0 B8R0.1 C#CCCC(=O)CCO CS-0038477 [0,0,0,0,0,0|2,0,2]=4 1 B8R0.1 C#CCCC(=O)OCC CS-0044527 [0,0,0,0,0,0|0,0,2]=2 2 B8R0.1 C(CBr)=CC(=O)OCC CS-W007837 [0,0,0,0,0,0|1,0,2]=3 3 B8R0.1 C=CCOC(=O)OCC CS-0197813 [0,0,0,0,0,0|1,0,2]=3 4 B8R0.1 CCCCC(O)CCC CS-0362569 [0,0,0,0,0,0|1,0,2]=3 5 B8R0.1 CCCCN(C)CCO CS-0132259 [0,0,0,0,0,0|4,0,0]=4 6 B8R0.1 CCCNC(=O)CC#N CS-0215383 [0,0,0,0,0,0|3,0,1]=4 7 B8R0.1 CCCOC(=O)CC#N CS-0217234 [0,0,0,0,0,0|3,0,1]=4 8 B8R0.1 CCOC(=O)CCC#N CS-0094471 [0,0,0,0,0,0|1,0,1]=2 9 B8R0.1 CCOC(=O)CCCBr CS-W020133 [0,0,0,0,0,0|1,0,0]=1 10 B8R0.1 CCOC(=O)CCCI CS-0029516 [0,0,0,0,0,0|1,0,0]=1 11 B8R0.1 CCOC(=O)CCCN CS-W010794 [0,0,0,0,0,0|1,0,0]=1 12 B8R0.1 CCOC(=O)CCNN CS-0151578 [0,0,0,0,0,0|2,0,0]=2 13 B8R0.1 CCOC(=O)CNC=O CS-0201687 [0,0,0,0,0,0|2,0,1]=3 14 B8R0.1 CCOC(=O)\C=C/C#N CS-0356867 [0,0,0,0,0,0|1,0,3]=4 15 B8R0.1 CCOC(=O)\C=C\C=O CS-W020184 [0,0,0,0,0,0|1,0,3]=4 16 B8R0.1 CCOCC(=O)OCC CS-0151430 [0,0,0,0,0,0|1,0,0]=1 17 B7R0.1 CCCCCCCBr CS-W017293 [1,0,0,0,0,0|2,0,1]=4 18 B7R0.1 CCCCCCCO CS-0152146 [1,0,0,0,0,0|2,0,1]=4 19 B7R0.1 CCCCNCCO CS-0077079 [1,0,0,0,0,0|3,0,0]=4 20 B7R0.1 CCCC\C=C\C=O CS-0185633 [1,0,0,0,0,0|2,0,1]=4 21 B7R0.1 CCCOCCCN CS-0213493 [1,0,0,0,0,0|3,0,0]=4 22 B7R0.1 CCNCCCCO CS-0206547 [1,0,0,0,0,0|2,0,1]=4 23 B7R0.3 C#CCCC(=O)OC CS-0137200 [1,0,0,0,0,0|0,0,2]=3 24 B7R0.3 C=CCCC(=O)OC CS-0187527 [1,0,0,0,0,0|0,0,2]=3 25 B7R0.3 C=CCOC(=O)OC CS-0040098 [1,0,0,0,0,0|1,0,2]=4 26 B7R0.3 CCCCC(=O)O[Na] CS-W007087 [1,0,0,0,0,0|1,0,0]=2 27 B7R0.3 CCCCC(O)CO CS-W013596 [1,0,0,0,0,0|1,0,2]=4 28 B7R0.3 CCCC[C@@H](N)CO CS-0089933 [1,0,0,0,0,0|2,0,1]=4 29 B7R0.3 CCCC[C@@H](N)CO CS-0162184 [1,0,0,0,0,0|2,0,1]=4 30 B7R0.3 CCCC\C(O)=N\N CS-W013606 [1,0,0,0,0,0|2,0,1]=4 31 B7R0.3 CCCNC(=O)CCl CS-0074801 [1,0,0,0,0,0|2,0,0]=3 32 B7R0.3 CCCOC(=O)OC CS-0111112 [1,0,0,0,0,0|1,0,0]=2 33 B7R0.3 CNCCC(=O)OC CS-0150994 [1,0,0,0,0,0|1,0,0]=2 34 B7R0.3 COC(=O)C#CCO CS-0029743 [1,0,0,0,0,0|1,0,2]=4 35 B7R0.3 COC(=O)CCC#N CS-W009546 [1,0,0,0,0,0|1,0,1]=3 36 B7R0.3 COC(=O)CCCBr CS-W004701 [1,0,0,0,0,0|1,0,0]=2 37 B7R0.3 COC(=O)CCCCl CS-0001466 [1,0,0,0,0,0|1,0,0]=2 38 B7R0.3 COC(=O)CCCI CS-0001467 [1,0,0,0,0,0|1,0,0]=2 39 B7R0.3 COC(=O)CCCN CS-W019991 [1,0,0,0,0,0|1,0,0]=2 40 B7R0.3 COC(=O)CCSC CS-0128902 [1,0,0,0,0,0|1,0,0]=2 41 B7R0.3 COC(=O)CNC=O CS-0187476 [1,0,0,0,0,0|2,0,1]=4 42 B7R0.3 COC(=O)\C=C\CBr CS-0146524 [1,0,0,0,0,0|1,0,2]=4 43 B7R0.3 COC(=O)\C=C\CBr CS-W008761 [1,0,0,0,0,0|1,0,2]=4 44 B7R0.3 COC(=O)\C=C\CN CS-0187948 [1,0,0,0,0,0|1,0,2]=4 45 B7R0.3 COCCC(=O)OC CS-0072438 [1,0,0,0,0,0|1,0,0]=2 46 B7R0.3 CO\C=C\C(=O)OC CS-0076974 [1,0,0,0,0,0|1,0,2]=4 47 B7R0.3 CO\C=C\C(=O)OC CS-W007972 [1,0,0,0,0,0|1,0,2]=4 48 B7R0.3 NCCNC(=O)CCl CS-0697880 [1,0,0,0,0,0|3,0,0]=4 49 B7R0.3 O=C(CNCO)O[Na] CS-W019206 [1,0,0,0,0,0|3,0,0]=4 50 B7R0.7 C#CCC(=O)OCC CS-0667023 [1,0,0,0,0,0|0,0,2]=3 51 B7R0.7 C=C=CC(=O)OCC CS-0204496 [1,0,0,0,0,0|0,0,3]=4 52 B7R0.7 C=CCC(=O)OCC CS-0147250 [1,0,0,0,0,0|0,0,2]=3 53 B7R0.7 CC#CC(=O)OCC CS-W009547 [1,0,0,0,0,0|0,0,2]=3 54 B7R0.7 CCCC(Br)CCC CS-0106173 [1,0,0,0,0,0|2,0,1]=4 55 B7R0.7 CCCC(O)CCC CS-0132313 [1,0,0,0,0,0|1,0,2]=4 56 B7R0.7 CCNC(=O)CC#N CS-0141694 [1,0,0,0,0,0|2,0,1]=4 57 B7R0.7 CCNC(=O)CCCl CS-0151980 [1,0,0,0,0,0|2,0,0]=3 58 B7R0.7 CCNC(=S)NCC CS-0076442 [1,0,0,0,0,0|2,1,0]=4 59 B7R0.7 CCOC(=O)C#CBr CS-W022671 [1,0,0,0,0,0|1,0,2]=4 60 B7R0.7 CCOC(=O)CCBr CS-W007449 [1,0,0,0,0,0|1,0,0]=2 61 B7R0.7 CCOC(=O)CCI CS-W002223 [1,0,0,0,0,0|1,0,0]=2 62 B7R0.7 CCOC(=O)CCN CS-W019943 [1,0,0,0,0,0|1,0,0]=2 63 B7R0.7 CCOC(=O)CCO CS-0139545 [1,0,0,0,0,0|1,0,0]=2 64 B7R0.7 CCOC(=O)CNC CS-W020595 [1,0,0,0,0,0|1,0,0]=2 