0 B7R0.1 BrCCCCCCBr CS-0015831 [0,0,0,0,0,0|2,0,0]=2 1 B7R0.1 C#CCCCCCO CS-W007441 [0,0,0,0,0,0|0,0,2]=2 2 B7R0.1 C#CCOCCOC CS-0038923 [0,0,0,0,0,0|3,0,1]=4 3 B7R0.1 C=CCCCCCBr CS-W009270 [0,0,0,0,0,0|1,0,2]=3 4 B7R0.1 C=CCCCCNC CS-0187593 [0,0,0,0,0,0|2,0,1]=3 5 B7R0.1 C=COCCCCO CS-0077087 [0,0,0,0,0,0|1,0,2]=3 6 B7R0.1 CCCCCCCBr CS-W017293 [0,0,0,0,0,0|1,0,0]=1 7 B7R0.1 CCCCCCCO CS-0152146 [0,0,0,0,0,0|0,0,0]=0 8 B7R0.1 CCCCNCCO CS-0077079 [0,0,0,0,0,0|1,0,0]=1 9 B7R0.1 CCCC\C=C\C=O CS-0185633 [0,0,0,0,0,0|0,0,4]=4 10 B7R0.1 CCCOCCCN CS-0213493 [0,0,0,0,0,0|2,0,0]=2 11 B7R0.1 CCNCCCCO CS-0206547 [0,0,0,0,0,0|1,0,0]=1 12 B7R0.1 CNCCOCCO CS-0209922 [0,0,0,0,0,0|2,0,0]=2 13 B7R0.1 COCCOCCBr CS-0116183 [0,0,0,0,0,0|3,0,0]=3 14 B7R0.1 COCCOCCI CS-0150162 [0,0,0,0,0,0|3,0,0]=3 15 B7R0.1 COCCOCCN CS-0115786 [0,0,0,0,0,0|3,0,0]=3 16 B7R0.1 COCCOCCN CS-0115787 [0,0,0,0,0,0|3,0,0]=3 17 B7R0.1 COCCOCCN CS-0115788 [0,0,0,0,0,0|3,0,0]=3 18 B7R0.1 COCCOCCN CS-0115790 [0,0,0,0,0,0|3,0,0]=3 19 B7R0.1 COCCOCCN CS-W008429 [0,0,0,0,0,0|3,0,0]=3 20 B7R0.1 COCCOCCO CS-0116122 [0,0,0,0,0,0|2,0,0]=2 21 B7R0.1 COCCOCCO CS-0644881 [0,0,0,0,0,0|2,0,0]=2 22 B7R0.1 COCCOCCO CS-0889987 [0,0,0,0,0,0|2,0,0]=2 23 B7R0.1 COCCOCCO CS-W013578 [0,0,0,0,0,0|2,0,0]=2 24 B7R0.1 COCCOCCS CS-0115760 [0,0,0,0,0,0|2,1,0]=3 25 B7R0.1 COCCOCCS CS-0115764 [0,0,0,0,0,0|2,1,0]=3 26 B7R0.1 COCCOCCS CS-0650914 [0,0,0,0,0,0|2,1,0]=3 27 B7R0.1 ClCCCCCCBr CS-W010503 [0,0,0,0,0,0|2,0,0]=2 28 B7R0.1 ClCCCCCCCl CS-W016259 [0,0,0,0,0,0|2,0,0]=2 29 B7R0.1 ClCCCCCCI CS-0059200 [0,0,0,0,0,0|2,0,0]=2 30 B7R0.1 ICCCCCCI CS-W011914 [0,0,0,0,0,0|2,0,0]=2 31 B7R0.1 N#CCCCCCBr CS-0158396 [0,0,0,0,0,0|2,0,1]=3 32 B7R0.1 N#CCCCCCN CS-0147655 [0,0,0,0,0,0|2,0,1]=3 33 B7R0.1 NCCCCCCBr CS-0158390 [0,0,0,0,0,0|2,0,0]=2 34 B7R0.1 NCCCCCCN CS-W015964 [0,0,0,0,0,0|2,0,0]=2 35 B7R0.1 NCCCCCCO CS-W007957 [0,0,0,0,0,0|1,0,0]=1 36 B7R0.1 NCCCCCCS CS-D0506 [0,0,0,0,0,0|1,1,0]=2 37 B7R0.1 NCCCNCCBr CS-W022895 [0,0,0,0,0,0|3,0,0]=3 38 B7R0.1 NCCCNCCO CS-0158337 [0,0,0,0,0,0|2,0,0]=2 39 B7R0.1 NCCCNCCS CS-7832 [0,0,0,0,0,0|2,1,0]=3 40 B7R0.1 NCCNCCCO CS-0199570 [0,0,0,0,0,0|2,0,0]=2 41 B7R0.1 NCCOCCON CS-1013820 [0,0,0,0,0,0|4,0,0]=4 42 B7R0.1 NCCOCCON CS-1038497 [0,0,0,0,0,0|4,0,0]=4 43 B7R0.1 NCCOCCON CS-1038500 [0,0,0,0,0,0|4,0,0]=4 44 B7R0.1 NCCSSCCN CS-0032055 [0,0,0,0,0,0|4,0,0]=4 45 B7R0.1 NCCSSCCN CS-0086613 [0,0,0,0,0,0|4,0,0]=4 46 B7R0.1 NCC[Se][Se]CCN CS-0158446 [0,0,0,0,0,0|4,0,0]=4 47 B7R0.1 OCCCCCCBr CS-0654104 [0,0,0,0,0,0|1,0,0]=1 48 B7R0.1 OCCCCCCBr CS-W017171 [0,0,0,0,0,0|1,0,0]=1 49 B7R0.1 OCCCCCCCl CS-B1599 [0,0,0,0,0,0|1,0,0]=1 50 B7R0.1 OCCCCCCO CS-W011221 [0,0,0,0,0,0|1,0,0]=1 51 B7R0.1 OCCSSCCO CS-0181622 [0,0,0,0,0,0|3,0,0]=3 52 B7R0.1 [N-]=[N+]=NCCCCN CS-0028502 [0,0,0,0,0,0|4,0,0]=4 53 B7R0.1 [N-]=[N+]=NCCCCN CS-0567236 [0,0,0,0,0,0|4,0,0]=4 54 B6R0.6 BrCCCCCBr CS-W019956 [1,0,0,0,0,0|2,0,0]=3 55 B6R0.6 BrCCOCCBr CS-W014174 [1,0,0,0,0,0|3,0,0]=4 56 B6R0.6 C#CCCCCCl CS-0204489 [1,0,0,0,0,0|1,0,2]=4 57 B6R0.6 C#CCCCCI CS-0088557 [1,0,0,0,0,0|1,0,2]=4 58 B6R0.6 C#CCCCCN CS-0059697 [1,0,0,0,0,0|1,0,2]=4 59 B6R0.6 C#CCCCCN CS-0106594 [1,0,0,0,0,0|1,0,2]=4 60 B6R0.6 C#CCCCCO CS-W016659 [1,0,0,0,0,0|0,0,2]=3 61 B6R0.6 C#CCOCCO CS-0086239 [1,0,0,0,0,0|1,0,2]=4 62 B6R0.6 C(CC)=CCCO CS-W009552 [1,0,0,0,0,0|0,0,2]=3 63 B6R0.6 C(CO)=CCCC CS-W016652 [1,0,0,0,0,0|0,0,2]=3 64 B6R0.6 C=C=CCCCO CS-1014365 [1,0,0,0,0,0|0,0,3]=4 65 B6R0.6 C=CCCCCBr CS-W008939 [1,0,0,0,0,0|1,0,2]=4 66 B6R0.6 C=CCCCCN CS-0210385 [1,0,0,0,0,0|1,0,2]=4 67 B6R0.6 C=CCCCCO CS-W013711 [1,0,0,0,0,0|0,0,2]=3 68 B6R0.6 C=CCOCCO CS-0157967 [1,0,0,0,0,0|1,0,2]=4 69 B6R0.6 CCC#CCCO CS-0040171 [1,0,0,0,0,0|0,0,2]=3 70 B6R0.6 CCCCCCI CS-0132388 [1,0,0,0,0,0|1,0,0]=2 71 B6R0.6 CCCCCCN CS-0196786 [1,0,0,0,0,0|1,0,0]=2 72 B6R0.6 CCCNCCC CS-0187381 [1,0,0,0,0,0|1,0,0]=2 73 B6R0.6 CCCNCCC CS-0214120 [1,0,0,0,0,0|1,0,0]=2 74 B6R0.6 CCCNCCO CS-0105782 [1,0,0,0,0,0|1,0,0]=2 75 B6R0.6 CCCOCCCl CS-0200392 [1,0,0,0,0,0|2,0,0]=3 76 B6R0.6 CCNCCCN CS-0151962 [1,0,0,0,0,0|2,0,0]=3 77 B6R0.6 CCOCCCO CS-W013685 [1,0,0,0,0,0|1,0,0]=2 78 B6R0.6 CC\C=C/CCO CS-W011323 [1,0,0,0,0,0|0,0,2]=3 79 B6R0.6 CNCCCCBr CS-0163109 [1,0,0,0,0,0|2,0,0]=3 80 B6R0.6 CNCCCCO CS-W006493 [1,0,0,0,0,0|1,0,0]=2 81 B6R0.6 COCCCCBr CS-W021313 [1,0,0,0,0,0|2,0,0]=3 82 B6R0.6 COCCCCCl CS-0039726 [1,0,0,0,0,0|2,0,0]=3 83 B6R0.6 COCCCCO CS-0150179 [1,0,0,0,0,0|1,0,0]=2 84 B6R0.6 CSCCCCO CS-0204406 [1,0,0,0,0,0|1,0,0]=2 85 B6R0.6 ClCCCCCBr CS-W016940 [1,0,0,0,0,0|2,0,0]=3 86 B6R0.6 ClCCCCCI CS-0135342 [1,0,0,0,0,0|2,0,0]=3 87 B6R0.6 ClCCNCCCl CS-W020124 [1,0,0,0,0,0|3,0,0]=4 88 B6R0.6 FCCCCCBr CS-W005161 [1,0,0,0,0,0|2,0,0]=3 89 B6R0.6 ICCCCCI CS-0041009 [1,0,0,0,0,0|2,0,0]=3 90 B6R0.6 ICCOCCI CS-W011980 [1,0,0,0,0,0|3,0,0]=4 91 B6R0.6 N#CCCCCBr CS-D1429 [1,0,0,0,0,0|2,0,1]=4 92 B6R0.6 N#CCCCCCl CS-W022361 [1,0,0,0,0,0|2,0,1]=4 93 B6R0.6 NCCCCCBr CS-0006784 [1,0,0,0,0,0|2,0,0]=3 94 B6R0.6 NCCCCCN CS-W017466 [1,0,0,0,0,0|2,0,0]=3 95 B6R0.6 NCCCCCO CS-W013687 [1,0,0,0,0,0|1,0,0]=2 96 B6R0.6 NCCNCCN CS-0498854 [1,0,0,0,0,0|3,0,0]=4 97 B6R0.6 NCCNCCO CS-W011299 [1,0,0,0,0,0|2,0,0]=3 98 B6R0.6 NCCOCCN CS-0114847 [1,0,0,0,0,0|3,0,0]=4 99 B6R0.6 NCCOCCN CS-0115750 [1,0,0,0,0,0|3,0,0]=4 100 B6R0.6 NCCOCCO CS-1013822 [1,0,0,0,0,0|2,0,0]=3 101 B6R0.6 NCCOCCO CS-1013830 [1,0,0,0,0,0|2,0,0]=3 102 B6R0.6 NCCOCCO CS-1014116 [1,0,0,0,0,0|2,0,0]=3 103 B6R0.6 NCCSCCN CS-W013570 [1,0,0,0,0,0|3,0,0]=4 104 B6R0.6 OCCCCCBr CS-0905394 [1,0,0,0,0,0|1,0,0]=2 105 B6R0.6 OCCCCCBr CS-W007393 [1,0,0,0,0,0|1,0,0]=2 106 B6R0.6 OCCCCCCl CS-0095410 [1,0,0,0,0,0|1,0,0]=2 107 B6R0.6 OCCCCCI CS-0252955 [1,0,0,0,0,0|1,0,0]=2 108 B6R0.6 OCCCCCO CS-W020635 [1,0,0,0,0,0|1,0,0]=2 109 B6R0.6 OCCNCCCl CS-0064563 [1,0,0,0,0,0|2,0,0]=3 110 B6R0.6 OCCOCCBr CS-0114928 [1,0,0,0,0,0|2,0,0]=3 111 B6R0.6 OCCOCCCl CS-0016058 [1,0,0,0,0,0|2,0,0]=3 112 B6R0.6 OCCOCCF CS-0199113 [1,0,0,0,0,0|2,0,0]=3 113 B6R0.6 OCCOCCI CS-0139452 [1,0,0,0,0,0|2,0,0]=3 114 B8R0.1 C#CCCC(=O)CCO CS-0038477 [0,1,0,0,0,0|0,0,3]=4 115 B8R0.1 CCCCC(O)CCC CS-0362569 [0,1,0,0,0,0|1,0,0]=2 116 B8R0.1 CCCCN(C)CCO CS-0132259 [0,1,0,0,0,0|1,0,0]=2 117 B8R0.1 CCOC(=O)CCCBr CS-W020133 [0,1,0,0,0,0|2,0,1]=4 118 B8R0.1 CCOC(=O)CCCI CS-0029516 [0,1,0,0,0,0|2,0,1]=4 119 B8R0.1 CCOC(=O)CCCN CS-W010794 [0,1,0,0,0,0|2,0,1]=4 120 B8R0.4 BrCCCCCCCBr CS-W010166 [0,1,0,0,0,0|1,0,0]=2 121 B8R0.4 BrCCCOCCCBr CS-0526980 [0,1,0,0,0,0|2,0,0]=3 122 B8R0.4 C#CCCCCCCBr CS-0648097 [0,1,0,0,0,0|1,0,1]=3 123 B8R0.4 C#CCCCCCCO CS-W008554 [0,1,0,0,0,0|0,0,1]=2 124 B8R0.4 C=CCCCCCCBr CS-W010733 [0,1,0,0,0,0|1,0,1]=3 125 B8R0.4 C=CCCCCCCO CS-0185603 [0,1,0,0,0,0|0,0,1]=2 126 B8R0.4 C=COCCOCCO CS-0167854 [0,1,0,0,0,0|1,0,2]=4 127 B8R0.4 CCCC=C=CCCO CS-1173689 [0,1,0,0,0,0|0,0,2]=3 128 B8R0.4 CCCCC#CCCO CS-0315148 [0,1,0,0,0,0|0,0,1]=2 129 B8R0.4 CCCCCCCC=O CS-0138976 [0,1,0,0,0,0|0,0,1]=2 130 B8R0.4 CCCCCCCCBr CS-0076039 [0,1,0,0,0,0|1,0,0]=2 131 B8R0.4 CCCCCCCCI CS-0188391 [0,1,0,0,0,0|1,0,0]=2 132 B8R0.4 CCCCCCCCN CS-0076038 [0,1,0,0,0,0|1,0,0]=2 133 B8R0.4 CCCCCCCCN CS-0179378 [0,1,0,0,0,0|1,0,0]=2 134 B8R0.4 CCCCCCCCO CS-0076037 [0,1,0,0,0,0|0,0,0]=1 135 B8R0.4 CCCCC\C=C\C=O CS-0200283 [0,1,0,0,0,0|0,0,3]=4 136 B8R0.4 CCCCC\C=C\CO CS-0152366 [0,1,0,0,0,0|0,0,1]=2 137 B8R0.4 CCCCOCCCN CS-0130475 [0,1,0,0,0,0|1,0,0]=2 138 B8R0.4 CCCCSCCCC CS-0255960 [0,1,0,0,0,0|1,0,0]=2 139 B8R0.4 