0 B7R0.3 C#CCCC(=O)OC CS-0137200 [0,0,0,0,0,0|2,0,2]=4 1 B7R0.3 C#CCNC(=O)CN CS-0179644 [0,0,0,0,0,0|2,0,2]=4 2 B7R0.3 C=CC(=O)NCCN CS-0128084 [0,0,0,0,0,0|2,0,2]=4 3 B7R0.3 C=CC(=O)OCCBr CS-0106645 [0,0,0,0,0,0|1,0,2]=3 4 B7R0.3 C=CC(=O)OCCO CS-W013616 [0,0,0,0,0,0|1,0,2]=3 5 B7R0.3 C=CCCC(=O)OC CS-0187527 [0,0,0,0,0,0|2,0,2]=4 6 B7R0.3 C=CCOC(=O)CCl CS-W013366 [0,0,0,0,0,0|1,0,2]=3 7 B7R0.3 C=CCOC(=O)OC CS-0040098 [0,0,0,0,0,0|1,0,2]=3 8 B7R0.3 CCCCC(=O)O[Na] CS-W007087 [0,0,0,0,0,0|3,0,0]=3 9 B7R0.3 CCCCC(O)CO CS-W013596 [0,0,0,0,0,0|2,0,2]=4 10 B7R0.3 CCCC[C@@H](N)CO CS-0089933 [0,0,0,0,0,0|3,0,1]=4 11 B7R0.3 CCCC[C@@H](N)CO CS-0162184 [0,0,0,0,0,0|3,0,1]=4 12 B7R0.3 CCCC\C(O)=N\N CS-W013606 [0,0,0,0,0,0|3,0,1]=4 13 B7R0.3 CCCNC(=O)CCl CS-0074801 [0,0,0,0,0,0|2,0,0]=2 14 B7R0.3 CCCOC(=O)OC CS-0111112 [0,0,0,0,0,0|1,0,0]=1 15 B7R0.3 CNCCC(=O)OC CS-0150994 [0,0,0,0,0,0|3,0,0]=3 16 B7R0.3 COC(=O)C#CCO CS-0029743 [0,0,0,0,0,0|3,0,1]=4 17 B7R0.3 COC(=O)CCC#N CS-W009546 [0,0,0,0,0,0|3,0,1]=4 18 B7R0.3 COC(=O)CCCBr CS-W004701 [0,0,0,0,0,0|3,0,0]=3 19 B7R0.3 COC(=O)CCCCl CS-0001466 [0,0,0,0,0,0|3,0,0]=3 20 B7R0.3 COC(=O)CCCI CS-0001467 [0,0,0,0,0,0|3,0,0]=3 21 B7R0.3 COC(=O)CCCN CS-W019991 [0,0,0,0,0,0|3,0,0]=3 22 B7R0.3 COC(=O)CCSC CS-0128902 [0,0,0,0,0,0|3,0,0]=3 23 B7R0.3 COC(=O)\C=C\CBr CS-0146524 [0,0,0,0,0,0|3,0,1]=4 24 B7R0.3 COC(=O)\C=C\CBr CS-W008761 [0,0,0,0,0,0|3,0,1]=4 25 B7R0.3 COC(=O)\C=C\CN CS-0187948 [0,0,0,0,0,0|3,0,1]=4 26 B7R0.3 COCCC(=O)OC CS-0072438 [0,0,0,0,0,0|3,0,0]=3 27 B7R0.3 CO\C=C\C(=O)OC CS-0076974 [0,0,0,0,0,0|3,0,1]=4 28 B7R0.3 CO\C=C\C(=O)OC CS-W007972 [0,0,0,0,0,0|3,0,1]=4 29 B7R0.3 NCCNC(=O)CCl CS-0697880 [0,0,0,0,0,0|3,0,0]=3 30 B6R0.1 C#CC(=O)NCC CS-0168077 [1,0,0,0,0,0|1,0,2]=4 31 B6R0.1 C=CC(=O)NCC CS-W013719 [1,0,0,0,0,0|1,0,2]=4 32 B6R0.1 C=CCC(=O)OC CS-0158011 [1,0,0,0,0,0|1,0,2]=4 33 B6R0.1 CC#CC(=O)OC CS-0066219 [1,0,0,0,0,0|1,0,2]=4 34 B6R0.1 CCC(=O)COC CS-0213932 [1,0,0,0,0,0|1,0,0]=2 35 B6R0.1 CCCC(=O)NN CS-0152447 [1,0,0,0,0,0|2,0,0]=3 36 B6R0.1 CCCC(Cl)CC CS-0102884 [1,0,0,0,0,0|1,0,1]=3 37 B6R0.1 CCCC(O)CO CS-0017222 [1,0,0,0,0,0|1,0,2]=4 38 B6R0.1 CCC[C@H](N)CO CS-M1841 [1,0,0,0,0,0|2,0,1]=4 39 B6R0.1 CCC[C@H](N)CO CS-M2256 [1,0,0,0,0,0|2,0,1]=4 40 B6R0.1 CCNC(=O)CBr CS-0239382 [1,0,0,0,0,0|2,0,0]=3 41 B6R0.1 CCOC(=O)C#N CS-0022374 [1,0,0,0,0,0|1,0,1]=3 42 B6R0.1 CCOC(=O)CN CS-W020007 [1,0,0,0,0,0|1,0,0]=2 43 B6R0.1 CCOC(=O)CO CS-W019892 [1,0,0,0,0,0|1,0,0]=2 44 B6R0.1 CCOC(=O)NN CS-W008412 [1,0,0,0,0,0|2,0,0]=3 45 B6R0.1 CCOC(C)CC CS-0196425 [1,0,0,0,0,0|1,0,1]=3 46 B6R0.1 CCO\C(C)=N\O CS-W013688 [1,0,0,0,0,0|3,0,0]=4 47 B6R0.1 CNC(=O)CC#N CS-W018827 [1,0,0,0,0,0|2,0,1]=4 48 B6R0.1 CNC(=O)CCCl CS-0143787 [1,0,0,0,0,0|2,0,0]=3 49 B6R0.1 CNC(=O)CCO CS-0188403 [1,0,0,0,0,0|2,0,0]=3 50 B6R0.1 CNCC(=O)O[Na] CS-0077129 [1,0,0,0,0,0|3,0,0]=4 51 B6R0.1 COC(=O)CC#N CS-W016657 [1,0,0,0,0,0|2,0,1]=4 52 B6R0.1 COC(=O)CCBr CS-W008728 [1,0,0,0,0,0|2,0,0]=3 53 B6R0.1 COC(=O)CCCl CS-0131786 [1,0,0,0,0,0|2,0,0]=3 54 B6R0.1 COC(=O)CCI CS-0615889 [1,0,0,0,0,0|2,0,0]=3 55 B6R0.1 COC(=O)CCN CS-W007648 [1,0,0,0,0,0|2,0,0]=3 56 B6R0.1 COC(=O)CCO CS-0022864 [1,0,0,0,0,0|2,0,0]=3 57 B6R0.1 COC(=O)CCS CS-0000049 [1,0,0,0,0,0|2,0,0]=3 58 B6R0.1 COC(=O)OCCl CS-0067504 [1,0,0,0,0,0|2,0,0]=3 59 B6R0.1 COCC(=O)NN CS-W005634 [1,0,0,0,0,0|3,0,0]=4 60 B6R0.1 NNC(=O)CCS CS-0513962 [1,0,0,0,0,0|3,0,0]=4 61 B6R0.1 O=C(CCl)NCO CS-0147071 [1,0,0,0,0,0|3,0,0]=4 62 B6R0.4 C#CCNC(C)=O CS-0434175 [1,0,0,0,0,0|1,0,2]=4 63 B6R0.4 C#CCOC(C)=O CS-0158541 [1,0,0,0,0,0|0,0,2]=3 64 B6R0.4 CC(=O)CCCCl CS-W013569 [1,0,0,0,0,0|2,0,0]=3 65 B6R0.4 CC(=O)CCCO CS-0020001 [1,0,0,0,0,0|2,0,0]=3 66 B6R0.4 CC(=O)NCCO CS-W013689 [1,0,0,0,0,0|2,0,0]=3 67 B6R0.4 CC(=O)OCCBr CS-W007598 [1,0,0,0,0,0|1,0,0]=2 68 B6R0.4 CC(=O)OCCN CS-0657679 [1,0,0,0,0,0|1,0,0]=2 69 B6R0.4 CC(=O)OCCO CS-0154995 [1,0,0,0,0,0|1,0,0]=2 70 B6R0.4 CC(C)=CCCBr CS-0155165 [1,0,0,0,0,0|3,0,0]=4 71 B6R0.4 CC(C)OCCBr CS-W018660 [1,0,0,0,0,0|2,0,1]=4 72 B6R0.4 CCC#CC(=O)O CS-W013726 [1,0,0,0,0,0|2,0,1]=4 73 B6R0.4 CCCCC(=N)N CS-0122242 [1,0,0,0,0,0|3,0,0]=4 74 B6R0.4 CCCCC(N)=S CS-0248646 [1,0,0,0,0,0|2,1,0]=4 75 B6R0.4 CCCCS(=O)[O-] CS-0851776 [1,0,0,0,0,0|3,0,0]=4 76 B6R0.4 CCCC[C@@H](C)O CS-0179419 [1,0,0,0,0,0|1,0,2]=4 77 B6R0.4 CCCC[C@H](C)O CS-0179420 [1,0,0,0,0,0|1,0,2]=4 78 B6R0.4 CCCNC(C)=O CS-0246738 [1,0,0,0,0,0|1,0,0]=2 79 B6R0.4 CCCOC(N)=O CS-W019060 [1,0,0,0,0,0|1,0,0]=2 80 B6R0.4 CCNCC(=O)O CS-0201673 [1,0,0,0,0,0|3,0,0]=4 81 B6R0.4 CCOCC(=O)O CS-0071579 [1,0,0,0,0,0|3,0,0]=4 82 B6R0.4 CCSCC(=O)O CS-0197336 [1,0,0,0,0,0|3,0,0]=4 83 B6R0.4 CC\C=C\C(=O)O CS-0053528 [1,0,0,0,0,0|2,0,1]=4 84 B6R0.4 CNCCC(=O)O CS-0112815 [1,0,0,0,0,0|3,0,0]=4 85 B6R0.4 CNCCC(=O)O CS-0169148 [1,0,0,0,0,0|3,0,0]=4 86 B6R0.4 CNCCC(N)=O CS-0214971 [1,0,0,0,0,0|3,0,0]=4 87 B6R0.4 COCCC(=O)O CS-W009112 [1,0,0,0,0,0|3,0,0]=4 88 B6R0.4 CO\C=C\C(C)=O CS-0145411 [1,0,0,0,0,0|2,0,1]=4 89 B6R0.4 CO\C=C\C(C)=O CS-W013712 [1,0,0,0,0,0|2,0,1]=4 90 B6R0.4 CS(=O)CCCN CS-0286765 [1,0,0,0,0,0|3,0,0]=4 91 B6R0.4 CSCCC(=O)O CS-6296 [1,0,0,0,0,0|3,0,0]=4 92 B6R0.4 CSCCC(C)=O CS-0206726 [1,0,0,0,0,0|2,0,0]=3 93 B6R0.4 NC(=O)NCCCl CS-0317452 [1,0,0,0,0,0|3,0,0]=4 94 B6R0.4 NCCCC(=O)O CS-W020704 [1,0,0,0,0,0|3,0,0]=4 95 B6R0.4 NCCCC(N)=O CS-0103894 [1,0,0,0,0,0|3,0,0]=4 96 B6R0.4 NCCNC(N)=O CS-0139236 [1,0,0,0,0,0|3,0,0]=4 97 B6R0.4 O=C(O)CCCBr CS-W016047 [1,0,0,0,0,0|3,0,0]=4 98 B6R0.4 O=C(O)CCCCl CS-W013545 [1,0,0,0,0,0|3,0,0]=4 99 B6R0.6 BrCCOCCBr CS-W014174 [1,0,0,0,0,0|2,0,1]=4 100 B6R0.6 C(CC)=CCCO CS-W009552 [1,0,0,0,0,0|2,0,0]=3 101 B6R0.6 C(CO)=CCCC CS-W016652 [1,0,0,0,0,0|2,0,0]=3 102 B6R0.6 CCC#CCCO CS-0040171 [1,0,0,0,0,0|2,0,1]=4 103 B6R0.6 CCCCCCI CS-0132388 [1,0,0,0,0,0|2,0,1]=4 104 B6R0.6 CCCCCCN CS-0196786 [1,0,0,0,0,0|2,0,1]=4 105 B6R0.6 CCCNCCC CS-0187381 [1,0,0,0,0,0|1,0,1]=3 106 B6R0.6 CCCNCCC CS-0214120 [1,0,0,0,0,0|1,0,1]=3 107 B6R0.6 CCCNCCO CS-0105782 [1,0,0,0,0,0|2,0,1]=4 108 B6R0.6 CCCOCCCl CS-0200392 [1,0,0,0,0,0|1,0,1]=3 109 B6R0.6 CCC\C=C\C=O CS-0099263 [1,0,0,0,0,0|2,0,1]=4 110 B6R0.6 CCNCCCN CS-0151962 [1,0,0,0,0,0|3,0,0]=4 111 B6R0.6 CCOCCCO CS-W013685 [1,0,0,0,0,0|3,0,0]=4 112 B6R0.6 CC\C=C/CCO CS-W011323 [1,0,0,0,0,0|2,0,0]=3 113 B6R0.6 ICCOCCI CS-W011980 [1,0,0,0,0,0|2,0,1]=4 114 B6R0.6 NCCOCCN CS-0114847 [1,0,0,0,0,0|2,0,1]=4 115 B6R0.6 NCCOCCN CS-0115750 [1,0,0,0,0,0|2,0,1]=4 116 B6R0.6 NCCOCCO CS-1013822 [1,0,0,0,0,0|2,0,1]=4 117 B6R0.6 NCCOCCO CS-1013830 [1,0,0,0,0,0|2,0,1]=4 118 B6R0.6 NCCOCCO CS-1014116 [1,0,0,0,0,0|2,0,1]=4 119 B6R0.6 OCCOCCBr CS-0114928 [1,0,0,0,0,0|2,0,1]=4 120 B6R0.6 OCCOCCCl CS-0016058 [1,0,0,0,0,0|2,0,1]=4 121 B6R0.6 OCCOCCF CS-0199113 [1,0,0,0,0,0|2,0,1]=4 122 B6R0.6 OCCOCCI CS-0139452 [1,0,0,0,0,0|2,0,1]=4 123 B8R0.1 C#CCCC(=O)CCO CS-0038477 [0,1,0,0,0,0|1,0,2]=4 124 B8R0.1 C#CCCC(=O)OCC CS-0044527 [0,1,0,0,0,0|1,0,2]=4 125 B8R0.1 C(CBr)=CC(=O)OCC CS-W007837 [0,1,0,0,0,0|2,0,1]=4 126 B8R0.1 C=CCOC(=O)OCC CS-0197813 [0,1,0,0,0,0|0,0,2]=3 127 B8R0.1 CCCCC(O)CCC CS-0362569 [0,1,0,0,0,0|1,0,2]=4 128 B8R0.1 CCCCN(C)CCO CS-0132259 [0,1,0,0,0,0|3,0,0]=4 129 B8R0.1 CCCNC(=O)CC#N CS-0215383 [0,1,0,0,0,0|1,0,1]=3 130 B8R0.1 CCCOC(=O)CC#N CS-0217234 [0,1,0,0,0,0|0,0,1]=2 131 B8R0.1 CCOC(=O)CCC#N CS-0094471 [0,1,0,0,0,0|2,0,1]=4 132 B8R0.1 CCOC(=O)CCCBr CS-W020133 [0,1,0,0,0,0|2,0,0]=3 133 B8R0.1 CCOC(=O)CCCI CS-0029516 [0,1,0,0,0,0|2,0,0]=3 134 B8R0.1 CCOC(=O)CCCN CS-W010794 [0,1,0,0,0,0|2,0,0]=3 135 B8R0.1 CCOC(=O)CCNN CS-0151578 [0,1,0,0,0,0|3,0,0]=4 136 B8R0.1 CCOCC(=O)OCC CS-0151430 [0,1,0,0,0,0|2,0,0]=3 137 B8R0.3 CCCC(N)C(=O)OC CS-0152454 [0,1,0,0,0,0|2,0,0]=3 138 B8R0.3 CCC[C@H](N)C(=O)OC CS-0152592 [0,1,0,0,0,0|2,0,0]=3 139 B8R0.3 CCOC(=O)C(=O)CC CS-W005382 [0,1,0,0,0,0|2,0,0]=3 140 B8R0.3 COC(=O)C(C)CCCl CS-0205287 [0,1,0,0,0,0|3,0,0]=4 141 B8R0.3 COC(=O)[C@@H](N)CSC CS-0654810 [0,1,0,0,0,0|3,0,0]=4 142 B8R0.3 COC[C@@H](N)C(=O)OC CS-0162497 [0,1,0,0,0,0|3,0,0]=4 143 B8R0.6 C#CCCCC(=O)OC CS-0127624 [0,1,0,0,0,0|2,0,1]=4 144 B8R0.6 C=CC(=O)CCCCC CS-0168504 [0,1,0,0,0,0|1,0,2]=4 145 B8R0.6 C=CC(=O)NCCCC CS-0152107 [0,1,0,0,0,0|1,0,2]=4 146 B8R0.6 C=CCCCC(=O)OC CS-0015919 [0,1,0,0,0,0|2,0,1]=4 147 B8R0.6 CCCCCC(=O)NN CS-0152328 [0,1,0,0,0,0|3,0,0]=4 148 B8R0.6 CCCCCC(O)CC CS-0152331 [0,1,0,0,0,0|1,0,2]=4 149 B8R0.6 CCCCC[C@@H](O)CC CS-0464840 [0,1,0,0,0,0|1,0,2]=4 150 B8R0.6 CCCCNC(=O)CCl CS-0116592 [0,1,0,0,0,0|2,0,0]=3 151 B8R0.6 CCCCOC(=O)CN CS-0571899 [0,1,0,0,0,0|1,0,0]=2 152 B8R0.6 CCCCOC(=O)CS CS-0297731 [0,1,0,0,0,0|1,0,0]=2 153 B8R0.6 CCC\C=C\C(=O)OC CS-W013465 [0,1,0,0,0,0|2,0,0]=3 154 B8R0.6 CNCCCC(=O)OC CS-0112438 [0,1,0,0,0,0|2,0,0]=3 155 B8R0.6 COC(=O)CCCC#N CS-0216788 [0,1,0,0,0,0|2,0,1]=4 156 B8R0.6 COC(=O)CCCCBr CS-W022866 [0,1,0,0,0,0|2,0,0]=3 157 B8R0.6 COC(=O)CCCCCl CS-0098043 [0,1,0,0,0,0|2,0,0]=3 158 B8R0.6 COC(=O)CCCCN CS-0018002 [0,1,0,0,0,0|2,0,0]=3 159 B8R0.6 COC(=O)CCCCO CS-0021769 [0,1,0,0,0,0|2,0,0]=3 160 B8R0.6 COC(=O)COCCCl CS-0209481 [0,1,0,0,0,0|2,0,0]=3 161 B8R0.6 COCCCC(=O)OC CS-W011093 [0,1,0,0,0,0|2,0,0]=3 162 B8R0.6 COC\C=C\C(=O)OC CS-0528723 [0,1,0,0,0,0|2,0,1]=4 163 B8R0.6 O=C(CCCCO)O[Na] CS-0047732 [0,1,0,0,0,0|3,0,0]=4 164 B8R0.8 C=C(C)C(=O)NCCO CS-0160432 [0,1,0,0,0,0|2,0,1]=4 165 B8R0.8 C=C(C)C(=O)OCCN CS-0112263 [0,1,0,0,0,0|1,0,1]=3 166 B8R0.8 C=C(C)C(=O)OCCO CS-W013439 [0,1,0,0,0,0|1,0,1]=3 167 B8R0.8 CCCCC(=O)C(=O)O CS-0069654 [0,1,0,0,0,0|2,0,1]=4 168 B8R0.9 CCC(=O)NCC(=O)O CS-0643654 [0,1,0,0,0,0|2,0,1]=4 169 B8R0.9 COC(=O)CCC(C)=O CS-0023754 [0,1,0,0,0,0|2,0,1]=4 170 B8R0.9 COC(=O)CC[C@H](C)N CS-0572078 [0,1,0,0,0,0|2,0,0]=3 171 B8R0.9 COC(=O)CNC(C)C CS-0200417 [0,1,0,0,0,0|3,0,0]=4 172 B8R0.11 CCCCC(CC)CBr CS-W004392 [0,1,0,0,0,0|2,0,1]=4 173 B8R0.11 CCCCC(CC)CCl CS-W016329 [0,1,0,0,0,0|2,0,1]=4 174 B8R0.11 CCCCC(CC)CO CS-0016002 [0,1,0,0,0,0|1,0,2]=4 175 B8R0.19 CCC(=O)CC(=O)CC CS-W013466 [0,1,0,0,0,0|1,0,1]=3 176 B8R0.19 CCC(=O)CC(=O)OC CS-W011110 [0,1,0,0,0,0|2,0,1]=4 177 B8R0.19 CC[C@@H](O)CC(=O)OC CS-0852565 [0,1,0,0,0,0|2,0,0]=3 178 B8R0.19 CNC(C)CC(=O)OC CS-0124917 [0,1,0,0,0,0|3,0,0]=4 179 B8R0.19 COC(=O)N[C@@H](C)CN CS-0010956 [0,1,0,0,0,0|3,0,0]=4 180 B8R1.1 C=CC1COC(=O)O1 CS-W011250 [0,0,0,1,0,0|1,0,2]=4 181 B8R1.1 CCC1CCC(=O)N1 CS-0046651 [0,0,0,1,0,0|1,0,0]=2 182 B8R1.1 CCC1COC(=O)N1 CS-0447690 [0,0,0,1,0,0|2,0,0]=3 183 B8R1.1 CCC1COC(=O)O1 CS-0187002 [0,0,0,1,0,0|1,0,0]=2 184 B8R1.1 CC[C@H]1COC(=O)N1 CS-0093963 [0,0,0,1,0,0|2,0,0]=3 185 B8R1.1 COC1=CC(=O)CC1 CS-0040746 [0,0,0,1,0,0|2,0,1]=4 186 B8R1.1 N#C[C@@H]1CCC(=O)C1 CS-0056414 [0,0,0,1,0,0|2,0,1]=4 187 B8R1.1 NCC1CCC(=O)N1 CS-0029734 [0,0,0,1,0,0|2,0,0]=3 188 B8R1.1 NCC1CCC(=O)N1 CS-0075962 [0,0,0,1,0,0|2,0,0]=3 189 B8R1.1 NCC1CNC(=O)C1 CS-0051184 [0,0,0,1,0,0|3,0,0]=4 190 B8R1.1 NC[C@@H]1CCC(=O)N1 CS-0144990 [0,0,0,1,0,0|2,0,0]=3 191 B8R1.1 NC[C@H]1CCC(=O)N1 CS-0105178 [0,0,0,1,0,0|2,0,0]=3 192 B8R1.1 O=C1CC(CO)CN1 CS-0046664 [0,0,0,1,0,0|3,0,0]=4 193 B8R1.1 O=C1CC(CO)CO1 CS-0037642 [0,0,0,1,0,0|3,0,0]=4 194 B8R1.1 O=C1CCC(CO)C1 CS-0315717 [0,0,0,1,0,0|2,0,0]=3 195 B8R1.1 O=C1CCC(CO)N1 CS-W001608 [0,0,0,1,0,0|2,0,0]=3 196 B8R1.1 O=C1CCC(CO)O1 CS-0113560 [0,0,0,1,0,0|1,0,0]=2 197 B8R1.1 O=C1CC[C@@H](CBr)N1 CS-B0460 [0,0,0,1,0,0|2,0,0]=3 198 B8R1.1 O=C1CC[C@@H](CO)N1 CS-B0366 [0,0,0,1,0,0|2,0,0]=3 199 B8R1.1 O=C1CC[C@H](CO)N1 CS-W001840 [0,0,0,1,0,0|2,0,0]=3 200 B8R1.1 O=C1NC(CO)CO1 CS-0309754 [0,0,0,1,0,0|3,0,0]=4 201 B8R1.1 O=C1NCC(CO)O1 CS-0113076 [0,0,0,1,0,0|2,0,0]=3 202 B8R1.1 O=C1NC[C@@H](CCl)O1 CS-0186187 [0,0,0,1,0,0|2,0,0]=3 203 B8R1.1 O=C1NC[C@@H](CO)O1 CS-0067235 [0,0,0,1,0,0|2,0,0]=3 204 B8R1.1 O=C1NC[C@H](CCl)O1 CS-0436811 [0,0,0,1,0,0|2,0,0]=3 205 B8R1.1 O=C1NC[C@H](CO)O1 CS-0131343 [0,0,0,1,0,0|2,0,0]=3 206 B8R1.1 O=C1N[C@@H](CF)CO1 CS-0256092 [0,0,0,1,0,0|3,0,0]=4 207 B8R1.1 O=C1N[C@@H](CI)CO1 CS-0149725 [0,0,0,1,0,0|3,0,0]=4 208 B8R1.1 O=C1N[C@@H](CO)CO1 CS-0067476 [0,0,0,1,0,0|3,0,0]=4 209 B8R1.1 O=C1N[C@H](CO)CO1 CS-0216909 [0,0,0,1,0,0|3,0,0]=4 210 B8R1.1 O=C1OCC(CO)O1 