65 B7R0.7 CCOC(=O)CNN CS-W002085 [1,0,0,0,0,0|2,0,0]=3 66 B7R0.7 CCOC(=O)COC CS-0008463 [1,0,0,0,0,0|1,0,0]=2 67 B7R0.7 CCOC(=O)CSC CS-0133049 [1,0,0,0,0,0|1,0,0]=2 68 B7R0.7 CCOC(=O)OCCl CS-W005334 [1,0,0,0,0,0|2,0,0]=3 69 B7R0.7 CC\N=C(/O)NCC CS-W013607 [1,0,0,0,0,0|2,0,1]=4 70 B7R0.7 COCC(=O)COC CS-W007070 [1,0,0,0,0,0|3,0,0]=4 71 B7R0.7 O=C(CCCl)CCCl CS-W004439 [1,0,0,0,0,0|3,0,0]=4 72 B9R0.4 CCCCC(C)OC(C)=O CS-0255972 [0,1,0,0,0,0|1,0,2]=4 73 B9R0.4 CCCOC(=O)CC(C)C CS-0453597 [0,1,0,0,0,0|2,0,0]=3 74 B9R0.5 C#CCCCC(=O)OCC CS-0532490 [0,1,0,0,0,0|0,0,1]=2 75 B9R0.5 C(C)=C/C=CC(=O)OCC CS-W014374 [0,1,0,0,0,0|0,0,3]=4 76 B9R0.5 CCCCOC(=O)CC#N CS-W016439 [0,1,0,0,0,0|2,0,1]=4 77 B9R0.5 CCC\C=C\C(=O)OCC CS-W018283 [0,1,0,0,0,0|0,0,1]=2 78 B9R0.5 CCOC(=O)CCCC#N CS-0151586 [0,1,0,0,0,0|0,0,1]=2 79 B9R0.5 CCOC(=O)CCCCBr CS-W008658 [0,1,0,0,0,0|0,0,0]=1 80 B9R0.5 CCOC(=O)CCCCN CS-W022699 [0,1,0,0,0,0|0,0,0]=1 81 B9R0.5 CCOC(=O)COCCCl CS-W018917 [0,1,0,0,0,0|1,0,0]=2 82 B9R0.5 CCOCCC(=O)OCC CS-W013312 [0,1,0,0,0,0|0,0,0]=1 83 B9R0.5 CCO\C=C\C(=O)OCC CS-0046174 [0,1,0,0,0,0|0,0,2]=3 84 B9R0.5 CCO\C=C\C(=O)OCC CS-W002052 [0,1,0,0,0,0|0,0,2]=3 85 B9R0.8 CCCCC(=O)N(C)OC CS-0123008 [0,1,0,0,0,0|2,0,0]=3 86 B9R0.8 CON(C)C(=O)CCCCl CS-0046358 [0,1,0,0,0,0|3,0,0]=4 87 B9R0.18 C=CCOC(=O)NCCBr CS-0697868 [0,1,0,0,0,0|2,0,1]=4 88 B9R0.18 C=CCOC(=O)NCCN CS-0151406 [0,1,0,0,0,0|2,0,1]=4 89 B9R0.18 CCCCC(=O)CCCC CS-W018275 [0,1,0,0,0,0|1,0,0]=2 90 B9R0.18 CCCCC(O)CCCC CS-0083495 [0,1,0,0,0,0|1,0,2]=4 91 B9R0.18 CCCCS(=O)CCCC CS-0181824 [0,1,0,0,0,0|2,0,0]=3 92 B9R0.18 CCOCC(O)COCC CS-0217718 [0,1,0,0,0,0|1,0,2]=4 93 B9R0.18 O=C(CCCCl)CCCCl CS-W018764 [0,1,0,0,0,0|2,0,0]=3 94 B9R0.18 O=C(NCCO)NCCO CS-0142124 [0,1,0,0,0,0|3,0,0]=4 95 B9R0.34 CCCC(=O)CC(=O)OC CS-W005176 [0,1,0,0,0,0|2,0,1]=4 96 B9R0.34 