COCCNCCOC CS-D1692 [0,1,0,0,0,0|2,0,0]=3 140 B8R0.4 COCCOCCOC CS-0017205 [0,1,0,0,0,0|2,0,0]=3 141 B8R0.4 COCCOCCOC CS-0099019 [0,1,0,0,0,0|2,0,0]=3 142 B8R0.4 COCOCOCOC CS-0186491 [0,1,0,0,0,0|3,0,0]=4 143 B8R0.4 ClCCCOCCCCl CS-0169240 [0,1,0,0,0,0|2,0,0]=3 144 B8R0.4 NCCCCCCCN CS-W009537 [0,1,0,0,0,0|1,0,0]=2 145 B8R0.4 NCCCCCCCO CS-0088962 [0,1,0,0,0,0|0,0,0]=1 146 B8R0.4 NCCCOCCCN CS-0207652 [0,1,0,0,0,0|2,0,0]=3 147 B8R0.4 NCCCOCCCO CS-0147757 [0,1,0,0,0,0|1,0,0]=2 148 B8R0.4 OCCCCCCCBr CS-W008425 [0,1,0,0,0,0|0,0,0]=1 149 B8R0.4 OCCCCCCCO CS-W013404 [0,1,0,0,0,0|0,0,0]=1 150 B8R0.4 OCCCNCCCO CS-0186731 [0,1,0,0,0,0|1,0,0]=2 151 B8R0.4 OCCCOCCCCl CS-0147762 [0,1,0,0,0,0|1,0,0]=2 152 B8R0.4 OCCCOCCCO CS-0131092 [0,1,0,0,0,0|1,0,0]=2 153 B8R0.4 [N-]=[N+]=NCCCCCN CS-0626851 [0,1,0,0,0,0|3,0,0]=4 154 B8R0.4 [N-]=[N+]=NCCOCCO CS-0114587 [0,1,0,0,0,0|3,0,0]=4 155 B8R0.6 C#CC(O)CCCCC CS-W011154 [0,1,0,0,0,0|1,0,1]=3 156 B8R0.6 C=CC(=O)CCCCC CS-0168504 [0,1,0,0,0,0|1,0,2]=4 157 B8R0.6 C=CC(O)CCCCC CS-W011126 [0,1,0,0,0,0|1,0,1]=3 158 B8R0.6 CCCCCC(=O)NN CS-0152328 [0,1,0,0,0,0|2,0,1]=4 159 B8R0.6 CCCCCC(O)CC CS-0152331 [0,1,0,0,0,0|1,0,0]=2 160 B8R0.6 CCCCC[C@@H](O)CC CS-0464840 [0,1,0,0,0,0|1,0,0]=2 161 B8R0.6 CCCCNC(=O)CCl CS-0116592 [0,1,0,0,0,0|2,0,1]=4 162 B8R0.6 CCCCOC(=O)CN CS-0571899 [0,1,0,0,0,0|2,0,1]=4 163 B8R0.6 CCCCOC(=O)CS CS-0297731 [0,1,0,0,0,0|1,1,1]=4 164 B8R0.6 COC(=O)CCCCBr CS-W022866 [0,1,0,0,0,0|2,0,1]=4 165 B8R0.6 COC(=O)CCCCCl CS-0098043 [0,1,0,0,0,0|2,0,1]=4 166 B8R0.6 COC(=O)CCCCN CS-0018002 [0,1,0,0,0,0|2,0,1]=4 167 B8R0.6 COC(=O)CCCCO CS-0021769 [0,1,0,0,0,0|1,0,1]=3 168 B8R0.6 O=C(CCCCO)O[Na] CS-0047732 [0,1,0,0,0,0|2,0,1]=4 169 B8R0.7 C#CCCCCC(=O)O CS-0020150 [0,1,0,0,0,0|0,0,3]=4 170 B8R0.7 C=CCCCCB(O)O CS-0130748 [0,1,0,0,0,0|1,0,2]=4 171 B8R0.7 C=CCCCCC(=O)O CS-0097711 [0,1,0,0,0,0|0,0,3]=4 172 B8R0.7 CC(=O)NCCCCN CS-0453679 [0,1,0,0,0,0|2,0,1]=4 173 B8R0.7 CC(=O)OCCCCCl CS-W010967 [0,1,0,0,0,0|2,0,1]=4 174 B8R0.7 CC(C)CCCCCO CS-0210352 [0,1,0,0,0,0|0,0,0]=1 175 B8R0.7 CC(C)CCCCCO CS-0641181 [0,1,0,0,0,0|0,0,0]=1 176 B8R0.7 CC(C)NCCCCO CS-M3069 [0,1,0,0,0,0|1,0,0]=2 177 B8R0.7 CCCCCCB(O)O CS-W000880 [0,1,0,0,0,0|1,0,0]=2 178 B8R0.7 CCCCCCC(C)=O CS-W011125 [0,1,0,0,0,0|0,0,2]=3 179 B8R0.7 CCCCCCC(C)Br CS-0182749 [0,1,0,0,0,0|1,0,0]=2 180 B8R0.7 CCCCCCC(C)O CS-W011107 [0,1,0,0,0,0|0,0,0]=1 181 B8R0.7 CCCCCC[C@@H](C)N CS-0204339 [0,1,0,0,0,0|1,0,0]=2 182 B8R0.7 CCCCCC[C@@H](C)O CS-0140572 [0,1,0,0,0,0|0,0,0]=1 183 B8R0.7 CCCCCC[C@H](C)O CS-0140577 [0,1,0,0,0,0|0,0,0]=1 184 B8R0.7 CCCCOCC(=O)O CS-0152080 [0,1,0,0,0,0|1,0,1]=3 185 B8R0.7 CCCC\C=C\B(O)O CS-0094491 [0,1,0,0,0,0|1,0,2]=4 186 B8R0.7 CN(C)CCCCCN CS-0044781 [0,1,0,0,0,0|2,0,0]=3 187 B8R0.7 CN(C)CCOCCO CS-W011078 [0,1,0,0,0,0|2,0,0]=3 188 B8R0.7 COCCOCC(=O)O CS-0084611 [0,1,0,0,0,0|2,0,1]=4 189 B8R0.7 COCCOCC(=O)O CS-0527879 [0,1,0,0,0,0|2,0,1]=4 190 B8R0.7 COCCOCC(=O)O CS-0527882 [0,1,0,0,0,0|2,0,1]=4 191 B8R0.7 FC(F)CCCCCBr CS-0639269 [0,1,0,0,0,0|2,0,0]=3 192 B8R0.7 NC(=O)CCCCCBr CS-0138401 [0,1,0,0,0,0|1,0,2]=4 193 B8R0.7 NCCCCCC(=O)O CS-2204 [0,1,0,0,0,0|1,0,1]=3 194 B8R0.7 NCCCCCC(N)=O CS-0137981 [0,1,0,0,0,0|1,0,2]=4 195 B8R0.7 O=C(O)CCCCCBr CS-W007559 [0,1,0,0,0,0|1,0,1]=3 196 B8R0.7 O=C(O)CCCCCCl CS-W018132 [0,1,0,0,0,0|1,0,1]=3 197 B8R0.7 O=C(O)CCCCCO CS-0158392 [0,1,0,0,0,0|1,0,1]=3 198 B8R0.7 O=C(O)CCCCC[O-] CS-0160664 [0,1,0,0,0,0|1,0,1]=3 199 B8R0.7 O=C(O)CCOCCBr CS-0107735 [0,1,0,0,0,0|2,0,1]=4 200 B8R0.7 O=C(O)CCOCCO CS-0066172 [0,1,0,0,0,0|2,0,1]=4 201 B8R0.7 O=C(O)CCOCCO CS-0528773 [0,1,0,0,0,0|2,0,1]=4 202 B8R0.7 O=C([O-])CCCCCO CS-0158395 [0,1,0,0,0,0|1,0,1]=3 203 B8R1.2 BrCC1CCCCC1 CS-W007517 [0,0,0,1,0,0|1,0,0]=2 204 B8R1.2 BrCC1CCCCO1 CS-0214963 [0,0,0,1,0,0|1,0,0]=2 205 B8R1.2 BrCC1CCNCC1 CS-W001304 [0,0,0,1,0,0|2,0,0]=3 206 B8R1.2 BrCC1CCOCC1 CS-W003105 [0,0,0,1,0,0|2,0,0]=3 207 B8R1.2 C#CC1CCCCC1 CS-W022720 [0,0,0,1,0,0|1,0,1]=3 208 B8R1.2 C#CC1CCCNC1 CS-0040070 [0,0,0,1,0,0|2,0,1]=4 209 B8R1.2 C#CC1CCNCC1 CS-0050866 [0,0,0,1,0,0|2,0,1]=4 210 B8R1.2 C#CC1CCOCC1 CS-0050867 [0,0,0,1,0,0|2,0,1]=4 211 B8R1.2 CCC1CCNCC1 CS-0147296 [0,0,0,1,0,0|2,0,0]=3 212 B8R1.2 CCC1CNCCN1 CS-D0270 [0,0,0,1,0,0|2,0,0]=3 213 B8R1.2 CCC1CNCCO1 CS-0080681 [0,0,0,1,0,0|1,0,0]=2 214 B8R1.2 CCC1COCCN1 CS-0059261 [0,0,0,1,0,0|2,0,0]=3 215 B8R1.2 CC[C@@H]1CNCCO1 CS-0096526 [0,0,0,1,0,0|1,0,0]=2 216 B8R1.2 CC[C@@H]1COCCN1 CS-0146937 [0,0,0,1,0,0|2,0,0]=3 217 B8R1.2 CC[C@@H]1COCCN1 CS-0146943 [0,0,0,1,0,0|2,0,0]=3 218 B8R1.2 CC[C@H]1CNCCN1 CS-M0319 [0,0,0,1,0,0|2,0,0]=3 219 B8R1.2 CC[C@H]1CNCCO1 CS-0100795 [0,0,0,1,0,0|1,0,0]=2 220 B8R1.2 CC[C@H]1COCCN1 CS-0146945 [0,0,0,1,0,0|2,0,0]=3 221 B8R1.2 CNC1CCCNC1 CS-W016863 [0,0,0,1,0,0|3,0,0]=4 222 B8R1.2 CNC1CCNCC1 CS-0048783 [0,0,0,1,0,0|3,0,0]=4 223 B8R1.2 CNC1CCOCC1 CS-D1570 [0,0,0,1,0,0|3,0,0]=4 224 B8R1.2 COC1=NCCCC1 CS-0150206 [0,0,0,1,0,0|2,0,1]=4 225 B8R1.2 COC1CCCCO1 CS-0197358 [0,0,0,1,0,0|1,0,0]=2 226 B8R1.2 COC1CCCNC1 CS-0051284 [0,0,0,1,0,0|3,0,0]=4 227 B8R1.2 COC1CCCNC1 CS-0150202 [0,0,0,1,0,0|3,0,0]=4 228 B8R1.2 COC1CCNCC1 CS-0040128 [0,0,0,1,0,0|3,0,0]=4 229 B8R1.2 COC1CCNCC1 CS-W005038 [0,0,0,1,0,0|3,0,0]=4 230 B8R1.2 CO[C@@H]1CCCNC1 CS-0053772 [0,0,0,1,0,0|3,0,0]=4 231 B8R1.2 CO[C@H]1CCCNC1 CS-0053262 [0,0,0,1,0,0|3,0,0]=4 232 B8R1.2 CSC1CCNCC1 CS-0051141 [0,0,0,1,0,0|3,0,0]=4 233 B8R1.2 ClCC1CCNCC1 CS-0051167 [0,0,0,1,0,0|2,0,0]=3 234 B8R1.2 ClCC1CCOCC1 CS-0069602 [0,0,0,1,0,0|2,0,0]=3 235 B8R1.2 ClCC1CNCCO1 CS-0060823 [0,0,0,1,0,0|2,0,0]=3 236 B8R1.2 FCC1CCCNC1 CS-W001354 [0,0,0,1,0,0|2,0,0]=3 237 B8R1.2 ICC1CCCCC1 CS-0155327 [0,0,0,1,0,0|1,0,0]=2 238 B8R1.2 ICC1CCCCO1 CS-0058218 [0,0,0,1,0,0|1,0,0]=2 239 B8R1.2 ICC1CCOCC1 CS-W001910 [0,0,0,1,0,0|2,0,0]=3 240 B8R1.2 N#CC1CCCCC1 CS-W019522 [0,0,0,1,0,0|1,0,1]=3 241 B8R1.2 N#CC1CCCCN1 CS-0187605 [0,0,0,1,0,0|2,0,1]=4 242 B8R1.2 N#CC1CCCNC1 CS-0315616 [0,0,0,1,0,0|2,0,1]=4 243 B8R1.2 N#CC1CCNCC1 CS-0007612 [0,0,0,1,0,0|2,0,1]=4 244 B8R1.2 N#CC1CCNCC1 CS-0019876 [0,0,0,1,0,0|2,0,1]=4 245 B8R1.2 N#CC1CCOCC1 CS-W019661 [0,0,0,1,0,0|2,0,1]=4 246 B8R1.2 N#CC1CNCCO1 CS-W005833 [0,0,0,1,0,0|2,0,1]=4 247 B8R1.2 N#C[C@@H]1CCCNC1 CS-0053312 [0,0,0,1,0,0|2,0,1]=4 248 B8R1.2 N#C[C@@H]1CCCNC1 CS-0060758 [0,0,0,1,0,0|2,0,1]=4 249 B8R1.2 N#C[C@@H]1CNCCO1 CS-0103653 [0,0,0,1,0,0|2,0,1]=4 250 B8R1.2 NCC1CCCCN1 CS-W011240 [0,0,0,1,0,0|2,0,0]=3 251 B8R1.2 NCC1CCCNC1 CS-0028231 [0,0,0,1,0,0|2,0,0]=3 252 B8R1.2 NCC1CCCOC1 CS-0048770 [0,0,0,1,0,0|2,0,0]=3 253 B8R1.2 NCC1CCNCC1 CS-W011241 [0,0,0,1,0,0|2,0,0]=3 254 B8R1.2 NCC1CCOCC1 CS-0036420 [0,0,0,1,0,0|2,0,0]=3 255 B8R1.2 NCC1CCOCC1 CS-W008973 [0,0,0,1,0,0|2,0,0]=3 256 B8R1.2 NCC1CCSCC1 CS-0045666 [0,0,0,1,0,0|2,0,0]=3 257 B8R1.2 NCC1CNCCO1 CS-0046184 [0,0,0,1,0,0|2,0,0]=3 258 B8R1.2 NCC1COCCO1 CS-0055041 [0,0,0,1,0,0|2,0,0]=3 259 B8R1.2 NC[C@@H]1COCCO1 CS-0037059 [0,0,0,1,0,0|2,0,0]=3 260 B8R1.2 NC[C@H]1COCCO1 CS-0053454 [0,0,0,1,0,0|2,0,0]=3 261 B8R1.2 NNC1CCCCC1 CS-W007595 [0,0,0,1,0,0|2,0,0]=3 262 B8R1.2 NNC1CCNCC1 CS-0109590 [0,0,0,1,0,0|3,0,0]=4 263 B8R1.2 NNC1CCOCC1 CS-0037407 [0,0,0,1,0,0|3,0,0]=4 264 B8R1.2 NNC1CCOCC1 CS-0047579 [0,0,0,1,0,0|3,0,0]=4 265 B8R1.2 NNC1CCOCC1 CS-B0289 [0,0,0,1,0,0|3,0,0]=4 266 B8R1.2 NOC1CCCCO1 CS-W007325 [0,0,0,1,0,0|2,0,0]=3 267 B8R1.2 O=CC1CCNCC1 CS-0171609 [0,0,0,1,0,0|1,0,2]=4 268 B8R1.2 O=CC1CCOCC1 CS-D1228 [0,0,0,1,0,0|1,0,2]=4 269 B8R1.2 O=CC1CCSCC1 CS-0199595 [0,0,0,1,0,0|1,0,2]=4 270 B8R1.2 O=CN1CCCCC1 CS-W016610 [0,0,0,1,0,0|1,0,2]=4 271 B8R1.2 OCC1CC=CCC1 CS-W013655 [0,0,0,1,0,0|0,0,2]=3 272 B8R1.2 OCC1CCC=CO1 CS-0020174 [0,0,0,1,0,0|1,0,2]=4 273 B8R1.2 OCC1CCCCC1 CS-W011242 [0,0,0,1,0,0|0,0,0]=1 274 B8R1.2 OCC1CCCCN1 CS-W013620 [0,0,0,1,0,0|1,0,0]=2 275 B8R1.2 OCC1CCCCO1 CS-0034490 [0,0,0,1,0,0|1,0,0]=2 276 B8R1.2 OCC1CCCNC1 CS-W001981 [0,0,0,1,0,0|1,0,0]=2 277 B8R1.2 OCC1CCCOC1 CS-D0478 [0,0,0,1,0,0|1,0,0]=2 278 B8R1.2 OCC1CCNCC1 CS-0185406 [0,0,0,1,0,0|1,0,0]=2 279 B8R1.2 OCC1CCNCC1 CS-W002476 [0,0,0,1,0,0|1,0,0]=2 280 B8R1.2 OCC1CCOCC1 CS-D1227 [0,0,0,1,0,0|1,0,0]=2 281 B8R1.2 OCC1CCSCC1 CS-0053969 [0,0,0,1,0,0|1,0,0]=2 282 B8R1.2 OCC1CNCCN1 CS-0146587 [0,0,0,1,0,0|2,0,0]=3 283 B8R1.2 OCC1CNCCO1 CS-0106282 [0,0,0,1,0,0|2,0,0]=3 284 B8R1.2 OCC1CNCCO1 CS-W022892 [0,0,0,1,0,0|2,0,0]=3 285 B8R1.2 OCC1COCCN1 CS-0053095 [0,0,0,1,0,0|2,0,0]=3 286 B8R1.2 OCC1COCCN1 CS-0104915 [0,0,0,1,0,0|2,0,0]=3 287 B8R1.2 OCC1COCCO1 CS-0130467 [0,0,0,1,0,0|2,0,0]=3 288 B8R1.2 OC[C@@H]1CCCCN1 CS-W001568 [0,0,0,1,0,0|1,0,0]=2 289 B8R1.2 OC[C@@H]1CCCNC1 CS-0030374 [0,0,0,1,0,0|1,0,0]=2 290 B8R1.2 OC[C@@H]1CCCNC1 CS-W018674 [0,0,0,1,0,0|1,0,0]=2 291 B8R1.2 OC[C@@H]1CNCCN1 CS-0146586 [0,0,0,1,0,0|2,0,0]=3 292 B8R1.2 OC[C@@H]1CNCCO1 CS-W003855 [0,0,0,1,0,0|2,0,0]=3 293 B8R1.2 OC[C@@H]1COCCN1 CS-0034507 [0,0,0,1,0,0|2,0,0]=3 294 B8R1.2 OC[C@@H]1COCCN1 CS-W018991 [0,0,0,1,0,0|2,0,0]=3 295 B8R1.2 OC[C@@H]1COCCO1 CS-0041581 [0,0,0,1,0,0|2,0,0]=3 296 B8R1.2 OC[C@H]1CCCCN1 CS-W018567 [0,0,0,1,0,0|1,0,0]=2 297 B8R1.2 OC[C@H]1CCCNC1 CS-0133006 [0,0,0,1,0,0|1,0,0]=2 298 B8R1.2 OC[C@H]1CCCNC1 CS-W019674 [0,0,0,1,0,0|1,0,0]=2 299 B8R1.2 OC[C@H]1CNCCN1 CS-0042552 [0,0,0,1,0,0|2,0,0]=3 300 B8R1.2 OC[C@H]1CNCCN1 CS-0106317 [0,0,0,1,0,0|2,0,0]=3 301 B8R1.2 OC[C@H]1CNCCO1 CS-0108806 [0,0,0,1,0,0|2,0,0]=3 302 B8R1.2 OC[C@H]1CNCCO1 CS-W003761 [0,0,0,1,0,0|2,0,0]=3 303 B8R1.2 OC[C@H]1COCCN1 CS-0031401 [0,0,0,1,0,0|2,0,0]=3 304 B8R1.2 OC[C@H]1COCCN1 CS-W006711 [0,0,0,1,0,0|2,0,0]=3 305 B8R1.2 OC[C@H]1COCCO1 CS-0102180 [0,0,0,1,0,0|2,0,0]=3 306 B8R1.2 ON=C1CCOCC1 CS-0045844 [0,0,0,1,0,0|2,0,1]=4 307 B8R1.2 ON=C1CCSCC1 CS-0045803 [0,0,0,1,0,0|2,0,1]=4 308 B8R1.2 ONC1CCCCC1 CS-0155321 [0,0,0,1,0,0|1,0,0]=2 309 B8R1.5 CC1CCCCC1N CS-W013646 [0,0,0,1,0,0|1,0,0]=2 310 B8R1.5 CC1CCCNC1=O CS-0186670 [0,0,0,1,0,0|1,0,2]=4 311 B8R1.5 CC1CNCCC1=O CS-D0046 [0,0,0,1,0,0|1,0,2]=4 312 B8R1.5 CC1CNCCC1=O CS-D0300 [0,0,0,1,0,0|1,0,2]=4 313 B8R1.5 CC1CNCCC1O CS-0051241 [0,0,0,1,0,0|1,0,0]=2 314 B8R1.5 CC1CNCCN1C CS-W005051 [0,0,0,1,0,0|3,0,0]=4 315 B8R1.5 CC1COCCC1=O CS-W003860 [0,0,0,1,0,0|1,0,2]=4 316 B8R1.5 C[C@@H]1CCCC[C@@H]1N CS-0158236 [0,0,0,1,0,0|1,0,0]=2 317 B8R1.5 C[C@@H]1CNCCN1C CS-0006864 [0,0,0,1,0,0|3,0,0]=4 318 B8R1.5 C[C@@H]1CNCCN1C CS-0053508 [0,0,0,1,0,0|3,0,0]=4 319 B8R1.5 C[C@@H]1CNCC[C@H]1O CS-0051211 [0,0,0,1,0,0|1,0,0]=2 320 B8R1.5 C[C@H]1CCCC[C@H]1N CS-0162390 [0,0,0,1,0,0|1,0,0]=2 321 B8R1.5 C[C@H]1CNCCN1C CS-0006863 [0,0,0,1,0,0|3,0,0]=4 322 B8R1.5 C[C@H]1CNCCN1C CS-0053455 [0,0,0,1,0,0|3,0,0]=4 323 B8R1.5 Cl[C@@H]1CCCC[C@H]1Cl CS-0455908 [0,0,0,1,0,0|2,0,0]=3 324 B8R1.5 NC1CCCCC1=O CS-0099232 [0,0,0,1,0,0|1,0,2]=4 325 B8R1.5 NC1CCCCC1N CS-0514846 [0,0,0,1,0,0|2,0,0]=3 326 B8R1.5 NC1CCCCC1O CS-0128497 [0,0,0,1,0,0|1,0,0]=2 327 B8R1.5 NC1CCCCC1O CS-0330487 [0,0,0,1,0,0|1,0,0]=2 328 B8R1.5 NC1CCCN=C1O CS-W005854 [0,0,0,1,0,0|2,0,1]=4 329 B8R1.5 N[C@@H]1CCCC[C@@H]1O CS-W008418 [0,0,0,1,0,0|1,0,0]=2 330 B8R1.5 N[C@@H]1CCCC[C@H]1F CS-0038959 [0,0,0,1,0,0|2,0,0]=3 331 B8R1.5 N[C@@H]1CCCC[C@H]1N CS-0019667 [0,0,0,1,0,0|2,0,0]=3 332 B8R1.5 N[C@@H]1CCCC[C@H]1O CS-0062471 [0,0,0,1,0,0|1,0,0]=2 333 B8R1.5 N[C@@H]1CCCC[C@H]1O CS-0096323 [0,0,0,1,0,0|1,0,0]=2 334 B8R1.5 N[C@@H]1CCCC[C@H]1O CS-W003455 [0,0,0,1,0,0|1,0,0]=2 335 B8R1.5 N[C@@H]1CCCC[C@H]1O CS-W005443 [0,0,0,1,0,0|1,0,0]=2 336 B8R1.5 N[C@@H]1CCOC[C@@H]1F CS-0049705 [0,0,0,1,0,0|3,0,0]=4 337 B8R1.5 N[C@@H]1CCOC[C@@H]1O CS-0049677 [0,0,0,1,0,0|2,0,0]=3 338 B8R1.5 N[C@@H]1CCOC[C@H]1O CS-0053238 [0,0,0,1,0,0|2,0,0]=3 339 B8R1.5 N[C@@H]1COCC[C@H]1O CS-0053305 [0,0,0,1,0,0|2,0,0]=3 340 B8R1.5 N[C@H]1CCCC[C@@H]1O CS-D0607 [0,0,0,1,0,0|1,0,0]=2 341 B8R1.5 N[C@H]1CCCC[C@@H]1O CS-W019691 [0,0,0,1,0,0|1,0,0]=2 342 B8R1.5 N[C@H]1CCCC[C@H]1N CS-M3552 [0,0,0,1,0,0|2,0,0]=3 343 B8R1.5 N[C@H]1CCCC[C@H]1O CS-0134767 [0,0,0,1,0,0|1,0,0]=2 344 B8R1.5 N[C@H]1CCCC[C@H]1O CS-W008152 [0,0,0,1,0,0|1,0,0]=2 345 B8R1.5 N[C@H]1CCOC[C@@H]1F CS-0047782 [0,0,0,1,0,0|3,0,0]=4 346 B8R1.5 N[C@H]1CCOC[C@@H]1O CS-0029596 [0,0,0,1,0,0|2,0,0]=3 347 B8R1.5 O=C1CCCCC1Cl CS-W013402 [0,0,0,1,0,0|1,0,2]=4 348 B8R1.5 O=C1CCCCC1O CS-0262973 [0,0,0,1,0,0|1,0,1]=3 349 B8R1.5 O=C1NCCCC1O CS-W008630 [0,0,0,1,0,0|2,0,1]=4 350 B8R1.5 OC1CCCCC1Cl CS-W016535 [0,0,0,1,0,0|1,0,0]=2 351 B8R1.5 OC1CCCCC1O CS-0155355 [0,0,0,1,0,0|1,0,0]=2 352 B8R1.5 O[C@@H]1CCCC[C@H]1O CS-W011230 [0,0,0,1,0,0|1,0,0]=2 353 B8R1.5 O[C@@H]1CNCC[C@H]1F CS-0053301 [0,0,0,1,0,0|2,0,0]=3 354 B8R1.5 O[C@@H]1CSSC[C@H]1O CS-0157913 [0,0,0,1,0,0|3,0,0]=4 355 B8R1.5 O[C@H]1CCCC[C@H]1O CS-0059289 [0,0,0,1,0,0|1,0,0]=2 356 B8R1.5 O[C@H]1CCNC[C@H]1F CS-0058642 [0,0,0,1,0,0|2,0,0]=3 357 B8R1.5 O[C@H]1CNCC[C@H]1O CS-0049724 [0,0,0,1,0,0|2,0,0]=3 358 B8R1.8 BrCCC1OCCO1 CS-W019935 [0,0,0,1,0,0|2,0,0]=3 359 B8R1.8 BrCCN1CCCC1 CS-0040578 [0,0,0,1,0,0|2,0,0]=3 360 B8R1.8 C#CCN1CCCC1 CS-0058395 [0,0,0,1,0,0|2,0,1]=4 361 B8R1.8 C#CCN1CCCC1 CS-W005949 [0,0,0,1,0,0|2,0,1]=4 362 B8R1.8 CCCC1=NCCN1 CS-0119918 [0,0,0,1,0,0|2,0,1]=4 363 B8R1.8 CCO[C@@H]1CCNC1 CS-0053329 [0,0,0,1,0,0|3,0,0]=4 364 B8R1.8 CNCC1CCCN1 CS-0162490 [0,0,0,1,0,0|2,0,0]=3 365 B8R1.8 CNCC1CCOC1 CS-0048865 [0,0,0,1,0,0|3,0,0]=4 366 B8R1.8 CNC[C@@H]1CCCN1 CS-0162015 [0,0,0,1,0,0|2,0,0]=3 367 B8R1.8 COCC1CCNC1 CS-0058668 [0,0,0,1,0,0|3,0,0]=4 368 B8R1.8 COC[C@@H]1CCCN1 CS-W002057 [0,0,0,1,0,0|2,0,0]=3 369 B8R1.8 COC[C@H]1CCCN1 CS-W002305 [0,0,0,1,0,0|2,0,0]=3 370 B8R1.8 ClCCN1CCCC1 CS-D1148 [0,0,0,1,0,0|2,0,0]=3 371 B8R1.8 N#CCC1CCCC1 CS-0060786 [0,0,0,1,0,0|1,0,1]=3 372 B8R1.8 N#CCN1CCCC1 CS-0155280 [0,0,0,1,0,0|2,0,1]=4 373 B8R1.8 N#CCN1CCCC1 CS-0155281 [0,0,0,1,0,0|2,0,1]=4 374 B8R1.8 NCCC1CCCC1 CS-W006125 [0,0,0,1,0,0|1,0,0]=2 375 B8R1.8 NCCN1CCCC1 CS-D1372 [0,0,0,1,0,0|2,0,0]=3 376 B8R1.8 OCCC1CCCC1 CS-0055010 [0,0,0,1,0,0|0,0,0]=1 377 B8R1.8 OCCC1CCCO1 CS-0451231 [0,0,0,1,0,0|1,0,0]=2 378 B8R1.8 OCCC1CCOC1 CS-0240119 [0,0,0,1,0,0|1,0,0]=2 379 B8R1.8 OCCN1CCOC1 CS-0374348 [0,0,0,1,0,0|2,0,0]=3 380 B8R1.8 OCC[C@H]1CCCN1 CS-0572825 [0,0,0,1,0,0|1,0,0]=2 381 B8R1.11 CCC1CCCC1=O CS-0152470 [0,0,0,1,0,0|0,0,2]=3 382 B8R1.11 CCN1CCCC1=O CS-W013650 [0,0,0,1,0,0|1,0,2]=4 383 B8R1.11 CN1CCCC1CN CS-0128646 [0,0,0,1,0,0|2,0,0]=3 384 B8R1.11 CN1CCCC1CO CS-W019511 [0,0,0,1,0,0|1,0,0]=2 385 B8R1.11 CN1CCC[C@@H]1CN CS-0053069 [0,0,0,1,0,0|2,0,0]=3 386 B8R1.11 CN1CCC[C@@H]1CO CS-W003381 [0,0,0,1,0,0|1,0,0]=2 387 B8R1.11 CN1CCC[C@H]1CBr CS-0112933 [0,0,0,1,0,0|2,0,0]=3 388 B8R1.11 CN1CCC[C@H]1CN CS-0053063 [0,0,0,1,0,0|2,0,0]=3 389 B8R1.11 CN1CCC[C@H]1CN CS-0128648 [0,0,0,1,0,0|2,0,0]=3 390 B8R1.11 CN1CCC[C@H]1CO CS-0030792 [0,0,0,1,0,0|1,0,0]=2 391 B8R1.11 CO[C@@H]1CNC[C@H]1O CS-0047754 [0,0,0,1,0,0|2,0,0]=3 392 B8R1.11 C[C@H]1CNC[C@@H]1CO CS-0172749 [0,0,0,1,0,0|1,0,0]=2 393 B8R1.11 N#C[C@@H]1CCC[C@H]1O CS-0160316 [0,0,0,1,0,0|1,0,1]=3 394 B8R1.11 O=C1CCCC1CO CS-0136671 [0,0,0,1,0,0|1,0,1]=3 395 B8R1.11 O=C1NCCC1CO