,0|2,0,0]=3 234 B5R0.1 C[C@@H](N)CCO SC-48293 [0,0,1,0,0,0|2,0,1]=4 235 B5R0.1 C[C@@H](O)CCO SC-05919 [0,0,1,0,0,0|1,0,2]=4 236 B5R0.1 C[C@H](O)CCO SC-02840 [0,0,1,0,0,0|1,0,2]=4 237 B5R0.1 C\C=C/C(=O)O SC-25924 [0,0,1,0,0,0|1,0,2]=4 238 B5R0.1 C\C=C/C(C)=O SC-48085 [0,0,1,0,0,0|0,0,2]=3 239 B5R0.1 C\C=C\C(=O)Cl SC-16256 [0,0,1,0,0,0|1,0,2]=4 240 B5R0.1 N#CCC(=O)O SC-18648 [0,0,1,0,0,0|2,0,1]=4 241 B5R0.1 N#CCC(N)=O SC-26759 [0,0,1,0,0,0|2,0,1]=4 242 B5R0.1 NCCC(=O)O SC-10014 [0,0,1,0,0,0|2,0,0]=3 243 B5R0.1 NCCC(N)=O SC-48688 [0,0,1,0,0,0|2,0,0]=3 244 B5R0.1 NCCC(N)=O SC-84499 [0,0,1,0,0,0|2,0,0]=3 245 B5R0.1 O=C(Cl)CCCl SC-16310 [0,0,1,0,0,0|2,0,0]=3 246 B5R0.1 O=C(O)CCBr SC-18441 [0,0,1,0,0,0|2,0,0]=3 247 B5R0.1 O=C(O)CCS SC-22642 [0,0,1,0,0,0|2,0,0]=3 248 B5R0.2 C#CCCCCl SC-46678 [0,0,1,0,0,0|2,0,1]=4 249 B5R0.2 C#CCCCI SC-A2786 [0,0,1,0,0,0|2,0,1]=4 250 B5R0.2 C#CCCCN SC-48603 [0,0,1,0,0,0|2,0,1]=4 251 B5R0.2 C#CCCCN SC-99931 [0,0,1,0,0,0|2,0,1]=4 252 B5R0.2 C=CCCCBr SC-47340 [0,0,1,0,0,0|2,0,0]=3 253 B5R0.2 C=CCCCN SC-28944 [0,0,1,0,0,0|2,0,0]=3 254 B5R0.2 C=CCCCO SC-78424 [0,0,1,0,0,0|2,0,0]=3 255 B5R0.2 C=CCSSC SC-87236 [0,0,1,0,0,0|3,0,0]=4 256 B5R0.2 C=COCCO SC-22660 [0,0,1,0,0,0|3,0,0]=4 257 B5R0.2 CC#CCC=O SC-89818 [0,0,1,0,0,0|0,0,2]=3 258 B5R0.2 CCCCNN SC-68008 [0,0,1,0,0,0|2,0,0]=3 259 B5R0.2 CCSCCCl SC-43710 [0,0,1,0,0,0|2,0,1]=4 260 B5R0.2 CNCCC#N SC-15494 [0,0,1,0,0,0|2,0,1]=4 261 B5R0.2 CNCCCO SC-94106 [0,0,1,0,0,0|1,0,2]=4 262 B5R0.2 CNCCNC SC-19090 [0,0,1,0,0,0|3,0,0]=4 263 B5R0.2 CNCCOC SC-15056 [0,0,1,0,0,0|3,0,0]=4 264 B5R0.2 CNCCSC SC-74374 [0,0,1,0,0,0|3,0,0]=4 265 B5R0.2 CNCCSC SC-83575 [0,0,1,0,0,0|3,0,0]=4 266 B5R0.2 COCCC=O SC-85357 [0,0,1,0,0,0|1,0,0]=2 267 B5R0.2 COCCCBr SC-20920 [0,0,1,0,0,0|2,0,1]=4 268 B5R0.2 COCCNN SC-53129 [0,0,1,0,0,0|3,0,0]=4 269 B5R0.2 COCCNN SC-70814 [0,0,1,0,0,0|3,0,0]=4 270 B5R0.2 C\C=C\OCC SC-89361 [0,0,1,0,0,0|2,0,1]=4 271 B5R0.2 ClCCCCBr SC-17538 [0,0,1,0,0,0|2,0,1]=4 272 B5R0.2 FCCCCBr SC-43880 [0,0,1,0,0,0|2,0,1]=4 273 B5R0.2 ICCCCI SC-69402 [0,0,1,0,0,0|2,0,1]=4 274 B5R0.2 N#CCCCBr SC-20060 [0,0,1,0,0,0|2,0,1]=4 275 B5R0.2 N#CCCCCl SC-16423 [0,0,1,0,0,0|2,0,1]=4 276 B5R0.2 NCCCCCl SC-14246 [0,0,1,0,0,0|2,0,1]=4 277 B5R0.2 NCCCCN SC-20919 [0,0,1,0,0,0|2,0,1]=4 278 B5R0.2 NCCCCO SC-48186 [0,0,1,0,0,0|1,0,2]=4 279 B5R0.2 O=C=NCCBr SC-82407 [0,0,1,0,0,0|2,0,1]=4 280 B5R0.2 O=C=NCCCl SC-13627 [0,0,1,0,0,0|2,0,1]=4 281 B5R0.2 O=CCCC=O SC-13455 [0,0,1,0,0,0|1,0,1]=3 282 B5R0.2 O=CCCCBr SC-69595 [0,0,1,0,0,0|1,0,0]=2 283 B5R0.2 OCCCCBr SC-12645 [0,0,1,0,0,0|1,0,2]=4 284 B5R0.2 OCCCCCl SC-23109 [0,0,1,0,0,0|1,0,2]=4 285 B5R0.3 C#CC(=O)OC SC-27849 [0,0,1,0,0,0|1,0,2]=4 286 B5R0.3 C=C(CCl)CCl SC-21050 [0,0,1,0,0,0|3,0,0]=4 287 B5R0.3 C=C(CO)CO SC-17984 [0,0,1,0,0,0|3,0,0]=4 288 B5R0.3 CCC(=O)NN SC-25039 [0,0,1,0,0,0|2,0,0]=3 289 B5R0.3 CCC(C)CO SC-08990 [0,0,1,0,0,0|2,0,1]=4 290 B5R0.3 CCC(N)CC SC-81736 [0,0,1,0,0,0|1,0,1]=3 291 B5R0.3 CCC(N)CO SC-21072 [0,0,1,0,0,0|2,0,1]=4 292 B5R0.3 CCC(O)CC SC-62307 [0,0,1,0,0,0|0,0,2]=3 293 B5R0.3 CC[PH](=O)CC SC-96905 [0,0,1,0,0,0|1,0,0]=2 294 B5R0.3 CC\C(N)=N\O SC-28960 [0,0,1,0,0,0|3,0,0]=4 295 B5R0.3 CNC(=O)CBr SC-27946 [0,0,1,0,0,0|2,0,0]=3 296 B5R0.3 CNC(=O)CN SC-47802 [0,0,1,0,0,0|2,0,0]=3 297 B5R0.3 CNC(=O)OC SC-97890 [0,0,1,0,0,0|2,0,0]=3 298 B5R0.3 COC(=O)C#N SC-49091 [0,0,1,0,0,0|2,0,1]=4 299 B5R0.3 COC(=O)CBr SC-15855 [0,0,1,0,0,0|2,0,0]=3 300 B5R0.3 COC(=O)CN SC-09571 [0,0,1,0,0,0|2,0,0]=3 301 B5R0.3 COC(=O)CN SC-49390 [0,0,1,0,0,0|2,0,0]=3 302 B5R0.3 COC(=O)CO SC-28291 [0,0,1,0,0,0|2,0,0]=3 303 B5R0.3 COC(=O)CS SC-54102 [0,0,1,0,0,0|2,0,0]=3 304 B5R0.3 COS(=O)OC SC-25522 [0,0,1,0,0,0|3,0,0]=4 305 B5R0.3 CSC(=S)SC SC-19457 [0,0,1,0,0,0|2,1,0]=4 306 B5R0.3 NNC(=O)CO SC-83204 [0,0,1,0,0,0|3,0,0]=4 307 B5R0.3 O=C(CBr)CBr SC-99341 [0,0,1,0,0,0|2,0,0]=3 308 B5R0.3 O=C(CO)CO SC-07450 [0,0,1,0,0,0|2,0,0]=3 309 B5R0.3 [C@H](N)(CC)CO SC-08958 [0,0,1,0,0,0|2,0,1]=4 310 B7R2.13 C1CC2CC2N1 SC-A3242 [0,0,0,1,0,0|2,0,1]=4 311 B7R2.13 C1CC2OC2C1 SC-15327 [0,0,0,1,0,0|0,0,2]=3 312 B7R2.13 C1NCC2CC12 SC-88257 [0,0,0,1,0,0|2,0,1]=4 313 B5R1.2 BrC1CCC1 SC-50402 [0,0,0,0,1,0|1,0,1]=3 314 B5R1.2 CC1CCN1 SC-70091 [0,0,0,0,1,0|2,0,1]=4 315 B5R1.2 CC1CCN1 SC-A3607 [0,0,0,0,1,0|2,0,1]=4 316 B5R1.2 CC1CCN1 SC-A3960 [0,0,0,0,1,0|2,0,1]=4 317 B5R1.2 CC1CNC1 SC-50429 [0,0,0,0,1,0|2,0,1]=4 318 B5R1.2 FC1CNC1 SC-47665 [0,0,0,0,1,0|2,0,1]=4 319 B5R1.2 FC1CNC1 SC-51742 [0,0,0,0,1,0|2,0,1]=4 320 B5R1.2 IC1CCC1 SC-92367 [0,0,0,0,1,0|1,0,1]=3 321 B5R1.2 IC1COC1 SC-43780 [0,0,0,0,1,0|2,0,1]=4 322 B5R1.2 NC1CCC1 SC-20422 [0,0,0,0,1,0|1,0,1]=3 