CCOC(=O)CC(=N)NO CS-0197481 [0,1,0,0,0,0|2,0,1]=4 97 B9R0.34 CCOC(=O)CC(=O)CC CS-W019881 [0,1,0,0,0,0|0,0,1]=2 98 B9R0.34 CCOC(=O)CC(=O)CCl CS-D1440 [0,1,0,0,0,0|1,0,1]=3 99 B9R0.34 CCOC(=O)CC(=O)NC CS-0151538 [0,1,0,0,0,0|1,0,1]=3 100 B9R0.34 CCOC(=O)CC(=O)NN CS-W004175 [0,1,0,0,0,0|2,0,1]=4 101 B9R0.34 CCOC(=O)CC(=O)O[K] CS-D1444 [0,1,0,0,0,0|2,0,1]=4 102 B9R0.34 CCOC(=O)C[C@@H](O)CCl CS-W010802 [0,1,0,0,0,0|1,0,0]=2 103 B9R0.34 CCOC(=O)C[C@H](O)CCl CS-W017853 [0,1,0,0,0,0|1,0,0]=2 104 B9R0.34 CCOC(=O)NC(=O)CCl CS-0093623 [0,1,0,0,0,0|2,0,1]=4 105 B9R0.34 CCOC(=O)\C=C(/C)CBr CS-0106214 [0,1,0,0,0,0|1,0,2]=4 106 B9R0.35 C=CC[C@H](N)C(=O)OCC CS-0340794 [0,1,0,0,0,0|0,0,2]=3 107 B9R0.35 CCCC(Br)C(=O)OCC CS-W015179 [0,1,0,0,0,0|0,0,0]=1 108 B9R0.35 CCC[C@@H](N)C(=O)OCC CS-0539079 [0,1,0,0,0,0|0,0,0]=1 109 B9R0.35 CCC[C@H](N)C(=O)OCC CS-M0539 [0,1,0,0,0,0|0,0,0]=1 110 B9R0.35 CCOC(=N)C(=O)OCC CS-W006056 [0,1,0,0,0,0|1,0,1]=3 111 B9R0.35 CCOC(=O)C(Cl)OCC CS-0663093 [0,1,0,0,0,0|1,0,0]=2 112 B9R0.35 CCOC(=O)C(N)CSC CS-0311793 [0,1,0,0,0,0|1,0,0]=2 113 B9R0.48 C=C(C)CCC(=O)OCC CS-W018285 [0,1,0,0,0,0|0,0,1]=2 114 B9R0.48 CCOC(=O)CCC(=O)O CS-W013313 [0,1,0,0,0,0|1,0,1]=3 115 B9R0.48 CCOC(=O)CCC(C)=O CS-0204023 [0,1,0,0,0,0|0,0,1]=2 116 B9R0.48 CCOC(=O)CCC(C)Br CS-0139323 [0,1,0,0,0,0|0,0,0]=1 117 B9R0.48 CCOC(=O)CCC(C)C CS-0151589 [0,1,0,0,0,0|0,0,0]=1 118 B9R0.48 CCOC(=O)CCN(C)C CS-0124937 [0,1,0,0,0,0|1,0,0]=2 119 B9R0.48 CCOC(=O)CNC(C)=O CS-W016367 [0,1,0,0,0,0|1,0,1]=3 120 B9R0.48 CCOC(=O)NCC(=O)O CS-0106586 [0,1,0,0,0,0|2,0,1]=4 121 B9R0.48 CCOC(=O)\C=C\N(C)C CS-0028335 [0,1,0,0,0,0|1,0,2]=4 122 B9R0.48 CCOC(=O)\C=C\N(C)C CS-W008982 [0,1,0,0,0,0|1,0,2]=4 123 B9R0.66 CCO[Si](C)(C)CCCN CS-0151951 [0,1,0,0,0,0|2,1,0]=4 124 B9R1.2 CCN1CCNC(=O)C1 CS-0145869 [0,0,0,1,0,0|2,0,0]=3 125 B9R1.2 