0 B7R0.7 CC#CC(=O)OCC CS-W009547 [0,0,0,0,0,0|2,0,2]=4 1 B7R0.7 CC(CCBr)CCBr CS-0182622 [0,0,0,0,0,0|4,0,0]=4 2 B7R0.7 CC(CCO)CCO CS-0188324 [0,0,0,0,0,0|4,0,0]=4 3 B7R0.7 CCCC(Br)CCC CS-0106173 [0,0,0,0,0,0|3,0,0]=3 4 B7R0.7 CCCC(O)CCC CS-0132313 [0,0,0,0,0,0|3,0,0]=3 5 B7R0.7 CCC[C@H](N)CCO CS-0152589 [0,0,0,0,0,0|4,0,0]=4 6 B7R0.7 CCNC(=S)NCC CS-0076442 [0,0,0,0,0,0|3,0,1]=4 7 B7R0.7 CCOC(=O)CCBr CS-W007449 [0,0,0,0,0,0|3,0,1]=4 8 B7R0.7 CCOC(=O)CCI CS-W002223 [0,0,0,0,0,0|3,0,1]=4 9 B7R0.7 CCOC(=O)CCN CS-W019943 [0,0,0,0,0,0|3,0,1]=4 10 B7R0.7 CCOC(=O)CCO CS-0139545 [0,0,0,0,0,0|3,0,1]=4 11 B7R0.7 CCOC(=O)CNC CS-W020595 [0,0,0,0,0,0|3,0,1]=4 12 B7R0.7 CCOC(=O)COC CS-0008463 [0,0,0,0,0,0|3,0,1]=4 13 B7R0.7 CCOC(=O)CSC CS-0133049 [0,0,0,0,0,0|3,0,1]=4 14 B7R0.7 CCOC(=O)OCCl CS-W005334 [0,0,0,0,0,0|2,0,1]=3 15 B7R0.7 CCO\C(C)=N\C#N CS-0147117 [0,0,0,0,0,0|2,0,2]=4 16 B7R0.7 CC\N=C(/O)NCC CS-W013607 [0,0,0,0,0,0|3,0,1]=4 17 B6R0.1 CC(CO)CCN CS-0154050 [1,0,0,0,0,0|3,0,0]=4 18 B6R0.1 CC(CO)CCO CS-0517219 [1,0,0,0,0,0|3,0,0]=4 19 B6R0.1 CCCC(Cl)CC CS-0102884 [1,0,0,0,0,0|2,0,0]=3 20 B6R0.1 CCCC(O)CO CS-0017222 [1,0,0,0,0,0|3,0,0]=4 21 B6R0.1 CCC[C@H](N)CO CS-M1841 [1,0,0,0,0,0|3,0,0]=4 22 B6R0.1 CCC[C@H](N)CO CS-M2256 [1,0,0,0,0,0|3,0,0]=4 23 B6R0.1 CCOC(=O)CN CS-W020007 [1,0,0,0,0,0|2,0,1]=4 24 B6R0.1 CCOC(=O)CO CS-W019892 [1,0,0,0,0,0|2,0,1]=4 25 B6R0.1 CCOC(C)CC CS-0196425 [1,0,0,0,0,0|0,0,0]=1 26 B6R0.1 CCO\C(C)=N\O CS-W013688 [1,0,0,0,0,0|2,0,1]=4 27 B6R0.1 CNC(C)COC CS-0301311 [1,0,0,0,0,0|3,0,0]=4 28 B6R0.1 COC(=O)OCCl CS-0067504 [1,0,0,0,0,0|2,0,1]=4 29 B6R0.1 COC(C)CCO CS-W013686 [1,0,0,0,0,0|2,0,0]=3 30 B6R0.6 CCCCCCI CS-0132388 [1,0,0,0,0,0|3,0,0]=4 31 B6R0.6 CCCCCCN CS-0196786 [1,0,0,0,0,0|3,0,0]=4 32 B6R0.6 CCCNCCC CS-0187381 [1,0,0,0,0,0|3,0,0]=4 33 B6R0.6 CCCNCCC CS-0214120 [1,0,0,0,0,0|3,0,0]=4 34 B6R0.6 CCNCCCN CS-0151962 [1,0,0,0,0,0|3,0,0]=4 35 B6R0.6 CCOCCCO CS-W013685 [1,0,0,0,0,0|2,0,0]=3 36 B8R0.1 C=CCOC(=O)OCC CS-0197813 [0,1,0,0,0,0|1,0,2]=4 37 B8R0.1 CCCCC(O)CCC CS-0362569 [0,1,0,0,0,0|3,0,0]=4 38 B8R0.1 CCOC(=O)CCCBr CS-W020133 [0,1,0,0,0,0|2,0,1]=4 39 B8R0.1 CCOC(=O)CCCI CS-0029516 [0,1,0,0,0,0|2,0,1]=4 40 B8R0.1 CCOC(=O)CCCN CS-W010794 [0,1,0,0,0,0|2,0,1]=4 41 B8R0.1 CCOCC(=O)OCC CS-0151430 [0,1,0,0,0,0|1,0,1]=3 42 B8R0.3 CCOC(=O)C(=O)CC CS-W005382 [0,1,0,0,0,0|2,0,1]=4 43 B8R0.3 CCOC(=O)C(Br)CC CS-W010634 [0,1,0,0,0,0|2,0,1]=4 44 B8R0.3 CCOC(=O)C(N)CC CS-0197280 [0,1,0,0,0,0|2,0,1]=4 45 B8R0.3 CCOC(=O)C(O)CC CS-0185728 [0,1,0,0,0,0|2,0,1]=4 46 