CS-0158426 [0,0,0,1,0,0|2,0,0]=3 211 B8R1.1 OC1=NCC(CCl)O1 CS-W011062 [0,0,0,1,0,0|2,0,1]=4 212 B8R1.2 BrCC1CCCCO1 CS-0214963 [0,0,0,1,0,0|2,0,1]=4 213 B8R1.2 CCC1CNCCO1 CS-0080681 [0,0,0,1,0,0|2,0,1]=4 214 B8R1.2 CC[C@@H]1CNCCO1 CS-0096526 [0,0,0,1,0,0|2,0,1]=4 215 B8R1.2 CC[C@H]1CNCCO1 CS-0100795 [0,0,0,1,0,0|2,0,1]=4 216 B8R1.2 COC1=NCCCC1 CS-0150206 [0,0,0,1,0,0|3,0,0]=4 217 B8R1.2 COC1CCCCO1 CS-0197358 [0,0,0,1,0,0|2,0,1]=4 218 B8R1.2 ICC1CCCCO1 CS-0058218 [0,0,0,1,0,0|2,0,1]=4 219 B8R1.2 OCC1CCCCO1 CS-0034490 [0,0,0,1,0,0|2,0,1]=4 220 B8R1.3 CC1=NNC(=O)CC1 CS-W011268 [0,0,0,1,0,0|2,0,1]=4 221 B8R1.3 CC1CCC(=O)CC1 CS-W013656 [0,0,0,1,0,0|1,0,0]=2 222 B8R1.3 CC1CCC(=O)NC1 CS-0009361 [0,0,0,1,0,0|1,0,0]=2 223 B8R1.3 CC1CCC(O)CC1 CS-0059254 [0,0,0,1,0,0|1,0,2]=4 224 B8R1.3 CC1CNC(=O)CO1 CS-0444103 [0,0,0,1,0,0|2,0,0]=3 225 B8R1.3 CN1CCC(=O)CC1 CS-W009198 [0,0,0,1,0,0|2,0,0]=3 226 B8R1.3 C[C@@H]1CNC(=O)CO1 CS-0478990 [0,0,0,1,0,0|2,0,0]=3 227 B8R1.3 C[C@@H]1CO[C@H](C)CN1 CS-0158230 [0,0,0,1,0,0|2,0,1]=4 228 B8R1.3 C[C@H]1CC[C@@H](N)CC1 CS-0170852 [0,0,0,1,0,0|2,0,1]=4 229 B8R1.3 C[C@H]1CC[C@@H](O)CC1 CS-0180937 [0,0,0,1,0,0|1,0,2]=4 230 B8R1.3 C[C@H]1CC[C@H](N)CC1 CS-W003376 [0,0,0,1,0,0|2,0,1]=4 231 B8R1.3 C[C@H]1CC[C@H](N)CC1 CS-W011254 [0,0,0,1,0,0|2,0,1]=4 232 B8R1.3 C[C@H]1CC[C@H](O)CC1 CS-0180938 [0,0,0,1,0,0|1,0,2]=4 233 B8R1.3 C[C@H]1CNC(=O)CO1 CS-0478989 [0,0,0,1,0,0|2,0,0]=3 234 B8R1.3 C[C@H]1CO[C@@H](C)CN1 CS-W021076 [0,0,0,1,0,0|2,0,1]=4 235 B8R1.3 NC1CCC(=O)CC1 CS-W005034 [0,0,0,1,0,0|2,0,0]=3 236 B8R1.3 NC1CCC(=O)NC1 CS-0050676 [0,0,0,1,0,0|2,0,0]=3 237 B8R1.3 N[C@H]1CCC(=O)NC1 CS-0185259 [0,0,0,1,0,0|2,0,0]=3 238 B8R1.3 O=C1CCC(=O)CC1 CS-W011270 [0,0,0,1,0,0|2,0,1]=4 239 B8R1.3 O=C1CCC(O)CC1 CS-D0911 [0,0,0,1,0,0|2,0,0]=3 240 B8R1.3 O=C1CCC(O)CN1 CS-D0057 [0,0,0,1,0,0|2,0,0]=3 241 B8R1.3 O=C1CCS(=O)CC1 CS-0188184 [0,0,0,1,0,0|3,0,0]=4 242 B8R1.3 O=C1CC[C@H](O)CN1 CS-D0042 [0,0,0,1,0,0|2,0,0]=3 243 B8R1.3 O=C1COC(=O)CO1 CS-0046191 [0,0,0,1,0,0|2,0,1]=4 244 B8R1.5 C=C1CCCNC1=O CS-0312427 [0,0,0,1,0,0|1,0,2]=4 245 B8R1.5 CC1=NCCCN1C CS-W021273 [0,0,0,1,0,0|3,0,0]=4 246 B8R1.5 CC1CCCCC1N CS-W013646 [0,0,0,1,0,0|2,0,1]=4 247 B8R1.5 CC1CCCNC1=O CS-0186670 [0,0,0,1,0,0|1,0,0]=2 248 B8R1.5 CC1CNCCC1=O CS-D0046 [0,0,0,1,0,0|2,0,0]=3 249 B8R1.5 CC1CNCCC1=O CS-D0300 [0,0,0,1,0,0|2,0,0]=3 250 B8R1.5 CC1COCCC1=O CS-W003860 [0,0,0,1,0,0|2,0,0]=3 251 B8R1.5 CC1NCCNC1=O CS-0046850 [0,0,0,1,0,0|2,0,0]=3 252 B8R1.5 CN1CCCNC1=O CS-0068150 [0,0,0,1,0,0|2,0,0]=3 253 B8R1.5 CN1CCNCC1=O CS-0052424 [0,0,0,1,0,0|3,0,0]=4 254 B8R1.5 CN1CCNCC1=O CS-D0697 [0,0,0,1,0,0|3,0,0]=4 255 B8R1.5 CN1CCOCC1=O CS-0145226 [0,0,0,1,0,0|3,0,0]=4 256 B8R1.5 C[C@@H]1CCCC[C@@H]1N CS-0158236 [0,0,0,1,0,0|2,0,1]=4 257 B8R1.5 C[C@@H]1NCCNC1=O CS-0130514 [0,0,0,1,0,0|2,0,0]=3 258 B8R1.5 C[C@H]1CCCC[C@H]1N CS-0162390 [0,0,0,1,0,0|2,0,1]=4 259 B8R1.5 C[C@H]1NCCNC1=O CS-0042202 [0,0,0,1,0,0|2,0,0]=3 260 B8R1.5 NC1CCCCC1=O CS-0099232 [0,0,0,1,0,0|2,0,0]=3 261 B8R1.5 NC1CCCN=C1O CS-W005854 [0,0,0,1,0,0|2,0,1]=4 262 B8R1.5 NC1CCCNC1=O CS-D0182 [0,0,0,1,0,0|2,0,0]=3 263 B8R1.5 N[C@@H]1CCCNC1=O CS-0102181 [0,0,0,1,0,0|2,0,0]=3 264 B8R1.5 N[C@H]1CCCNC1=O CS-0112427 [0,0,0,1,0,0|2,0,0]=3 265 B8R1.5 O=C1CCCCC1=O CS-W007347 [0,0,0,1,0,0|2,0,1]=4 266 B8R1.5 O=C1CCCCC1Cl CS-W013402 [0,0,0,1,0,0|2,0,0]=3 267 B8R1.5 O=C1CCCCC1O CS-0262973 [0,0,0,1,0,0|2,0,0]=3 268 B8R1.5 O=C1CCNCC1F CS-0044438 [0,0,0,1,0,0|3,0,0]=4 269 B8R1.5 O=C1CCOCC1Br CS-0039271 [0,0,0,1,0,0|3,0,0]=4 270 B8R1.5 O=C1CCOCC1F CS-0051355 [0,0,0,1,0,0|3,0,0]=4 271 B8R1.5 O=C1NCCCC1O CS-W008630 [0,0,0,1,0,0|2,0,0]=3 272 B8R1.22 BrC1=CCCCCC1 CS-0448697 [0,0,0,1,0,0|2,0,0]=3 273 B8R1.22 BrC1CCCCCC1 CS-0146614 [0,0,0,1,0,0|2,0,1]=4 274 B8R1.22 C=C1OCCCCO1 CS-W006464 [0,0,0,1,0,0|2,0,0]=3 275 B8R1.22 ClC1CCCCCC1 CS-0155300 [0,0,0,1,0,0|2,0,1]=4 276 B8R1.22 NC1CCCCCC1 CS-0071927 [0,0,0,1,0,0|2,0,1]=4 277 B8R1.22 O=C1C=CCCCC1 CS-W007594 [0,0,0,1,0,0|1,0,1]=3 278 B8R1.22 O=C1CCCCCN1 CS-W011258 [0,0,0,1,0,0|1,0,0]=2 279 B8R1.22 O=C1CCCCNC1 CS-0155246 [0,0,0,1,0,0|2,0,0]=3 280 B8R1.22 O=C1CCCNCC1 CS-W001845 [0,0,0,1,0,0|2,0,0]=3 281 B8R1.22 O=C1CCNCCN1 CS-W003673 [0,0,0,1,0,0|2,0,0]=3 282 B8R1.22 O=C1CCOCCN1 CS-W021289 [0,0,0,1,0,0|2,0,0]=3 283 B8R1.22 O=C1COCCCN1 CS-0037454 [0,0,0,1,0,0|2,0,0]=3 284 B8R1.22 O=C1OCCCCO1 CS-0665438 [0,0,0,1,0,0|1,0,0]=2 285 B8R1.22 OC1=NCCNCC1 CS-W011246 [0,0,0,1,0,0|2,0,1]=4 286 B8R1.22 OC1CCCCCC1 CS-W013633 [0,0,0,1,0,0|1,0,2]=4 287 B8R1.38 CCC(N)C1CCC1 CS-0655543 [0,0,0,1,0,0|2,0,1]=4 288 B8R1.38 CNC(=O)C1CNC1 CS-0184861 [0,0,0,1,0,0|3,0,0]=4 289 B8R1.38 COC(=O)C1CCC1 CS-W013640 [0,0,0,1,0,0|2,0,0]=3 290 B8R1.38 COC(=O)C1CNC1 CS-D1541 [0,0,0,1,0,0|3,0,0]=4 291 B8R1.38 COC(=O)C1COC1 CS-0045513 [0,0,0,1,0,0|3,0,0]=4 292 B8R1.38 O=C(CCl)N1CCC1 CS-0054578 [0,0,0,1,0,0|2,0,0]=3 293 B8R1.40 NCC(=O)NC1CC1 CS-0077363 [0,0,0,1,0,0|2,0,0]=3 294 B8R1.40 O=C(CBr)NC1CC1 CS-0627309 [0,0,0,1,0,0|2,0,0]=3 295 B8R1.40 O\C(CCl)=N/C1CC1 CS-W005640 [0,0,0,1,0,0|2,0,1]=4 296 B8R1.50 CC1=C(O)COC1=O CS-0085459 [0,0,0,1,0,0|1,0,2]=4 297 B8R1.50 CC1C(=O)CCC1=O CS-W013660 [0,0,0,1,0,0|2,0,1]=4 298 B8R1.50 CC1CCC(=O)C1=O CS-W011271 [0,0,0,1,0,0|2,0,1]=4 299 B8R1.50 O=C1COC(=O)C1Cl CS-0155475 [0,0,0,1,0,0|2,0,1]=4 300 B8R1.50 O=C1OC[C@@H](O)[C@H]1O CS-0157912 [0,0,0,1,0,0|2,0,0]=3 301 B8R1.52 CCC1(O)CCCC1 CS-W013632 [0,0,0,1,0,0|1,0,2]=4 302 B8R1.52 CC[N+]1(C)CCCC1 CS-0185898 [0,0,0,1,0,0|3,0,0]=4 303 B8R1.52 CC[N+]1(C)CCCC1 CS-W015752 [0,0,0,1,0,0|3,0,0]=4 304 B5R0.1 CC(=O)CCCl CS-W022162 [2,0,0,0,0,0|1,0,0]=3 305 B5R0.1 CC(=O)CCN CS-0209803 [2,0,0,0,0,0|1,0,0]=3 306 B5R0.1 CC(=O)NCO CS-0061075 [2,0,0,0,0,0|2,0,0]=4 307 B5R0.1 CC(=O)OCBr CS-0090812 [2,0,0,0,0,0|1,0,0]=3 308 B5R0.1 CC(=O)OCCl CS-0139458 [2,0,0,0,0,0|1,0,0]=3 309 B5R0.1 CCCC(=N)N CS-W013544 [2,0,0,0,0,0|2,0,0]=4 310 B5R0.1 CCCC(=O)O CS-0977378 [2,0,0,0,0,0|1,0,0]=3 311 B5R0.1 CCCC(N)=O CS-0130522 [2,0,0,0,0,0|1,0,0]=3 312 B5R0.1 CCC[C@@H](C)N CS-0162182 [2,0,0,0,0,0|1,0,1]=4 313 B5R0.1 CCC[C@H](C)N CS-W006528 [2,0,0,0,0,0|1,0,1]=4 314 B5R0.1 CCNC(N)=O CS-W011351 [2,0,0,0,0,0|2,0,0]=4 315 B5R0.1 CCOC(=N)N CS-W019160 [2,0,0,0,0,0|2,0,0]=4 316 B5R0.1 CCOC(C)=N CS-W008601 [2,0,0,0,0,0|1,0,0]=3 317 B5R0.1 CCOC(N)=O CS-4731 [2,0,0,0,0,0|1,0,0]=3 318 B5R0.1 CNCC(=O)O CS-W013507 [2,0,0,0,0,0|2,0,0]=4 319 B5R0.1 CNCC(=O)O CS-W018511 [2,0,0,0,0,0|2,0,0]=4 320 B5R0.1 CNCC(N)=O CS-W011178 [2,0,0,0,0,0|2,0,0]=4 321 B5R0.1 COCC(=O)O CS-W020123 [2,0,0,0,0,0|2,0,0]=4 322 B5R0.1 CSCC(=O)O CS-0015159 [2,0,0,0,0,0|2,0,0]=4 323 B5R0.1 CSCC(N)=O CS-0150088 [2,0,0,0,0,0|2,0,0]=4 324 B5R0.1 CSCS(C)=O CS-0146450 [2,0,0,0,0,0|2,0,0]=4 325 B5R0.1 C\C=C\C(C)=O CS-0022376 [2,0,0,0,0,0|0,0,2]=4 326 B5R0.1 C\C=C\C(C)=O CS-0513711 [2,0,0,0,0,0|0,0,2]=4 327 B5R0.1 NC(=O)CCBr CS-0046169 [2,0,0,0,0,0|2,0,0]=4 328 B5R0.1 NC(=O)CCCl CS-0204808 [2,0,0,0,0,0|2,0,0]=4 329 B5R0.1 NC(=O)CCO CS-0205185 [2,0,0,0,0,0|2,0,0]=4 330 B5R0.1 NCCC(=O)O CS-0668359 [2,0,0,0,0,0|2,0,0]=4 331 B5R0.1 NCCC(=O)O CS-W020126 [2,0,0,0,0,0|2,0,0]=4 332 B5R0.1 O=C(O)CCF CS-0038385 [2,0,0,0,0,0|2,0,0]=4 333 B5R0.1 O=C(O)CCI CS-0204563 [2,0,0,0,0,0|2,0,0]=4 334 B5R0.1 O=C(O)CCO CS-0147832 [2,0,0,0,0,0|2,0,0]=4 335 B5R0.2 CCNCCO CS-0076051 [2,0,0,0,0,0|2,0,0]=4 336 B5R0.2 CCSCCN CS-0663845 [2,0,0,0,0,0|1,1,0]=4 337 B5R0.2 CC\C=C\C=O CS-0173472 [2,0,0,0,0,0|1,0,1]=4 338 B5R0.2 C\C=C\CCO CS-0162245 [2,0,0,0,0,0|1,0,1]=4 339 B5R0.2 N#CCOC=O CS-0181845 [2,0,0,0,0,0|1,0,1]=4 340 B5R0.3 CCC(=O)CBr CS-0131119 [2,0,0,0,0,0|1,0,0]=3 341 B5R0.3 CCC(=O)CN CS-W005374 [2,0,0,0,0,0|1,0,0]=3 342 B5R0.3 CCC(=O)CO CS-W005327 [2,0,0,0,0,0|1,0,0]=3 343 B5R0.3 CCC(=O)NC CS-0179730 [2,0,0,0,0,0|1,0,0]=3 344 B5R0.3 CCC(=O)NN CS-0206618 [2,0,0,0,0,0|2,0,0]=4 345 B5R0.3 CCC(=O)O[K] CS-0019431 [2,0,0,0,0,0|1,0,0]=3 346 B5R0.3 CCC(=O)O[Na] CS-0013802 [2,0,0,0,0,0|1,0,0]=3 347 B5R0.3 CCC(Br)CC CS-0015742 [2,0,0,0,0,0|1,0,1]=4 348 B5R0.3 CCC(N)CC CS-0128806 [2,0,0,0,0,0|1,0,1]=4 349 B5R0.3 CCC(O)CC CS-0128838 [2,0,0,0,0,0|0,0,2]=4 350 B5R0.3 CCS(=O)CC CS-0199213 [2,0,0,0,0,0|1,0,0]=3 351 B5R0.3 CCS(=O)O[Na] CS-0020098 [2,0,0,0,0,0|2,0,0]=4 352 B5R0.3 CNC(=O)CBr CS-0023001 [2,0,0,0,0,0|2,0,0]=4 353 B5R0.3 CNC(=O)CCl CS-W007769 [2,0,0,0,0,0|2,0,0]=4 354 B5R0.3 CNC(=O)CI CS-0244983 [2,0,0,0,0,0|2,0,0]=4 355 B5R0.3 CNC(=O)CN CS-0008246 [2,0,0,0,0,0|2,0,0]=4 356 B5R0.3 CNC(=O)CN CS-0130384 [2,0,0,0,0,0|2,0,0]=4 357 B5R0.3 COC(=N)CCl CS-0150960 [2,0,0,0,0,0|2,0,0]=4 358 B5R0.3 COC(=O)CI CS-0235696 [2,0,0,0,0,0|1,0,0]=3 359 B5R0.3 COC(=O)CN CS-W018508 [2,0,0,0,0,0|1,0,0]=3 360 B5R0.3 COC(=O)CO CS-W004068 [2,0,0,0,0,0|1,0,0]=3 361 B5R0.3 COC(=O)NN CS-0015902 [2,0,0,0,0,0|2,0,0]=4 362 B5R0.3 COC(=O)SCl CS-0313613 [2,0,0,0,0,0|2,0,0]=4 363 B5R0.3 COS(=O)OC CS-0230894 [2,0,0,0,0,0|2,0,0]=4 364 B5R0.3 NCC(=O)O[Na] CS-W016662 [2,0,0,0,0,0|2,0,0]=4 365 B5R0.3 O=C(CBr)CBr CS-W020932 [2,0,0,0,0,0|2,0,0]=4 366 B5R0.3 O=C(CI)O[Na] CS-0014819 [2,0,0,0,0,0|2,0,0]=4 367 B5R0.3 O=C(CO)CO CS-W019614 [2,0,0,0,0,0|2,0,0]=4 368 B5R0.3 O=C(CS)O[Na] CS-0197966 [2,0,0,0,0,0|2,0,0]=4 369 B7R0.2 CC(C)CC(=O)NN CS-0343165 [1,1,0,0,0,0|2,0,0]=4 370 B7R0.2 CC(C)NC(=O)CCl CS-0128417 [1,1,0,0,0,0|2,0,0]=4 371 B7R0.2 CC(C)OC(=O)CN CS-0154172 [1,1,0,0,0,0|1,0,0]=3 372 B7R0.2 CC(O)CC(=O)O[Na] CS-W011168 [1,1,0,0,0,0|2,0,0]=4 373 B7R0.2 CCC(=O)CC(C)=O CS-W023089 [1,1,0,0,0,0|0,0,1]=3 374 B7R0.2 CCC(C)CC(C)N CS-W016309 [1,1,0,0,0,0|1,0,1]=4 375 B7R0.2 COC(=O)CC(C)N CS-0147336 [1,1,0,0,0,0|1,0,0]=3 376 B7R0.2 COC(=O)C[C@@H](C)N CS-0003933 [1,1,0,0,0,0|1,0,0]=3 377 B7R0.2 COC(=O)C[C@@H](C)N CS-0059282 [1,1,0,0,0,0|1,0,0]=3 378 B7R0.2 COC(=O)C[C@H](C)N CS-0147334 [1,1,0,0,0,0|1,0,0]=3 379 B7R0.2 C[C@@H](O)CC(=O)O[Na] CS-W016567 [1,1,0,0,0,0|2,0,0]=4 380 B7R0.2 [C@@H](C)(O)CC(=O)OC CS-W013601 [1,1,0,0,0,0|1,0,0]=3 381 B7R0.2 [C@H](C)(O)CC(=O)OC CS-W011223 [1,1,0,0,0,0|1,0,0]=3 382 B7R0.5 CC(C)C(=O)CC#N CS-0044094 [1,1,0,0,0,0|1,0,1]=4 383 B7R0.5 CCCC(=O)C(C)=O CS-0258819 [1,1,0,0,0,0|0,0,1]=3 384 B7R0.5 CCOC(=O)C(=N)N CS-0151910 [1,1,0,0,0,0|1,0,1]=4 385 B7R0.5 CCOC(=O)C(=O)O CS-W018770 [1,1,0,0,0,0|1,0,1]=4 386 B7R0.5 CCOC(=O)C(=O)[O-] CS-0046170 [1,1,0,0,0,0|1,0,1]=4 387 B7R0.5 CCOC(=O)C(C)=O CS-0017821 [1,1,0,0,0,0|0,0,1]=3 388 B7R0.5 CCOC(=O)C(C)N CS-0151889 [1,1,0,0,0,0|0,0,0]=2 389 B7R0.5 CCOC(=O)C(F)Br CS-0198023 [1,1,0,0,0,0|1,0,0]=3 390 B7R0.5 CCOC(=O)C(F)Cl CS-0434923 [1,1,0,0,0,0|1,0,0]=3 391 B7R0.5 CCOC(=O)C(N)=O CS-0008213 [1,1,0,0,0,0|1,0,1]=4 392 B7R0.5 CCOC(=O)C(N)=S CS-M2164 [1,1,0,0,0,0|1,0,1]=4 393 B7R0.5 CCOC(=O)[C@H](C)F CS-0670914 [1,1,0,0,0,0|0,0,0]=2 394 B7R0.5 CCOC(=O)[C@H](C)N CS-0009409 [1,1,0,0,0,0|0,0,0]=2 395 B7R0.5 COCC(=O)N(C)C CS-0356748 [1,1,0,0,0,0|2,0,0]=4 396 B7R0.5 [C@H](C)(O)C(=O)OCC CS-W013602 [1,1,0,0,0,0|0,0,0]=2 397 B7R0.7 C#CCC(=O)OCC CS-0667023 [1,1,0,0,0,0|0,0,1]=3 398 B7R0.7 C=C=CC(=O)OCC CS-0204496 [1,1,0,0,0,0|0,0,2]=4 399 B7R0.7 C=CCC(=O)OCC CS-0147250 [1,1,0,0,0,0|0,0,1]=3 400 B7R0.7 CC#CC(=O)OCC CS-W009547 [1,1,0,0,0,0|0,0,1]=3 401 B7R0.7 CCCC(Br)CCC CS-0106173 [1,1,0,0,0,0|1,0,1]=4 402 B7R0.7 CCCC(O)CCC CS-0132313 [1,1,0,0,0,0|0,0,2]=4 403 B7R0.7 CCC[C@H](N)CCO CS-0152589 [1,1,0,0,0,0|1,0,1]=4 404 B7R0.7 CCNC(=O)CC#N CS-0141694 [1,1,0,0,0,0|1,0,1]=4 405 B7R0.7 CCNC(=O)CCCl CS-0151980 [1,1,0,0,0,0|1,0,0]=3 406 B7R0.7 CCNC(=S)NCC CS-0076442 [1,1,0,0,0,0|1,1,0]=4 407 B7R0.7 CCOC(=O)C#CBr CS-W022671 [1,1,0,0,0,0|0,0,2]=4 408 B7R0.7 CCOC(=O)CCBr CS-W007449 [1,1,0,0,0,0|0,0,0]=2 409 B7R0.7 CCOC(=O)CCI CS-W002223 [1,1,0,0,0,0|0,0,0]=2 410 B7R0.7 CCOC(=O)CCN CS-W019943 [1,1,0,0,0,0|0,0,0]=2 411 B7R0.7 CCOC(=O)CCO CS-0139545 [1,1,0,0,0,0|0,0,0]=2 412 B7R0.7 CCOC(=O)CNC CS-W020595 [1,1,0,0,0,0|0,0,0]=2 413 B7R0.7 CCOC(=O)CNN CS-W002085 [1,1,0,0,0,0|1,0,0]=3 414 B7R0.7 CCOC(=O)COC CS-0008463 [1,1,0,0,0,0|0,0,0]=2 415 B7R0.7 CCOC(=O)CSC CS-0133049 [1,1,0,0,0,0|0,0,0]=2 416 B7R0.7 CCOC(=O)OCCl CS-W005334 [1,1,0,0,0,0|1,0,0]=3 417 B7R0.7 CC\N=C(/O)NCC CS-W013607 [1,1,0,0,0,0|1,0,1]=4 418 B7R0.7 