CS-0051681 [0,0,0,1,0,0|2,0,1]=4 396 B8R1.11 OC[C@H]1OCC[C@@H]1O CS-0089202 [0,0,0,1,0,0|2,0,0]=3 397 B8R1.22 BrC1=CCCCCC1 CS-0448697 [0,0,0,1,0,0|1,0,2]=4 398 B8R1.22 BrC1CCCCCC1 CS-0146614 [0,0,0,1,0,0|1,0,0]=2 399 B8R1.22 C=C1OCCCCO1 CS-W006464 [0,0,0,1,0,0|1,0,2]=4 400 B8R1.22 CC1CCCNCC1 CS-0199646 [0,0,0,1,0,0|2,0,0]=3 401 B8R1.22 CN1CCCNCC1 CS-W013631 [0,0,0,1,0,0|3,0,0]=4 402 B8R1.22 ClC1CCCCCC1 CS-0155300 [0,0,0,1,0,0|1,0,0]=2 403 B8R1.22 FC1CCCCNC1 CS-0308682 [0,0,0,1,0,0|2,0,0]=3 404 B8R1.22 NC1CCCCCC1 CS-0071927 [0,0,0,1,0,0|1,0,0]=2 405 B8R1.22 NC1CCCCNC1 CS-W002928 [0,0,0,1,0,0|2,0,0]=3 406 B8R1.22 NC1CCCNCC1 CS-0271304 [0,0,0,1,0,0|2,0,0]=3 407 B8R1.22 N[C@@H]1CCCCNC1 CS-M3616 [0,0,0,1,0,0|2,0,0]=3 408 B8R1.22 N[C@H]1CCCCNC1 CS-0147270 [0,0,0,1,0,0|2,0,0]=3 409 B8R1.22 O=C1CCCCCN1 CS-W011258 [0,0,0,1,0,0|1,0,2]=4 410 B8R1.22 O=C1CCCCNC1 CS-0155246 [0,0,0,1,0,0|1,0,2]=4 411 B8R1.22 O=C1CCCNCC1 CS-W001845 [0,0,0,1,0,0|1,0,2]=4 412 B8R1.22 O=C1OCCCCO1 CS-0665438 [0,0,0,1,0,0|2,0,1]=4 413 B8R1.22 OC1=NCCNCC1 CS-W011246 [0,0,0,1,0,0|2,0,1]=4 414 B8R1.22 OC1CCCCCC1 CS-W013633 [0,0,0,1,0,0|0,0,0]=1 415 B8R1.22 OC1CCCCNC1 CS-0475252 [0,0,0,1,0,0|1,0,0]=2 416 B8R1.22 OC1CCCNCC1 CS-0038201 [0,0,0,1,0,0|1,0,0]=2 417 B8R1.22 O[C@@H]1CNCCOC1 CS-0311689 [0,0,0,1,0,0|2,0,0]=3 418 B8R1.22 O[C@H]1CNCCOC1 CS-0340560 [0,0,0,1,0,0|2,0,0]=3 419 B8R1.22 O[C@H]1CNCCOC1 CS-0641374 [0,0,0,1,0,0|2,0,0]=3 420 B8R1.36 C#CCOCC1CO1 CS-0199006 [0,0,0,1,0,0|1,0,2]=4 421 B8R1.36 CCCCCC1CO1 CS-0205209 [0,0,0,1,0,0|0,0,0]=1 422 B8R1.36 N#CCCNC1CC1 CS-0247670 [0,0,0,1,0,0|2,0,1]=4 423 B8R1.49 C1=CCCCCCC1 CS-0035172 [0,0,0,1,0,0|1,0,1]=3 424 B8R1.49 C1CCCNCCC1 CS-0204387 [0,0,0,1,0,0|1,0,0]=2 425 B5R0.2 BrCCCCBr CS-W020631 [2,0,0,0,0,0|2,0,0]=4 426 B5R0.2 C#CCCCO CS-W011358 [2,0,0,0,0,0|0,0,2]=4 427 B5R0.2 CCC#CCO CS-0143646 [2,0,0,0,0,0|0,0,2]=4 428 B5R0.2 CCCCON CS-0106180 [2,0,0,0,0,0|2,0,0]=4 429 B5R0.2 CCNCCO CS-0076051 [2,0,0,0,0,0|1,0,0]=3 430 B5R0.2 CCSCCN CS-0663845 [2,0,0,0,0,0|2,0,0]=4 431 B5R0.2 CNCCCCl CS-0150991 [2,0,0,0,0,0|2,0,0]=4 432 B5R0.2 CNCCCO CS-W007469 [2,0,0,0,0,0|1,0,0]=3 433 B5R0.2 COCCCBr CS-W010945 [2,0,0,0,0,0|2,0,0]=4 434 B5R0.2 CSCCCO CS-0015993 [2,0,0,0,0,0|1,0,0]=3 435 B5R0.2 C\C=C\CCO CS-0162245 [2,0,0,0,0,0|0,0,2]=4 436 B5R0.2 ClCCCCBr CS-W017647 [2,0,0,0,0,0|2,0,0]=4 437 B5R0.2 ClCCCCI CS-W019348 [2,0,0,0,0,0|2,0,0]=4 438 B5R0.2 FCCCCBr CS-W018025 [2,0,0,0,0,0|2,0,0]=4 439 B5R0.2 ICCCCI CS-W004871 [2,0,0,0,0,0|2,0,0]=4 440 B5R0.2 NCCCCBr CS-W005399 [2,0,0,0,0,0|2,0,0]=4 441 B5R0.2 NCCCCCl CS-0158355 [2,0,0,0,0,0|2,0,0]=4 442 B5R0.2 NCCCCO CS-W002041 [2,0,0,0,0,0|1,0,0]=3 443 B5R0.2 OCCCCBr CS-W000344 [2,0,0,0,0,0|1,0,0]=3 444 B5R0.2 OCCCCCl CS-0022417 [2,0,0,0,0,0|1,0,0]=3 445 B5R0.2 OCCCCF CS-0116811 [2,0,0,0,0,0|1,0,0]=3 446 B5R0.2 OCCNCO CS-0203827 [2,0,0,0,0,0|2,0,0]=4 447 B7R0.3 C#CC(O)CCCC CS-W011267 [1,1,0,0,0,0|0,0,2]=4 448 B7R0.3 CCCCC(O)CO CS-W013596 [1,1,0,0,0,0|0,0,0]=2 449 B7R0.3 CCCC[C@@H](N)CO CS-0089933 [1,1,0,0,0,0|0,0,0]=2 450 B7R0.3 CCCC[C@@H](N)CO CS-0162184 [1,1,0,0,0,0|0,0,0]=2 451 B7R0.3 CCOCC(O)CO CS-0151429 [1,1,0,0,0,0|1,0,0]=3 452 B7R0.3 CSCC[C@H](N)CO CS-0020145 [1,1,0,0,0,0|1,0,0]=3 453 B7R0.3 C[C@@H](CN)CCCO CS-0368510 [1,1,0,0,0,0|1,0,0]=3 454 B7R0.4 CC(=O)CCCCCl CS-W013363 [1,1,0,0,0,0|1,0,1]=4 455 B7R0.4 CC(C)CCCCBr CS-0154231 [1,1,0,0,0,0|1,0,0]=3 456 B7R0.4 CC(C)CCCCO CS-W011227 [1,1,0,0,0,0|0,0,0]=2 457 B7R0.4 CC(O)CCCCO CS-0572924 [1,1,0,0,0,0|0,0,0]=2 458 B7R0.4 CC(O)CSCCO CS-0159777 [1,1,0,0,0,0|1,0,0]=3 459 B7R0.4 CCCCCB(O)O CS-W018820 [1,1,0,0,0,0|1,0,0]=3 460 B7R0.4 CCCCCC(C)O CS-W016595 [1,1,0,0,0,0|0,0,0]=2 461 B7R0.4 CCCCC[C@@H](C)O CS-0152365 [1,1,0,0,0,0|0,0,0]=2 462 B7R0.4 CCCCC[C@H](C)O CS-0179417 [1,1,0,0,0,0|0,0,0]=2 463 B7R0.4 CCCNCC(=O)O CS-0250530 [1,1,0,0,0,0|1,0,1]=4 464 B7R0.4 CCCOCC(=O)O CS-0152048 [1,1,0,0,0,0|1,0,1]=4 465 B7R0.4 CCCSCC(=O)O CS-0651549 [1,1,0,0,0,0|1,0,1]=4 466 B7R0.4 CN(C)CCCCCl CS-0059660 [1,1,0,0,0,0|2,0,0]=4 467 B7R0.4 CN(C)CCCCN CS-0206346 [1,1,0,0,0,0|2,0,0]=4 468 B7R0.4 CN(C)CCCCN CS-0669419 [1,1,0,0,0,0|2,0,0]=4 469 B7R0.4 CN(C)CCCCO CS-W022016 [1,1,0,0,0,0|1,0,0]=3 470 B7R0.4 CNCCCC(=O)O CS-0096860 [1,1,0,0,0,0|1,0,1]=4 471 B7R0.4 CNCCCC(=O)O CS-0133777 [1,1,0,0,0,0|1,0,1]=4 472 B7R0.4 COCCCC(=O)O CS-W001021 [1,1,0,0,0,0|1,0,1]=4 473 B7R0.4 NCCCCC(=O)O CS-0181832 [1,1,0,0,0,0|1,0,1]=4 474 B7R0.4 NCCCCC(=O)O CS-W016594 [1,1,0,0,0,0|1,0,1]=4 475 B7R0.4 O=C(O)CCCCBr CS-W017172 [1,1,0,0,0,0|1,0,1]=4 476 B7R0.4 O=C(O)CCCCCl CS-W022362 [1,1,0,0,0,0|1,0,1]=4 477 B7R0.7 CC(CCBr)CCBr CS-0182622 [1,1,0,0,0,0|2,0,0]=4 478 B7R0.7 CC(CCO)CCO CS-0188324 [1,1,0,0,0,0|1,0,0]=3 479 B7R0.7 CCCC(Br)CCC CS-0106173 [1,1,0,0,0,0|0,0,0]=2 480 B7R0.7 CCCC(O)CCC CS-0132313 [1,1,0,0,0,0|0,0,0]=2 481 B7R0.7 CCC[C@H](N)CCO CS-0152589 [1,1,0,0,0,0|0,0,0]=2 482 B7R0.7 CCOC(=O)CCO CS-0139545 [1,1,0,0,0,0|1,0,1]=4 483 B7R0.7 COCC(N)COC CS-W005488 [1,1,0,0,0,0|2,0,0]=4 484 B7R0.7 COCC(O)COC CS-W018661 [1,1,0,0,0,0|2,0,0]=4 485 B7R0.7 OCCC(O)CCO CS-0469963 [1,1,0,0,0,0|1,0,0]=3 486 B9R0.4 CSCC[C@@H](N)CC(=O)O CS-0196593 [0,2,0,0,0,0|1,0,1]=4 487 B9R0.4 CSCC[C@H](N)CC(=O)O CS-0062044 [0,2,0,0,0,0|1,0,1]=4 488 B9R0.4 CSCC[C@H](N)CC(=O)O CS-0150087 [0,2,0,0,0,0|1,0,1]=4 489 B9R0.5 C=C=CC(O)CCCCC CS-1014360 [0,2,0,0,0,0|1,0,1]=4 490 B9R0.5 CCOC(=O)CCCCBr CS-W008658 [0,2,0,0,0,0|1,0,1]=4 491 B9R0.5 CCOC(=O)CCCCN CS-W022699 [0,2,0,0,0,0|1,0,1]=4 492 B9R0.18 CCCCC(=O)CCCC CS-W018275 [0,2,0,0,0,0|1,0,0]=3 493 B9R0.18 CCCCC(O)CCCC CS-0083495 [0,2,0,0,0,0|1,0,0]=3 494 B9R0.18 CCCCS(=O)CCCC CS-0181824 [0,2,0,0,0,0|1,0,0]=3 495 B9R0.18 CCOCC(O)COCC CS-0217718 [0,2,0,0,0,0|2,0,0]=4 496 B9R0.18 O=C(CCCCl)CCCCl CS-W018764 [0,2,0,0,0,0|1,0,1]=4 497 B9R0.48 COCC(C)OCC(C)O CS-W016335 [0,2,0,0,0,0|2,0,0]=4 498 B9R0.2 C#CCCCCCC(=O)O CS-0006437 [0,2,0,0,0,0|0,0,2]=4 499 B9R0.2 C=CCCCCCC(=O)O CS-0147251 [0,2,0,0,0,0|0,0,2]=4 500 B9R0.2 CC(=O)OCCCCCBr CS-0006787 [0,2,0,0,0,0|1,0,1]=4 501 B9R0.2 CC(=O)OCCOCCO CS-0147717 [0,2,0,0,0,0|1,0,1]=4 502 B9R0.2 CCCCCC#CC(=O)O CS-0297443 [0,2,0,0,0,0|0,0,2]=4 503 B9R0.2 CCCCCCCC(=O)O CS-0016549 [0,2,0,0,0,0|0,0,0]=2 504 B9R0.2 CCCCCCCC(C)=O CS-0015991 [0,2,0,0,0,0|0,0,1]=3 505 B9R0.2 CCCCC\C=C\C(=O)O CS-0098436 [0,2,0,0,0,0|0,0,2]=4 506 B9R0.2 CCCNCCCN(C)C CS-0116651 [0,2,0,0,0,0|2,0,0]=4 507 B9R0.2 CN(C)CCCCCCO CS-W017749 [0,2,0,0,0,0|0,0,0]=2 508 B9R0.2 COCCOCCC(=O)O CS-0105847 [0,2,0,0,0,0|1,0,1]=4 509 B9R0.2 NCCCCCCC(=O)O CS-W002042 [0,2,0,0,0,0|0,0,1]=3 510 B9R0.2 O=C(O)CCCCCCBr CS-W007714 [0,2,0,0,0,0|0,0,1]=3 511 B9R0.2 O=C(O)CCCCCCO CS-W022546 [0,2,0,0,0,0|0,0,1]=3 512 B9R0.45 BrCCCCCCCCBr CS-0007585 [0,2,0,0,0,0|1,0,0]=3 513 B9R0.45 BrCCOCCOCCBr CS-0109308 [0,2,0,0,0,0|2,0,0]=4 514 B9R0.45 C#CCCC#CCCCC CS-0186304 [0,2,0,0,0,0|1,0,1]=4 515 B9R0.45 C#CCCCCCCCC CS-0031636 [0,2,0,0,0,0|1,0,0]=3 516 B9R0.45 C#CCCCCCCCI CS-0614924 [0,2,0,0,0,0|1,0,0]=3 517 B9R0.45 C#CCCCCCCCO CS-W018840 [0,2,0,0,0,0|0,0,0]=2 518 B9R0.45 C#CCOCCOCCO CS-0108947 [0,2,0,0,0,0|0,0,2]=4 519 B9R0.45 C(CC)=CCCCCCO CS-W018274 [0,2,0,0,0,0|0,0,0]=2 520 B9R0.45 C=CCCCCCCC=C CS-0199334 [0,2,0,0,0,0|1,0,1]=4 521 B9R0.45 C=CCCCCCCCBr CS-W006397 [0,2,0,0,0,0|1,0,0]=3 522 B9R0.45 C=CCCCCCCCO CS-0185599 [0,2,0,0,0,0|0,0,0]=2 523 B9R0.45 C=CCOCCOCCO CS-0099993 [0,2,0,0,0,0|0,0,2]=4 524 B9R0.45 CCCCC#CCCCC CS-0066208 [0,2,0,0,0,0|1,0,0]=3 525 B9R0.45 CCCCC=C=CCCO CS-1173690 [0,2,0,0,0,0|0,0,1]=3 526 B9R0.45 CCCCCCCCCBr CS-W015275 [0,2,0,0,0,0|1,0,0]=3 527 B9R0.45 CCCCCCCCCI CS-0179369 [0,2,0,0,0,0|1,0,0]=3 528 B9R0.45 CCCCCCCCCN CS-W016408 [0,2,0,0,0,0|1,0,0]=3 529 B9R0.45 CCCCCCCCCO CS-W009532 [0,2,0,0,0,0|0,0,0]=2 530 B9R0.45 CCCCCCCCNC CS-0152155 [0,2,0,0,0,0|1,0,0]=3 531 B9R0.45 CCCCCCCCSC CS-0451724 [0,2,0,0,0,0|0,1,0]=3 532 B9R0.45 CCCCNCCCCO CS-0152101 [0,2,0,0,0,0|0,0,0]=2 533 B9R0.45 CNCCCCCCNC CS-0150992 [0,2,0,0,0,0|1,0,0]=3 534 B9R0.45 COCCCCCCOC CS-0321041 [0,2,0,0,0,0|0,0,0]=2 535 B9R0.45 ClCCOCCOCCCl CS-0158308 [0,2,0,0,0,0|2,0,0]=4 536 B9R0.45 ICCCCCCCCI CS-0196432 [0,2,0,0,0,0|1,0,0]=3 537 B9R0.45 ICCOCCOCCI CS-0112243 [0,2,0,0,0,0|2,0,0]=4 538 B9R0.45 NCCCCCCCCN CS-W016375 [0,2,0,0,0,0|1,0,0]=3 539 B9R0.45 NCCCCCCCCO CS-0147845 [0,2,0,0,0,0|0,0,0]=2 540 B9R0.45 NCCCCNCCCN CS-0013804 [0,2,0,0,0,0|1,0,0]=3 541 B9R0.45 NCCOCCOCCN CS-0100622 [0,2,0,0,0,0|2,0,0]=4 542 B9R0.45 NCCOCCOCCN CS-0115753 [0,2,0,0,0,0|2,0,0]=4 543 B9R0.45 NCCOCCOCCN CS-0173746 [0,2,0,0,0,0|2,0,0]=4 544 B9R0.45 NCCOCCOCCO CS-W007545 [0,2,0,0,0,0|1,0,0]=3 545 B9R0.45 NCCOCCOCCS CS-0148601 [0,2,0,0,0,0|1,1,0]=4 546 B9R0.45 OCCCCCCCCBr CS-0015428 [0,2,0,0,0,0|0,0,0]=2 547 B9R0.45 OCCCCCCCCCl CS-W014309 [0,2,0,0,0,0|0,0,0]=2 548 B9R0.45 OCCCCCCCCO CS-W018224 [0,2,0,0,0,0|0,0,0]=2 549 B9R0.45 OCCCSSCCCO CS-0162834 [0,2,0,0,0,0|1,0,0]=3 550 B9R0.45 OCCNCCNCCO CS-W018184 [0,2,0,0,0,0|1,0,0]=3 551 B9R0.45 OCCOCCOCCBr CS-0109578 [0,2,0,0,0,0|1,0,0]=3 552 B9R0.45 OCCOCCOCCCl CS-W016036 [0,2,0,0,0,0|1,0,0]=3 553 B9R0.45 OCCOCCOCCO CS-W018156 [0,2,0,0,0,0|1,0,0]=3 554 B9R0.45 SCCOCCOCCS CS-0040829 [0,2,0,0,0,0|1,1,0]=4 555 B9R0.45 [N-]=[N+]=NCCCCCCN CS-0148141 [0,2,0,0,0,0|2,0,0]=4 556 B9R0.45 [N-]=[N+]=NCCCCCCO CS-0148603 [0,2,0,0,0,0|1,0,0]=3 557 B9R0.46 CCCCCCC(=O)CC CS-0330265 [0,2,0,0,0,0|1,0,0]=3 558 B9R0.46 CCCCCCC(=O)NN CS-0215224 [0,2,0,0,0,0|0,0,2]=4 559 B9R0.46 CCCCCCC(=O)OC CS-0182587 [0,2,0,0,0,0|0,0,1]=3 560 B9R0.46 CCCCCCC(=O)O[Na] CS-0182616 [0,2,0,0,0,0|0,0,1]=3 561 B9R0.46 CCCCCCC(O)CC CS-0199187 [0,2,0,0,0,0|0,0,0]=2 562 B9R0.46 CCCCCCC(O)CO CS-W018222 [0,2,0,0,0,0|0,0,0]=2 563 B9R0.46 COC(=O)CCCCCBr CS-W015176 [0,2,0,0,0,0|1,0,1]=4 564 B9R0.46 COC(=O)CCCCCN CS-W008066 [0,2,0,0,0,0|1,0,1]=4 565 B9R0.46 COC(=O)CCCCCO CS-0187523 [0,2,0,0,0,0|0,0,1]=3 566 B9R0.46 COCCOCC(O)CO CS-0888968 [0,2,0,0,0,0|1,0,0]=3 567 B9R0.20 CCCCCC(C)(C)CC CS-0128828 [0,2,0,0,0,0|1,0,0]=3 568 B9R0.24 CC[C@@H](O)CC[C@H](O)CC CS-0106832 [0,2,0,0,0,0|1,0,0]=3 569 B9R0.47 CCCCCC(N)C(=O)O CS-W016364 [0,2,0,0,0,0|0,0,1]=3 570 B9R0.47 CCCCCC(O)C(=O)O CS-0242197 [0,2,0,0,0,0|0,0,1]=3 571 B9R0.47 CCCCC[C@@H](N)C(=O)O CS-0152364 [0,2,0,0,0,0|0,0,1]=3 572 B9R0.47 CCCCC[C@H](N)C(=O)O CS-W018819 [0,2,0,0,0,0|0,0,1]=3 573 B9R0.47 CCCCOC(=O)[C@H](C)O CS-0451298 [0,2,0,0,0,0|1,0,1]=4 574 B9R0.47 CCSCC[C@H](N)C(=O)O CS-W017916 [0,2,0,0,0,0|1,0,1]=4 575 B9R0.47 CC[Se]CCC(N)C(=O)O CS-0640882 [0,2,0,0,0,0|1,0,1]=4 576 B9R0.47 NCCCCC(N)C(=O)O CS-0071275 [0,2,0,0,0,0|1,0,1]=4 577 B9R0.47 NCCCCC(N)C(=O)O CS-0201768 [0,2,0,0,0,0|1,0,1]=4 578 B9R0.47 NCCCCC(N)C(=O)O CS-7806 [0,2,0,0,0,0|1,0,1]=4 579 B9R0.47 NCCCC[C@@H](N)C(=O)O CS-0016215 [0,2,0,0,0,0|1,0,1]=4 580 B9R0.47 NCCCC[C@@H](N)C(=O)O CS-D1670 [0,2,0,0,0,0|1,0,1]=4 581 B9R0.47 NCCCC[C@H](N)C(=O)O CS-1184636 [0,2,0,0,0,0|1,0,1]=4 582 B9R0.47 NCCCC[C@H](N)C(=O)O CS-7885 [0,2,0,0,0,0|1,0,1]=4 583 B9R0.47 NCCCC[C@H](N)C(=O)O CS-W016086 [0,2,0,0,0,0|1,0,1]=4 584 B9R0.47 NCCCC[C@H](N)C(=O)O CS-W019758 [0,2,0,0,0,0|1,0,1]=4 585 B9R0.47 [C@@H](N)(CCSCC)C(=O)O CS-W017917 [0,2,0,0,0,0|1,0,1]=4 586 B9R0.38 CC(C)(C)SSCCCO CS-0978762 [0,2,0,0,0,0|2,0,0]=4 587 B9R0.38 CCCCCC[N+](C)(C)C CS-0152324 [0,2,0,0,0,0|2,0,0]=4 588 B9R0.55 CC(=O)CCCCC(=O)O CS-W008210 [0,2,0,0,0,0|0,0,2]=4 589 B9R0.55 CC(C)CCCCC(=O)O CS-0154230 [0,2,0,0,0,0|0,0,1]=3 590 B9R0.55 CN(C)CCCCC(=O)O CS-0151284 [0,2,0,0,0,0|1,0,1]=4 591 B9R0.55 CN(C)CCCCC(=O)O CS-0151285 [0,2,0,0,0,0|1,0,1]=4 592 B7R1.1 BrCC1CCCC1 CS-W004985 [1,0,0,1,0,0|1,0,0]=3 593 B7R1.1 BrCC1CCOC1 CS-W004268 [1,0,0,1,0,0|2,0,0]=4 594 B7R1.1 BrCC1OCCO1 CS-W021428 [1,0,0,1,0,0|2,0,0]=4 595 B7R1.1 CCC1CCCN1 CS-0454761 [1,0,0,1,0,0|1,0,0]=3 596 B7R1.1 CC[C@H]1CCCN1 CS-0197308 [1,0,0,1,0,0|1,0,0]=3 597 B7R1.1 CN[C@H]1CCOC1 CS-0053255 [1,0,0,1,0,0|2,0,0]=4 598 B7R1.1 COC1CCNC1 CS-0039937 [1,0,0,1,0,0|2,0,0]=4 599 B7R1.1 COC1CCNC1 CS-W004880 [1,0,0,1,0,0|2,0,0]=4 600 B7R1.1 CO[C@@H]1CCNC1 CS-0053757 [1,0,0,1,0,0|2,0,0]=4 601 B7R1.1 CO[C@@H]1CCNC1 CS-W021134 [1,0,0,1,0,0|2,0,0]=4 602 B7R1.1 CO[C@H]1CCNC1 CS-0031390 [1,0,0,1,0,0|2,0,0]=4 603 B7R1.1 ClCC1OCCO1 CS-0137170 [1,0,0,1,0,0|2,0,0]=4 604 B7R1.1 FC[C@@H]1CCCN1 CS-0053450 [1,0,0,1,0,0|2,0,0]=4 605 B7R1.1 ICC1CCCC1 CS-0309298 [1,0,0,1,0,0|1,0,0]=3 606 B7R1.1 ICC1CCOC1 CS-W004269 [1,0,0,1,0,0|2,0,0]=4 607 B7R1.1 N#CC1CCCC1 CS-0072286 [1,0,0,1,0,0|1,0,1]=4 608 B7R1.1 NCC1CCCC1 CS-D0472 [1,0,0,1,0,0|1,0,0]=3 609 B7R1.1 NCC1CCCN1 CS-0019253 [1,0,0,1,0,0|2,0,0]=4 610 B7R1.1 NCC1CCOC1 CS-W004787 [1,0,0,1,0,0|2,0,0]=4 611 B7R1.1 NC[C@@H]1CCCO1 CS-0438150 [1,0,0,1,0,0|1,0,0]=3 612 B7R1.1 NC[C@@H]1CCCO1 CS-W011316 [1,0,0,1,0,0|1,0,0]=3 613 B7R1.1 NC[C@@H]1CCOC1 CS-0053039 [1,0,0,1,0,0|2,0,0]=4 614 B7R1.1 NC[C@@H]1CCOC1 CS-0053252 [1,0,0,1,0,0|2,0,0]=4 615 B7R1.1 NC[C@H]1CCOC1 CS-0053315 [1,0,0,1,0,0|2,0,0]=4 616 B7R1.1 NNC1CCCC1 CS-D0525 [1,0,0,1,0,0|2,0,0]=4 617 B7R1.1 OCC1CC=CC1 CS-W003141 [1,0,0,1,0,0|0,0,2]=4 618 B7R1.1 OCC1CCCC1 CS-W001923 [1,0,0,1,0,0|0,0,0]=2 619 B7R1.1 OCC1CCCN1 CS-W007622 [1,0,0,1,0,0|1,0,0]=3 620 B7R1.1 OCC1CCNC1 CS-W019882 [1,0,0,1,0,0|1,0,0]=3 621 B7R1.1 OCC1CCOC1 CS-D1159 [1,0,0,1,0,0|1,0,0]=3 622 B7R1.1 OCC1OCCO1 CS-W019186 [1,0,0,1,0,0|2,0,0]=4 623 B7R1.1 OC[C@@H]1CCCN1 CS-D1460 [1,0,0,1,0,0|1,0,0]=3 624 B7R1.1 OC[C@@H]1CCCO1 CS-0031452 [1,0,0,1,0,0|1,0,0]=3 625 B7R1.1 OC[C@@H]1CCNC1 CS-0005415 [1,0,0,1,0,0|1,0,0]=3 626 B7R1.1 OC[C@H]1CCCN1 CS-D1509 [1,0,0,1,0,0|1,0,0]=3 627 B7R1.1 OC[C@H]1CCNC1 CS-W008960 [1,0,0,1,0,0|1,0,0]=3 628 B7R1.1 ON=C1CCCC1 CS-W013717 [1,0,0,1,0,0|1,0,1]=4 629 B7R1.1 [C@@H]1(CN)CCCN1 CS-0043760 [1,0,0,1,0,0|2,0,0]=4 630 B7R1.1 [C@H]1(CN)CCCO1 CS-W011317 [1,0,0,1,0,0|1,0,0]=3 631 B7R1.1 [C@H]1(CO)CCCO1 CS-W013695 [1,0,0,1,0,0|1,0,0]=3 632 B7R1.3 BrC1CCCCC1 CS-W017925 [1,0,0,1,0,0|1,0,0]=3 633 B7R1.3 BrC1CCCOC1 CS-W019418 [1,0,0,1,0,0|2,0,0]=4 634 B7R1.3 BrC1CCNCC1 CS-W014130 [1,0,0,1,0,0|2,0,0]=4 635 B7R1.3 BrC1CCOCC1 CS-W003396 [1,0,0,1,0,0|2,0,0]=4 636 B7R1.3 CC1=NCCCO1 CS-1006941 [1,0,0,1,0,0|1,0,1]=4 637 B7R1.3 CC1CCOCC1 CS-0233092 [1,0,0,1,0,0|1,0,0]=3 638 B7R1.3 CC1CCOCO1 CS-0181838 [1,0,0,1,0,0|1,0,0]=3 639 B7R1.3 CC1CNCCO1 CS-0152670 [1,0,0,1,0,0|1,0,0]=3 640 B7R1.3 CC1CNCCO1 CS-D1584 [1,0,0,1,0,0|1,0,0]=3 641 B7R1.3 CC1COCCN1 CS-W009058 [1,0,0,1,0,0|2,0,0]=4 642 B7R1.3 CC1SCCCS1 CS-0094743 [1,0,0,1,0,0|1,1,0]=4 643 B7R1.3 CN1CCNCC1 CS-W017563 [1,0,0,1,0,0|2,0,0]=4 644 B7R1.3 C[C@@H]1CCCCN1 CS-W019137 [1,0,0,1,0,0|1,0,0]=3 645 B7R1.3 C[C@@H]1CCCNC1 CS-W021135 [1,0,0,1,0,0|1,0,0]=3 646 B7R1.3 C[C@@H]1CNCCN1 CS-W020739 [1,0,0,1,0,0|2,0,0]=4 647 B7R1.3 C[C@@H]1CNCCO1 CS-0019313 [1,0,0,1,0,0|1,0,0]=3 648 B7R1.3 C[C@@H]1CNCCO1 CS-W018656 [1,0,0,1,0,0|1,0,0]=3 649 B7R1.3 C[C@@H]1COCCN1 CS-D1634 [1,0,0,1,0,0|2,0,0]=4 650 B7R1.3 C[C@@H]1COCCN1 CS-W020732 [1,0,0,1,0,0|2,0,0]=4 651 B7R1.3 C[C@H]1CCCCN1 CS-0145867 [1,0,0,1,0,0|1,0,0]=3 652 B7R1.3 C[C@H]1CNCCO1 CS-W020614 [1,0,0,1,0,0|1,0,0]=3 