323 B5R1.2 NC1CNC1 SC-82511 [0,0,0,0,1,0|2,0,1]=4 324 B5R1.2 NC1COC1 SC-20809 [0,0,0,0,1,0|2,0,1]=4 325 B5R1.2 O=C1CCC1 SC-00523 [0,0,0,0,1,0|0,0,0]=1 326 B5R1.2 O=C1CCN1 SC-44172 [0,0,0,0,1,0|1,0,0]=2 327 B5R1.2 O=C1CNC1 SC-48283 [0,0,0,0,1,0|1,0,0]=2 328 B5R1.2 O=C1COC1 SC-21889 [0,0,0,0,1,0|1,0,0]=2 329 B5R1.2 OC1CNC1 SC-04637 [0,0,0,0,1,0|1,0,2]=4 330 B5R1.2 OC1CNC1 SC-19998 [0,0,0,0,1,0|1,0,2]=4 331 B5R1.2 OC1COC1 SC-25466 [0,0,0,0,1,0|1,0,2]=4 332 B5R1.2 OC1CSC1 SC-36448 [0,0,0,0,1,0|1,0,2]=4 333 B5R1.2 SC1COC1 SC-B7217 [0,0,0,0,1,0|1,1,1]=4 334 B7R1.3 BrC1=CCCCC1 SC-69986 [0,0,0,0,0,1|1,0,0]=2 335 B7R1.3 BrC1CCCOC1 SC-43426 [0,0,0,0,0,1|1,0,1]=3 336 B7R1.3 BrC1CCNCC1 SC-05213 [0,0,0,0,0,1|1,0,1]=3 337 B7R1.3 BrC1CCNCC1 SC-48705 [0,0,0,0,0,1|1,0,1]=3 338 B7R1.3 BrC1CCOCC1 SC-27394 [0,0,0,0,0,1|1,0,1]=3 339 B7R1.3 C=C1CCNCC1 SC-88353 [0,0,0,0,0,1|1,0,0]=2 340 B7R1.3 CC1=CCCCC1 SC-99243 [0,0,0,0,0,1|1,0,0]=2 341 B7R1.3 CC1=CCCNC1 SC-82898 [0,0,0,0,0,1|1,0,1]=3 342 B7R1.3 CC1=CCNCC1 SC-B8899 [0,0,0,0,0,1|1,0,1]=3 343 B7R1.3 CC1CCCCC1 SC-79075 [0,0,0,0,0,1|1,0,1]=3 344 B7R1.3 CC1CCCNC1 SC-46299 [0,0,0,0,0,1|1,0,1]=3 345 B7R1.3 CC1CCNCC1 SC-05890 [0,0,0,0,0,1|1,0,1]=3 346 B7R1.3 CC1CNCCO1 SC-49158 [0,0,0,0,0,1|2,0,1]=4 347 B7R1.3 CC1CNCCO1 SC-82780 [0,0,0,0,0,1|2,0,1]=4 348 B7R1.3 CC1CNCCO1 SC-A3535 [0,0,0,0,0,1|2,0,1]=4 349 B7R1.3 CC1COCCN1 SC-49161 [0,0,0,0,0,1|2,0,1]=4 350 B7R1.3 CN1CCNCC1 SC-00315 [0,0,0,0,0,1|2,0,0]=3 351 B7R1.3 CN1CCNCC1 SC-66326 [0,0,0,0,0,1|2,0,0]=3 352 B7R1.3 C[C@@H]1CNCCO1 SC-43965 [0,0,0,0,0,1|2,0,1]=4 353 B7R1.3 C[C@@H]1CNCCO1 SC-88816 [0,0,0,0,0,1|2,0,1]=4 354 B7R1.3 C[C@@H]1COCCN1 SC-53994 [0,0,0,0,0,1|2,0,1]=4 355 B7R1.3 C[C@H]1CCCNC1 SC-99949 [0,0,0,0,0,1|1,0,1]=3 356 B7R1.3 C[C@H]1CNCCO1 SC-44479 [0,0,0,0,0,1|2,0,1]=4 357 B7R1.3 C[C@H]1COCCN1 SC-21564 [0,0,0,0,0,1|2,0,1]=4 358 B7R1.3 C[C@H]1COCCN1 SC-69967 [0,0,0,0,0,1|2,0,1]=4 359 B7R1.3 C[SiH]1CCCCO1 SC-91060 [0,0,0,0,0,1|1,1,0]=3 360 B7R1.3 ClC1CCCCO1 SC-85266 [0,0,0,0,0,1|1,0,1]=3 361 B7R1.3 FC1CCCCC1 SC-09547 [0,0,0,0,0,1|1,0,1]=3 362 B7R1.3 FC1CCCNC1 SC-21265 [0,0,0,0,0,1|1,0,1]=3 363 B7R1.3 IC1CCOCC1 SC-98886 [0,0,0,0,0,1|1,0,1]=3 364 B7R1.3 NC1CCCNC1 SC-54118 [0,0,0,0,0,1|1,0,1]=3 365 B7R1.3 NC1CCCNC1 SC-77469 [0,0,0,0,0,1|1,0,1]=3 366 B7R1.3 NC1CCCOC1 SC-35742 [0,0,0,0,0,1|1,0,1]=3 367 B7R1.3 NC1CCCOC1 SC-49332 [0,0,0,0,0,1|1,0,1]=3 368 B7R1.3 NC1CCNCC1 SC-00743 [0,0,0,0,0,1|1,0,1]=3 369 B7R1.3 NC1CCNCC1 SC-03792 [0,0,0,0,0,1|1,0,1]=3 370 B7R1.3 NC1CCOCC1 SC-03529 [0,0,0,0,0,1|1,0,1]=3 371 B7R1.3 NC1CCOCC1 SC-04006 [0,0,0,0,0,1|1,0,1]=3 372 B7R1.3 NC1CCSCC1 SC-35455 [0,0,0,0,0,1|1,0,1]=3 373 B7R1.3 NC1CCSCC1 SC-49681 [0,0,0,0,0,1|1,0,1]=3 374 B7R1.3 NN1CCCCC1 SC-18780 [0,0,0,0,0,1|2,0,0]=3 375 B7R1.3 NN1CCOCC1 SC-27139 [0,0,0,0,0,1|2,0,0]=3 376 B7R1.3 N[C@@H]1CCCNC1 SC-03568 [0,0,0,0,0,1|1,0,1]=3 377 B7R1.3 N[C@@H]1CCCOC1 SC-71639 [0,0,0,0,0,1|1,0,1]=3 378 B7R1.3 N[C@@H]1CCCOC1 SC-96408 [0,0,0,0,0,1|1,0,1]=3 379 B7R1.3 N[C@H]1CCCNC1 SC-25042 [0,0,0,0,0,1|1,0,1]=3 380 B7R1.3 N[C@H]1CCCOC1 SC-94110 [0,0,0,0,0,1|1,0,1]=3 381 B7R1.3 O=C1C=CCCN1 SC-25185 [0,0,0,0,0,1|0,0,2]=3 382 B7R1.3 O=C1C=CCCO1 SC-50374 [0,0,0,0,0,1|0,0,2]=3 383 B7R1.3 O=C1CCCCN1 SC-16274 [0,0,0,0,0,1|0,0,0]=1 384 B7R1.3 O=C1CCCCO1 SC-65111 [0,0,0,0,0,1|0,0,0]=1 385 B7R1.3 O=C1CCCNC1 SC-29391 [0,0,0,0,0,1|0,0,0]=1 386 B7R1.3 O=C1CCCNC1 SC-48015 [0,0,0,0,0,1|0,0,0]=1 387 B7R1.3 O=C1CCCOC1 SC-14944 [0,0,0,0,0,1|0,0,0]=1 388 B7R1.3 O=C1CCNCC1 SC-04236 [0,0,0,0,0,1|0,0,0]=1 389 B7R1.3 O=C1CCNCC1 SC-04379 [0,0,0,0,0,1|0,0,0]=1 390 B7R1.3 O=C1CCNCC1 SC-19352 [0,0,0,0,0,1|0,0,0]=1 391 B7R1.3 O=C1CCOCC1 SC-03251 [0,0,0,0,0,1|0,0,0]=1 392 B7R1.3 O=C1CCSCC1 SC-19697 [0,0,0,0,0,1|0,0,0]=1 393 B7R1.3 O=C1CNCCN1 SC-05365 [0,0,0,0,0,1|1,0,0]=2 394 B7R1.3 O=C1CNCCO1 SC-84883 [0,0,0,0,0,1|1,0,0]=2 395 B7R1.3 O=C1COCCN1 SC-24222 [0,0,0,0,0,1|1,0,0]=2 396 B7R1.3 O=C1CSCCN1 SC-28581 [0,0,0,0,0,1|1,0,0]=2 397 B7R1.3 OC1=CN=NCC1 SC-89630 [0,0,0,0,0,1|1,0,2]=4 398 B7R1.3 OC1CC=CCC1 SC-87372 [0,0,0,0,0,1|0,0,3]=4 399 B7R1.3 OC1CCCCO1 SC-84303 [0,0,0,0,0,1|0,0,2]=3 400 B7R1.3 OC1CCCNC1 SC-06262 [0,0,0,0,0,1|0,0,2]=3 401 B7R1.3 OC1CCCNC1 SC-47771 [0,0,0,0,0,1|0,0,2]=3 402 B7R1.3 OC1CCCOC1 SC-19794 [0,0,0,0,0,1|0,0,2]=3 403 B7R1.3 OC1CCCOC1 SC-35801 [0,0,0,0,0,1|0,0,2]=3 404 B7R1.3 OC1CCNCC1 SC-05165 [0,0,0,0,0,1|0,0,2]=3 405 B7R1.3 OC1CCOCC1 SC-02372 [0,0,0,0,0,1|0,0,2]=3 406 B7R1.3 OC1CCSCC1 SC-35917 [0,0,0,0,0,1|0,0,2]=3 407 B7R1.3 ON1CCCCC1 SC-13334 [0,0,0,0,0,1|1,0,1]=3 408 B7R1.3 O[C@@H]1CCCNC1 SC-12564 [0,0,0,0,0,1|0,0,2]=3 409 B7R1.3 O[C@H]1CCCNC1 SC-19802 [0,0,0,0,0,1|0,0,2]=3 410 B7R1.3 SC1CCOCC1 SC-47759 [0,0,0,0,0,1|0,1,1]=3 411 B7R1.3 [C@H]1(C)CNCCN1 SC-16783 [0,0,0,0,0,1|2,0,1]=4 412 B4R0.1 C=C(C)CBr SC-50158 [1,0,1,0,0,0|2,0,0]=4 413 B4R0.1 C=C(C)CF SC-89300 [1,0,1,0,0,0|2,0,0]=4 414 B4R0.1 C=C(C)CN SC-43404 [1,0,1,0,0,0|2,0,0]=4 415 B4R0.1 C=C(C)CN SC-84159 [1,0,1,0,0,0|2,0,0]=4 416 B4R0.1 CC(=O)C#N SC-51001 [1,0,1,0,0,0|1,0,1]=4 417 B4R0.1 CC(=O)C=O SC-74380 [1,0,1,0,0,0|1,0,1]=4 418 B4R0.1 CC(=O)CBr SC-20936 [1,0,1,0,0,0|1,0,0]=3 419 B4R0.1 CC(=O)CN SC-28532 [1,0,1,0,0,0|1,0,0]=3 420 B4R0.1 CC(=O)CN SC-89750 [1,0,1,0,0,0|1,0,0]=3 421 B4R0.1 CC(=O)NO SC-18498 [1,0,1,0,0,0|2,0,0]=4 422 B4R0.1 CCC(=N)N SC-53846 [1,0,1,0,0,0|2,0,0]=4 423 B4R0.1 CCC(=O)O SC-22887 [1,0,1,0,0,0|1,0,0]=3 424 B4R0.1 CCC(=O)[O-] SC-47286 [1,0,1,0,0,0|1,0,0]=3 425 B4R0.1 CCC(C)O SC-01234 [1,0,1,0,0,0|0,0,2]=4 426 B4R0.1 CCC(N)=O SC-18213 [1,0,1,0,0,0|1,0,0]=3 427 B4R0.1 CCS(=O)[O-] SC-20356 [1,0,1,0,0,0|2,0,0]=4 428 B4R0.1 CC[C@H](C)N SC-81828 [1,0,1,0,0,0|1,0,1]=4 429 B4R0.1 CC[C@H](C)O SC-04418 [1,0,1,0,0,0|0,0,2]=4 430 B4R0.1 CNC(N)=O SC-15862 [1,0,1,0,0,0|2,0,0]=4 431 B4R0.1 C\C=C(\C)Br SC-91379 [1,0,1,0,0,0|1,0,1]=4 432 B4R0.1 NC(=O)CBr SC-17752 [1,0,1,0,0,0|2,0,0]=4 433 B4R0.1 NC(=O)CI SC-18913 [1,0,1,0,0,0|2,0,0]=4 434 B4R0.1 NCC(=O)O SC-26884 [1,0,1,0,0,0|2,0,0]=4 435 B4R0.1 NCC(N)=O SC-09567 [1,0,1,0,0,0|2,0,0]=4 436 B4R0.1 NCC(N)=O SC-18427 [1,0,1,0,0,0|2,0,0]=4 437 B4R0.1 O=C(Br)CBr SC-18428 [1,0,1,0,0,0|2,0,0]=4 438 B4R0.1 O=C(Cl)CBr SC-49267 [1,0,1,0,0,0|2,0,0]=4 439 B4R0.1 O=C(O)CBr SC-18211 [1,0,1,0,0,0|2,0,0]=4 440 B4R0.1 O=C(O)CO SC-23119 [1,0,1,0,0,0|2,0,0]=4 441 B4R0.1 O=C(O)CO SC-26092 [1,0,1,0,0,0|2,0,0]=4 442 B4R0.1 O=C([O-])CI SC-80290 [1,0,1,0,0,0|2,0,0]=4 443 B4R0.2 BrCCCBr SC-79111 [1,0,1,0,0,0|2,0,0]=4 444 B4R0.2 C=CCCCl SC-90795 [1,0,1,0,0,0|1,0,1]=4 445 B4R0.2 C=CCCN SC-48242 [1,0,1,0,0,0|1,0,1]=4 446 B4R0.2 C=CCCN SC-52106 [1,0,1,0,0,0|1,0,1]=4 447 B4R0.2 C=CCCO SC-45284 [1,0,1,0,0,0|1,0,1]=4 448 B4R0.2 C=CCNC SC-05902 [1,0,1,0,0,0|1,0,1]=4 449 B4R0.2 C=CCSC SC-47211 [1,0,1,0,0,0|1,0,1]=4 450 B4R0.2 CCCNC SC-27548 [1,0,1,0,0,0|1,0,0]=3 451 B4R0.2 CCN=C=O SC-11793 [1,0,1,0,0,0|1,0,1]=4 452 B4R0.2 CCOCC SC-73354 [1,0,1,0,0,0|1,0,0]=3 453 B4R0.2 CNCCBr SC-98001 [1,0,1,0,0,0|2,0,0]=4 454 B4R0.2 COCC=O SC-48883 [1,0,1,0,0,0|1,0,0]=3 455 B4R0.2 COCCCl SC-05903 [1,0,1,0,0,0|2,0,0]=4 456 B4R0.2 COCCN SC-22236 [1,0,1,0,0,0|2,0,0]=4 457 B4R0.2 CSCCCl SC-53991 [1,0,1,0,0,0|2,0,0]=4 458 B4R0.2 CSCCN SC-28443 [1,0,1,0,0,0|2,0,0]=4 459 B4R0.2 CSCCN SC-83550 [1,0,1,0,0,0|2,0,0]=4 460 B4R0.2 CSCCO SC-19276 [1,0,1,0,0,0|1,0,1]=4 461 B4R0.2 C\C=C/CO SC-69832 [1,0,1,0,0,0|1,0,1]=4 462 B4R0.2 C\C=C\CCl SC-22573 [1,0,1,0,0,0|1,0,1]=4 463 B4R0.2 C\C=C\CO SC-25521 [1,0,1,0,0,0|1,0,1]=4 464 B4R0.2 C\C=C\CO SC-69597 [1,0,1,0,0,0|1,0,1]=4 465 B4R0.2 C\C=C\OC SC-97407 [1,0,1,0,0,0|1,0,1]=4 466 B4R0.2 ClCCCI SC-73683 [1,0,1,0,0,0|2,0,0]=4 467 B4R0.2 FCCCBr SC-49851 [1,0,1,0,0,0|2,0,0]=4 468 B4R0.2 FCCCI SC-84350 [1,0,1,0,0,0|2,0,0]=4 469 B4R0.2 ICCCI SC-89448 [1,0,1,0,0,0|2,0,0]=4 470 B4R0.2 NCCCBr SC-39593 [1,0,1,0,0,0|2,0,0]=4 471 B4R0.2 NCCCBr SC-48386 [1,0,1,0,0,0|2,0,0]=4 472 B4R0.2 NCCCCl SC-15218 [1,0,1,0,0,0|2,0,0]=4 473 B4R0.2 NCCCO SC-16407 [1,0,1,0,0,0|1,0,1]=4 474 B4R0.2 NCCCS SC-52748 [1,0,1,0,0,0|1,1,0]=4 475 B4R0.2 O=CCCCl SC-71322 [1,0,1,0,0,0|1,0,0]=3 476 B4R0.2 O=CCCO SC-52939 [1,0,1,0,0,0|1,0,0]=3 477 B4R0.2 OCCCBr SC-13514 [1,0,1,0,0,0|1,0,1]=4 478 B4R0.2 OCCCCl SC-15525 [1,0,1,0,0,0|1,0,1]=4 479 B4R0.2 OCCCF SC-24862 [1,0,1,0,0,0|1,0,1]=4 480 B4R0.2 OCCCI SC-65803 [1,0,1,0,0,0|1,0,1]=4 481 B4R0.2 OCCCO SC-25736 [1,0,1,0,0,0|1,0,1]=4 482 B4R0.2 SCCCS SC-17571 [1,0,1,0,0,0|1,1,0]=4 483 B6R0.1 C#CC(=O)OCC SC-05846 [0,1,1,0,0,0|1,0,1]=4 484 B6R0.1 C#CCC(=O)OC SC-13148 [0,1,1,0,0,0|0,0,2]=4 485 B6R0.1 C=CCC(=O)OC SC-48829 [0,1,1,0,0,0|0,0,2]=4 486 B6R0.1 CC#CC(=O)OC SC-48510 [0,1,1,0,0,0|0,0,2]=4 487 B6R0.1 CCOC(=N)CCl SC-39703 [0,1,1,0,0,0|2,0,0]=4 488 B6R0.1 CCOC(=N)CCl SC-53117 [0,1,1,0,0,0|2,0,0]=4 489 B6R0.1 CCOC(=O)C#N SC-20120 [0,1,1,0,0,0|1,0,1]=4 490 B6R0.1 CCOC(=O)CBr SC-17870 [0,1,1,0,0,0|1,0,0]=3 491 B6R0.1 CCOC(=O)CCl SC-79310 [0,1,1,0,0,0|1,0,0]=3 492 B6R0.1 CCOC(=O)CN SC-09569 [0,1,1,0,0,0|1,0,0]=3 493 B6R0.1 CCOC(=O)CN SC-48652 [0,1,1,0,0,0|1,0,0]=3 494 B6R0.1 CCOC(=O)CO SC-50412 [0,1,1,0,0,0|1,0,0]=3 495 B6R0.1 CCOC(=O)CS SC-18381 [0,1,1,0,0,0|1,0,0]=3 496 B6R0.1 CCOC(=O)NN SC-50147 [0,1,1,0,0,0|2,0,0]=4 497 B6R0.1 CNC(=O)CC#N SC-97600 [0,1,1,0,0,0|1,0,1]=4 498 B6R0.1 CNCC(=O)OC SC-10432 [0,1,1,0,0,0|1,0,0]=3 499 B6R0.1 COC(=O)CC=O SC-53143 [0,1,1,0,0,0|1,0,1]=4 500 B6R0.1 COC(=O)CCBr SC-18677 [0,1,1,0,0,0|1,0,0]=3 501 B6R0.1 COC(=O)CCN SC-21486 [0,1,1,0,0,0|1,0,0]=3 502 B6R0.1 COC(=O)CCO SC-21690 [0,1,1,0,0,0|1,0,0]=3 503 B6R0.1 COC(=O)CSC SC-20536 [0,1,1,0,0,0|1,0,0]=3 504 B6R0.1 COC(=O)OCCl SC-53303 [0,1,1,0,0,0|2,0,0]=4 505 B6R0.1 COCC(=O)NN SC-54001 [0,1,1,0,0,0|2,0,0]=4 506 B6R0.1 COCC(=O)OC SC-62202 [0,1,1,0,0,0|1,0,0]=3 507 B6R0.1 C\C=C\C(=O)OC SC-22589 [0,1,1,0,0,0|0,0,2]=4 508 B6R0.1 O=C(CCl)NCO SC-21590 [0,1,1,0,0,0|2,0,0]=4 509 B6R0.1 [C-]#[N+]CC(=O)OC SC-19522 [0,1,1,0,0,0|1,0,1]=4 510 B6R0.2 CC(=O)CC(C)=O SC-77723 [0,1,1,0,0,0|0,0,1]=3 511 B6R0.2 CC(=O)NC(C)C SC-A3057 [0,1,1,0,0,0|1,0,0]=3 512 B6R0.2 CC(=O)OC(C)C SC-25616 [0,1,1,0,0,0|1,0,0]=3 513 B6R0.2 CC(=O)\C=C(\C)N SC-89382 [0,1,1,0,0,0|0,0,2]=4 514 B6R0.2 CC(=O)\C=C(\C)O SC-20333 [0,1,1,0,0,0|0,0,2]=4 515 B6R0.2 CC(=O)\C=C(\C)O SC-67757 [0,1,1,0,0,0|0,0,2]=4 516 B6R0.2 CC(=O)\C=C(\C)[O-] SC-19412 [0,1,1,0,0,0|0,0,2]=4 517 B6R0.2 CC(Cl)CN(C)C SC-81232 [0,1,1,0,0,0|2,0,0]=4 518 B6R0.2 CC(Cl)OC(=O)Cl SC-13624 [0,1,1,0,0,0|2,0,0]=4 519 B6R0.2 CN(C)CC(N)=O SC-89197 [0,1,1,0,0,0|2,0,0]=4 520 B6R0.2 C[C@@H](N)CC(=O)O SC-10059 [0,1,1,0,0,0|1,0,0]=3 521 B6R0.2 C[C@@H](N)CC(=O)O SC-44142 [0,1,1,0,0,0|1,0,0]=3 522 B6R0.2 C[C@H](N)CC(=O)O SC-21979 [0,1,1,0,0,0|1,0,0]=3 523 B6R0.2 C[C@H](O)CC(=O)O SC-B3327 [0,1,1,0,0,0|1,0,0]=3 524 B6R0.2 C[S+](C)CC(=O)[O-] SC-72907 [0,1,1,0,0,0|2,0,0]=4 525 B6R0.3 CC(CBr)C(=O)O SC-53016 [0,1,1,0,0,0|2,0,0]=4 526 B6R0.3 CC(CN)C(=O)O SC-10095 [0,1,1,0,0,0|2,0,0]=4 527 B6R0.3 CC(CN)C(=O)O SC-16443 [0,1,1,0,0,0|2,0,0]=4 528 B6R0.3 CCC(F)C(=O)O SC-82839 [0,1,1,0,0,0|1,0,0]=3 529 B6R0.3 CCC(N)C(=O)O SC-25570 [0,1,1,0,0,0|1,0,0]=3 530 B6R0.3 CCC(N)C(N)=O SC-67619 [0,1,1,0,0,0|1,0,0]=3 531 B6R0.3 CCC(S)C(=O)O SC-90417 [0,1,1,0,0,0|1,0,0]=3 532 B6R0.3 CCN(O)C(C)=O SC-69302 [0,1,1,0,0,0|1,0,0]=3 533 B6R0.3 CC[C@@H](C)C(=O)O SC-92309 [0,1,1,0,0,0|1,0,0]=3 534 B6R0.3 CC[C@@H](N)C(=O)O SC-10051 [0,1,1,0,0,0|1,0,0]=3 535 B6R0.3 CC[C@@H](O)C(=O)O SC-53865 [0,1,1,0,0,0|1,0,0]=3 536 B6R0.3 CC[C@H](N)C(=O)O SC-10052 [0,1,1,0,0,0|1,0,0]=3 537 B6R0.3 CC[C@H](N)C(N)=O SC-15825 [0,1,1,0,0,0|1,0,0]=3 538 B6R0.3 CN[C@H](C)C(=O)O SC-45134 [0,1,1,0,0,0|2,0,0]=4 539 B6R0.3 COC(=O)C(C)=O SC-15233 [0,1,1,0,0,0|1,0,1]=4 540 B6R0.3 COC(C)C(=O)O SC-49776 [0,1,1,0,0,0|2,0,0]=4 541 B6R0.3 CON(C)C(C)=O SC-20924 [0,1,1,0,0,0|2,0,0]=4 542 B6R0.3 CO[C@@H](C)C(=O)O SC-89341 [0,1,1,0,0,0|2,0,0]=4 543 B6R0.3 CO[C@H](C)C(=O)O SC-A3340 [0,1,1,0,0,0|2,0,0]=4 544 B6R0.3 C[C@@H](CN)C(=O)O SC-69436 [0,1,1,0,0,0|2,0,0]=4 545 B6R0.3 C[C@H](CN)C(=O)O SC-90232 [0,1,1,0,0,0|2,0,0]=4 546 B6R0.3 C[C@H](CN)C(=O)O SC-A1203 [0,1,1,0,0,0|2,0,0]=4 547 B6R0.3 NC(=O)[C@@H](N)CO SC-09855 [0,1,1,0,0,0|2,0,0]=4 548 B6R0.3 NC(CO)C(=O)O SC-09828 [0,1,1,0,0,0|2,0,0]=4 549 B6R0.3 NC(CS)C(=O)O SC-16429 [0,1,1,0,0,0|2,0,0]=4 550 B6R0.3 NCC(N)C(=O)O SC-12518 [0,1,1,0,0,0|2,0,0]=4 551 B6R0.3 NCC(N)C(=O)O SC-26817 [0,1,1,0,0,0|2,0,0]=4 552 B6R0.3 NCC(O)C(=O)O SC-10335 [0,1,1,0,0,0|2,0,0]=4 553 B6R0.3 NC[C@@H](N)C(=O)O SC-10203 [0,1,1,0,0,0|2,0,0]=4 554 B6R0.3 N[C@@H](CO)C(=O)O SC-09827 [0,1,1,0,0,0|2,0,0]=4 555 B6R0.3 N[C@@H](CS)C(=O)O SC-45550 [0,1,1,0,0,0|2,0,0]=4 556 B6R0.3 N[C@H](CO)C(=O)O SC-09826 [0,1,1,0,0,0|2,0,0]=4 557 B6R0.3 O=C(Cl)C(Br)CBr SC-76209 [0,1,1,0,0,0|2,0,0]=4 558 B6R0.3 O=C(O)C(Br)CBr SC-26969 [0,1,1,0,0,0|2,0,0]=4 559 B6R0.3 O=C(O)C(O)CCl SC-83865 [0,1,1,0,0,0|2,0,0]=4 560 B6R0.3 [C@@H](N)(CC)C(N)=O SC-49088 [0,1,1,0,0,0|1,0,0]=3 561 B6R0.3 [C@@H](N)(CS)C(=O)O SC-09427 [0,1,1,0,0,0|2,0,0]=4 562 B6R0.3 [C@@H](N)(CS)C(=O)O SC-09430 [0,1,1,0,0,0|2,0,0]=4 563 B6R0.3 [C@H](N)(CS)C(=O)O SC-09426 [0,1,1,0,0,0|2,0,0]=4 564 B6R0.4 C=C(C)CNCC SC-47240 [0,1,1,0,0,0|1,0,0]=3 565 B6R0.4 C=CCCC(=O)O SC-25836 [0,1,1,0,0,0|1,0,1]=4 566 B6R0.4 CC(=O)CCCBr SC-91341 [0,1,1,0,0,0|0,0,0]=2 567 B6R0.4 CC(=O)NCCN SC-19651 [0,1,1,0,0,0|1,0,0]=3 568 B6R0.4 CCCCC(=O)Cl SC-46867 [0,1,1,0,0,0|1,0,0]=3 569 B6R0.4 CC\C=C\C(=O)O SC-92876 [0,1,1,0,0,0|1,0,1]=4 570 B6R0.4 CN(C)CCCBr SC-12824 [0,1,1,0,0,0|2,0,0]=4 571 B6R0.4 CN(C)CCCBr SC-48972 [0,1,1,0,0,0|2,0,0]=4 572 B6R0.4 CN(C)CCCCl SC-18516 [0,1,1,0,0,0|2,0,0]=4 573 B6R0.4 CN(C)CCCCl SC-53120 [0,1,1,0,0,0|2,0,0]=4 574 B6R0.4 CNCCC(=O)O SC-27492 [0,1,1,0,0,0|1,0,0]=3 575 B6R0.4 CNCCC(=O)O SC-52914 [0,1,1,0,0,0|1,0,0]=3 576 B6R0.4 CNCCN(C)C SC-29103 [0,1,1,0,0,0|2,0,0]=4 577 B6R0.4 COCCC(=O)O SC-50255 [0,1,1,0,0,0|1,0,0]=3 578 B6R0.4 COCCN(C)C SC-21743 [0,1,1,0,0,0|2,0,0]=4 579 B6R0.4 CO\C=C\C(C)=O SC-71024 [0,1,1,0,0,0|0,0,2]=4 580 B6R0.4 CSCCC(=O)O SC-96567 [0,1,1,0,0,0|1,0,0]=3 