COCC(=O)COC CS-W007070 [1,1,0,0,0,0|1,0,0]=3 419 B7R0.7 O=C(CCCl)CCCl CS-W004439 [1,1,0,0,0,0|1,0,0]=3 420 B7R0.10 CCC(=O)C(=O)CC CS-W013639 [1,1,0,0,0,0|0,0,1]=3 421 B7R0.10 CCC(=O)N(C)OC CS-0122993 [1,1,0,0,0,0|2,0,0]=4 422 B7R0.10 CCC(N)C(=O)OC CS-W018067 [1,1,0,0,0,0|1,0,0]=3 423 B7R0.10 CC[C@@H](N)C(=O)OC CS-0059300 [1,1,0,0,0,0|1,0,0]=3 424 B7R0.10 CC[C@@H](O)C(=O)OC CS-0099841 [1,1,0,0,0,0|1,0,0]=3 425 B7R0.10 CC[C@H](N)C(=O)OC CS-0031391 [1,1,0,0,0,0|1,0,0]=3 426 B7R0.10 CC[C@H](O)C(=O)OC CS-0138542 [1,1,0,0,0,0|1,0,0]=3 427 B7R0.10 CN[C@@H](C)C(=O)OC CS-0068182 [1,1,0,0,0,0|2,0,0]=4 428 B7R0.10 COC(=O)C(Br)CO CS-0187469 [1,1,0,0,0,0|2,0,0]=4 429 B7R0.10 COC(=O)C(C)CN CS-0253549 [1,1,0,0,0,0|2,0,0]=4 430 B7R0.10 COC(=O)C(C)CO CS-0697290 [1,1,0,0,0,0|2,0,0]=4 431 B7R0.10 COC(=O)C(Cl)OC CS-0698983 [1,1,0,0,0,0|2,0,0]=4 432 B7R0.10 COC(=O)C(N)CO CS-W014338 [1,1,0,0,0,0|2,0,0]=4 433 B7R0.10 COC(=O)C(N)CS CS-0150913 [1,1,0,0,0,0|2,0,0]=4 434 B7R0.10 COC(=O)C(O)CN CS-0042395 [1,1,0,0,0,0|2,0,0]=4 435 B7R0.10 COC(=O)C(O)CO CS-0454216 [1,1,0,0,0,0|2,0,0]=4 436 B7R0.10 COC(=O)[C@@H](C)CBr CS-0130400 [1,1,0,0,0,0|2,0,0]=4 437 B7R0.10 COC(=O)[C@@H](C)CO CS-W023098 [1,1,0,0,0,0|2,0,0]=4 438 B7R0.10 COC(=O)[C@@H](N)CO CS-B1301 [1,1,0,0,0,0|2,0,0]=4 439 B7R0.10 COC(=O)[C@@H](N)CS CS-4557 [1,1,0,0,0,0|2,0,0]=4 440 B7R0.10 COC(=O)[C@@H](O)CN CS-0131698 [1,1,0,0,0,0|2,0,0]=4 441 B7R0.10 COC(=O)[C@@H](O)CO CS-W000794 [1,1,0,0,0,0|2,0,0]=4 442 B7R0.10 COC(=O)[C@H](C)CBr CS-0158189 [1,1,0,0,0,0|2,0,0]=4 443 B7R0.10 COC(=O)[C@H](C)CO CS-0019967 [1,1,0,0,0,0|2,0,0]=4 444 B7R0.10 COC(=O)[C@H](N)CCl CS-W017536 [1,1,0,0,0,0|2,0,0]=4 445 B7R0.10 COC(=O)[C@H](N)CS CS-W020211 [1,1,0,0,0,0|2,0,0]=4 446 B7R0.10 COC(=O)[C@H](O)CO CS-W023221 [1,1,0,0,0,0|2,0,0]=4 447 B7R0.10 [C@@H](N)(CO)C(=O)OC CS-W016249 [1,1,0,0,0,0|2,0,0]=4 448 B7R0.11 CCOS(=O)(=O)CC CS-0044478 [1,1,0,0,0,0|1,0,0]=3 449 B7R0.4 CC(=O)CCCCCl CS-W013363 [1,1,0,0,0,0|1,0,0]=3 450 B7R0.4 CC(=O)OCCCCl CS-W017752 [1,1,0,0,0,0|0,0,0]=2 451 B7R0.4 CC(=O)OCCCI CS-0166646 [1,1,0,0,0,0|0,0,0]=2 452 B7R0.4 CCCCNC(N)=O CS-0071736 [1,1,0,0,0,0|2,0,0]=4 453 B7R0.4 CCCCOC(=S)[S-] CS-0187867 [1,1,0,0,0,0|1,1,0]=4 454 B7R0.4 CCCNCC(=O)O CS-0250530 [1,1,0,0,0,0|2,0,0]=4 455 B7R0.4 CCCOCC(=O)O CS-0152048 [1,1,0,0,0,0|1,0,0]=3 456 B7R0.4 CCCSCC(=O)O CS-0651549 [1,1,0,0,0,0|1,1,0]=4 457 B7R0.4 CCC\C=C\C(=O)O CS-W011247 [1,1,0,0,0,0|2,0,0]=4 458 B7R0.4 CCC\C=C\C(C)=O CS-0152429 [1,1,0,0,0,0|1,0,0]=3 459 B7R0.4 CNCCCC(=O)O CS-0096860 [1,1,0,0,0,0|2,0,0]=4 460 B7R0.4 CNCCCC(=O)O CS-0133777 [1,1,0,0,0,0|2,0,0]=4 461 B7R0.4 COCCCC(=O)O CS-W001021 [1,1,0,0,0,0|2,0,0]=4 462 B7R0.4 NC(=O)COCCCl CS-0149936 [1,1,0,0,0,0|2,0,0]=4 463 B7R0.4 NCCCCC(=O)O CS-0181832 [1,1,0,0,0,0|2,0,0]=4 464 B7R0.4 NCCCCC(=O)O CS-W016594 [1,1,0,0,0,0|2,0,0]=4 465 B7R0.4 NCCOCC(=O)O CS-0115741 [1,1,0,0,0,0|2,0,0]=4 466 B7R0.4 NCCOCC(=O)O CS-0115743 [1,1,0,0,0,0|2,0,0]=4 467 B7R0.4 NCCOCC(=O)O CS-0127947 [1,1,0,0,0,0|2,0,0]=4 468 B7R0.4 O=C(O)CCCCBr CS-W017172 [1,1,0,0,0,0|2,0,0]=4 469 B7R0.4 O=C(O)CCCCCl CS-W022362 [1,1,0,0,0,0|2,0,0]=4 470 B7R0.4 O=C(O)COCCBr CS-0105329 [1,1,0,0,0,0|2,0,0]=4 471 B7R0.4 O=C(O)COCCCl CS-W006556 [1,1,0,0,0,0|2,0,0]=4 472 B7R0.4 O=C(O)COCCS CS-0115755 [1,1,0,0,0,0|2,0,0]=4 473 B7R0.4 O=C(O)COCCS CS-0115757 [1,1,0,0,0,0|2,0,0]=4 474 B7R0.4 O=C([O-])COCCO CS-0158309 [1,1,0,0,0,0|2,0,0]=4 475 B7R0.4 O=[N+]([O-])OCCCO CS-0213543 [1,1,0,0,0,0|2,0,0]=4 476 B7R0.6 C=C(C)CCC(C)=O CS-0225159 [1,1,0,0,0,0|1,0,1]=4 477 B7R0.6 CC(=O)CCC(C)=O CS-D1203 [1,1,0,0,0,0|1,0,1]=4 478 B7R0.6 CC(=O)CNC(C)=O CS-0154040 [1,1,0,0,0,0|1,0,1]=4 479 B7R0.6 CC(=O)OCC(=O)O CS-0155005 [1,1,0,0,0,0|1,0,1]=4 480 B7R0.6 CC(=O)OCC(N)=S CS-0248602 [1,1,0,0,0,0|1,0,1]=4 481 B7R0.6 CC(=O)\C=C\C(C)C CS-0199438 [1,1,0,0,0,0|1,0,1]=4 482 B7R0.6 CC(C)CCC(=O)O CS-W016598 [1,1,0,0,0,0|2,0,0]=4 483 B7R0.6 CC(N)CCC(=O)O CS-0276521 [1,1,0,0,0,0|2,0,0]=4 484 B7R0.6 C[C@H](N)CCC(=O)O CS-0529054 [1,1,0,0,0,0|2,0,0]=4 485 B7R0.8 CCCOS(C)(=O)=O CS-0152047 [1,1,0,0,0,0|1,0,0]=3 486 B7R0.1 CCCCCCCBr CS-W017293 [1,1,0,0,0,0|1,0,1]=4 487 B7R0.1 CCCCCCCO CS-0152146 [1,1,0,0,0,0|1,0,1]=4 488 B7R0.1 CCCCNCCO CS-0077079 [1,1,0,0,0,0|2,0,0]=4 489 B7R0.1 CCCOCCCN CS-0213493 [1,1,0,0,0,0|0,0,1]=3 490 B7R0.1 CCNCCCCO CS-0206547 [1,1,0,0,0,0|2,0,0]=4 491 B7R0.1 CNCCOCCO CS-0209922 [1,1,0,0,0,0|1,0,1]=4 492 B7R0.1 COCCOCCBr CS-0116183 [1,1,0,0,0,0|1,0,1]=4 493 B7R0.1 COCCOCCI CS-0150162 [1,1,0,0,0,0|1,0,1]=4 494 B7R0.1 COCCOCCN CS-0115786 [1,1,0,0,0,0|1,0,1]=4 495 B7R0.1 COCCOCCN CS-0115787 [1,1,0,0,0,0|1,0,1]=4 496 B7R0.1 COCCOCCN CS-0115788 [1,1,0,0,0,0|1,0,1]=4 497 B7R0.1 COCCOCCN CS-0115790 [1,1,0,0,0,0|1,0,1]=4 498 B7R0.1 COCCOCCN CS-W008429 [1,1,0,0,0,0|1,0,1]=4 499 B7R0.1 COCCOCCO CS-0116122 [1,1,0,0,0,0|1,0,1]=4 500 B7R0.1 COCCOCCO CS-0644881 [1,1,0,0,0,0|1,0,1]=4 501 B7R0.1 COCCOCCO CS-0889987 [1,1,0,0,0,0|1,0,1]=4 502 B7R0.1 COCCOCCO CS-W013578 [1,1,0,0,0,0|1,0,1]=4 503 B7R0.1 COCCOCCS CS-0115760 [1,1,0,0,0,0|1,0,1]=4 504 B7R0.1 COCCOCCS CS-0115764 [1,1,0,0,0,0|1,0,1]=4 505 B7R0.1 COCCOCCS CS-0650914 [1,1,0,0,0,0|1,0,1]=4 506 B9R0.4 C=CCOC(=O)CC(C)=O CS-W018294 [0,2,0,0,0,0|0,0,2]=4 507 B9R0.4 CC(=O)CC(=O)NCCO CS-0138442 [0,2,0,0,0,0|2,0,0]=4 508 B9R0.4 CCCOC(=O)CC(C)C CS-0453597 [0,2,0,0,0,0|0,0,0]=2 509 B9R0.5 C#CCCCC(=O)OCC CS-0532490 [0,2,0,0,0,0|1,0,1]=4 510 B9R0.5 CCCCOC(=O)CC#N CS-W016439 [0,2,0,0,0,0|0,0,1]=3 511 B9R0.5 CCC\C=C\C(=O)OCC CS-W018283 [0,2,0,0,0,0|1,0,0]=3 512 B9R0.5 CCOC(=O)CCCC#N CS-0151586 [0,2,0,0,0,0|1,0,1]=4 513 B9R0.5 CCOC(=O)CCCCBr CS-W008658 [0,2,0,0,0,0|1,0,0]=3 514 B9R0.5 CCOC(=O)CCCCN CS-W022699 [0,2,0,0,0,0|1,0,0]=3 515 B9R0.5 CCOC(=O)COCCCl CS-W018917 [0,2,0,0,0,0|1,0,0]=3 516 B9R0.5 CCOCCC(=O)OCC CS-W013312 [0,2,0,0,0,0|1,0,0]=3 517 B9R0.5 CCO\C=C\C(=O)OCC CS-0046174 [0,2,0,0,0,0|1,0,1]=4 518 B9R0.5 CCO\C=C\C(=O)OCC CS-W002052 [0,2,0,0,0,0|1,0,1]=4 519 B9R0.8 CCCCC(=O)N(C)OC CS-0123008 [0,2,0,0,0,0|2,0,0]=4 520 B9R0.8 CCCCC(Br)C(=O)OC CS-M2020 [0,2,0,0,0,0|2,0,0]=4 521 B9R0.8 CCCCC(N)C(=O)OC CS-W017144 [0,2,0,0,0,0|2,0,0]=4 522 B9R0.8 CCCC[C@H](N)C(=O)OC CS-0152444 [0,2,0,0,0,0|2,0,0]=4 523 B9R0.8 COC(=O)C(Br)CCCBr CS-0150917 [0,2,0,0,0,0|2,0,0]=4 524 B9R0.8 COC(=O)C(N)CCSC CS-0169307 [0,2,0,0,0,0|2,0,0]=4 525 B9R0.8 COC(=O)[C@@H](N)CCCN CS-W010477 [0,2,0,0,0,0|2,0,0]=4 526 B9R0.8 COC(=O)[C@@H](N)CCSC CS-W015632 [0,2,0,0,0,0|2,0,0]=4 527 B9R0.8 COC(=O)[C@H](N)CCSC CS-W015633 [0,2,0,0,0,0|2,0,0]=4 528 B9R0.18 C=CCOC(=O)NCCBr CS-0697868 [0,2,0,0,0,0|0,0,2]=4 529 B9R0.18 C=CCOC(=O)NCCN CS-0151406 [0,2,0,0,0,0|0,0,2]=4 530 B9R0.18 CCCCC(=O)CCCC CS-W018275 [0,2,0,0,0,0|1,0,0]=3 531 B9R0.18 CCCCS(=O)CCCC CS-0181824 [0,2,0,0,0,0|2,0,0]=4 532 B9R0.18 O=C(CCCCl)CCCCl CS-W018764 [0,2,0,0,0,0|2,0,0]=4 533 B9R0.18 O=C(NCCO)NCCO CS-0142124 [0,2,0,0,0,0|2,0,0]=4 534 B9R0.34 CCCC(=O)CC(=O)OC CS-W005176 [0,2,0,0,0,0|2,0,0]=4 535 B9R0.34 CCOC(=O)CC(=O)CC CS-W019881 [0,2,0,0,0,0|1,0,1]=4 536 B9R0.34 CCOC(=O)C[C@@H](O)CCl CS-W010802 [0,2,0,0,0,0|2,0,0]=4 537 B9R0.34 CCOC(=O)C[C@H](O)CCl CS-W017853 [0,2,0,0,0,0|2,0,0]=4 538 B9R0.35 CCCC(Br)C(=O)OCC CS-W015179 [0,2,0,0,0,0|1,0,0]=3 539 B9R0.35 CCC[C@@H](N)C(=O)OCC CS-0539079 [0,2,0,0,0,0|1,0,0]=3 540 B9R0.35 CCC[C@H](N)C(=O)OCC CS-M0539 [0,2,0,0,0,0|1,0,0]=3 541 B9R0.35 CCOC(=N)C(=O)OCC CS-W006056 [0,2,0,0,0,0|2,0,0]=4 542 B9R0.35 CCOC(=O)C(Cl)OCC CS-0663093 [0,2,0,0,0,0|2,0,0]=4 543 B9R0.35 CCOC(=O)C(N)CSC CS-0311793 [0,2,0,0,0,0|2,0,0]=4 544 B9R0.48 C=C(C)CCC(=O)OCC CS-W018285 [0,2,0,0,0,0|1,0,1]=4 545 B9R0.48 CCOC(=O)CCC(C)=O CS-0204023 [0,2,0,0,0,0|1,0,1]=4 546 B9R0.48 CCOC(=O)CCC(C)Br CS-0139323 [0,2,0,0,0,0|1,0,0]=3 547 B9R0.48 CCOC(=O)CCC(C)C CS-0151589 [0,2,0,0,0,0|1,0,0]=3 548 B9R0.48 CCOC(=O)CCN(C)C CS-0124937 [0,2,0,0,0,0|2,0,0]=4 549 B9R0.48 COCC(C)OCC(C)O CS-W016335 [0,2,0,0,0,0|1,0,1]=4 550 B9R0.6 CCOC(=O)C(=O)C(C)Br CS-W006537 [0,2,0,0,0,0|2,0,0]=4 551 B9R0.6 CCOC(=O)C(=O)C(C)C CS-0151907 [0,2,0,0,0,0|2,0,0]=4 552 B9R0.23 CNC(=O)C(N)CC(C)C CS-0273991 [0,2,0,0,0,0|2,0,0]=4 553 B9R0.23 COC(=O)C(Br)CC(C)C CS-0465894 [0,2,0,0,0,0|2,0,0]=4 554 B9R0.23 COC(=O)C(N)CC(C)C CS-0213107 [0,2,0,0,0,0|2,0,0]=4 555 B9R0.23 COC(=O)C(O)CC(C)C CS-0033017 [0,2,0,0,0,0|2,0,0]=4 556 B9R0.23 COC(=O)[C@H](N)CC(C)C CS-W017141 [0,2,0,0,0,0|2,0,0]=4 557 B9R0.23 [C@H](N)(CC(C)C)C(=O)OC CS-W017143 [0,2,0,0,0,0|2,0,0]=4 558 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC CS-W017139 [0,2,0,0,0,0|2,0,0]=4 559 B9R0.1 C=CC(=O)OCCN(C)C CS-W016416 [0,2,0,0,0,0|0,0,2]=4 560 B9R0.1 COC(=O)CCCC(C)=O CS-0090564 [0,2,0,0,0,0|2,0,0]=4 561 B9R0.24 CCC(=O)CCC(=O)CC CS-0152646 [0,2,0,0,0,0|1,0,0]=3 562 B9R0.46 C=CC(=O)OCCCCO CS-0167368 [0,2,0,0,0,0|0,0,2]=4 563 B9R0.46 CCCCCCC(=O)CC CS-0330265 [0,2,0,0,0,0|1,0,0]=3 564 B9R0.46 CCCCCCC(=O)OC CS-0182587 [0,2,0,0,0,0|2,0,0]=4 565 B9R0.46 COC(=O)CCCCCBr CS-W015176 [0,2,0,0,0,0|2,0,0]=4 566 B9R0.46 COC(=O)CCCCCN CS-W008066 [0,2,0,0,0,0|2,0,0]=4 567 B9R0.46 COC(=O)CCCCCO CS-0187523 [0,2,0,0,0,0|2,0,0]=4 568 B9R0.46 NCCCCNC(=O)CCl CS-0224033 [0,2,0,0,0,0|2,0,0]=4 569 B9R0.47 C=C(C)C(=O)NCCCN CS-W002334 [0,2,0,0,0,0|1,0,1]=4 570 B9R0.47 C=C(C)C(=O)OCCOC CS-W016392 [0,2,0,0,0,0|0,0,1]=3 571 B9R0.47 CCCCOC(=O)[C@H](C)N CS-0523493 [0,2,0,0,0,0|0,0,0]=2 572 B9R0.47 CCCCOC(=O)[C@H](C)O CS-0451298 [0,2,0,0,0,0|0,0,0]=2 573 B9R0.3 CC(C)(C)C(=O)SCCO CS-0097019 [0,2,0,0,0,0|1,1,0]=4 574 B9R0.7 C=C(C)C(=O)NCC(C)O CS-0115777 [0,2,0,0,0,0|1,0,1]=4 575 B9R0.7 CC(C)COC(=O)[C@H](C)N CS-0199364 [0,2,0,0,0,0|0,0,0]=2 576 B9R0.13 CCCCC(CC)C(=O)O CS-0196714 [0,2,0,0,0,0|1,0,1]=4 577 B9R0.13 CCCCC(CC)C(=O)O CS-W016381 [0,2,0,0,0,0|1,0,1]=4 578 B9R0.13 CCCCC(CC)C(=O)[O-] CS-0106411 [0,2,0,0,0,0|1,0,1]=4 579 B9R0.13 CCCCC(CC)C(=O)[O-] CS-0152385 [0,2,0,0,0,0|1,0,1]=4 580 B9R0.42 C=C(C)C(=O)OC(C)CO CS-W011008 [0,2,0,0,0,0|1,0,1]=4 581 B9R0.42 CCC(=O)OC(Cl)C(C)C CS-0152640 [0,2,0,0,0,0|0,0,0]=2 582 B9R0.42 COC(=O)C[C@@H](N)C(C)C CS-0171929 [0,2,0,0,0,0|2,0,0]=4 583 B9R0.42 COC(=O)C[C@H](N)C(C)C CS-0171932 [0,2,0,0,0,0|2,0,0]=4 584 B9R0.21 CC(C)(C)COC(=O)CBr CS-0879755 [0,2,0,0,0,0|1,0,0]=3 585 B9R0.21 COC(=O)OCC(F)(F)F CS-0162373 [0,2,0,0,0,0|2,0,0]=4 586 B7R1.1 CCC1CCCN1 CS-0454761 [1,0,0,1,0,0|1,0,1]=4 587 B7R1.1 CC[C@H]1CCCN1 CS-0197308 [1,0,0,1,0,0|1,0,1]=4 588 B7R1.1 COC1=NCCC1 CS-W022401 [1,0,0,1,0,0|2,0,0]=4 589 B7R1.2 CC1=CC(=O)CC1 CS-W013730 [1,0,0,1,0,0|0,0,2]=4 590 B7R1.2 CC1C=CC(=O)O1 CS-0152699 [1,0,0,1,0,0|0,0,2]=4 591 B7R1.2 CC1CCC(=O)O1 CS-W016654 [1,0,0,1,0,0|0,0,0]=2 592 B7R1.2 CC1CNC(=O)C1 CS-0040667 [1,0,0,1,0,0|1,0,0]=3 593 B7R1.2 CC1COC(=O)N1 CS-0181060 [1,0,0,1,0,0|2,0,0]=4 594 B7R1.2 CN1CCC(=O)C1 CS-0172438 [1,0,0,1,0,0|1,0,0]=3 595 B7R1.2 C[C@@H]1CCC(=O)N1 CS-0046592 [1,0,0,1,0,0|1,0,0]=3 596 B7R1.2 C[C@@H]1CNC(=O)O1 CS-0416189 [1,0,0,1,0,0|1,0,0]=3 597 B7R1.2 C[C@@H]1COC(=O)N1 CS-0158229 [1,0,0,1,0,0|2,0,0]=4 598 B7R1.2 C[C@@H]1COC(=O)O1 CS-0015926 [1,0,0,1,0,0|1,0,0]=3 599 B7R1.2 C[C@H]1CC(=O)CN1 CS-0567258 [1,0,0,1,0,0|1,0,0]=3 600 B7R1.2 C[C@H]1CCC(=O)N1 CS-0046594 [1,0,0,1,0,0|1,0,0]=3 601 B7R1.2 C[C@H]1CNC(=O)C1 CS-0055121 [1,0,0,1,0,0|1,0,0]=3 602 B7R1.2 C[C@H]1COC(=O)N1 CS-0059840 [1,0,0,1,0,0|2,0,0]=4 603 B7R1.2 C[C@H]1COC(=O)O1 CS-W011314 [1,0,0,1,0,0|1,0,0]=3 604 B7R1.2 NC1CNC(=O)C1 CS-W023257 [1,0,0,1,0,0|2,0,0]=4 605 B7R1.2 N[C@@H]1CNC(=O)C1 CS-W003954 [1,0,0,1,0,0|2,0,0]=4 606 B7R1.2 N[C@@H]1COC(=O)C1 CS-W009169 [1,0,0,1,0,0|2,0,0]=4 607 B7R1.2 N[C@H]1COC(=O)C1 CS-B1346 [1,0,0,1,0,0|2,0,0]=4 608 B7R1.2 O=C1CC(O)CN1 CS-W018808 [1,0,0,1,0,0|2,0,0]=4 609 B7R1.2 O=C1CCC(=O)C1 CS-D0815 [1,0,0,1,0,0|1,0,1]=4 610 B7R1.2 O=C1CCC(=O)O1 CS-0011581 [1,0,0,1,0,0|1,0,1]=4 611 B7R1.2 O=C1CCC(O)C1 CS-0051334 [1,0,0,1,0,0|1,0,0]=3 612 B7R1.2 O=C1C[C@@H](O)CN1 CS-W013709 [1,0,0,1,0,0|2,0,0]=4 613 B7R1.2 O=C1C[C@H](O)CN1 CS-W002597 [1,0,0,1,0,0|2,0,0]=4 614 B7R1.2 O=C1OCC(Cl)O1 CS-0046028 [1,0,0,1,0,0|2,0,0]=4 615 B7R1.2 O=C1OCC(F)O1 CS-0155468 [1,0,0,1,0,0|2,0,0]=4 616 B7R1.2 [C@@H]1(O)COC(=O)C1 CS-W013702 [1,0,0,1,0,0|2,0,0]=4 617 B7R1.3 