B8R0.3 CCOC(=O)[C@@H](N)CC CS-0162057 [0,1,0,0,0,0|2,0,1]=4 47 B8R0.3 CCOC(=O)[C@@H](O)CC CS-0527449 [0,1,0,0,0,0|2,0,1]=4 48 B8R0.5 CC(C)OC(=O)OCCl CS-W016293 [0,1,0,0,0,0|2,0,1]=4 49 B8R0.5 CC(C)OC(=O)OCI CS-0070034 [0,1,0,0,0,0|2,0,1]=4 50 B8R0.5 CCOC(=O)CC(C)Br CS-0197403 [0,1,0,0,0,0|2,0,1]=4 51 B8R0.5 CCOC(=O)CC(C)N CS-0030781 [0,1,0,0,0,0|2,0,1]=4 52 B8R0.5 CCOC(=O)CC(C)O CS-W013417 [0,1,0,0,0,0|2,0,1]=4 53 B8R0.5 CCOC(=O)C[C@@H](C)N CS-0162169 [0,1,0,0,0,0|2,0,1]=4 54 B8R0.5 CCOC(=O)C[C@H](C)N CS-0095476 [0,1,0,0,0,0|2,0,1]=4 55 B8R0.5 CCOC(=O)C[C@H](C)O CS-0112519 [0,1,0,0,0,0|2,0,1]=4 56 B8R0.5 CCOC(=O)OC(C)Cl CS-W016294 [0,1,0,0,0,0|1,0,1]=3 57 B8R0.5 COCC(C)OC(C)=O CS-0198137 [0,1,0,0,0,0|2,0,1]=4 58 B8R0.22 CCCC(C#N)CCC CS-0186685 [0,1,0,0,0,0|2,0,1]=4 59 B8R0.22 CCCC(CO)CCC CS-0204896 [0,1,0,0,0,0|2,0,0]=3 60 B8R0.22 CCOC(C#N)OCC CS-W013452 [0,1,0,0,0,0|0,0,1]=2 61 B8R0.22 CCOC(CCl)OCC CS-0016031 [0,1,0,0,0,0|0,0,0]=1 62 B8R0.22 CCOC(CI)OCC CS-0215062 [0,1,0,0,0,0|0,0,0]=1 63 B8R0.22 CCOC(CN)OCC CS-W001150 [0,1,0,0,0,0|0,0,0]=1 64 B8R0.22 CCOC(CO)OCC CS-W011070 [0,1,0,0,0,0|0,0,0]=1 65 B8R0.30 CCCC(C)(O)CCC CS-0360467 [0,1,0,0,0,0|2,0,0]=3 66 B8R0.30 CCOP(=O)(O)OCC CS-6295 [0,1,0,0,0,0|2,0,0]=3 67 B8R0.30 CCOP(=O)([O-])OCC CS-0152008 [0,1,0,0,0,0|2,0,0]=3 68 B8R0.30 CCOP(=S)(S)OCC CS-0141956 [0,1,0,0,0,0|2,0,0]=3 69 B8R1.4 CC1CC(=O)CCO1 CS-W004274 [0,0,0,1,0,0|2,0,1]=4 70 B8R1.4 CC1CCCC(=O)O1 CS-0015920 [0,0,0,1,0,0|2,0,1]=4 71 B8R1.4 CC1CCCC(N)C1 CS-D0430 [0,0,0,1,0,0|3,0,0]=4 72 B8R1.4 CC1CN(C)CCN1 CS-0173710 [0,0,0,1,0,0|3,0,0]=4 73 B8R1.4 CC1CNCC(C)N1 CS-W013629 [0,0,0,1,0,0|3,0,0]=4 74 B8R1.4 CC1COCC(C)N1 CS-0075433 [0,0,0,1,0,0|3,0,0]=4 75 B8R1.4 C[C@@H]1CN(C)CCN1 CS-0006865 [0,0,0,1,0,0|3,0,0]=4 76 B8R1.4 C[C@@H]1CN(C)CCN1 CS-0067514 [0,0,0,1,0,0|3,0,0]=4 77 B8R1.4 C[C@@H]1CNC[C@@H](C)N1 CS-0001868 [0,0,0,1,0,0|3,0,0]=4 78 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 CS-0088046 [0,0,0,1,0,0|2,0,0]=3 79 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 CS-W005832 [0,0,0,1,0,0|2,0,0]=3 80 B8R1.4 C[C@@H]1CNC[C@H](C)C1 CS-0139658 [0,0,0,1,0,0|3,0,0]=4 81 B8R1.4 C[C@@H]1COC[C@@H](C)N1 CS-0084653 [0,0,0,1,0,0|3,0,0]=4 82 B8R1.4 C[C@@H]1COC[C@@H](C)N1 CS-0112796 [0,0,0,1,0,0|3,0,0]=4 83 B8R1.4 C[C@H]1CCC[C@@H](C)N1 CS-0015754 [0,0,0,1,0,0|2,0,0]=3 84 B8R1.4 C[C@H]1CCC[C@@H](C)N1 CS-0995219 [0,0,0,1,0,0|2,0,0]=3 85 B8R1.4 C[C@H]1CN(C)CCN1 CS-0054951 [0,0,0,1,0,0|3,0,0]=4 86 B8R1.4 C[C@H]1CN(C)CCN1 CS-0183803 [0,0,0,1,0,0|3,0,0]=4 87 B8R1.4 