581 B6R0.4 NCCCC(=O)O SC-10045 [0,1,1,0,0,0|1,0,0]=3 582 B6R0.4 O=C(Cl)CCCBr SC-70369 [0,1,1,0,0,0|1,0,0]=3 583 B6R0.4 O=C(O)CCCCl SC-89723 [0,1,1,0,0,0|1,0,0]=3 584 B6R0.5 CCCP(=O)(O)O SC-A3323 [0,1,1,0,0,0|2,0,0]=4 585 B6R0.5 CCCS(=O)(=O)O SC-80781 [0,1,1,0,0,0|2,0,0]=4 586 B6R0.5 CCCS(N)(=O)=O SC-95067 [0,1,1,0,0,0|2,0,0]=4 587 B6R0.5 CCC[N+](C)(C)C SC-79778 [0,1,1,0,0,0|2,0,0]=4 588 B6R0.5 CCOS(C)(=O)=O SC-21355 [0,1,1,0,0,0|2,0,0]=4 589 B6R0.5 CCOS(C)(=O)=O SC-80833 [0,1,1,0,0,0|2,0,0]=4 590 B6R0.5 CS(=O)(=O)CCBr SC-03864 [0,1,1,0,0,0|2,0,0]=4 591 B6R0.5 CS(=O)(=O)CCN SC-12252 [0,1,1,0,0,0|2,0,0]=4 592 B6R0.6 BrCCCCCBr SC-00350 [0,1,1,0,0,0|1,0,1]=4 593 B6R0.6 C#CCCCCN SC-A3767 [0,1,1,0,0,0|1,0,1]=4 594 B6R0.6 C#CCCCCO SC-87514 [0,1,1,0,0,0|1,0,1]=4 595 B6R0.6 C=CCCCCBr SC-27023 [0,1,1,0,0,0|1,0,0]=3 596 B6R0.6 CCCCCNC SC-25672 [0,1,1,0,0,0|1,0,1]=4 597 B6R0.6 CCCCON=O SC-70750 [0,1,1,0,0,0|1,0,0]=3 598 B6R0.6 CCC\C=C\C=O SC-25240 [0,1,1,0,0,0|0,0,1]=3 599 B6R0.6 CCOCCCO SC-00354 [0,1,1,0,0,0|0,0,2]=4 600 B6R0.6 CNCCCCO SC-13108 [0,1,1,0,0,0|0,0,2]=4 601 B6R0.6 CNCCCNC SC-47576 [0,1,1,0,0,0|2,0,0]=4 602 B6R0.6 CNCCCOC SC-51293 [0,1,1,0,0,0|2,0,0]=4 603 B6R0.6 COCCCCCl SC-01876 [0,1,1,0,0,0|1,0,1]=4 604 B6R0.6 COCCCOC SC-47077 [0,1,1,0,0,0|2,0,0]=4 605 B6R0.6 COCCN=C=O SC-72245 [0,1,1,0,0,0|1,0,1]=4 606 B6R0.6 C\C=C\CCCO SC-48265 [0,1,1,0,0,0|1,0,1]=4 607 B6R0.6 FCCCCCBr SC-45318 [0,1,1,0,0,0|1,0,1]=4 608 B6R0.6 ICCCCCI SC-82357 [0,1,1,0,0,0|1,0,1]=4 609 B6R0.6 N#CCCCCCl SC-16304 [0,1,1,0,0,0|1,0,1]=4 610 B6R0.6 NCCCCCN SC-35536 [0,1,1,0,0,0|1,0,1]=4 611 B6R0.6 NCCCCCO SC-20467 [0,1,1,0,0,0|0,0,2]=4 612 B6R0.6 O=CCCCCCl SC-A3300 [0,1,1,0,0,0|0,0,0]=2 613 B6R0.6 OCCCCCBr SC-43699 [0,1,1,0,0,0|0,0,2]=4 614 B6R0.6 OCCCCCO SC-69222 [0,1,1,0,0,0|0,0,2]=4 615 B6R0.8 CCS(=O)(=O)CC SC-81611 [0,1,1,0,0,0|1,0,0]=3 616 B6R0.9 CCB(CC)OC SC-22792 [0,1,1,0,0,0|1,0,1]=4 617 B6R0.9 CCN(CC)CC SC-65212 [0,1,1,0,0,0|2,0,0]=4 618 B6R0.9 CCN(CC)CC SC-66535 [0,1,1,0,0,0|2,0,0]=4 619 B6R1.5 CN1CC(N)C1 SC-48566 [0,1,0,0,1,0|2,0,0]=4 620 B6R1.5 CN1CC(N)C1 SC-96394 [0,1,0,0,1,0|2,0,0]=4 621 B6R1.5 CN1CC(N)C1 SC-98163 [0,1,0,0,1,0|2,0,0]=4 622 B6R1.5 CN1CC(O)C1 SC-92160 [0,1,0,0,1,0|2,0,0]=4 623 B6R1.5 NC1CC(=O)C1 SC-50311 [0,1,0,0,1,0|0,0,0]=2 624 B6R1.5 NC1CC(=O)C1 SC-67476 [0,1,0,0,1,0|0,0,0]=2 625 B6R1.5 NC1CC(F)C1 SC-82347 [0,1,0,0,1,0|1,0,1]=4 626 B6R1.5 NC1CC(O)C1 SC-52840 [0,1,0,0,1,0|0,0,2]=4 627 B6R1.5 N[C@H]1C[C@@H](O)C1 SC-94821 [0,1,0,0,1,0|0,0,2]=4 628 B6R1.5 N[C@H]1C[C@H](O)C1 SC-51722 [0,1,0,0,1,0|0,0,2]=4 629 B6R1.5 N[C@H]1C[C@H](O)C1 SC-94820 [0,1,0,0,1,0|0,0,2]=4 630 B6R1.6 BrCC1CCC1 SC-17177 [0,1,0,0,1,0|1,0,1]=4 631 B6R1.6 CNC1CCC1 SC-48003 [0,1,0,0,1,0|1,0,1]=4 632 B6R1.6 ICC1CCC1 SC-B3939 [0,1,0,0,1,0|1,0,1]=4 633 B6R1.6 N#CC1CCC1 SC-43622 [0,1,0,0,1,0|1,0,1]=4 634 B6R1.6 NCC1CCC1 SC-12470 [0,1,0,0,1,0|1,0,1]=4 635 B6R1.6 NCC1CCC1 SC-22241 [0,1,0,0,1,0|1,0,1]=4 636 B6R1.6 NCC1CCC1 SC-A4294 [0,1,0,0,1,0|1,0,1]=4 637 B6R1.6 NNC1CCC1 SC-12374 [0,1,0,0,1,0|1,0,1]=4 638 B6R1.6 NNC1CCC1 SC-12770 [0,1,0,0,1,0|1,0,1]=4 639 B6R1.6 NNC1CCC1 SC-72265 [0,1,0,0,1,0|1,0,1]=4 640 B6R1.6 O=CC1CCC1 SC-14218 [0,1,0,0,1,0|0,0,1]=3 641 B6R1.6 O=CC1COC1 SC-65750 [0,1,0,0,1,0|1,0,1]=4 642 B6R1.6 OCC1CCC1 SC-16736 [0,1,0,0,1,0|0,0,2]=4 643 B6R1.10 CC1(N)CCC1 SC-38385 [0,1,0,0,1,0|1,0,1]=4 644 B6R1.10 CC1(N)CCC1 SC-82175 [0,1,0,0,1,0|1,0,1]=4 645 B6R1.10 C[Si]1(Cl)CCC1 SC-65745 [0,1,0,0,1,0|1,1,0]=4 646 B6R1.10 O=S1(=O)CCC1 SC-28013 [0,1,0,0,1,0|1,0,0]=3 647 B8R1.2 BrCC1CCCCC1 SC-02918 [0,1,0,0,0,1|1,0,1]=4 648 B8R1.2 BrCC1CCCCO1 SC-20895 [0,1,0,0,0,1|1,0,1]=4 649 B8R1.2 BrCC1CCCOC1 SC-44714 [0,1,0,0,0,1|1,0,1]=4 650 B8R1.2 BrCC1CCOCC1 SC-00660 [0,1,0,0,0,1|1,0,1]=4 651 B8R1.2 C#CC1CCOCC1 SC-96268 [0,1,0,0,0,1|1,0,1]=4 652 B8R1.2 CCN1CCNCC1 SC-05095 [0,1,0,0,0,1|2,0,0]=4 653 B8R1.2 CNC1CCCNC1 SC-00689 [0,1,0,0,0,1|1,0,1]=4 654 B8R1.2 CNC1CCCNC1 SC-52816 [0,1,0,0,0,1|1,0,1]=4 655 B8R1.2 CNC1CCCOC1 SC-35264 [0,1,0,0,0,1|1,0,1]=4 656 B8R1.2 CNC1CCNCC1 SC-04666 [0,1,0,0,0,1|1,0,1]=4 657 B8R1.2 COC1=CCCCC1 SC-28269 [0,1,0,0,0,1|0,0,1]=3 658 B8R1.2 COC1CCCNC1 SC-15522 [0,1,0,0,0,1|0,0,2]=4 659 B8R1.2 COC1CCCNC1 SC-45634 [0,1,0,0,0,1|0,0,2]=4 660 B8R1.2 COC1CCNCC1 SC-04308 [0,1,0,0,0,1|0,0,2]=4 661 B8R1.2 ICC1CCOCC1 SC-28261 [0,1,0,0,0,1|1,0,1]=4 662 B8R1.2 N#CC1CCCCC1 SC-73272 [0,1,0,0,0,1|1,0,1]=4 663 B8R1.2 N#CC1CCCCN1 SC-21123 [0,1,0,0,0,1|1,0,1]=4 664 B8R1.2 N#CC1CCNCC1 SC-04502 [0,1,0,0,0,1|1,0,1]=4 665 B8R1.2 N#CC1CCOCC1 SC-49321 [0,1,0,0,0,1|1,0,1]=4 666 B8R1.2 NCC1CCCCC1 SC-26900 [0,1,0,0,0,1|1,0,1]=4 667 B8R1.2 NCC1CCCCN1 