CSC1CCCC(=O)C1 CS-0237612 [0,0,0,1,0,0|2,0,0]=3 126 B9R1.2 N#CC1CCCC(=O)C1 CS-0119852 [0,0,0,1,0,0|2,0,1]=4 127 B9R1.2 NCC1CCNC(=O)C1 CS-0037079 [0,0,0,1,0,0|2,0,0]=3 128 B9R1.2 O=C1CC(CO)CCN1 CS-0051145 [0,0,0,1,0,0|2,0,0]=3 129 B9R1.2 O=C1CCCC(CO)N1 CS-0099968 [0,0,0,1,0,0|3,0,0]=4 130 B9R1.7 CCOC1=CC(=O)CC1 CS-0039741 [0,0,0,1,0,0|2,0,1]=4 131 B9R1.8 CCNC1CCCCC1 CS-W016555 [0,0,0,1,0,0|2,0,1]=4 132 B9R1.8 CCOC1=NCCCC1 CS-0188155 [0,0,0,1,0,0|1,0,0]=2 133 B9R1.8 NCCC1=CCCCC1 CS-0072656 [0,0,0,1,0,0|3,0,0]=4 134 B9R1.12 BrCCCC1OCCO1 CS-0159608 [0,0,0,1,0,0|1,0,2]=4 135 B9R1.12 ClCCCC1OCCO1 CS-W018131 [0,0,0,1,0,0|1,0,2]=4 136 B9R1.15 CCC1CCCCC1=O CS-0103893 [0,0,0,1,0,0|1,0,0]=2 137 B9R1.15 CCC1NCCNC1=O CS-0172224 [0,0,0,1,0,0|3,0,0]=4 138 B9R1.15 COC1COCCC1=O CS-0051285 [0,0,0,1,0,0|3,0,0]=4 139 B9R1.15 N#CC1CCCCC1=O CS-0054141 [0,0,0,1,0,0|2,0,1]=4 140 B9R1.27 CCC1C(=O)CCC1=O CS-0042297 [0,0,0,1,0,0|2,0,1]=4 141 B9R1.33 NCCN1CCNC1=O CS-W004517 [0,0,0,1,0,0|3,0,0]=4 142 B9R1.33 NCCN1CCOC1=O CS-0040773 [0,0,0,1,0,0|2,0,0]=3 143 B9R1.33 O=C1CCCN1CCBr CS-0040579 [0,0,0,1,0,0|3,0,0]=4 144 B9R1.33 O=C1CCCN1CCCl CS-0036362 [0,0,0,1,0,0|3,0,0]=4 145 B9R1.33 O=C1NCCN1CCO CS-0077124 [0,0,0,1,0,0|3,0,0]=4 146 B9R1.48 O=C1CCCCC(=O)C1 CS-W002860 [0,0,0,1,0,0|2,0,1]=4 147 B9R1.48 O=C1CCCCC(=O)O1 CS-W019642 [0,0,0,1,0,0|1,0,1]=3 148 B9R1.49 CN1CCCC(=O)CC1 CS-W003427 [0,0,0,1,0,0|2,0,0]=3 149 B9R1.49 O=C1CCCC(O)CN1 CS-0187220 [0,0,0,1,0,0|3,0,0]=4 150 B9R1.50 NC1CCCCCCC1 CS-0155298 [0,0,0,1,0,0|2,0,1]=4 151 B9R1.50 O=C1CCCCCCC1 CS-W007564 [0,0,0,1,0,0|1,0,0]=2 152 B9R1.50 O=C1CCCCCCN1 CS-W022575 [0,0,0,1,0,0|1,0,0]=2 153 B9R1.69 CC1CCC(O)CC1C CS-0206609 [0,0,0,1,0,0|1,0,2]=4 154 B9R1.73 CCOC(=N)C1CCC1 CS-B1686 [0,0,0,1,0,0|1,0,0]=2 155 B9R1.73 CCOC(=O)C1CCC1 CS-D1706 [0,0,0,1,0,0|0,0,0]=1 156 B9R1.73 