653 B7R1.3 C[C@H]1COCCN1 CS-M0392 [1,0,0,1,0,0|2,0,0]=4 654 B7R1.3 C[C@H]1COCCN1 CS-W008644 [1,0,0,1,0,0|2,0,0]=4 655 B7R1.3 ClC1CCCCC1 CS-0198086 [1,0,0,1,0,0|1,0,0]=3 656 B7R1.3 ClC1CCNCC1 CS-W006160 [1,0,0,1,0,0|2,0,0]=4 657 B7R1.3 ClC1CCOCC1 CS-W016579 [1,0,0,1,0,0|2,0,0]=4 658 B7R1.3 FC1CCCNC1 CS-W001632 [1,0,0,1,0,0|2,0,0]=4 659 B7R1.3 FC1CCNCC1 CS-0040905 [1,0,0,1,0,0|2,0,0]=4 660 B7R1.3 FC1CCNCC1 CS-0101735 [1,0,0,1,0,0|2,0,0]=4 661 B7R1.3 F[C@@H]1CCCNC1 CS-0053327 [1,0,0,1,0,0|2,0,0]=4 662 B7R1.3 IC1CCCCC1 CS-0148628 [1,0,0,1,0,0|1,0,0]=3 663 B7R1.3 IC1CCNCC1 CS-0145320 [1,0,0,1,0,0|2,0,0]=4 664 B7R1.3 IC1CCOCC1 CS-W004278 [1,0,0,1,0,0|2,0,0]=4 665 B7R1.3 NC1CCCCC1 CS-W013335 [1,0,0,1,0,0|1,0,0]=3 666 B7R1.3 NC1CCCNC1 CS-W002078 [1,0,0,1,0,0|2,0,0]=4 667 B7R1.3 NC1CCCOC1 CS-0044162 [1,0,0,1,0,0|2,0,0]=4 668 B7R1.3 NC1CCCOC1 CS-0069616 [1,0,0,1,0,0|2,0,0]=4 669 B7R1.3 NC1CCOCC1 CS-B0654 [1,0,0,1,0,0|2,0,0]=4 670 B7R1.3 NC1CCOCC1 CS-W002372 [1,0,0,1,0,0|2,0,0]=4 671 B7R1.3 NC1CCSCC1 CS-0043960 [1,0,0,1,0,0|2,0,0]=4 672 B7R1.3 NC1CCSCC1 CS-W000397 [1,0,0,1,0,0|2,0,0]=4 673 B7R1.3 NN1CCCCC1 CS-W007639 [1,0,0,1,0,0|2,0,0]=4 674 B7R1.3 N[C@@H]1CCCNC1 CS-B0670 [1,0,0,1,0,0|2,0,0]=4 675 B7R1.3 N[C@@H]1CCCNC1 CS-W009139 [1,0,0,1,0,0|2,0,0]=4 676 B7R1.3 N[C@H]1CCCOC1 CS-W018654 [1,0,0,1,0,0|2,0,0]=4 677 B7R1.3 O=C1CCCCO1 CS-W013713 [1,0,0,1,0,0|1,0,1]=4 678 B7R1.3 OC1C=CCCC1 CS-W011333 [1,0,0,1,0,0|0,0,2]=4 679 B7R1.3 OC1CC=CCC1 CS-0161778 [1,0,0,1,0,0|0,0,2]=4 680 B7R1.3 OC1CCCCC1 CS-0017198 [1,0,0,1,0,0|0,0,0]=2 681 B7R1.3 OC1CCCCO1 CS-0015921 [1,0,0,1,0,0|1,0,0]=3 682 B7R1.3 OC1CCCNC1 CS-D1393 [1,0,0,1,0,0|1,0,0]=3 683 B7R1.3 OC1CCCNC1 CS-W013706 [1,0,0,1,0,0|1,0,0]=3 684 B7R1.3 OC1CCCOC1 CS-D1560 [1,0,0,1,0,0|1,0,0]=3 685 B7R1.3 OC1CCNCC1 CS-W002165 [1,0,0,1,0,0|1,0,0]=3 686 B7R1.3 OC1CCNCC1 CS-W004328 [1,0,0,1,0,0|1,0,0]=3 687 B7R1.3 OC1CCOCC1 CS-W004264 [1,0,0,1,0,0|1,0,0]=3 688 B7R1.3 OC1CCSCC1 CS-D1275 [1,0,0,1,0,0|1,0,0]=3 689 B7R1.3 OC1CNCCO1 CS-W006148 [1,0,0,1,0,0|2,0,0]=4 690 B7R1.3 OC1COCOC1 CS-W016639 [1,0,0,1,0,0|2,0,0]=4 691 B7R1.3 ON1CCCCC1 CS-W016646 [1,0,0,1,0,0|1,0,0]=3 692 B7R1.3 O[C@@H]1CCCNC1 CS-0053770 [1,0,0,1,0,0|1,0,0]=3 693 B7R1.3 O[C@H]1CCCNC1 CS-0029964 [1,0,0,1,0,0|1,0,0]=3 694 B7R1.3 O[C@H]1CCCNC1 CS-W003070 [1,0,0,1,0,0|1,0,0]=3 695 B7R1.3 S=C1CCCCC1 CS-0661522 [1,0,0,1,0,0|0,1,1]=4 696 B7R1.3 [C@@H]1(N)CCCOC1 CS-W006989 [1,0,0,1,0,0|2,0,0]=4 697 B7R1.3 [C@@H]1(O)CCCNC1 CS-W013330 [1,0,0,1,0,0|1,0,0]=3 698 B7R1.3 [C@H]1(C)CCCCN1 CS-0044046 [1,0,0,1,0,0|1,0,0]=3 699 B7R1.3 [C@H]1(C)CCCNC1 CS-W006435 [1,0,0,1,0,0|1,0,0]=3 700 B7R1.3 [C@H]1(C)CNCCN1 CS-W011321 [1,0,0,1,0,0|2,0,0]=4 701 B7R1.3 [C@H]1(C)CNCCO1 CS-W006079 [1,0,0,1,0,0|1,0,0]=3 702 B7R1.4 CC1OCCC1S CS-W013594 [1,0,0,1,0,0|1,1,0]=4 703 B7R1.4 C[C@H]1CNC[C@@H]1O CS-0035605 [1,0,0,1,0,0|1,0,0]=3 704 B7R1.4 N[C@@H]1CCC[C@@H]1O CS-W003557 [1,0,0,1,0,0|1,0,0]=3 705 B7R1.4 N[C@@H]1CCC[C@H]1O CS-0130454 [1,0,0,1,0,0|1,0,0]=3 706 B7R1.4 N[C@@H]1CCC[C@H]1O CS-W008557 [1,0,0,1,0,0|1,0,0]=3 707 B7R1.4 N[C@H]1CCC[C@@H]1O CS-W004139 [1,0,0,1,0,0|1,0,0]=3 708 B7R1.4 N[C@H]1CCC[C@H]1N CS-0049664 [1,0,0,1,0,0|2,0,0]=4 709 B7R1.4 N[C@H]1CCC[C@H]1O CS-W003393 [1,0,0,1,0,0|1,0,0]=3 710 B7R1.4 N[C@H]1COC[C@@H]1O CS-0046711 [1,0,0,1,0,0|2,0,0]=4 711 B7R1.4 N[C@H]1COC[C@@H]1O CS-0047593 [1,0,0,1,0,0|2,0,0]=4 712 B7R1.4 O[C@@H]1CCC[C@H]1O CS-W005508 [1,0,0,1,0,0|1,0,0]=3 713 B7R1.4 O[C@@H]1CNC[C@@H]1F CS-0047354 [1,0,0,1,0,0|2,0,0]=4 714 B7R1.4 O[C@@H]1CNC[C@H]1F CS-0054190 [1,0,0,1,0,0|2,0,0]=4 715 B7R1.4 O[C@@H]1CNC[C@H]1O CS-0053303 [1,0,0,1,0,0|2,0,0]=4 716 B7R1.4 O[C@H]1CNC[C@@H]1F CS-0042168 [1,0,0,1,0,0|2,0,0]=4 717 B7R1.4 O[C@H]1CNC[C@@H]1F CS-0058680 [1,0,0,1,0,0|2,0,0]=4 718 B7R1.4 O[C@H]1CNC[C@H]1O CS-W022618 [1,0,0,1,0,0|2,0,0]=4 719 B7R1.4 O[C@H]1COC[C@H]1O CS-0049648 [1,0,0,1,0,0|2,0,0]=4 720 B7R1.4 [C@H]1(O)CNC[C@@H]1O CS-W005107 [1,0,0,1,0,0|2,0,0]=4 721 B7R1.6 COCC1CNC1 CS-W023140 [1,0,0,1,0,0|2,0,0]=4 722 B7R1.6 NCCN1CCC1 CS-0127626 [1,0,0,1,0,0|2,0,0]=4 723 B7R1.6 NOCC1CCC1 CS-0145228 [1,0,0,1,0,0|2,0,0]=4 724 B7R1.6 OCCC1COC1 CS-0052216 [1,0,0,1,0,0|1,0,0]=3 725 B7R1.6 OCCN1CCC1 CS-D0268 [1,0,0,1,0,0|1,0,0]=3 726 B7R1.7 OCC#CC1CC1 CS-0051385 [1,0,0,1,0,0|0,0,2]=4 727 B7R1.7 OCCNC1CC1 CS-0072588 [1,0,0,1,0,0|1,0,0]=3 728 B7R1.8 CN1CC[C@@H]1CO CS-0172773 [1,0,0,1,0,0|1,0,0]=3 729 B7R1.9 OC[C@H]1C[C@H]1CO CS-0053077 [1,0,0,1,0,0|1,0,0]=3 730 B7R1.24 C1CNCCNC1 CS-W007768 [1,0,0,1,0,0|2,0,0]=4 731 B7R1.24 C1CNCCOC1 CS-0171615 [1,0,0,1,0,0|1,0,0]=3 732 B7R1.24 C1CNCCOC1 CS-B1101 [1,0,0,1,0,0|1,0,0]=3 733 B9R1.2 CCN1CCCC(O)C1 CS-0075008 [0,1,0,1,0,0|1,0,0]=3 734 B9R1.2 CCN1CCC[C@@H](N)C1 CS-0311909 [0,1,0,1,0,0|2,0,0]=4 735 B9R1.2 CN1CCCC(CN)C1 CS-B1372 [0,1,0,1,0,0|2,0,0]=4 736 B9R1.2 CN1CCCC(CO)C1 CS-W021353 [0,1,0,1,0,0|1,0,0]=3 737 B9R1.2 CN1CCC[C@@H](CO)C1 CS-B0137 [0,1,0,1,0,0|1,0,0]=3 738 B9R1.2 CN1CCC[C@H](CO)C1 CS-B0136 [0,1,0,1,0,0|1,0,0]=3 739 B9R1.2 CN1CCOC(CN)C1 CS-0036409 [0,1,0,1,0,0|2,0,0]=4 740 B9R1.2 CN1CCOC(CN)C1 CS-W005495 [0,1,0,1,0,0|2,0,0]=4 741 B9R1.2 CN1CCOC(CO)C1 CS-0061775 [0,1,0,1,0,0|2,0,0]=4 742 B9R1.2 CN1CCO[C@@H](CO)C1 CS-0061774 [0,1,0,1,0,0|2,0,0]=4 743 B9R1.2 CN1CCO[C@H](CO)C1 CS-0061772 [0,1,0,1,0,0|2,0,0]=4 744 B9R1.2 O=C1CC(CO)CCN1 CS-0051145 [0,1,0,1,0,0|1,0,1]=4 745 B9R1.2 O=C1CCCC(CO)N1 CS-0099968 [0,1,0,1,0,0|1,0,1]=4 746 B9R1.7 CCCC1COC(=O)O1 CS-0134586 [0,1,0,1,0,0|1,0,1]=4 747 B9R1.8 BrCCC1CCCCC1 CS-W010732 [0,1,0,1,0,0|1,0,0]=3 748 B9R1.8 BrCCC1CCOCC1 CS-M3430 [0,1,0,1,0,0|1,0,0]=3 749 B9R1.8 BrCCC1OCCCO1 CS-W010633 [0,1,0,1,0,0|1,0,0]=3 750 B9R1.8 BrCCN1CCCCC1 CS-W005524 [0,1,0,1,0,0|1,0,0]=3 751 B9R1.8 BrCCN1CCOCC1 CS-W005009 [0,1,0,1,0,0|2,0,0]=4 752 B9R1.8 CCCC1CCNCC1 CS-0434112 [0,1,0,1,0,0|1,0,0]=3 753 B9R1.8 CCCN1CCNCC1 CS-0152069 [0,1,0,1,0,0|2,0,0]=4 754 B9R1.8 CCNC1CCCCC1 CS-W016555 [0,1,0,1,0,0|1,0,0]=3 755 B9R1.8 CCNC1CCOCC1 CS-0040480 [0,1,0,1,0,0|2,0,0]=4 756 B9R1.8 CCOC1=NCCCC1 CS-0188155 [0,1,0,1,0,0|1,0,1]=4 757 B9R1.8 CNCC1CNCCO1 CS-0301640 [0,1,0,1,0,0|1,0,0]=3 758 B9R1.8 COCC1CCCCN1 CS-0207116 [0,1,0,1,0,0|1,0,0]=3 759 B9R1.8 COCC1CCCNC1 CS-0217524 [0,1,0,1,0,0|1,0,0]=3 760 B9R1.8 COCC1CCNCC1 CS-0051142 [0,1,0,1,0,0|1,0,0]=3 761 B9R1.8 COCC1CCNCC1 CS-W003464 [0,1,0,1,0,0|1,0,0]=3 762 B9R1.8 COCC1CNCCO1 CS-W021442 [0,1,0,1,0,0|1,0,0]=3 763 B9R1.8 COC[C@@H]1CNCCO1 CS-W020731 [0,1,0,1,0,0|1,0,0]=3 764 B9R1.8 COC[C@@H]1COCCN1 CS-0061891 [0,1,0,1,0,0|2,0,0]=4 765 B9R1.8 COC[C@H]1CNCCO1 CS-W018994 [0,1,0,1,0,0|1,0,0]=3 766 B9R1.8 COC[C@H]1COCCN1 CS-0103639 [0,1,0,1,0,0|2,0,0]=4 767 B9R1.8 CSCC1CCNCC1 CS-0241897 [0,1,0,1,0,0|1,1,0]=4 768 B9R1.8 ClCCN1CCCCC1 CS-B0962 [0,1,0,1,0,0|1,0,0]=3 769 B9R1.8 ClCCN1CCNCC1 CS-0453437 [0,1,0,1,0,0|2,0,0]=4 770 B9R1.8 ClCCN1CCOCC1 CS-0015128 [0,1,0,1,0,0|2,0,0]=4 771 B9R1.8 ClCCN1CCOCC1 CS-W004894 [0,1,0,1,0,0|2,0,0]=4 772 B9R1.8 FCCC1CCNCC1 CS-0480408 [0,1,0,1,0,0|1,0,0]=3 773 B9R1.8 FCCN1CCNCC1 CS-0106300 [0,1,0,1,0,0|2,0,0]=4 774 B9R1.8 FCCN1CCNCC1 CS-0158333 [0,1,0,1,0,0|2,0,0]=4 775 B9R1.8 FCCN1CCNCC1 CS-W021204 [0,1,0,1,0,0|2,0,0]=4 776 B9R1.8 N#CCC1CCOCC1 CS-W018364 [0,1,0,1,0,0|1,0,1]=4 777 B9R1.8 NCCC1=CCCCC1 CS-0072656 [0,1,0,1,0,0|1,0,1]=4 778 B9R1.8 NCCC1CCCCC1 CS-0040906 [0,1,0,1,0,0|1,0,0]=3 779 B9R1.8 NCCC1CCCCO1 CS-0084526 [0,1,0,1,0,0|0,0,0]=2 780 B9R1.8 NCCC1CCOCC1 CS-W002907 [0,1,0,1,0,0|1,0,0]=3 781 B9R1.8 NCCN1CCCCC1 