BrC1=CCCCC1 CS-0155410 [1,0,0,1,0,0|1,0,1]=4 618 B7R1.3 BrC1CCCCC1 CS-W017925 [1,0,0,1,0,0|1,0,1]=4 619 B7R1.3 C=C1CCNCC1 CS-D0508 [1,0,0,1,0,0|2,0,0]=4 620 B7R1.3 CC1=NCCCO1 CS-1006941 [1,0,0,1,0,0|2,0,0]=4 621 B7R1.3 ClC1CCCCC1 CS-0198086 [1,0,0,1,0,0|1,0,1]=4 622 B7R1.3 IC1CCCCC1 CS-0148628 [1,0,0,1,0,0|1,0,1]=4 623 B7R1.3 NC1CCCCC1 CS-W013335 [1,0,0,1,0,0|1,0,1]=4 624 B7R1.3 NN1CCCCC1 CS-W007639 [1,0,0,1,0,0|2,0,0]=4 625 B7R1.3 O=C1CCCCN1 CS-W022933 [1,0,0,1,0,0|1,0,0]=3 626 B7R1.3 O=C1CCCCO1 CS-W013713 [1,0,0,1,0,0|0,0,0]=2 627 B7R1.3 O=C1CCCNC1 CS-0048756 [1,0,0,1,0,0|1,0,0]=3 628 B7R1.3 O=C1CCCNC1 CS-0185548 [1,0,0,1,0,0|1,0,0]=3 629 B7R1.3 O=C1CCCOC1 CS-D1576 [1,0,0,1,0,0|1,0,0]=3 630 B7R1.3 O=C1CCCSC1 CS-D0446 [1,0,0,1,0,0|1,0,0]=3 631 B7R1.3 O=C1CCOCC1 CS-D0601 [1,0,0,1,0,0|1,0,0]=3 632 B7R1.3 O=C1CCSCC1 CS-W002007 [1,0,0,1,0,0|1,0,0]=3 633 B7R1.3 O=C1CNCCN1 CS-B0039 [1,0,0,1,0,0|2,0,0]=4 634 B7R1.3 O=C1CNCCO1 CS-0098127 [1,0,0,1,0,0|1,0,0]=3 635 B7R1.3 O=C1COCCN1 CS-D1427 [1,0,0,1,0,0|2,0,0]=4 636 B7R1.3 O=C1COCCO1 CS-0031423 [1,0,0,1,0,0|1,0,0]=3 637 B7R1.3 O=C1CSCCN1 CS-W019146 [1,0,0,1,0,0|2,0,0]=4 638 B7R1.3 O=C1NCCCO1 CS-0088044 [1,0,0,1,0,0|1,0,0]=3 639 B7R1.3 O=C1OCCCO1 CS-0155207 [1,0,0,1,0,0|1,0,0]=3 640 B7R1.3 O=S1CCNCC1 CS-0043941 [1,0,0,1,0,0|2,0,0]=4 641 B7R1.3 OC1CCCCC1 CS-0017198 [1,0,0,1,0,0|0,0,2]=4 642 B7R1.3 OC1CCCCO1 CS-0015921 [1,0,0,1,0,0|0,0,2]=4 643 B7R1.3 ON1CCCCC1 CS-W016646 [1,0,0,1,0,0|1,0,1]=4 644 B7R1.3 S=C1CCCCC1 CS-0661522 [1,0,0,1,0,0|0,1,0]=3 645 B7R1.4 CC1=CCCC1=O CS-0180943 [1,0,0,1,0,0|0,0,2]=4 646 B7R1.4 CC1CCNC1=O CS-W004958 [1,0,0,1,0,0|1,0,0]=3 647 B7R1.4 CC1CCOC1=O CS-0152675 [1,0,0,1,0,0|0,0,0]=2 648 B7R1.4 CC1OCCC1=O CS-W011324 [1,0,0,1,0,0|1,0,0]=3 649 B7R1.4 CC1SCCC1=O CS-W011228 [1,0,0,1,0,0|1,0,0]=3 650 B7R1.4 CN1CCCC1=O CS-0017258 [1,0,0,1,0,0|1,0,0]=3 651 B7R1.4 CN1CCCC1=S CS-W013619 [1,0,0,1,0,0|1,1,0]=4 652 B7R1.4 CN1CCNC1=O CS-W005507 [1,0,0,1,0,0|2,0,0]=4 653 B7R1.4 CN1CCOC1=O CS-W016647 [1,0,0,1,0,0|1,0,0]=3 654 B7R1.4 NC1CCNC1=O CS-0113495 [1,0,0,1,0,0|2,0,0]=4 655 B7R1.4 NC1CCOC1=O CS-0051531 [1,0,0,1,0,0|1,0,0]=3 656 B7R1.4 NC1CCSC1=O CS-0021300 [1,0,0,1,0,0|1,1,0]=4 657 B7R1.4 NN1CCCC1=O CS-D0019 [1,0,0,1,0,0|2,0,0]=4 658 B7R1.4 NN1CCOC1=O CS-W013698 [1,0,0,1,0,0|2,0,0]=4 659 B7R1.4 N[C@@H]1CCNC1=O CS-0094049 [1,0,0,1,0,0|2,0,0]=4 660 B7R1.4 N[C@@H]1CCOC1=O CS-0022064 [1,0,0,1,0,0|1,0,0]=3 661 B7R1.4 N[C@@H]1CCSC1=O CS-0375845 [1,0,0,1,0,0|1,1,0]=4 662 B7R1.4 N[C@H]1CCNC1=O CS-W021173 [1,0,0,1,0,0|2,0,0]=4 663 B7R1.4 N[C@H]1CCOC1=O CS-0022019 [1,0,0,1,0,0|1,0,0]=3 664 B7R1.4 N[C@H]1CCSC1=O CS-6394 [1,0,0,1,0,0|1,1,0]=4 665 B7R1.4 O=C1NCCC1O CS-W005201 [1,0,0,1,0,0|2,0,0]=4 666 B7R1.4 O=C1NCC[C@@H]1O CS-W003342 [1,0,0,1,0,0|2,0,0]=4 667 B7R1.4 O=C1NCC[C@H]1F CS-0500742 [1,0,0,1,0,0|2,0,0]=4 668 B7R1.4 O=C1NCC[C@H]1O CS-W018663 [1,0,0,1,0,0|2,0,0]=4 669 B7R1.4 O=C1OCCC1Br CS-W001104 [1,0,0,1,0,0|1,0,0]=3 670 B7R1.4 O=C1OCCC1O CS-W013699 [1,0,0,1,0,0|1,0,0]=3 671 B7R1.4 O=C1OCC[C@@H]1O CS-0312594 [1,0,0,1,0,0|1,0,0]=3 672 B7R1.4 [C@@H]1(N)CCOC1=O CS-W011054 [1,0,0,1,0,0|1,0,0]=3 673 B7R1.4 [C@H]1(N)CCOC1=O CS-W016516 [1,0,0,1,0,0|1,0,0]=3 674 B7R1.22 CCC(N)C1CC1 CS-0052574 [1,0,0,1,0,0|1,0,1]=4 675 B7R1.22 CCC(O)C1CC1 CS-0052573 [1,0,0,1,0,0|0,0,2]=4 676 B7R1.22 COC(=O)[C@@H]1CO1 CS-0063139 [1,0,0,1,0,0|2,0,0]=4 677 B7R1.22 COC(=O)[C@H]1CO1 CS-B1238 [1,0,0,1,0,0|2,0,0]=4 678 B7R1.22 NNC(=O)C1CC1 CS-D0255 [1,0,0,1,0,0|2,0,0]=4 679 B7R1.22 O=C(CO)C1CC1 CS-0230656 [1,0,0,1,0,0|1,0,0]=3 680 B7R1.12 CC1CC1C(=O)O CS-0072900 [1,0,0,1,0,0|2,0,0]=4 681 B7R1.12 C[C@@H]1C[C@H]1C(=O)O CS-0047824 [1,0,0,1,0,0|2,0,0]=4 682 B7R1.12 C[C@H]1C[C@@H]1C(=O)O CS-0089165 [1,0,0,1,0,0|2,0,0]=4 683 B7R1.14 O=S1(=O)CCCO1 CS-W011195 [1,0,0,1,0,0|2,0,0]=4 684 B7R1.18 NC(=O)C1CCC1 CS-D0904 [1,0,0,1,0,0|2,0,0]=4 685 B7R1.18 O=C(O)C1CCC1 CS-W011325 [1,0,0,1,0,0|2,0,0]=4 686 B7R1.20 NC(=O)NC1CC1 CS-0073680 [1,0,0,1,0,0|2,0,0]=4 687 B7R1.20 O=C(O)CC1CC1 CS-W011326 [1,0,0,1,0,0|2,0,0]=4 688 B7R1.24 C1CNCCOC1 CS-0171615 [1,0,0,1,0,0|1,0,1]=4 689 B7R1.24 C1CNCCOC1 CS-B1101 [1,0,0,1,0,0|1,0,1]=4 690 B9R1.2 CCN1CCNC(=O)C1 CS-0145869 [0,1,0,1,0,0|2,0,0]=4 691 B9R1.2 CSC1CCCC(=O)C1 CS-0237612 [0,1,0,1,0,0|2,0,0]=4 692 B9R1.2 NCC1CCNC(=O)C1 CS-0037079 [0,1,0,1,0,0|2,0,0]=4 693 B9R1.2 O=C1CC(CO)CCN1 CS-0051145 [0,1,0,1,0,0|2,0,0]=4 694 B9R1.2 O=C1CCCC(CO)N1 CS-0099968 [0,1,0,1,0,0|2,0,0]=4 695 B9R1.2 O=C1COCC(CO)N1 CS-W022261 [0,1,0,1,0,0|2,0,0]=4 696 B9R1.2 O=C1COC[C@H](CO)N1 CS-0146689 [0,1,0,1,0,0|2,0,0]=4 697 B9R1.7 CCCC1CNC(=O)C1 CS-0061478 [0,1,0,1,0,0|2,0,0]=4 698 B9R1.7 CCCC1COC(=O)O1 CS-0134586 [0,1,0,1,0,0|1,0,0]=3 699 B9R1.7 CCC[C@@H]1COC(=O)C1 CS-0188536 [0,1,0,1,0,0|2,0,0]=4 700 B9R1.7 CCOC1=CC(=O)CC1 CS-0039741 [0,1,0,1,0,0|1,0,1]=4 701 B9R1.7 O=S1OCC(CCCl)O1 CS-M1076 [0,1,0,1,0,0|2,0,0]=4 702 B9R1.8 BrCCC1OCCCO1 CS-W010633 [0,1,0,1,0,0|0,0,2]=4 703 B9R1.8 CCOC1=NCCCC1 CS-0188155 [0,1,0,1,0,0|2,0,0]=4 704 B9R1.8 NCCC1=CCCCC1 CS-0072656 [0,1,0,1,0,0|2,0,0]=4 705 B9R1.8 NCCC1CCCCO1 CS-0084526 [0,1,0,1,0,0|1,0,1]=4 706 B9R1.8 OCCC1CCCCO1 CS-0068082 [0,1,0,1,0,0|1,0,1]=4 707 B9R1.15 CCC1CCCCC1=O CS-0103893 [0,1,0,1,0,0|1,0,0]=3 708 B9R1.15 CCC1NCCNC1=O CS-0172224 [0,1,0,1,0,0|2,0,0]=4 709 B9R1.15 COC1COCCC1=O CS-0051285 [0,1,0,1,0,0|2,0,0]=4 710 B9R1.15 N#CC1CCCCC1=O CS-0054141 [0,1,0,1,0,0|1,0,1]=4 711 B9R1.22 O=C1C[C@H](O)[C@@H](CO)O1 CS-0053170 [0,1,0,1,0,0|1,0,0]=3 712 B9R1.33 NCCN1CCNC1=O CS-W004517 [0,1,0,1,0,0|2,0,0]=4 713 B9R1.33 NCCN1CCOC1=O CS-0040773 [0,1,0,1,0,0|2,0,0]=4 714 B9R1.33 O=C1CCCN1CCBr CS-0040579 [0,1,0,1,0,0|2,0,0]=4 715 B9R1.33 O=C1CCCN1CCCl CS-0036362 [0,1,0,1,0,0|2,0,0]=4 716 B9R1.33 O=C1NCCN1CCO CS-0077124 [0,1,0,1,0,0|2,0,0]=4 717 B9R1.48 O=C1CCCCC(=O)C1 CS-W002860 [0,1,0,1,0,0|1,0,1]=4 718 B9R1.48 O=C1CCCCC(=O)O1 CS-W019642 [0,1,0,1,0,0|0,0,1]=3 719 B9R1.49 CN1CCCC(=O)CC1 CS-W003427 [0,1,0,1,0,0|1,0,0]=3 720 B9R1.49 O=C1CCCC(O)CN1 CS-0187220 [0,1,0,1,0,0|1,0,0]=3 721 B9R1.50 