C[C@H]1CNC[C@@H](C)N1 CS-W013630 [0,0,0,1,0,0|3,0,0]=4 88 B8R1.4 C[C@H]1CNC[C@@H](C)O1 CS-0008437 [0,0,0,1,0,0|2,0,0]=3 89 B8R1.4 C[C@H]1CNC[C@H](C)O1 CS-0102294 [0,0,0,1,0,0|2,0,0]=3 90 B8R1.4 C[C@H]1COC[C@@H](C)N1 CS-0049722 [0,0,0,1,0,0|3,0,0]=4 91 B8R1.4 C[C@H]1COC[C@@H](C)N1 CS-0057260 [0,0,0,1,0,0|3,0,0]=4 92 B8R1.4 C[C@H]1COC[C@H](C)N1 CS-0102260 [0,0,0,1,0,0|3,0,0]=4 93 B8R1.4 C[C@H]1COC[C@H](C)N1 CS-0147828 [0,0,0,1,0,0|3,0,0]=4 94 B8R1.8 BrCCC1OCCO1 CS-W019935 [0,0,0,1,0,0|3,0,0]=4 95 B8R1.8 CCO[C@@H]1CCNC1 CS-0053329 [0,0,0,1,0,0|2,0,0]=3 96 B8R1.8 CNCC1CCCN1 CS-0162490 [0,0,0,1,0,0|3,0,0]=4 97 B8R1.8 CNC[C@@H]1CCCN1 CS-0162015 [0,0,0,1,0,0|3,0,0]=4 98 B8R1.8 COC[C@@H]1CCCN1 CS-W002057 [0,0,0,1,0,0|3,0,0]=4 99 B8R1.8 COC[C@H]1CCCN1 CS-W002305 [0,0,0,1,0,0|3,0,0]=4 100 B8R1.8 NCCC1CCCC1 CS-W006125 [0,0,0,1,0,0|3,0,0]=4 101 B8R1.8 OCCC1CCCC1 CS-0055010 [0,0,0,1,0,0|3,0,0]=4 102 B8R1.8 OCCC1CCCO1 CS-0451231 [0,0,0,1,0,0|2,0,0]=3 103 B8R1.8 OCC[C@H]1CCCN1 CS-0572825 [0,0,0,1,0,0|3,0,0]=4 104 B8R1.22 BrC1CCCCCC1 CS-0146614 [0,0,0,1,0,0|3,0,0]=4 105 B8R1.22 C=C1OCCCCO1 CS-W006464 [0,0,0,1,0,0|0,0,2]=3 106 B8R1.22 CC1CCCNCC1 CS-0199646 [0,0,0,1,0,0|3,0,0]=4 107 B8R1.22 ClC1CCCCCC1 CS-0155300 [0,0,0,1,0,0|3,0,0]=4 108 B8R1.22 NC1CCCCCC1 CS-0071927 [0,0,0,1,0,0|3,0,0]=4 109 B8R1.22 O=C1OCCCCO1 CS-0665438 [0,0,0,1,0,0|1,0,1]=3 110 B8R1.22 OC1CCCCCC1 CS-W013633 [0,0,0,1,0,0|3,0,0]=4 111 B8R1.37 CCOC(=N)C1CC1 CS-0122277 [0,0,0,1,0,0|2,0,1]=4 112 B8R1.66 CCOC1(C)CNC1 CS-0433396 [0,0,0,1,0,0|2,0,0]=3 113 B5R0.1 CC(O)CCBr CS-0142519 [2,0,0,0,0,0|2,0,0]=4 114 B5R0.1 CC(O)CCO CS-0115644 [2,0,0,0,0,0|2,0,0]=4 115 B5R0.1 CCC[C@@H](C)N CS-0162182 [2,0,0,0,0,0|2,0,0]=4 116 B5R0.1 CCC[C@H](C)N CS-W006528 [2,0,0,0,0,0|2,0,0]=4 117 B5R0.1 CCOC(C)=N CS-W008601 [2,0,0,0,0,0|1,0,1]=4 118 B5R0.1 CNCC(C)O CS-0216704 [2,0,0,0,0,0|2,0,0]=4 119 B5R0.1 COC[C@H](C)O CS-0031378 [2,0,0,0,0,0|2,0,0]=4 120 B5R0.1 C[C@@H](O)CCO CS-M1638 [2,0,0,0,0,0|2,0,0]=4 121 B5R0.1 C[C@H](O)CCO CS-W016671 [2,0,0,0,0,0|2,0,0]=4 122 B5R0.2 CCCCON CS-0106180 [2,0,0,0,0,0|2,0,0]=4 123 B5R0.2 CCNCCO CS-0076051 [2,0,0,0,0,0|2,0,0]=4 124 B5R0.2 CCSCCN CS-0663845 [2,0,0,0,0,0|1,1,0]=4 125 B5R0.2 COCCCBr CS-W010945 [2,0,0,0,0,0|2,0,0]=4 126 B5R0.3 CC(CBr)CBr CS-0154074 [2,0,0,0,0,0|2,0,0]=4 127 B5R0.3 CC(CCl)CBr CS-0204235 [2,0,0,0,0,0|2,0,0]=4 128 B5R0.3 CC(CN)CO CS-0447291 [2,0,0,0,0,0|2,0,0]=4 129 B5R0.3 CC(CO)CBr CS-0139638 [2,0,0,0,0,0|2,0,0]=4 130 B5R0.3 CC(CO)CO CS-0021060 [2,0,0,0,0,0|2,0,0]=4 131 B5R0.3 CCC(Br)CC CS-0015742 [2,0,0,0,0,0|1,0,0]=3 132 B5R0.3 CCC(C)C#N CS-0648856 [2,0,0,0,0,0|1,0,1]=4 133 B5R0.3 CCC(C)C#N CS-0649016 [2,0,0,0,0,0|1,0,1]=4 134 B5R0.3 CCC(C)C#N CS-0649019 [2,0,0,0,0,0|1,0,1]=4 135 B5R0.3 CCC(N)CC CS-0128806 [2,0,0,0,0,0|1,0,0]=3 136 B5R0.3 CCC(O)CC CS-0128838 [2,0,0,0,0,0|1,0,0]=3 137 B5R0.3 CCC(O)CN CS-0109319 [2,0,0,0,0,0|2,0,0]=4 138 B5R0.3 CCS(=O)CC CS-0199213 [2,0,0,0,0,0|2,0,0]=4 139 B5R0.3 CC[C@@H](C)CBr CS-0539690 [2,0,0,0,0,0|1,0,0]=3 140 B5R0.3 CC[C@@H](N)CO CS-W020734 [2,0,0,0,0,0|2,0,0]=4 141 B5R0.3 CC[C@H](C)CO CS-0139702 [2,0,0,0,0,0|1,0,0]=3 142 B5R0.3 CC[C@H](N)CO CS-W013745 [2,0,0,0,0,0|2,0,0]=4 143 B5R0.3 CC[C@H](O)CO CS-0031373 [2,0,0,0,0,0|2,0,0]=4 144 B5R0.3 CNC(C)CO CS-0197105 [2,0,0,0,0,0|2,0,0]=4 145 B5R0.3 CN[C@@H](C)CO CS-0139480 [2,0,0,0,0,0|2,0,0]=4 146 B5R0.3 CN[C@@H](C)CO CS-0162089 [2,0,0,0,0,0|2,0,0]=4 147 B5R0.3 CN[C@H](C)CO CS-0162211 [2,0,0,0,0,0|2,0,0]=4 148 B5R0.3 COC(C)C#N CS-0372147 [2,0,0,0,0,0|1,0,1]=4 149 B5R0.3 COS(=O)OC CS-0230894 [2,0,0,0,0,0|2,0,0]=4 150 B5R0.3 CO[C@@H](C)CN CS-W021167 [2,0,0,0,0,0|1,0,0]=3 151 B5R0.3 CO[C@@H](C)CO CS-0096324 [2,0,0,0,0,0|1,0,0]=3 152 B5R0.3 CO[C@H](C)CN CS-0148788 [2,0,0,0,0,0|1,0,0]=3 153 B5R0.3 CO[C@H](C)CN CS-0613352 [2,0,0,0,0,0|1,0,0]=3 154 B5R0.3 CO[C@H](C)CO CS-W011349 [2,0,0,0,0,0|1,0,0]=3 155 B5R0.3 C[C@@H](CO)CBr CS-0101486 [2,0,0,0,0,0|2,0,0]=4 156 B5R0.3 [C@@H](O)(CC)CO CS-W005888 [2,0,0,0,0,0|2,0,0]=4 157 B7R0.2 CCC(C)CC(C)N CS-W016309 [1,1,0,0,0,0|1,0,0]=3 158 B7R0.2 CCC(C)OC(=S)S CS-0182625 [1,1,0,0,0,0|1,0,1]=4 159 B7R0.3 CCCOC(=O)OC CS-0111112 [1,1,0,0,0,0|1,0,1]=4 160 B7R0.3 CCOCC(O)CO CS-0151429 [1,1,0,0,0,0|2,0,0]=4 161 B7R0.3 C[C@@H](CN)CCCO CS-0368510 [1,1,0,0,0,0|2,0,0]=4 162 B7R0.5 CCOC(=O)C(C)N CS-0151889 [1,1,0,0,0,0|1,0,1]=4 163 B7R0.5 CCOC(=O)[C@H](C)F CS-0670914 [1,1,0,0,0,0|1,0,1]=4 164 B7R0.5 CCOC(=O)[C@H](C)N CS-0009409 [1,1,0,0,0,0|1,0,1]=4 165 B7R0.5 [C@H](C)(O)C(=O)OCC CS-W013602 [1,1,0,0,0,0|1,0,1]=4 166 B7R0.10 CCC(=O)N(C)OC CS-0122993 [1,1,0,0,0,0|2,0,0]=4 167 B7R0.10 [C@H](C)(CC)[C@H](N)CO CS-W016591 [1,1,0,0,0,0|2,0,0]=4 168 B7R0.11 CCOS(=O)(=O)CC CS-0044478 [1,1,0,0,0,0|2,0,0]=4 169 B7R0.11 COC(C)(C)CCN CS-0540694 [1,1,0,0,0,0|2,0,0]=4 170 B7R0.11 COC(C)(C)CCO CS-0132453 [1,1,0,0,0,0|2,0,0]=4 171 B7R0.12 CCCC(CO)CO CS-W011220 [1,1,0,0,0,0|2,0,0]=4 172 B7R0.12 COC(CCBr)OC CS-W023200 [1,1,0,0,0,0|2,0,0]=4 173 B7R0.12 COCC(OC)OC CS-0150200 [1,1,0,0,0,0|2,0,0]=4 174 B7R0.1 CCCCCCCBr CS-W017293 [1,1,0,0,0,0|2,0,0]=4 175 B7R0.1 CCCCCCCO CS-0152146 [1,1,0,0,0,0|2,0,0]=4 176 B7R0.1 CCCCNCCO CS-0077079 [1,1,0,0,0,0|2,0,0]=4 177 B7R0.1 CCCOCCCN CS-0213493 [1,1,0,0,0,0|2,0,0]=4 178 B7R0.1 CCNCCCCO CS-0206547 [1,1,0,0,0,0|2,0,0]=4 179 B7R0.1 CNCCOCCO CS-0209922 [1,1,0,0,0,0|2,0,0]=4 180 B7R0.1 COCCOCCBr CS-0116183 [1,1,0,0,0,0|2,0,0]=4 181 B7R0.1 COCCOCCI CS-0150162 [1,1,0,0,0,0|2,0,0]=4 182 B7R0.1 COCCOCCN CS-0115786 [1,1,0,0,0,0|2,0,0]=4 183 B7R0.1 COCCOCCN CS-0115787 [1,1,0,0,0,0|2,0,0]=4 184 B7R0.1 COCCOCCN CS-0115788 [1,1,0,0,0,0|2,0,0]=4 185 B7R0.1 COCCOCCN CS-0115790 [1,1,0,0,0,0|2,0,0]=4 186 B7R0.1 COCCOCCN CS-W008429 [1,1,0,0,0,0|2,0,0]=4 187 B7R0.1 COCCOCCO CS-0116122 [1,1,0,0,0,0|2,0,0]=4 188 B7R0.1 COCCOCCO CS-0644881 [1,1,0,0,0,0|2,0,0]=4 189 B7R0.1 COCCOCCO CS-0889987 [1,1,0,0,0,0|2,0,0]=4 190 B7R0.1 COCCOCCO CS-W013578 [1,1,0,0,0,0|2,0,0]=4 191 B7R0.1 COCCOCCS CS-0115760 [1,1,0,0,0,0|2,0,0]=4 192 B7R0.1 COCCOCCS CS-0115764 [1,1,0,0,0,0|2,0,0]=4 193 B7R0.1 COCCOCCS CS-0650914 [1,1,0,0,0,0|2,0,0]=4 194 B7R0.4 CCCCCC(C)O CS-W016595 [1,1,0,0,0,0|2,0,0]=4 195 B7R0.4 CCCCC[C@@H](C)O CS-0152365 [1,1,0,0,0,0|2,0,0]=4 196 B7R0.4 CCCCC[C@H](C)O CS-0179417 [1,1,0,0,0,0|2,0,0]=4 197 B9R0.4 CCCCC(C)OC(C)=O CS-0255972 [0,2,0,0,0,0|1,0,1]=4 198 B9R0.5 CCOC(=O)COCCCl CS-W018917 [0,2,0,0,0,0|1,0,1]=4 199 B9R0.5 CCOCCC(=O)OCC CS-W013312 [0,2,0,0,0,0|1,0,1]=4 200 B9R0.5 CCO\C=C\C(=O)OCC CS-0046174 [0,2,0,0,0,0|1,0,1]=4 201 B9R0.5 CCO\C=C\C(=O)OCC CS-W002052 [0,2,0,0,0,0|1,0,1]=4 202 B9R0.18 CCOCC(O)COCC CS-0217718 [0,2,0,0,0,0|1,0,0]=3 203 B9R0.35 CCCC(Br)C(=O)OCC CS-W015179 [0,2,0,0,0,0|2,0,0]=4 204 B9R0.35 CCC[C@@H](N)C(=O)OCC CS-0539079 [0,2,0,0,0,0|2,0,0]=4 205 B9R0.35 CCC[C@H](N)C(=O)OCC CS-M0539 [0,2,0,0,0,0|2,0,0]=4 206 B9R0.35 CCOC(=N)C(=O)OCC CS-W006056 [0,2,0,0,0,0|1,0,1]=4 207 B9R0.35 CCOC(=O)C(Cl)OCC CS-0663093 [0,2,0,0,0,0|1,0,0]=3 208 B9R0.48 COCC(C)OCC(C)O CS-W016335 [0,2,0,0,0,0|2,0,0]=4 209 B9R0.66 CCO[Si](C)(C)CCCN CS-0151951 [0,2,0,0,0,0|1,1,0]=4 210 B9R0.53 CC(C)CC(C)CC(C)O CS-0232992 [0,2,0,0,0,0|2,0,0]=4 211 B9R0.53 CC(C)OC(=O)OC(C)C CS-W014351 [0,2,0,0,0,0|1,0,1]=4 212 B9R0.53 CC(C)OC(=O)OC(C)Cl CS-W021319 [0,2,0,0,0,0|1,0,1]=4 213 B9R0.53 CC(C)OC(C)OC(C)C CS-0875077 [0,2,0,0,0,0|0,0,0]=2 214 B9R0.53 CC(Cl)OC(=O)OC(C)Cl CS-0160241 [0,2,0,0,0,0|1,0,1]=4 215 B9R0.53 P(=O)(OC(C)C)OC(C)C CS-0021106 [0,2,0,0,0,0|2,0,0]=4 216 B9R0.15 CCOC(OCC)C(=N)O CS-W016347 [0,2,0,0,0,0|0,0,1]=3 217 B9R0.15 CCOC(OCC)C(=O)O CS-0163537 [0,2,0,0,0,0|0,0,1]=3 218 B9R0.15 CCOC(OCC)C(C)Br CS-0148273 [0,2,0,0,0,0|0,0,0]=2 219 B9R0.17 