SC-46326 [0,1,0,0,0,1|1,0,1]=4 668 B8R1.2 NCC1CCCCO1 SC-27902 [0,1,0,0,0,1|1,0,1]=4 669 B8R1.2 NCC1CCCOC1 SC-35931 [0,1,0,0,0,1|1,0,1]=4 670 B8R1.2 NCC1CCCOC1 SC-85451 [0,1,0,0,0,1|1,0,1]=4 671 B8R1.2 NCC1CCNCC1 SC-06464 [0,1,0,0,0,1|1,0,1]=4 672 B8R1.2 NCC1CCOCC1 SC-00740 [0,1,0,0,0,1|1,0,1]=4 673 B8R1.2 NNC1CCCCC1 SC-12375 [0,1,0,0,0,1|1,0,1]=4 674 B8R1.2 NNC1CCCCC1 SC-58187 [0,1,0,0,0,1|1,0,1]=4 675 B8R1.2 NNC1CCOCC1 SC-12777 [0,1,0,0,0,1|1,0,1]=4 676 B8R1.2 NNC1CCOCC1 SC-50560 [0,1,0,0,0,1|1,0,1]=4 677 B8R1.2 O=CC1=COCCC1 SC-46524 [0,1,0,0,0,1|0,0,1]=3 678 B8R1.2 O=CC1CCCCC1 SC-02305 [0,1,0,0,0,1|0,0,1]=3 679 B8R1.2 O=CC1CCCCN1 SC-29120 [0,1,0,0,0,1|0,0,1]=3 680 B8R1.2 O=CC1CCCOC1 SC-45114 [0,1,0,0,0,1|0,0,1]=3 681 B8R1.2 O=CC1CCNCC1 SC-21173 [0,1,0,0,0,1|0,0,1]=3 682 B8R1.2 O=CC1CCNCC1 SC-A3016 [0,1,0,0,0,1|0,0,1]=3 683 B8R1.2 O=CC1CCOCC1 SC-04900 [0,1,0,0,0,1|0,0,1]=3 684 B8R1.2 O=CC1CCSCC1 SC-96130 [0,1,0,0,0,1|0,0,1]=3 685 B8R1.2 O=CN1CCCCC1 SC-02942 [0,1,0,0,0,1|1,0,0]=3 686 B8R1.2 O=CN1CCNCC1 SC-46658 [0,1,0,0,0,1|1,0,0]=3 687 B8R1.2 OCC1CCCCC1 SC-00039 [0,1,0,0,0,1|0,0,2]=4 688 B8R1.2 OCC1CCCCO1 SC-00052 [0,1,0,0,0,1|0,0,2]=4 689 B8R1.2 OCC1CCCNC1 SC-04704 [0,1,0,0,0,1|0,0,2]=4 690 B8R1.2 OCC1CCNCC1 SC-06048 [0,1,0,0,0,1|0,0,2]=4 691 B8R1.2 OCC1CCOCC1 SC-01198 [0,1,0,0,0,1|0,0,2]=4 692 B8R1.2 OCN1CCOCC1 SC-47895 [0,1,0,0,0,1|1,0,1]=4 693 B8R1.2 OC[C@H]1CCCCN1 SC-83108 [0,1,0,0,0,1|0,0,2]=4 694 B8R1.2 ONC1CCCCC1 SC-A3793 [0,1,0,0,0,1|0,0,2]=4 695 B8R1.3 CC1=CCC(=O)CC1 SC-25236 [0,1,0,0,0,1|0,0,1]=3 696 B8R1.3 CC1=CCC(=O)CC1 SC-83877 [0,1,0,0,0,1|0,0,1]=3 697 B8R1.3 CC1=NNC(=O)CC1 SC-73679 [0,1,0,0,0,1|1,0,1]=4 698 B8R1.3 CC1CCC(N)CC1 SC-15967 [0,1,0,0,0,1|1,0,1]=4 699 B8R1.3 CC1CCC(N)CC1 SC-54542 [0,1,0,0,0,1|1,0,1]=4 700 B8R1.3 CN1CCC(=O)CC1 SC-01124 [0,1,0,0,0,1|0,0,0]=2 701 B8R1.3 CN1CCC(=O)CC1 SC-90211 [0,1,0,0,0,1|0,0,0]=2 702 B8R1.3 CN1CCC(Br)CC1 SC-24214 [0,1,0,0,0,1|1,0,1]=4 703 B8R1.3 CN1CCC(Cl)CC1 SC-05324 [0,1,0,0,0,1|1,0,1]=4 704 B8R1.3 NC1CCC(=O)CC1 SC-51421 [0,1,0,0,0,1|0,0,0]=2 705 B8R1.3 NC1CCC(=O)CC1 SC-94303 [0,1,0,0,0,1|0,0,0]=2 706 B8R1.3 NC1CCC(O)CC1 SC-26489 [0,1,0,0,0,1|0,0,2]=4 707 B8R1.3 NC1CCC(O)CC1 SC-43558 [0,1,0,0,0,1|0,0,2]=4 708 B8R1.3 NC1CCC(O)CC1 SC-45530 [0,1,0,0,0,1|0,0,2]=4 709 B8R1.3 N[C@H]1CCC(=O)NC1 SC-A3084 [0,1,0,0,0,1|0,0,0]=2 710 B8R1.3 N[C@H]1CC[C@H](O)CC1 SC-03065 [0,1,0,0,0,1|0,0,2]=4 711 B8R1.3 N[C@H]1CC[C@H](O)CC1 SC-21292 [0,1,0,0,0,1|0,0,2]=4 712 B8R1.3 O=C1CCC(=O)CC1 SC-15336 [0,1,0,0,0,1|0,0,0]=2 713 B8R1.3 O=C1CCC(=O)NC1 SC-35404 [0,1,0,0,0,1|0,0,1]=3 714 B8R1.3 O=C1CCC(O)CC1 SC-22101 [0,1,0,0,0,1|0,0,0]=2 715 B8R1.3 O=C1CCC(O)CN1 SC-14920 [0,1,0,0,0,1|0,0,0]=2 716 B8R1.3 O=C1COC(=O)CN1 SC-96522 [0,1,0,0,0,1|1,0,1]=4 717 B8R1.3 O=C1COC(=O)CO1 SC-86894 [0,1,0,0,0,1|1,0,1]=4 718 B8R1.3 OC1CCC(O)CC1 SC-22723 [0,1,0,0,0,1|0,0,2]=4 719 B8R1.3 O[C@H]1CC[C@H](O)CC1 SC-51814 [0,1,0,0,0,1|0,0,2]=4 720 B8R1.4 CC1CC(=O)CCN1 SC-14913 [0,1,0,0,0,1|0,0,0]=2 721 B8R1.4 CC1CC(=O)CCN1 SC-26346 [0,1,0,0,0,1|0,0,0]=2 722 B8R1.4 CC1CC(=O)CCO1 SC-43658 [0,1,0,0,0,1|0,0,0]=2 723 B8R1.4 CC1CC(O)CCO1 SC-15639 [0,1,0,0,0,1|0,0,2]=4 724 B8R1.4 CC1CCCC(=O)N1 SC-90092 [0,1,0,0,0,1|0,0,0]=2 725 B8R1.4 CC1CCNC(=O)C1 SC-65553 [0,1,0,0,0,1|0,0,0]=2 726 B8R1.4 CC1CCNC(C)C1 SC-05916 [0,1,0,0,0,1|1,0,1]=4 727 B8R1.4 CC1CN(C)CCN1 SC-93123 [0,1,0,0,0,1|2,0,0]=4 728 B8R1.4 CC1CNCC(=O)N1 SC-68745 [0,1,0,0,0,1|1,0,0]=3 729 B8R1.4 CN1CCCC(=O)C1 SC-88063 [0,1,0,0,0,1|0,0,0]=2 730 B8R1.4 CN1CCNC(=O)C1 SC-43594 [0,1,0,0,0,1|1,0,0]=3 731 B8R1.4 C[C@H]1CN(C)CCN1 SC-A3639 [0,1,0,0,0,1|2,0,0]=4 732 B8R1.4 C[C@H]1COCC(=O)N1 SC-82343 [0,1,0,0,0,1|1,0,0]=3 733 B8R1.4 NC1=CC(=O)CCC1 SC-18537 [0,1,0,0,0,1|0,0,1]=3 734 B8R1.4 NC1CCCC(O)C1 SC-19361 [0,1,0,0,0,1|0,0,2]=4 735 B8R1.4 N[C@@H]1CCC[C@@H](O)C1 SC-43595 [0,1,0,0,0,1|0,0,2]=4 736 B8R1.4 N[C@@H]1CCC[C@@H](O)C1 SC-47974 [0,1,0,0,0,1|0,0,2]=4 737 B8R1.4 N[C@@H]1CCC[C@H](O)C1 SC-43598 [0,1,0,0,0,1|0,0,2]=4 738 B8R1.4 N[C@H]1CCC[C@@H](N)C1 SC-A2329 [0,1,0,0,0,1|1,0,1]=4 739 B8R1.4 N[C@H]1CCC[C@@H](O)C1 SC-12531 [0,1,0,0,0,1|0,0,2]=4 740 B8R1.4 N[C@H]1CCC[C@@H](O)C1 SC-43597 [0,1,0,0,0,1|0,0,2]=4 741 B8R1.4 O=C1CC(O)CCN1 SC-14921 [0,1,0,0,0,1|0,0,0]=2 742 B8R1.4 O=C1CC(O)CCN1 SC-26449 [0,1,0,0,0,1|0,0,0]=2 743 B8R1.4 O=C1CCCC(=O)C1 SC-16085 [0,1,0,0,0,1|0,0,0]=2 744 B8R1.4 O=C1CCCC(=O)N1 SC-65454 [0,1,0,0,0,1|0,0,1]=3 745 B8R1.4 O=C1CCCC(=O)O1 SC-43876 [0,1,0,0,0,1|0,0,1]=3 746 B8R1.4 O=C1CCCC(O)C1 SC-52929 [0,1,0,0,0,1|0,0,0]=2 747 B8R1.4 O=C1COCC(=O)O1 SC-26890 [0,1,0,0,0,1|1,0,1]=4 748 B8R1.4 O=C1CSCC(=O)C1 SC-21904 [0,1,0,0,0,1|0,0,1]=3 749 B8R1.5 