CS-W007776 [0,1,0,1,0,0|1,0,0]=3 782 B9R1.8 NCCN1CCOCC1 CS-W016546 [0,1,0,1,0,0|2,0,0]=4 783 B9R1.8 O=CNC1CCCCC1 CS-0099360 [0,1,0,1,0,0|0,0,2]=4 784 B9R1.8 OCCC1CCCCC1 CS-0072235 [0,1,0,1,0,0|0,0,0]=2 785 B9R1.8 OCCC1CCCCN1 CS-W001979 [0,1,0,1,0,0|0,0,0]=2 786 B9R1.8 OCCC1CCCCO1 CS-0068082 [0,1,0,1,0,0|0,0,0]=2 787 B9R1.8 OCCC1CCCNC1 CS-D1062 [0,1,0,1,0,0|0,0,0]=2 788 B9R1.8 OCCC1CCCNC1 CS-WAA0206 [0,1,0,1,0,0|0,0,0]=2 789 B9R1.8 OCCC1CCNCC1 CS-0112429 [0,1,0,1,0,0|0,0,0]=2 790 B9R1.8 OCCC1CCNCC1 CS-W013445 [0,1,0,1,0,0|0,0,0]=2 791 B9R1.8 OCCC1CCOCC1 CS-0017747 [0,1,0,1,0,0|0,0,0]=2 792 B9R1.8 OCCC1CNCCN1 CS-W006875 [0,1,0,1,0,0|1,0,0]=3 793 B9R1.8 OCCC1COCCN1 CS-0146954 [0,1,0,1,0,0|1,0,0]=3 794 B9R1.8 OCCN1CCCCC1 CS-W013444 [0,1,0,1,0,0|0,0,0]=2 795 B9R1.8 OCCN1CCNCC1 CS-W020134 [0,1,0,1,0,0|1,0,0]=3 796 B9R1.8 OCCN1CCOCC1 CS-0311336 [0,1,0,1,0,0|1,0,0]=3 797 B9R1.8 OCC[C@@H]1CCCCN1 CS-0060809 [0,1,0,1,0,0|0,0,0]=2 798 B9R1.8 OCC[C@@H]1CCCCN1 CS-W019797 [0,1,0,1,0,0|0,0,0]=2 799 B9R1.8 OCC[C@@H]1CNCCN1 CS-0170826 [0,1,0,1,0,0|1,0,0]=3 800 B9R1.8 [C@H]1(CCO)CCCCN1 CS-W007158 [0,1,0,1,0,0|0,0,0]=2 801 B9R1.9 NC1CN(CCCF)C1 CS-0129788 [0,1,0,1,0,0|2,0,0]=4 802 B9R1.12 BrCCCC1OCCO1 CS-0159608 [0,1,0,1,0,0|1,0,0]=3 803 B9R1.12 BrCCCN1CCCC1 CS-W007182 [0,1,0,1,0,0|1,0,0]=3 804 B9R1.12 ClCCCC1OCCO1 CS-W018131 [0,1,0,1,0,0|1,0,0]=3 805 B9R1.12 ClCCCN1CCCC1 CS-0155277 [0,1,0,1,0,0|1,0,0]=3 806 B9R1.12 NCCCN1CCCC1 CS-W007457 [0,1,0,1,0,0|1,0,0]=3 807 B9R1.12 NCCOC1CCCC1 CS-0155346 [0,1,0,1,0,0|1,0,0]=3 808 B9R1.12 OCCCN1CCCC1 CS-W005320 [0,1,0,1,0,0|0,0,0]=2 809 B9R1.15 CCC1CCCCC1=O CS-0103893 [0,1,0,1,0,0|0,0,1]=3 810 B9R1.15 CN1CCCCC1CO CS-W011116 [0,1,0,1,0,0|0,0,0]=2 811 B9R1.15 CN1CCCC[C@@H]1CO CS-0099990 [0,1,0,1,0,0|0,0,0]=2 812 B9R1.15 CN1CCCC[C@H]1CO CS-0099987 [0,1,0,1,0,0|0,0,0]=2 813 B9R1.15 CN1CCOCC1CO CS-0061777 [0,1,0,1,0,0|1,0,0]=3 814 B9R1.15 CN1CCOC[C@@H]1CO CS-0061776 [0,1,0,1,0,0|1,0,0]=3 815 B9R1.15 CN1CCOC[C@H]1CO CS-0101191 [0,1,0,1,0,0|1,0,0]=3 816 B9R1.15 CN[C@@H]1CCCC[C@H]1O CS-0449943 [0,1,0,1,0,0|0,0,0]=2 817 B9R1.15 CN[C@H]1CCCC[C@@H]1O CS-0336415 [0,1,0,1,0,0|0,0,0]=2 818 B9R1.15 CO[C@H]1CCNC[C@H]1F CS-0565752 [0,1,0,1,0,0|2,0,0]=4 819 B9R1.15 C[C@H]1OCCN[C@@H]1CO CS-0103643 [0,1,0,1,0,0|1,0,0]=3 820 B9R1.15 OC[C@H]1CCNC[C@H]1F CS-W001673 [0,1,0,1,0,0|1,0,0]=3 821 B9R1.22 CN1C[C@@H](F)C[C@H]1CO CS-0159078 [0,1,0,1,0,0|1,0,0]=3 822 B9R1.22 CN1C[C@H](F)C[C@H]1CO CS-0146913 [0,1,0,1,0,0|1,0,0]=3 823 B9R1.22 CN1C[C@H](O)C[C@H]1CO CS-0159255 [0,1,0,1,0,0|1,0,0]=3 824 B9R1.33 CN1CCCC1CCN CS-W013459 [0,1,0,1,0,0|1,0,0]=3 825 B9R1.33 CN1CCCC1CCO CS-W013446 [0,1,0,1,0,0|0,0,0]=2 826 B9R1.49 O=C1CCCC(O)CN1 CS-0187220 [0,1,0,1,0,0|1,0,1]=4 827 B9R1.50 NC1CCCCCCC1 CS-0155298 [0,1,0,1,0,0|1,0,0]=3 828 B9R1.50 O=C1CCCCCCC1 CS-W007564 [0,1,0,1,0,0|0,0,1]=3 829 B9R1.50 O=C1CCCCCCN1 CS-W022575 [0,1,0,1,0,0|0,0,2]=4 830 B9R1.50 OC1C=CCCCCC1 CS-0782885 [0,1,0,1,0,0|0,0,1]=3 831 B9R1.50 OC1CCC=CCCC1 CS-W006126 [0,1,0,1,0,0|0,0,1]=3 832 B9R1.58 OCCN1CC(CF)C1 CS-0056292 [0,1,0,1,0,0|2,0,0]=4 833 B9R1.69 CC1CCC(O)CC1C CS-0206609 [0,1,0,1,0,0|1,0,0]=3 834 B9R1.134 CC1(CCN)OCCO1 CS-W013426 [0,1,0,1,0,0|2,0,0]=4 835 B9R1.134 CCC[N+]1(C)CCCC1 CS-0378408 [0,1,0,1,0,0|2,0,0]=4 836 B9R1.14 CCN1CCCC1CN CS-W013458 [0,1,0,1,0,0|1,0,0]=3 837 B9R1.14 CCN1CCC[C@H]1CN CS-W002498 [0,1,0,1,0,0|1,0,0]=3 838 B9R1.14 CCN1CCC[C@H]1CO CS-0159213 [0,1,0,1,0,0|0,0,0]=2 839 B9R1.83 CCCCCCC1CO1 CS-0152296 [0,1,0,1,0,0|0,0,0]=2 840 B9R1.83 COCCOCC1CO1 CS-0888964 [0,1,0,1,0,0|1,0,0]=3 841 B9R1.89 BrCC1CCCCCC1 CS-0144558 [0,1,0,1,0,0|1,0,0]=3 842 B9R1.89 CCN1CCCNCC1 CS-0124385 [0,1,0,1,0,0|2,0,0]=4 843 B9R1.89 N#CC1CCCCCC1 CS-0079887 [0,1,0,1,0,0|1,0,0]=3 844 B9R1.89 NCC1CCCCCC1 CS-0155299 [0,1,0,1,0,0|1,0,0]=3 845 B9R1.89 OCC1CCCCCC1 CS-0144557 [0,1,0,1,0,0|0,0,0]=2 846 B9R1.89 OCC1CCCCNC1 CS-0049917 [0,1,0,1,0,0|0,0,0]=2 847 B9R1.89 ONC1=NCCCCC1 CS-0449006 [0,1,0,1,0,0|1,0,1]=4 848 B9R1.103 C1CNCCNCCN1 CS-0105719 [0,1,0,1,0,0|2,0,0]=4 849 B9R1.103 C1CNCCNCCN1 CS-W006212 [0,1,0,1,0,0|2,0,0]=4 850 B9R1.1 C=C1CCC(CO)CC1 CS-0034131 [0,1,0,1,0,0|0,0,1]=3 851 B9R1.1 CCC1CCC(=O)CC1 CS-0226152 [0,1,0,1,0,0|1,0,1]=4 852 B9R1.1 CCC1CCC(N)CC1 CS-0216065 [0,1,0,1,0,0|1,0,0]=3 853 B9R1.1 CCC1CCC(O)CC1 CS-0152471 [0,1,0,1,0,0|1,0,0]=3 854 B9R1.1 CCN1CCC(N)CC1 CS-0069841 [0,1,0,1,0,0|2,0,0]=4 855 B9R1.1 CCN1CCC(O)CC1 CS-M1296 [0,1,0,1,0,0|2,0,0]=4 856 B9R1.1 CN1CCC(CCl)CC1 CS-0075760 [0,1,0,1,0,0|2,0,0]=4 857 B9R1.1 CN1CCC(CN)CC1 CS-0205823 [0,1,0,1,0,0|2,0,0]=4 858 B9R1.1 CN1CCC(CN)CC1 CS-W016551 [0,1,0,1,0,0|2,0,0]=4 859 B9R1.1 CN1CCC(CO)CC1 CS-D1113 [0,1,0,1,0,0|1,0,0]=3 860 B9R1.1 CNC1CCC(N)CC1 CS-0151020 [0,1,0,1,0,0|2,0,0]=4 861 B9R1.1 CN[C@H]1CC[C@H](O)CC1 CS-0159400 [0,1,0,1,0,0|2,0,0]=4 862 B9R1.1 CN[C@H]1CC[C@H](O)CC1 CS-W019271 [0,1,0,1,0,0|2,0,0]=4 863 B9R1.1 COC1CCC(N)CC1 CS-W003887 [0,1,0,1,0,0|2,0,0]=4 864 B9R1.1 COC1CCC(O)CC1 CS-W005092 [0,1,0,1,0,0|2,0,0]=4 865 B9R1.1 CO[C@H]1CC[C@@H](N)CC1 CS-0150980 [0,1,0,1,0,0|2,0,0]=4 866 B9R1.1 CO[C@H]1CC[C@H](N)CC1 CS-0094718 [0,1,0,1,0,0|2,0,0]=4 867 B9R1.1 CO[C@H]1CC[C@H](O)CC1 CS-0187696 [0,1,0,1,0,0|2,0,0]=4 868 B9R1.1 C[C@@H]1CN[C@@H](CO)CN1 CS-0146585 [0,1,0,1,0,0|2,0,0]=4 869 B9R1.1 C[C@H]1CN[C@H](CO)CN1 CS-0181918 [0,1,0,1,0,0|2,0,0]=4 870 B9R1.1 N#CC1CCC(N)CC1 CS-0043890 [0,1,0,1,0,0|1,0,1]=4 871 B9R1.1 N#CC1CCC(O)CC1 CS-D1577 [0,1,0,1,0,0|1,0,1]=4 872 B9R1.1 N#C[C@H]1CC[C@@H](N)CC1 CS-0187340 [0,1,0,1,0,0|1,0,1]=4 873 B9R1.1 N#C[C@H]1CC[C@H](N)CC1 CS-0106652 [0,1,0,1,0,0|1,0,1]=4 874 B9R1.1 N#C[C@H]1CC[C@H](O)CC1 CS-0645808 [0,1,0,1,0,0|1,0,1]=4 875 B9R1.1 N[C@H]1CC[C@H](CO)CC1 CS-0011345 [0,1,0,1,0,0|0,0,0]=2 876 B9R1.1 N[C@H]1CC[C@H](CO)CC1 CS-0047758 [0,1,0,1,0,0|0,0,0]=2 877 B9R1.1 O=C1CCC(CO)CC1 CS-W005330 [0,1,0,1,0,0|0,0,1]=3 878 B9R1.1 OCC1CCC(O)CC1 CS-W013434 [0,1,0,1,0,0|0,0,0]=2 879 B9R1.1 OC[C@H]1CC[C@H](O)CC1 CS-0058281 [0,1,0,1,0,0|0,0,0]=2 880 B9R1.3 CC1CCCC(C)C1=O CS-0215006 [0,1,0,1,0,0|0,0,2]=4 881 B9R1.3 OC1CCCC(O)C1O CS-0201494 [0,1,0,1,0,0|1,0,0]=3 882 B9R1.11 COC(=O)C1CCCO1 CS-0096501 [0,1,0,1,0,0|1,0,1]=4 883 B9R1.11 C[C@@H](CO)N1CCCC1 CS-0492203 [0,1,0,1,0,0|1,0,0]=3 884 B9R1.11 N#CC(N)C1CCCC1 CS-0213610 [0,1,0,1,0,0|1,0,1]=4 885 B9R1.21 OC[C@@H]1CC[C@H](CO)O1 CS-0005835 [0,1,0,1,0,0|1,0,0]=3 886 B9R1.88 COC(=O)[C@@H]1C[C@H]1CO CS-0078750 [0,1,0,1,0,0|1,0,1]=4 887 B9R1.118 C#CC1(N)CCCCC1 CS-0179732 [0,1,0,1,0,0|1,0,1]=4 888 B9R1.118 C#CC1(O)CCCCC1 CS-W011179 [0,1,0,1,0,0|1,0,1]=4 889 B9R1.118 C=CC1(O)CCCCC1 CS-0204609 [0,1,0,1,0,0|1,0,1]=4 890 B9R1.118 CC1(CN)CCOCC1 CS-0053196 [0,1,0,1,0,0|2,0,0]=4 891 B9R1.118 CC1(CO)CCCCC1 CS-0433278 [0,1,0,1,0,0|0,0,0]=2 892 B9R1.118 CC1(CO)CCNCC1 CS-0084165 [0,1,0,1,0,0|1,0,0]=3 893 B9R1.118 CC1(CO)CCOCC1 CS-0054747 [0,1,0,1,0,0|1,0,0]=3 894 B9R1.118 CCC1(O)CCCCC1 CS-0032047 [0,1,0,1,0,0|1,0,0]=3 895 B9R1.118 CCC1(O)CCNCC1 CS-0047072 [0,1,0,1,0,0|2,0,0]=4 896 B9R1.118 N#CC1(N)CCCCC1 CS-0168254 [0,1,0,1,0,0|1,0,1]=4 897 B9R1.118 NC1(CO)CCCCC1 CS-0146523 [0,1,0,1,0,0|0,0,0]=2 898 B9R1.118 NC1(CO)CCOCC1 CS-0053212 [0,1,0,1,0,0|1,0,0]=3 899 B9R1.118 NCC1(F)CCOCC1 CS-W021104 [0,1,0,1,0,0|2,0,0]=4 900 B9R1.118 NCC1(N)CCCCC1 CS-0064736 [0,1,0,1,0,0|1,0,0]=3 901 B9R1.118 NCC1(O)CCOCC1 CS-0028292 [0,1,0,1,0,0|2,0,0]=4 902 B9R1.118 OCC1(F)CCNCC1 CS-W021103 [0,1,0,1,0,0|1,0,0]=3 903 B9R1.118 OCC1(O)CCNCC1 CS-0051144 [0,1,0,1,0,0|1,0,0]=3 904 B9R1.118 