CCOC(CC#N)OCC CS-W016415 [0,2,0,0,0,0|0,0,0]=2 220 B9R0.17 CCOC(CCCl)OCC CS-0199408 [0,2,0,0,0,0|0,0,0]=2 221 B9R0.17 CCOC(CCN)OCC CS-0098622 [0,2,0,0,0,0|0,0,0]=2 222 B9R0.17 CCOC(CCO)OCC CS-0046319 [0,2,0,0,0,0|0,0,0]=2 223 B9R0.17 CCOC(CNC)OCC CS-0333660 [0,2,0,0,0,0|0,0,0]=2 224 B9R0.59 C#CP(=O)(OCC)OCC CS-0615476 [0,2,0,0,0,0|1,0,1]=4 225 B9R0.59 C=CP(=O)(OCC)OCC CS-D0588 [0,2,0,0,0,0|1,0,1]=4 226 B9R0.59 CCOP(=O)(C#N)OCC CS-W014320 [0,2,0,0,0,0|1,0,1]=4 227 B9R0.59 CCOP(=O)(CCl)OCC CS-0059172 [0,2,0,0,0,0|1,0,0]=3 228 B9R0.59 CCOP(=O)(CI)OCC CS-0063910 [0,2,0,0,0,0|1,0,0]=3 229 B9R0.59 CCOP(=O)(CN)OCC CS-0226501 [0,2,0,0,0,0|1,0,0]=3 230 B9R0.59 CCOP(=O)(CO)OCC CS-W017818 [0,2,0,0,0,0|1,0,0]=3 231 B9R0.59 CCOP(=S)(O[K])OCC CS-W015214 [0,2,0,0,0,0|2,0,0]=4 232 B7R1.1 BrCC1CCCC1 CS-W004985 [1,0,0,1,0,0|2,0,0]=4 233 B7R1.1 BrCC1OCCO1 CS-W021428 [1,0,0,1,0,0|2,0,0]=4 234 B7R1.1 CCC1CCCN1 CS-0454761 [1,0,0,1,0,0|1,0,0]=3 235 B7R1.1 CC[C@H]1CCCN1 CS-0197308 [1,0,0,1,0,0|1,0,0]=3 236 B7R1.1 COC1=NCCC1 CS-W022401 [1,0,0,1,0,0|1,0,1]=4 237 B7R1.1 COC1CCNC1 CS-0039937 [1,0,0,1,0,0|2,0,0]=4 238 B7R1.1 COC1CCNC1 CS-W004880 [1,0,0,1,0,0|2,0,0]=4 239 B7R1.1 CO[C@@H]1CCNC1 CS-0053757 [1,0,0,1,0,0|2,0,0]=4 240 B7R1.1 CO[C@@H]1CCNC1 CS-W021134 [1,0,0,1,0,0|2,0,0]=4 241 B7R1.1 CO[C@H]1CCNC1 CS-0031390 [1,0,0,1,0,0|2,0,0]=4 242 B7R1.1 ClCC1OCCO1 CS-0137170 [1,0,0,1,0,0|2,0,0]=4 243 B7R1.1 FC[C@@H]1CCCN1 CS-0053450 [1,0,0,1,0,0|2,0,0]=4 244 B7R1.1 ICC1CCCC1 CS-0309298 [1,0,0,1,0,0|2,0,0]=4 245 B7R1.1 NCC1CCCC1 CS-D0472 [1,0,0,1,0,0|2,0,0]=4 246 B7R1.1 NCC1CCCN1 CS-0019253 [1,0,0,1,0,0|2,0,0]=4 247 B7R1.1 NC[C@@H]1CCCO1 CS-0438150 [1,0,0,1,0,0|1,0,0]=3 248 B7R1.1 NC[C@@H]1CCCO1 CS-W011316 [1,0,0,1,0,0|1,0,0]=3 249 B7R1.1 OCC1CCCC1 CS-W001923 [1,0,0,1,0,0|2,0,0]=4 250 B7R1.1 OCC1CCCN1 CS-W007622 [1,0,0,1,0,0|2,0,0]=4 251 B7R1.1 OCC1OCCO1 CS-W019186 [1,0,0,1,0,0|2,0,0]=4 252 B7R1.1 OC[C@@H]1CCCN1 CS-D1460 [1,0,0,1,0,0|2,0,0]=4 253 B7R1.1 OC[C@@H]1CCCO1 CS-0031452 [1,0,0,1,0,0|1,0,0]=3 254 B7R1.1 OC[C@H]1CCCN1 CS-D1509 [1,0,0,1,0,0|2,0,0]=4 255 B7R1.1 [C@@H]1(CN)CCCN1 CS-0043760 [1,0,0,1,0,0|2,0,0]=4 256 B7R1.1 [C@H]1(CN)CCCO1 CS-W011317 [1,0,0,1,0,0|1,0,0]=3 257 B7R1.1 [C@H]1(CO)CCCO1 CS-W013695 [1,0,0,1,0,0|1,0,0]=3 258 B7R1.2 CC1CCC(=O)O1 CS-W016654 [1,0,0,1,0,0|1,0,1]=4 259 B7R1.2 C[C@@H]1CC[C@@H](C)N1 CS-0111299 [1,0,0,1,0,0|1,0,0]=3 260 B7R1.2 C[C@@H]1COC(=O)O1 CS-0015926 [1,0,0,1,0,0|1,0,1]=4 261 B7R1.2 C[C@H]1COC(=O)O1 CS-W011314 [1,0,0,1,0,0|1,0,1]=4 262 B7R1.3 BrC1CCCCC1 CS-W017925 [1,0,0,1,0,0|2,0,0]=4 263 B7R1.3 CC1=NCCCO1 CS-1006941 [1,0,0,1,0,0|1,0,1]=4 264 B7R1.3 CC1CCOCC1 CS-0233092 [1,0,0,1,0,0|2,0,0]=4 265 B7R1.3 CC1CCOCO1 CS-0181838 [1,0,0,1,0,0|1,0,0]=3 266 B7R1.3 CC1CNCCO1 CS-0152670 [1,0,0,1,0,0|1,0,0]=3 267 B7R1.3 CC1CNCCO1 CS-D1584 [1,0,0,1,0,0|1,0,0]=3 268 B7R1.3 CC1COCCN1 CS-W009058 [1,0,0,1,0,0|2,0,0]=4 269 B7R1.3 CC1SCCCS1 CS-0094743 [1,0,0,1,0,0|0,2,0]=4 270 B7R1.3 C[C@@H]1CCCCN1 CS-W019137 [1,0,0,1,0,0|1,0,0]=3 271 B7R1.3 C[C@@H]1CCCNC1 CS-W021135 [1,0,0,1,0,0|2,0,0]=4 272 B7R1.3 C[C@@H]1CNCCN1 CS-W020739 [1,0,0,1,0,0|2,0,0]=4 273 B7R1.3 C[C@@H]1CNCCO1 CS-0019313 [1,0,0,1,0,0|1,0,0]=3 274 B7R1.3 C[C@@H]1CNCCO1 CS-W018656 [1,0,0,1,0,0|1,0,0]=3 275 B7R1.3 C[C@@H]1COCCN1 CS-D1634 [1,0,0,1,0,0|2,0,0]=4 276 B7R1.3 C[C@@H]1COCCN1 CS-W020732 [1,0,0,1,0,0|2,0,0]=4 277 B7R1.3 C[C@H]1CCCCN1 CS-0145867 [1,0,0,1,0,0|1,0,0]=3 278 B7R1.3 C[C@H]1CNCCO1 CS-W020614 [1,0,0,1,0,0|1,0,0]=3 279 B7R1.3 C[C@H]1COCCN1 CS-M0392 [1,0,0,1,0,0|2,0,0]=4 280 B7R1.3 C[C@H]1COCCN1 CS-W008644 [1,0,0,1,0,0|2,0,0]=4 281 B7R1.3 ClC1CCCCC1 CS-0198086 [1,0,0,1,0,0|2,0,0]=4 282 B7R1.3 IC1CCCCC1 CS-0148628 [1,0,0,1,0,0|2,0,0]=4 283 B7R1.3 NC1CCCCC1 CS-W013335 [1,0,0,1,0,0|2,0,0]=4 284 B7R1.3 O=C1CCCCO1 CS-W013713 [1,0,0,1,0,0|1,0,1]=4 285 B7R1.3 O=C1OCCCO1 CS-0155207 [1,0,0,1,0,0|1,0,1]=4 286 B7R1.3 OC1CCCCC1 CS-0017198 [1,0,0,1,0,0|2,0,0]=4 287 B7R1.3 OC1CCCCO1 CS-0015921 [1,0,0,1,0,0|1,0,0]=3 288 B7R1.3 OC1CNCCO1 CS-W006148 [1,0,0,1,0,0|2,0,0]=4 289 B7R1.3 [C@H]1(C)CCCCN1 CS-0044046 [1,0,0,1,0,0|1,0,0]=3 290 B7R1.3 [C@H]1(C)CCCNC1 CS-W006435 [1,0,0,1,0,0|2,0,0]=4 291 B7R1.3 [C@H]1(C)CNCCN1 CS-W011321 [1,0,0,1,0,0|2,0,0]=4 292 B7R1.3 [C@H]1(C)CNCCO1 CS-W006079 [1,0,0,1,0,0|1,0,0]=3 293 B7R1.4 CC1CCOC1=O CS-0152675 [1,0,0,1,0,0|1,0,1]=4 294 B7R1.4 CC1OCCC1=O CS-W011324 [1,0,0,1,0,0|1,0,1]=4 295 B7R1.4 CC1OCCC1S CS-W013594 [1,0,0,1,0,0|1,0,0]=3 296 B7R1.10 CC1CC(CN)C1 CS-0036376 [1,0,0,1,0,0|2,0,0]=4 297 B7R1.10 CC1CC(CO)C1 CS-0215900 [1,0,0,1,0,0|2,0,0]=4 298 B7R1.10 COC1CC(N)C1 CS-0051290 [1,0,0,1,0,0|2,0,0]=4 299 B7R1.10 COC1CC(O)C1 CS-0056983 [1,0,0,1,0,0|2,0,0]=4 300 B7R1.10 CO[C@H]1C[C@H](N)C1 CS-0045545 [1,0,0,1,0,0|2,0,0]=4 301 B7R1.22 CCC(N)C1CC1 CS-0052574 [1,0,0,1,0,0|2,0,0]=4 302 B7R1.22 CCC(O)C1CC1 CS-0052573 [1,0,0,1,0,0|2,0,0]=4 303 B7R1.25 CC1(CBr)CCC1 CS-0070089 [1,0,0,1,0,0|2,0,0]=4 304 B7R1.25 CC1(CN)CCC1 CS-0045540 [1,0,0,1,0,0|2,0,0]=4 305 B7R1.25 CC1(CO)CCC1 CS-0072446 [1,0,0,1,0,0|2,0,0]=4 306 B7R1.25 COC1(C)CNC1 CS-0035135 [1,0,0,1,0,0|2,0,0]=4 