CC1CCCCC1=O SC-20428 [0,1,0,0,0,1|0,0,0]=2 750 B8R1.5 CC1CCCNC1C SC-57854 [0,1,0,0,0,1|1,0,1]=4 751 B8R1.5 CC1CNCCN1C SC-02882 [0,1,0,0,0,1|2,0,0]=4 752 B8R1.5 C[C@H]1NCCNC1=O SC-05130 [0,1,0,0,0,1|1,0,0]=3 753 B8R1.5 NC1CCCCC1=O SC-22252 [0,1,0,0,0,1|0,0,0]=2 754 B8R1.5 NC1CCCCC1=O SC-84826 [0,1,0,0,0,1|0,0,0]=2 755 B8R1.5 NC1CCCCC1N SC-02306 [0,1,0,0,0,1|1,0,1]=4 756 B8R1.5 NC1CCCCC1O SC-45073 [0,1,0,0,0,1|0,0,2]=4 757 B8R1.5 NC1CCCC[C@@H]1O SC-44498 [0,1,0,0,0,1|0,0,2]=4 758 B8R1.5 NC1CCCNC1=O SC-14514 [0,1,0,0,0,1|0,0,0]=2 759 B8R1.5 NC1CCNCC1O SC-97873 [0,1,0,0,0,1|0,0,2]=4 760 B8R1.5 N[C@@H]1CCCC[C@H]1N SC-17287 [0,1,0,0,0,1|1,0,1]=4 761 B8R1.5 N[C@@H]1CCCC[C@H]1O SC-15016 [0,1,0,0,0,1|0,0,2]=4 762 B8R1.5 N[C@@H]1CCCC[C@H]1O SC-26535 [0,1,0,0,0,1|0,0,2]=4 763 B8R1.5 N[C@@H]1CCCNC1=O SC-48796 [0,1,0,0,0,1|0,0,0]=2 764 B8R1.5 N[C@@H]1COCC[C@H]1O SC-20565 [0,1,0,0,0,1|0,0,2]=4 765 B8R1.5 N[C@H]1CCCC[C@@H]1N SC-02456 [0,1,0,0,0,1|1,0,1]=4 766 B8R1.5 N[C@H]1CCCC[C@@H]1O SC-26530 [0,1,0,0,0,1|0,0,2]=4 767 B8R1.5 N[C@H]1CCCC[C@H]1O SC-26560 [0,1,0,0,0,1|0,0,2]=4 768 B8R1.5 N[C@H]1CCCC[C@H]1O SC-35500 [0,1,0,0,0,1|0,0,2]=4 769 B8R1.5 N[C@H]1CCCC[C@H]1O SC-70916 [0,1,0,0,0,1|0,0,2]=4 770 B8R1.5 N[C@H]1CCCC[C@H]1O SC-99850 [0,1,0,0,0,1|0,0,2]=4 771 B8R1.5 N[C@H]1CCCNC1=O SC-27263 [0,1,0,0,0,1|0,0,0]=2 772 B8R1.5 O=C1CCCCC1=O SC-46435 [0,1,0,0,0,1|0,0,0]=2 773 B8R1.5 O=C1CCCCC1Br SC-86496 [0,1,0,0,0,1|0,0,0]=2 774 B8R1.5 O=C1CCCCC1Cl SC-20977 [0,1,0,0,0,1|0,0,0]=2 775 B8R1.5 O=C1CCCCC1O SC-49144 [0,1,0,0,0,1|0,0,0]=2 776 B8R1.5 O=C1CCNCC1Br SC-94331 [0,1,0,0,0,1|0,0,0]=2 777 B8R1.5 O=C1CCOCC1Br SC-33711 [0,1,0,0,0,1|0,0,0]=2 778 B8R1.5 O=C1NCCCC1O SC-14922 [0,1,0,0,0,1|0,0,0]=2 779 B8R1.5 O[C@@H]1CCCC[C@H]1O SC-20091 [0,1,0,0,0,1|0,0,2]=4 780 B8R1.5 O[C@H]1CCCC[C@H]1O SC-95524 [0,1,0,0,0,1|0,0,2]=4 781 B8R1.5 [C@@H]1(N)CCCC[C@H]1N SC-26625 [0,1,0,0,0,1|1,0,1]=4 782 B8R1.5 [C@H]1(N)CCCC[C@H]1N SC-45540 [0,1,0,0,0,1|1,0,1]=4 783 B8R1.72 CC1(C)CCCNC1 SC-A4757 [0,1,0,0,0,1|1,0,1]=4 784 B8R1.72 CC1(N)CCNCC1 SC-72271 [0,1,0,0,0,1|1,0,1]=4 785 B8R1.72 CC1(O)CCCCC1 SC-44648 [0,1,0,0,0,1|0,0,2]=4 786 B8R1.72 C[N+]1([O-])CCOCC1 SC-18301 [0,1,0,0,0,1|1,0,1]=4 787 B8R1.72 C[N+]1([O-])CCOCC1 SC-20032 [0,1,0,0,0,1|1,0,1]=4 788 B8R1.72 C[N+]1([O-])CCOCC1 SC-27550 [0,1,0,0,0,1|1,0,1]=4 789 B8R1.72 C[Si]1(C)CCNCC1 SC-B7755 [0,1,0,0,0,1|1,1,0]=4 790 B8R1.72 FC1(F)CCCCC1 SC-88951 [0,1,0,0,0,1|1,0,1]=4 791 B8R1.72 FC1(F)CCCNC1 SC-04828 [0,1,0,0,0,1|1,0,1]=4 792 B8R1.72 FC1(F)CCCNC1 SC-91906 [0,1,0,0,0,1|1,0,1]=4 793 B8R1.72 FC1(F)CCNCC1 SC-43924 [0,1,0,0,0,1|1,0,1]=4 794 B8R1.72 FC1(F)CCNCC1 SC-48150 [0,1,0,0,0,1|1,0,1]=4 795 B8R1.72 O=S1(=O)CCCCN1 SC-48177 [0,1,0,0,0,1|1,0,0]=3 796 B8R1.72 O=S1(=O)CCCCO1 SC-15335 [0,1,0,0,0,1|1,0,0]=3 797 B8R1.72 O=S1(=O)CCNCC1 SC-04097 [0,1,0,0,0,1|1,0,0]=3 798 B8R1.72 O=S1(=O)CCNCC1 SC-05623 [0,1,0,0,0,1|1,0,0]=3 799 B8R1.1 C=CC1COC(=O)O1 SC-15987 [0,2,0,0,0,0|2,0,0]=4 800 B8R1.1 CN1CCC(CN)C1 SC-29935 [0,2,0,0,0,0|2,0,0]=4 801 B8R1.1 CN1CCC(CN)C1 SC-51576 [0,2,0,0,0,0|2,0,0]=4 802 B8R1.1 CN1CCC(CO)C1 SC-48010 [0,2,0,0,0,0|2,0,0]=4 803 B8R1.1 CN1CC[C@@H](CO)C1 SC-A3243 [0,2,0,0,0,0|2,0,0]=4 804 B8R1.1 NCC1CCC(=O)N1 SC-53656 [0,2,0,0,0,0|1,0,0]=3 805 B8R1.1 NC[C@@H]1CCC(=O)N1 SC-44056 [0,2,0,0,0,0|1,0,0]=3 806 B8R1.1 O=C1CC(CO)CN1 SC-66045 [0,2,0,0,0,0|1,0,0]=3 807 B8R1.1 O=C1CC[C@@H](CO)N1 SC-09020 [0,2,0,0,0,0|1,0,0]=3 808 B8R1.1 O=C1CC[C@@H](CO)O1 SC-03496 [0,2,0,0,0,0|1,0,0]=3 809 B8R1.1 O=C1CC[C@H](CO)N1 SC-19648 [0,2,0,0,0,0|1,0,0]=3 810 B8R1.1 O=C1N[C@@H](CO)CO1 SC-33166 [0,2,0,0,0,0|2,0,0]=4 811 B8R1.1 [C@H]1(CBr)CCC(=O)N1 SC-23592 [0,2,0,0,0,0|1,0,0]=3 812 B8R1.7 CC(=O)C1CCCC1 SC-69830 [0,2,0,0,0,0|0,0,1]=3 813 B8R1.7 NC(=O)C1CCCN1 SC-24789 [0,2,0,0,0,0|1,0,1]=4 814 B8R1.7 NC(=O)C1CCNC1 SC-A3191 [0,2,0,0,0,0|1,0,1]=4 815 B8R1.7 NC(=O)[C@@H]1CCCN1 SC-06632 [0,2,0,0,0,0|1,0,1]=4 816 B8R1.7 O=C(Cl)C1CCCC1 SC-45320 [0,2,0,0,0,0|0,0,1]=3 817 B8R1.7 O=C(Cl)N1CCCC1 SC-72914 [0,2,0,0,0,0|1,0,0]=3 818 B8R1.7 O=C(O)C1=CCCC1 SC-65352 [0,2,0,0,0,0|0,0,1]=3 819 B8R1.7 O=C(O)C1CCCC1 SC-18675 [0,2,0,0,0,0|0,0,1]=3 820 B8R1.7 O=C(O)C1CCCN1 SC-09807 [0,2,0,0,0,0|1,0,1]=4 821 B8R1.7 O=C(O)C1CCCO1 SC-A4307 [0,2,0,0,0,0|1,0,1]=4 822 B8R1.7 O=C(O)C1CCOC1 SC-21248 [0,2,0,0,0,0|1,0,1]=4 823 B8R1.7 O=C(O)[C@@H]1CCCN1 SC-09806 [0,2,0,0,0,0|1,0,1]=4 824 B8R1.7 O=C(O)[C@@H]1CCNC1 SC-48463 [0,2,0,0,0,0|1,0,1]=4 825 B8R1.7 O=C(O)[C@@H]1CCOC1 SC-25192 [0,2,0,0,0,0|1,0,1]=4 826 B8R1.7 O=C(O)[C@H]1CCCN1 SC-09805 [0,2,0,0,0,0|1,0,1]=4 827 B8R1.7 O=C(O)[C@H]1CCCO1 SC-07092 [0,2,0,0,0,0|1,0,1]=4 828 B8R1.7 O=C(O)[C@H]1CCNC1 