O=C1CCCCCCC1 CS-W007564 [0,1,0,1,0,0|1,0,0]=3 722 B9R1.50 O=C1CCCCCCN1 CS-W022575 [0,1,0,1,0,0|1,0,0]=3 723 B9R1.69 CC1CN(C)CCC1=O CS-M1154 [0,1,0,1,0,0|2,0,0]=4 724 B9R1.69 CN1CC(N)CCC1=O CS-0053895 [0,1,0,1,0,0|2,0,0]=4 725 B9R1.69 CN1CC(N)CCC1=O CS-0437722 [0,1,0,1,0,0|2,0,0]=4 726 B9R1.69 C[C@@H]1CN(C)C(=O)CN1 CS-0183800 [0,1,0,1,0,0|2,0,0]=4 727 B9R1.69 C[C@H]1CN(C)C(=O)CN1 CS-0053137 [0,1,0,1,0,0|2,0,0]=4 728 B9R1.73 CCOC(=N)C1CCC1 CS-B1686 [0,1,0,1,0,0|2,0,0]=4 729 B9R1.73 CCOC(=O)C1CCC1 CS-D1706 [0,1,0,1,0,0|1,0,0]=3 730 B9R1.73 CCOC(=O)C1CNC1 CS-0045521 [0,1,0,1,0,0|2,0,0]=4 731 B9R1.75 CCOC(=O)C=C1CC1 CS-0340229 [0,1,0,1,0,0|1,0,1]=4 732 B9R1.75 CCOC(=O)CC1CC1 CS-W000547 [0,1,0,1,0,0|1,0,0]=3 733 B9R1.3 CC1C(=O)CCCC1=O CS-W019564 [0,1,0,1,0,0|1,0,1]=4 734 B9R1.3 CC1CCCC(C)C1=O CS-0215006 [0,1,0,1,0,0|1,0,0]=3 735 B9R1.3 CN1CCCN(C)C1=O CS-W009128 [0,1,0,1,0,0|2,0,0]=4 736 B9R1.3 C[C@H]1NCCN(C)C1=O CS-0341873 [0,1,0,1,0,0|2,0,0]=4 737 B9R1.5 NC1CCCCNC1=O CS-W002296 [0,1,0,1,0,0|1,0,0]=3 738 B9R1.5 N[C@@H]1CCCCNC1=O CS-0112895 [0,1,0,1,0,0|1,0,0]=3 739 B9R1.5 N[C@H]1CCCCNC1=O CS-W002297 [0,1,0,1,0,0|1,0,0]=3 740 B9R1.5 N[C@H]1CCCCNC1=O CS-W016082 [0,1,0,1,0,0|1,0,0]=3 741 B9R1.11 CNC(=O)C1CCNC1 CS-0188103 [0,1,0,1,0,0|2,0,0]=4 742 B9R1.11 CNC(=O)[C@@H]1CCCN1 CS-WAA0154 [0,1,0,1,0,0|2,0,0]=4 743 B9R1.11 COC(=O)C1=CCCC1 CS-D0999 [0,1,0,1,0,0|2,0,0]=4 744 B9R1.11 COC(=O)C1CCCC1 CS-W005310 [0,1,0,1,0,0|2,0,0]=4 745 B9R1.11 COC(=O)C1CCCN1 CS-W004744 [0,1,0,1,0,0|2,0,0]=4 746 B9R1.11 COC(=O)C1CCCO1 CS-0096501 [0,1,0,1,0,0|1,0,0]=3 747 B9R1.11 COC(=O)C1CCNC1 CS-W001842 [0,1,0,1,0,0|2,0,0]=4 748 B9R1.11 COC(=O)C1CCOC1 CS-W004271 [0,1,0,1,0,0|2,0,0]=4 749 B9R1.11 COC(=O)[C@@H]1CCCN1 CS-M0706 [0,1,0,1,0,0|2,0,0]=4 750 B9R1.11 COC(=O)[C@@H]1CCNC1 CS-B0685 [0,1,0,1,0,0|2,0,0]=4 751 B9R1.11 NCC(=O)N1CCCC1 CS-0055114 [0,1,0,1,0,0|2,0,0]=4 752 B9R1.11 O=C(CBr)N1CCCC1 CS-0461588 [0,1,0,1,0,0|2,0,0]=4 753 B9R1.11 O=C(CCl)N1CCCC1 CS-0037280 [0,1,0,1,0,0|2,0,0]=4 754 B9R1.11 [C@H]1(C(=O)OC)CCCN1 CS-W010818 [0,1,0,1,0,0|2,0,0]=4 755 B9R1.11 [C@H]1(C(=O)OC)CCNC1 CS-W005089 [0,1,0,1,0,0|2,0,0]=4 756 B9R1.37 C[C@@H]1C(=O)OC(=O)N1C CS-0053192 [0,1,0,1,0,0|1,0,1]=4 757 B9R1.37 C[C@H]1C(=O)OC(=O)N1C CS-0053178 [0,1,0,1,0,0|1,0,1]=4 758 B9R1.82 COC(=O)C1CC(F)C1 CS-0184849 [0,1,0,1,0,0|2,0,0]=4 759 B9R1.82 COC(=O)C1CC(N)C1 CS-W003888 [0,1,0,1,0,0|2,0,0]=4 760 B9R1.82 COC(=O)C1CC(O)C1 CS-0044067 [0,1,0,1,0,0|2,0,0]=4 761 B9R1.82 COC(=O)[C@H]1C[C@@H](N)C1 CS-W022617 [0,1,0,1,0,0|2,0,0]=4 762 B9R1.82 COC(=O)[C@H]1C[C@@H](O)C1 CS-0043491 [0,1,0,1,0,0|2,0,0]=4 763 B9R1.82 COC(=O)[C@H]1C[C@H](Br)C1 CS-0048877 [0,1,0,1,0,0|2,0,0]=4 764 B9R1.82 COC(=O)[C@H]1C[C@H](N)C1 CS-0048879 [0,1,0,1,0,0|2,0,0]=4 765 B9R1.82 O=C(CCl)N1CC(O)C1 CS-0145703 [0,1,0,1,0,0|2,0,0]=4 766 B9R1.82 [C@H]1(O)C[C@H](C(=O)OC)C1 CS-W004965 [0,1,0,1,0,0|2,0,0]=4 767 B9R1.88 COC(=O)[C@@H]1C[C@H]1CO CS-0078750 [0,1,0,1,0,0|2,0,0]=4 768 B9R1.101 COC(=O)C(N)C1CC1 CS-W005014 [0,1,0,1,0,0|2,0,0]=4 769 B9R1.101 COC(=O)[C@@H](N)C1CC1 CS-0150941 [0,1,0,1,0,0|2,0,0]=4 770 B9R1.101 COC(=O)[C@H](N)C1CC1 CS-0111776 [0,1,0,1,0,0|2,0,0]=4 771 B9R1.132 CN1C(=O)CCC1CO CS-W001672 [0,1,0,1,0,0|2,0,0]=4 772 B9R1.186 COC(=O)C1(Br)CCC1 CS-0037271 [0,1,0,1,0,0|2,0,0]=4 773 B9R1.186 COC(=O)C1(N)CCC1 CS-0183729 [0,1,0,1,0,0|2,0,0]=4 774 B9R1.186 COC(=O)C1(N)CCC1 CS-W005628 [0,1,0,1,0,0|2,0,0]=4 775 B9R1.1 C#CC1CCC(=O)CC1 CS-0132033 [0,1,0,1,0,0|1,0,1]=4 776 B9R1.1 C=C1CCC(CO)CC1 CS-0034131 [0,1,0,1,0,0|2,0,0]=4 777 B9R1.1 CCC1CCC(=O)CC1 CS-0226152 [0,1,0,1,0,0|1,0,0]=3 778 B9R1.1 CCN1CCC(=O)CC1 CS-0046794 [0,1,0,1,0,0|1,0,0]=3 779 B9R1.1 COC1CCC(=O)CC1 CS-W004809 [0,1,0,1,0,0|1,0,0]=3 780 B9R1.1 N#CC1CCC(=O)CC1 CS-D0281 [0,1,0,1,0,0|1,0,1]=4 781 B9R1.1 NCC1CNC(=O)CO1 CS-0311050 [0,1,0,1,0,0|2,0,0]=4 782 B9R1.1 O=C1CCC(CO)CC1 CS-W005330 [0,1,0,1,0,0|1,0,0]=3 783 B9R1.1 O=C1COC(CO)CN1 CS-W022434 [0,1,0,1,0,0|2,0,0]=4 784 B9R1.1 O=C1CO[C@@H](CO)CN1 CS-0183833 [0,1,0,1,0,0|2,0,0]=4 785 B9R1.1 O=C1CO[C@H](CO)CN1 CS-0036959 [0,1,0,1,0,0|2,0,0]=4 786 B9R1.79 COC(=O)CC1COC1 CS-0049199 [0,1,0,1,0,0|2,0,0]=4 787 B9R1.80 COC(=O)\C=C\C1CC1 CS-0380678 [0,1,0,1,0,0|2,0,0]=4 788 B9R1.89 ONC1=NCCCCC1 CS-0449006 [0,1,0,1,0,0|1,0,1]=4 789 B9R1.23 CN1C[C@H](CO)OC1=O CS-0162781 [0,1,0,1,0,0|2,0,0]=4 790 B9R1.35 CC(C)C1CNC(=O)C1 CS-0046667 [0,1,0,1,0,0|2,0,0]=4 791 B9R1.35 CC(C)C1COC(=O)N1 CS-0076533 [0,1,0,1,0,0|2,0,0]=4 792 B9R1.35 CC(C)[C@@H]1COC(=O)N1 CS-W002320 [0,1,0,1,0,0|2,0,0]=4 793 B9R1.35 CC(C)[C@H]1COC(=O)N1 CS-W002062 [0,1,0,1,0,0|2,0,0]=4 794 B9R1.35 O=C1CCC(C(=O)O)O1 CS-0129013 [0,1,0,1,0,0|1,0,1]=4 795 B9R1.35 O=C1CC[C@@H](C(=O)O)O1 CS-D0218 [0,1,0,1,0,0|1,0,1]=4 796 B9R1.35 O=C1CC[C@H](C(=O)O)O1 CS-W021140 [0,1,0,1,0,0|1,0,1]=4 797 B9R1.40 CC1(C)CCCCC1=O CS-W008668 [0,1,0,1,0,0|1,0,0]=3 798 B9R1.40 CC1(C)CCCOC1=O CS-0097007 [0,1,0,1,0,0|0,0,0]=2 799 B9R1.40 CC1(C)CNCCC1=O CS-0019268 [0,1,0,1,0,0|2,0,0]=4 800 B9R1.40 CC1(C)NCCNC1=O CS-W021790 [0,1,0,1,0,0|2,0,0]=4 801 B9R1.10 CC1(C)C=CC(=O)CC1 CS-0128266 [0,1,0,1,0,0|1,0,1]=4 802 B9R1.10 CC1(C)CCC(=O)CC1 CS-W002564 [0,1,0,1,0,0|1,0,0]=3 803 B9R1.10 CC1(O)CCC(=O)CC1 CS-0091842 [0,1,0,1,0,0|1,0,0]=3 804 B9R1.10 O=C1CCC(F)(F)CC1 CS-W007368 [0,1,0,1,0,0|2,0,0]=4 805 B9R1.138 CC1(C)COC(=O)C1=O CS-0065829 [0,1,0,1,0,0|1,0,1]=4 806 B9R1.138 CC1(C)COC(=O)C1O CS-0046126 [0,1,0,1,0,0|1,0,0]=3 807 B9R1.138 [C@@H]1(O)C(=O)OCC1(C)C CS-W013437 [0,1,0,1,0,0|1,0,0]=3 808 B9R1.138 [C@H]1(O)C(=O)OCC1(C)C CS-W011112 [0,1,0,1,0,0|1,0,0]=3 809 B9R2.39 O=C1CC2CCC1C2 CS-0072123 [0,0,0,2,0,0|1,0,0]=3 810 B9R2.39 O=C1NC2CCC1C2 CS-B1546 [0,0,0,2,0,0|1,0,0]=3 811 B9R2.39 O=C1N[C@H]2CC[C@@H]1C2 CS-0131290 [0,0,0,2,0,0|1,0,0]=3 812 B9R2.6 CC12CCCCC1O2 CS-0152704 [0,0,0,2,0,0|1,0,1]=4 813 B9R2.109 O=C1CCCC2CC12 CS-0049777 [0,0,0,2,0,0|1,0,0]=3 814 B9R2.109 O=C1CCCC2OC12 CS-0155446 [0,0,0,2,0,0|2,0,0]=4 815 B9R2.7 O=C1NC2CCCC12 CS-0063926 [0,0,0,2,0,0|1,0,0]=3 816 B9R2.36 O=C1CCC1C2CC2 CS-0670396 [0,0,0,2,0,0|1,0,0]=3