307 B7R1.24 C1CNCCOC1 CS-0171615 [1,0,0,1,0,0|2,0,0]=4 308 B7R1.24 C1CNCCOC1 CS-B1101 [1,0,0,1,0,0|2,0,0]=4 309 B9R1.2 CN1CCOC(CN)C1 CS-0036409 [0,1,0,1,0,0|2,0,0]=4 310 B9R1.2 CN1CCOC(CN)C1 CS-W005495 [0,1,0,1,0,0|2,0,0]=4 311 B9R1.2 CN1CCOC(CO)C1 CS-0061775 [0,1,0,1,0,0|2,0,0]=4 312 B9R1.2 CN1CCO[C@@H](CO)C1 CS-0061774 [0,1,0,1,0,0|2,0,0]=4 313 B9R1.2 CN1CCO[C@H](CO)C1 CS-0061772 [0,1,0,1,0,0|2,0,0]=4 314 B9R1.8 BrCCC1OCCCO1 CS-W010633 [0,1,0,1,0,0|2,0,0]=4 315 B9R1.8 CCCC1CCNCC1 CS-0434112 [0,1,0,1,0,0|2,0,0]=4 316 B9R1.8 CCNC1CCCCC1 CS-W016555 [0,1,0,1,0,0|2,0,0]=4 317 B9R1.8 CCNC1CCOCC1 CS-0040480 [0,1,0,1,0,0|2,0,0]=4 318 B9R1.8 CCOC1=NCCCC1 CS-0188155 [0,1,0,1,0,0|1,0,1]=4 319 B9R1.8 CNCC1CNCCO1 CS-0301640 [0,1,0,1,0,0|2,0,0]=4 320 B9R1.8 COCC1CNCCO1 CS-W021442 [0,1,0,1,0,0|2,0,0]=4 321 B9R1.8 COC[C@@H]1CNCCO1 CS-W020731 [0,1,0,1,0,0|2,0,0]=4 322 B9R1.8 COC[C@H]1CNCCO1 CS-W018994 [0,1,0,1,0,0|2,0,0]=4 323 B9R1.8 NCCC1CCCCO1 CS-0084526 [0,1,0,1,0,0|2,0,0]=4 324 B9R1.8 OCCC1CCCCO1 CS-0068082 [0,1,0,1,0,0|2,0,0]=4 325 B9R1.12 BrCCCC1OCCO1 CS-0159608 [0,1,0,1,0,0|2,0,0]=4 326 B9R1.12 C=CCOB1CCCO1 CS-0371147 [0,1,0,1,0,0|1,0,1]=4 327 B9R1.12 ClCCCC1OCCO1 CS-W018131 [0,1,0,1,0,0|2,0,0]=4 328 B9R1.12 NCCOC1CCCC1 CS-0155346 [0,1,0,1,0,0|1,0,0]=3 329 B9R1.15 C[C@H]1OCCN[C@@H]1CO CS-0103643 [0,1,0,1,0,0|2,0,0]=4 330 B9R1.134 CC1(CCN)OCCO1 CS-W013426 [0,1,0,1,0,0|2,0,0]=4 331 B9R1.3 CC1CCCC(C)C1=O CS-0215006 [0,1,0,1,0,0|2,0,0]=4 332 B9R1.11 COC(=O)C1CCCO1 CS-0096501 [0,1,0,1,0,0|2,0,0]=4 333 B9R1.13 CC(=O)OC1CCCO1 CS-0160246 [0,1,0,1,0,0|0,0,1]=3 334 B9R1.34 CC1CC(C)CC(O)C1 CS-0188357 [0,1,0,1,0,0|2,0,0]=4 335 B9R1.66 CC1(C)CC(I)CCO1 CS-0045139 [0,1,0,1,0,0|2,0,0]=4 336 B9R1.66 CC1(C)CC(N)CCO1 CS-0279260 [0,1,0,1,0,0|2,0,0]=4 337 B9R1.66 CC1(C)CC(N)CCO1 CS-D0455 [0,1,0,1,0,0|2,0,0]=4 338 B9R1.66 CC1CNCC(C)(C)O1 CS-0251847 [0,1,0,1,0,0|2,0,0]=4 339 B9R1.14 CCN1CCCC1CN CS-W013458 [0,1,0,1,0,0|2,0,0]=4 340 B9R1.14 CCN1CCC[C@H]1CN CS-W002498 [0,1,0,1,0,0|2,0,0]=4 341 B9R1.14 CCN1CCC[C@H]1CO CS-0159213 [0,1,0,1,0,0|2,0,0]=4 342 B9R1.89 BrCC1CCCCCC1 CS-0144558 [0,1,0,1,0,0|2,0,0]=4 343 B9R1.89 NCC1CCCCCC1 CS-0155299 [0,1,0,1,0,0|2,0,0]=4 344 B9R1.89 OCC1CCCCCC1 CS-0144557 [0,1,0,1,0,0|2,0,0]=4 345 B9R2.68 C1CC2CCC(C1)N2 CS-0049977 [0,0,0,2,0,0|2,0,0]=4 346 B9R2.68 C1CC2CNCC1O2 CS-M0310 [0,0,0,2,0,0|2,0,0]=4 347 B9R2.68 C1CC2CNCC1O2 CS-W005626 [0,0,0,2,0,0|2,0,0]=4 348 B9R2.173 C1COC2(C1)CNC2 CS-0050419 [0,0,0,2,0,0|2,0,0]=4 349 B9R2.6 CC12CCCCC1O2 CS-0152704 [0,0,0,2,0,0|1,0,0]=3