OCC1(O)CCNCC1 CS-0053858 [0,1,0,1,0,0|1,0,0]=3 905 B9R1.132 CN1C(=O)CCC1CO CS-W001672 [0,1,0,1,0,0|1,0,1]=4 906 B9R1.6 CC(=O)C1CCCCC1 CS-W007597 [0,1,0,1,0,0|0,0,2]=4 907 B9R1.6 CC(=O)C1CNCCO1 CS-0197640 [0,1,0,1,0,0|1,0,1]=4 908 B9R1.6 CC(C)C1CCNCC1 CS-0096311 [0,1,0,1,0,0|2,0,0]=4 909 B9R1.6 CC(C)C1CNCCO1 CS-0434264 [0,1,0,1,0,0|1,0,0]=3 910 B9R1.6 CC(C)C1COCCN1 CS-W019094 [0,1,0,1,0,0|2,0,0]=4 911 B9R1.6 CC(C)[C@@H]1CNCCO1 CS-0096525 [0,1,0,1,0,0|1,0,0]=3 912 B9R1.6 CC(C)[C@@H]1COCCN1 CS-0098379 [0,1,0,1,0,0|2,0,0]=4 913 B9R1.6 CC(C)[C@@H]1COCCN1 CS-0146951 [0,1,0,1,0,0|2,0,0]=4 914 B9R1.6 CC(C)[C@H]1CNCCO1 CS-0096498 [0,1,0,1,0,0|1,0,0]=3 915 B9R1.6 CC(C)[C@H]1COCCN1 CS-0098377 [0,1,0,1,0,0|2,0,0]=4 916 B9R1.6 CC(C)[C@H]1COCCN1 CS-0146949 [0,1,0,1,0,0|2,0,0]=4 917 B9R1.6 CC(N)C1CCCCC1 CS-0136579 [0,1,0,1,0,0|1,0,0]=3 918 B9R1.6 CC(N)C1CCOCC1 CS-0196712 [0,1,0,1,0,0|2,0,0]=4 919 B9R1.6 CC(O)C1CCCCC1 CS-0109616 [0,1,0,1,0,0|0,0,0]=2 920 B9R1.6 CC(O)C1CCOCC1 CS-W004281 [0,1,0,1,0,0|1,0,0]=3 921 B9R1.6 C[C@@H](N)C1CCCCC1 CS-0343288 [0,1,0,1,0,0|1,0,0]=3 922 B9R1.6 C[C@@H](O)C1CCCCC1 CS-0144970 [0,1,0,1,0,0|0,0,0]=2 923 B9R1.6 C[C@H](N)C1CCCCC1 CS-0136578 [0,1,0,1,0,0|1,0,0]=3 924 B9R1.6 FC(F)C1CCCNC1 CS-0356776 [0,1,0,1,0,0|2,0,0]=4 925 B9R1.6 FC(F)C1CCNCC1 CS-W022014 [0,1,0,1,0,0|2,0,0]=4 926 B9R1.6 N=C(N)C1CCCCC1 CS-0216687 [0,1,0,1,0,0|1,0,1]=4 927 B9R1.6 NC(=O)C1CCCCC1 CS-W013481 [0,1,0,1,0,0|0,0,2]=4 928 B9R1.6 O=C(O)C1CCCCC1 CS-D1501 [0,1,0,1,0,0|0,0,1]=3 929 B9R1.6 O=C(O)C1CCCCN1 CS-B1313 [0,1,0,1,0,0|1,0,1]=4 930 B9R1.6 O=C(O)C1CCCCO1 CS-W001872 [0,1,0,1,0,0|1,0,1]=4 931 B9R1.6 O=C(O)C1CCCNC1 CS-W020556 [0,1,0,1,0,0|1,0,1]=4 932 B9R1.6 O=C(O)C1CCCOC1 CS-W001890 [0,1,0,1,0,0|1,0,1]=4 933 B9R1.6 O=C(O)C1CCNCC1 CS-D1472 [0,1,0,1,0,0|1,0,1]=4 934 B9R1.6 O=C(O)C1CCOCC1 CS-W002155 [0,1,0,1,0,0|1,0,1]=4 935 B9R1.6 O=C(O)C1CCSCC1 CS-0045869 [0,1,0,1,0,0|1,0,1]=4 936 B9R1.6 O=C(O)N1CCCCC1 CS-0084306 [0,1,0,1,0,0|1,0,1]=4 937 B9R1.6 O=C(O)[C@@H]1CCCCN1 CS-0097749 [0,1,0,1,0,0|1,0,1]=4 938 B9R1.6 O=C(O)[C@H]1CCCCN1 CS-0143812 [0,1,0,1,0,0|1,0,1]=4 939 B9R1.6 O=C(O)[C@H]1CCCCN1 CS-D1144 [0,1,0,1,0,0|1,0,1]=4 940 B9R1.6 O=C(O)[C@H]1CCCNC1 CS-0043826 [0,1,0,1,0,0|1,0,1]=4 941 B9R1.6 OB(O)C1CCCCC1 CS-W007574 [0,1,0,1,0,0|1,0,0]=3 942 B9R1.6 [C@@H]1(C(=O)O)CCCCN1 CS-W013450 [0,1,0,1,0,0|1,0,1]=4 943 B9R1.6 [C@@H]1(C(=O)O)CCCNC1 CS-0043827 [0,1,0,1,0,0|1,0,1]=4 944 B9R1.6 [C@@H]1(C(=O)O)CCCNC1 CS-W008123 [0,1,0,1,0,0|1,0,1]=4 945 B9R1.6 [C@H]1(C(=O)O)CCCNC1 CS-W013451 [0,1,0,1,0,0|1,0,1]=4 946 B9R1.13 CC(=O)CC1CCCC1 CS-0134561 [0,1,0,1,0,0|0,0,2]=4 947 B9R1.13 CC(=O)OC1CCCO1 CS-0160246 [0,1,0,1,0,0|1,0,1]=4 948 B9R1.13 CN(C)C[C@@H]1CCCN1 CS-0049613 [0,1,0,1,0,0|2,0,0]=4 949 B9R1.13 O=C(O)CC1CCCC1 CS-W007405 [0,1,0,1,0,0|0,0,1]=3 950 B9R1.13 O=C(O)CC1CCCN1 CS-W017883 [0,1,0,1,0,0|1,0,1]=4 951 B9R1.13 O=C(O)CC1CCCO1 CS-0076866 [0,1,0,1,0,0|1,0,1]=4 952 B9R1.13 O=C(O)CC1CCNC1 CS-0052205 [0,1,0,1,0,0|1,0,1]=4 953 B9R1.13 O=C(O)CC1CCOC1 CS-W005250 [0,1,0,1,0,0|1,0,1]=4 954 B9R1.13 O=C(O)CN1CCCC1 CS-W004008 [0,1,0,1,0,0|1,0,1]=4 955 B9R1.13 O=C(O)CN1CCCC1 CS-W020371 [0,1,0,1,0,0|1,0,1]=4 956 B9R1.13 O=C(O)C[C@@H]1CCCN1 CS-0035426 [0,1,0,1,0,0|1,0,1]=4 957 B9R1.13 O=C(O)C[C@@H]1CCNC1 CS-0052117 [0,1,0,1,0,0|1,0,1]=4 958 B9R1.13 O=C(O)C[C@@H]1CCOC1 CS-0155206 [0,1,0,1,0,0|1,0,1]=4 959 B9R1.13 O=C(O)C[C@H]1CCCN1 CS-0031343 [0,1,0,1,0,0|1,0,1]=4 960 B9R1.13 O=C(O)C[C@H]1CCCN1 CS-0035825 [0,1,0,1,0,0|1,0,1]=4 961 B9R1.13 OB(O)CC1CCCC1 CS-0243064 [0,1,0,1,0,0|1,0,0]=3 962 B9R1.13 [C@@H]1(CC(=O)O)CCCN1 CS-W010817 [0,1,0,1,0,0|1,0,1]=4 963 B9R1.40 CC1(C)CCCCC1=O CS-W008668 [0,1,0,1,0,0|0,0,2]=4 964 B9R1.40 CC1(C)CNCCC1O CS-0648750 [0,1,0,1,0,0|1,0,0]=3 965 B9R1.40 CC1(C)COCCC1N CS-0184373 [0,1,0,1,0,0|2,0,0]=4 966 B9R1.40 CC1CNCCC1(F)F CS-0038958 [0,1,0,1,0,0|2,0,0]=4 967 B9R1.40 NC1CCCCC1(F)F CS-W021472 [0,1,0,1,0,0|2,0,0]=4 968 B9R1.41 CC1CCCC1C(=O)O CS-0047145 [0,1,0,1,0,0|0,0,1]=3 969 B9R1.41 CC1CNCC1C(=O)O CS-0460956 [0,1,0,1,0,0|1,0,1]=4 970 B9R1.41 CN1CCCC1C(=O)O CS-B1576 [0,1,0,1,0,0|1,0,1]=4 971 B9R1.41 CN1CCC[C@@H]1C(=O)O CS-W001861 [0,1,0,1,0,0|1,0,1]=4 972 B9R1.41 CN1CCC[C@@H]1C(=O)O CS-W001913 [0,1,0,1,0,0|1,0,1]=4 973 B9R1.41 CN1CCC[C@H]1C(=O)O CS-B1517 [0,1,0,1,0,0|1,0,1]=4 974 B9R1.41 C[C@H](O)[C@@H]1CCCN1C CS-0159084 [0,1,0,1,0,0|1,0,0]=3 975 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O CS-0120592 [0,1,0,1,0,0|1,0,1]=4 976 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O CS-0130164 [0,1,0,1,0,0|1,0,1]=4 977 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O CS-0130633 [0,1,0,1,0,0|1,0,1]=4 978 B9R1.84 O=C(O)CCC1CCC1 CS-0060765 [0,1,0,1,0,0|0,0,1]=3 979 B9R1.148 CC1(O)CNCCOC1 CS-0505489 [0,1,0,1,0,0|2,0,0]=4 980 B9R1.148 FC1(F)CCCNCC1 CS-0051120 [0,1,0,1,0,0|2,0,0]=4 981 B9R2.49 C1CC2CCC1CN2 CS-0052039 [0,0,0,2,0,0|1,0,0]=3 982 B9R2.49 C1CN2CCC1CC2 CS-W013663 [0,0,0,2,0,0|2,0,0]=4 983 B9R2.65 OCC1C2CNCC12 CS-0129465 [0,0,0,2,0,0|1,0,0]=3 984 B9R2.65 [C@@H]12CNC[C@@H]1[C@H]2CO CS-0049369 [0,0,0,2,0,0|1,0,0]=3 985 B9R2.68 C1CC2CCC(C1)N2 CS-0049977 [0,0,0,2,0,0|1,0,0]=3 986 B9R2.68 C1CC2CNCC1O2 CS-M0310 [0,0,0,2,0,0|1,0,0]=3 987 B9R2.68 C1CC2CNCC1O2 CS-W005626 [0,0,0,2,0,0|1,0,0]=3 988 B9R2.68 C1CC2COCC1N2 CS-0054659 [0,0,0,2,0,0|2,0,0]=4 989 B9R2.68 C1CC2COCC1N2 CS-W003900 [0,0,0,2,0,0|2,0,0]=4 990 B9R2.68 C1CN2CCC(C2)N1 CS-0052728 [0,0,0,2,0,0|2,0,0]=4 991 B9R2.174 C1CC2(CCN1)CC2 CS-0036883 [0,0,0,2,0,0|2,0,0]=4 992 B9R2.174 C1CC2(CCN1)CC2 CS-0047202 [0,0,0,2,0,0|2,0,0]=4 993 B9R2.174 C1CNC2(CC2)CN1 CS-B0651 [0,0,0,2,0,0|2,0,0]=4 994 B9R2.174 C1CNCC2(C1)CC2 CS-0138597 [0,0,0,2,0,0|2,0,0]=4 995 B9R2.174 C1COC2(CC2)CN1 CS-0050790 [0,0,0,2,0,0|1,0,0]=3 996 B9R2.6 CC12CCCCC1O2 CS-0152704 [0,0,0,2,0,0|0,0,0]=2 997 B9R2.39 BrC1CC2CCC1C2 CS-0139601 [0,0,0,2,0,0|1,0,0]=3 998 B9R2.39 CN1CC2CC1CN2 CS-0067198 [0,0,0,2,0,0|2,0,0]=4 999 B9R2.39 CN1CC2CC1CN2 CS-0309731 [0,0,0,2,0,0|2,0,0]=4 1000 B9R2.39 CN1C[C@@H]2C[C@H]1CN2 CS-0053549 [0,0,0,2,0,0|2,0,0]=4 1001 B9R2.39 N[C@@H]1C[C@H]2CC[C@@H]1C2 CS-0119860 [0,0,0,2,0,0|1,0,0]=3 1002 B9R2.39 O=C1CC2CCC1C2 CS-0072123 [0,0,0,2,0,0|0,0,2]=4 1003 B9R2.39 OC1CC2CCC1C2 CS-0214941 [0,0,0,2,0,0|0,0,0]=2 1004 B9R2.39 [C@H]1(N)C[C@@H]2CC[C@H]1C2 CS-0044000 [0,0,0,2,0,0|1,0,0]=3 1005 B9R2.39 [C@H]12CC[C@H](C1)[C@H](Br)C2 CS-0094482 [0,0,0,2,0,0|1,0,0]=3 1006 B9R2.39 [C@H]12CC[C@H](C1)[C@H](O)C2 CS-0063194 [0,0,0,2,0,0|0,0,0]=2 1007 B9R2.109 O=C1CCCC2CC12 CS-0049777 [0,0,0,2,0,0|0,0,2]=4 1008 B9R2.109 O=C1CCCC2OC12 CS-0155446 [0,0,0,2,0,0|1,0,1]=4 1009 B9R2.2 C1CC(C2CC2)CN1 CS-0128662 [0,0,0,2,0,0|2,0,0]=4 1010 B9R2.3 C1CC2CNCC2C1 CS-D1515 [0,0,0,2,0,0|1,0,0]=3 1011 B9R2.3 C1NCC2COCC12 CS-0071682 [0,0,0,2,0,0|1,0,0]=3 1012 B9R2.3 [C@@H]12CNC[C@@H]1COC2 CS-0047214 [0,0,0,2,0,0|1,0,0]=3 1013 B9R2.3 [C@H]12CCC[C@H]1CNC2 CS-0047006 [0,0,0,2,0,0|1,0,0]=3 1014 B9R2.3 [C@H]12CNC[C@@H]1COC2 CS-0047740 [0,0,0,2,0,0|1,0,0]=3 1015 B9R2.173 C1CC2(C1)CCNC2 CS-0050333 [0,0,0,2,0,0|2,0,0]=4 1016 B9R2.173 C1CC2(C1)CCNC2 CS-0050334 [0,0,0,2,0,0|2,0,0]=4 1017 B9R2.173 C1CCC2(C1)CNC2 CS-0197672 [0,0,0,2,0,0|2,0,0]=4 1018 B9R2.173 C1COC2(C1)CNC2 CS-0050419 [0,0,0,2,0,0|1,0,0]=3 1019 B9R2.173 C1COC2(CNC2)O1 CS-0100360 [0,0,0,2,0,0|2,0,0]=4 1020 B9R2.5 O=C1CCCC12CC2 CS-0139731 [0,0,0,2,0,0|0,0,2]=4 1021 B9R2.36 O=C1CCC1C2CC2 CS-0670396 [0,0,0,2,0,0|0,0,2]=4 1022 B9R2.69 C(CC1CO1)C2CO2 CS-0040215 [0,0,0,2,0,0|1,0,0]=3