SC-25206 [0,2,0,0,0,0|1,0,1]=4 829 B8R1.7 OB(O)C1=CCCC1 SC-53221 [0,2,0,0,0,0|0,0,2]=4 830 B8R1.7 OB(O)C1CCCC1 SC-58324 [0,2,0,0,0,0|0,0,2]=4 831 B8R1.7 S=C([S-])N1CCCC1 SC-15169 [0,2,0,0,0,0|1,1,0]=4 832 B8R1.7 [C@H]1(C(=O)O)CCNC1 SC-48462 [0,2,0,0,0,0|1,0,1]=4 833 B8R1.7 [C@H]1(C(N)=O)CCCN1 SC-13550 [0,2,0,0,0,0|1,0,1]=4 834 B8R1.8 BrCCC1CCCC1 SC-51481 [0,2,0,0,0,0|1,0,1]=4 835 B8R1.8 BrCCN1CCCC1 SC-12634 [0,2,0,0,0,0|2,0,0]=4 836 B8R1.8 ClCCN1CCCC1 SC-06532 [0,2,0,0,0,0|2,0,0]=4 837 B8R1.8 N#CCC1CCCC1 SC-40258 [0,2,0,0,0,0|1,0,1]=4 838 B8R1.8 N#CCN1CCCC1 SC-68917 [0,2,0,0,0,0|2,0,0]=4 839 B8R1.8 NCCC1CCCC1 SC-44893 [0,2,0,0,0,0|1,0,1]=4 840 B8R1.8 NCCC1CCCC1 SC-A3050 [0,2,0,0,0,0|1,0,1]=4 841 B8R1.8 NCCN1CCCC1 SC-27229 [0,2,0,0,0,0|2,0,0]=4 842 B8R1.8 O=C=NC1CCCC1 SC-27896 [0,2,0,0,0,0|0,0,1]=3 843 B8R1.8 OCCC1CCCC1 SC-41116 [0,2,0,0,0,0|0,0,2]=4 844 B8R1.8 OCCN1CCCC1 SC-15355 [0,2,0,0,0,0|1,0,1]=4 845 B8R1.11 C=CN1CCCC1=O SC-47246 [0,2,0,0,0,0|1,0,0]=3 846 B8R1.11 CN1CCC[C@H]1CO SC-03638 [0,2,0,0,0,0|2,0,0]=4 847 B8R1.11 N#CC1=C(N)CCC1 SC-15343 [0,2,0,0,0,0|1,0,1]=4 848 B8R1.11 N#CC1CCCC1=O SC-46105 [0,2,0,0,0,0|0,0,0]=2 849 B8R1.11 N[C@H]1CCC[C@H]1CO SC-20351 [0,2,0,0,0,0|0,0,2]=4 850 B8R1.52 C#CC1(O)CCCC1 SC-86923 [0,2,0,0,0,0|0,0,2]=4 851 B8R1.52 NC1(CO)CCCC1 SC-89144 [0,2,0,0,0,0|0,0,2]=4 852 B8R1.52 NCC1(O)CCCC1 SC-84863 [0,2,0,0,0,0|0,0,2]=4 853 B8R1.18 CC1CC(=O)OC1=O SC-97577 [0,2,0,0,0,0|1,0,1]=4 854 B8R1.18 CC1OC(=O)OC1C SC-21491 [0,2,0,0,0,0|2,0,0]=4 855 B8R1.50 C=C1CCN(C)C1=O SC-48828 [0,2,0,0,0,0|1,0,1]=4 856 B8R1.50 CC1=C(O)C(=O)CC1 SC-74535 [0,2,0,0,0,0|0,0,2]=4 857 B8R1.50 CC1C(=O)CCC1=O SC-62325 [0,2,0,0,0,0|0,0,1]=3 858 B8R1.50 CN1C(=O)CCC1O SC-88414 [0,2,0,0,0,0|1,0,0]=3 859 B8R1.50 CN1CCC(N)C1=O SC-25143 [0,2,0,0,0,0|1,0,0]=3 860 B8R1.50 O=C1CCC(=O)N1Br SC-00707 [0,2,0,0,0,0|1,0,1]=4 861 B8R1.50 O=C1CCC(=O)N1Cl SC-16479 [0,2,0,0,0,0|1,0,1]=4 862 B8R1.50 O=C1CCC(=O)N1I SC-14191 [0,2,0,0,0,0|1,0,1]=4 863 B8R1.50 O=C1CCC(=O)N1O SC-11266 [0,2,0,0,0,0|1,0,1]=4 864 B8R1.51 CC1(C)C=CC(=O)C1 SC-91103 [0,2,0,0,0,0|0,0,2]=4 865 B8R1.51 CC1(C)CCC(=O)O1 SC-21203 [0,2,0,0,0,0|1,0,0]=3 866 B8R1.51 CC1(C)CNC(=O)C1 SC-70558 [0,2,0,0,0,0|1,0,0]=3 867 B8R1.51 CC1CCS(=O)(=O)O1 SC-21616 [0,2,0,0,0,0|2,0,0]=4 868 B8R1.51 NC1CCC(F)(F)C1 SC-14684 [0,2,0,0,0,0|1,0,1]=4 869 B8R1.51 NC1CCC(F)(F)C1 SC-52555 [0,2,0,0,0,0|1,0,1]=4 870 B8R1.51 NC1CCS(=O)(=O)C1 SC-43760 [0,2,0,0,0,0|1,0,0]=3 871 B8R1.19 CC1(C)CCOC1=O SC-15803 [0,2,0,0,0,0|1,0,0]=3 872 B6R1.11 CC(=O)C1CC1 SC-17503 [0,0,1,1,0,0|0,0,0]=2 873 B6R1.11 CC(O)C1CC1 SC-19615 [0,0,1,1,0,0|0,0,2]=4 874 B6R1.11 CN(C)C1CC1 SC-00873 [0,0,1,1,0,0|2,0,0]=4 875 B6R1.11 C[C@@H](N)C1CC1 SC-83564 [0,0,1,1,0,0|1,0,1]=4 876 B6R1.11 C[C@H](N)C1CC1 SC-87033 [0,0,1,1,0,0|1,0,1]=4 877 B6R1.11 N=C(N)C1CC1 SC-05436 [0,0,1,1,0,0|2,0,0]=4 878 B6R1.11 N=C(N)C1CC1 SC-12465 [0,0,1,1,0,0|2,0,0]=4 879 B6R1.11 NC(=O)C1CC1 SC-92415 [0,0,1,1,0,0|1,0,0]=3 880 B6R1.11 O=C(Cl)C1CC1 SC-19263 [0,0,1,1,0,0|1,0,0]=3 881 B6R1.11 O=C(O)C1CC1 SC-22620 [0,0,1,1,0,0|1,0,0]=3 882 B6R1.11 O=C(O)C1CO1 SC-83949 [0,0,1,1,0,0|2,0,0]=4 883 B6R1.1 C1=CCNCC1 SC-83515 [0,0,1,1,0,0|2,0,0]=4 884 B6R1.1 C1=COCCC1 SC-00342 [0,0,1,1,0,0|0,0,2]=4 885 B6R1.1 C1CCNCC1 SC-05687 [0,0,1,1,0,0|1,0,1]=4 886 B6R1.1 C1CCNNC1 SC-84334 [0,0,1,1,0,0|2,0,0]=4 887 B6R1.1 C1CCONC1 SC-82296 [0,0,1,1,0,0|1,0,1]=4 888 B6R1.1 C1CC[NH2+]CC1 SC-48018 [0,0,1,1,0,0|1,0,1]=4 889 B8R2.11 NC1C2CNCC12 SC-89870 [0,0,0,1,0,1|1,0,1]=4 890 B8R2.23 C1NCC2CC1O2 SC-51309 [0,0,0,1,0,1|0,0,2]=4 891 B8R2.23 C1NCC2CC1O2 SC-B3877 [0,0,0,1,0,1|0,0,2]=4 892 B8R2.23 C1OCC2CC1N2 SC-A2549 [0,0,0,1,0,1|1,0,1]=4 893 B8R2.34 C1CC2CC1CN2 SC-67774 [0,0,0,1,0,1|1,0,1]=4 894 B8R2.34 C1CC2CC1CN2 SC-A4189 [0,0,0,1,0,1|1,0,1]=4 895 B8R2.34 C1CC2CCC1N2 SC-70696 [0,0,0,1,0,1|1,0,1]=4 896 B4R1.1 C1CNC1 SC-20716 [1,0,0,0,1,0|1,0,0]=3 897 B4R1.2 BrC1CC1 SC-13617 [0,0,0,0,2,0|1,0,1]=4 898 B4R1.2 CC1CC1 SC-53150 [0,0,0,0,2,0|1,0,1]=4 899 B4R1.2 NC1CC1 SC-13654 [0,0,0,0,2,0|1,0,1]=4 900 B4R1.2 OC1CC1 SC-48540 [0,0,0,0,2,0|0,0,2]=4 901 B8R1.22 CC1CCNCCN1 SC-52803 [0,0,0,0,0,2|1,0,1]=4 902 B8R1.22 CN1CCCNCC1 SC-19624 [0,0,0,0,0,2|2,0,0]=4 903 B8R1.22 NC1CCCCCC1 SC-51775 [0,0,0,0,0,2|1,0,1]=4 904 B8R1.22 NC1CCCCNC1 SC-A3641 [0,0,0,0,0,2|1,0,1]=4 905 B8R1.22 NC1CCCNCC1 SC-94792 [0,0,0,0,0,2|1,0,1]=4 906 B8R1.22 O=C1C=CCCCC1 SC-99582 [0,0,0,0,0,2|0,0,0]=2 907 B8R1.22 O=C1CCCNCC1 SC-20974 [0,0,0,0,0,2|0,0,0]=2 908 B8R1.22 O=C1CCCNCC1 SC-20993 [0,0,0,0,0,2|0,0,0]=2 909 B8R1.22 O=C1CCNCCN1 SC-05951 [0,0,0,0,0,2|0,0,0]=2 910 B8R1.22 O=C1CNCCCN1 SC-21981 [0,0,0,0,0,2|0,0,0]=2