CCOC(=O)C1CNC1 CS-0045521 [0,0,0,1,0,0|1,0,0]=2 157 B9R1.75 CCOC(=O)C=C1CC1 CS-0340229 [0,0,0,1,0,0|0,0,2]=3 158 B9R1.75 CCOC(=O)CC1CC1 CS-W000547 [0,0,0,1,0,0|0,0,0]=1 159 B9R1.134 CCC[N+]1(C)CCCC1 CS-0378408 [0,0,0,1,0,0|3,0,0]=4 160 B6R0.6 C(CC)=CCCO CS-W009552 [2,0,0,0,0,0|1,0,1]=4 161 B6R0.6 C(CO)=CCCC CS-W016652 [2,0,0,0,0,0|1,0,1]=4 162 B6R0.6 CCCCCCI CS-0132388 [2,0,0,0,0,0|1,0,1]=4 163 B6R0.6 CCCCCCN CS-0196786 [2,0,0,0,0,0|1,0,1]=4 164 B6R0.6 CCCNCCC CS-0187381 [2,0,0,0,0,0|1,0,1]=4 165 B6R0.6 CCCNCCC CS-0214120 [2,0,0,0,0,0|1,0,1]=4 166 B6R0.6 CCNCCCN CS-0151962 [2,0,0,0,0,0|2,0,0]=4 167 B6R0.6 CCOCCCO CS-W013685 [2,0,0,0,0,0|1,0,0]=3 168 B6R0.6 CC\C=C/CCO CS-W011323 [2,0,0,0,0,0|1,0,1]=4 169 B6R0.6 COCCCCBr CS-W021313 [2,0,0,0,0,0|1,0,1]=4 170 B6R0.6 COCCCCCl CS-0039726 [2,0,0,0,0,0|1,0,1]=4 171 B6R0.6 COCCCCO CS-0150179 [2,0,0,0,0,0|1,0,1]=4 172 B6R0.1 C=CCC(=O)OC CS-0158011 [2,0,0,0,0,0|0,0,2]=4 173 B6R0.1 CC#CC(=O)OC CS-0066219 [2,0,0,0,0,0|0,0,2]=4 174 B6R0.1 CCC(=O)COC CS-0213932 [2,0,0,0,0,0|1,0,0]=3 175 B6R0.1 CCCC(=O)NN CS-0152447 [2,0,0,0,0,0|2,0,0]=4 176 B6R0.1 CCCC(Cl)CC CS-0102884 [2,0,0,0,0,0|1,0,1]=4 177 B6R0.1 CCNC(=O)CBr CS-0239382 [2,0,0,0,0,0|2,0,0]=4 178 B6R0.1 CCOC(=O)C#N CS-0022374 [2,0,0,0,0,0|1,0,1]=4 179 B6R0.1 CCOC(=O)CN CS-W020007 [2,0,0,0,0,0|1,0,0]=3 180 B6R0.1 CCOC(=O)CO CS-W019892 [2,0,0,0,0,0|1,0,0]=3 181 B6R0.1 CCOC(=O)NN CS-W008412 [2,0,0,0,0,0|2,0,0]=4 182 B6R0.1 CCOC(C)CC CS-0196425 [2,0,0,0,0,0|1,0,1]=4 183 B6R0.1 CNC(=O)CCCl CS-0143787 [2,0,0,0,0,0|2,0,0]=4 184 B6R0.1 CNC(=O)CCO CS-0188403 [2,0,0,0,0,0|2,0,0]=4 185 B6R0.1 CNCC(=O)O[Na] CS-0077129 [2,0,0,0,0,0|2,0,0]=4 186 B6R0.1 COC(=O)CC#N CS-W016657 [2,0,0,0,0,0|1,0,1]=4 187 B6R0.1 COC(=O)CCBr CS-W008728 [2,0,0,0,0,0|1,0,0]=3 188 B6R0.1 COC(=O)CCCl CS-0131786 [2,0,0,0,0,0|1,0,0]=3 189 B6R0.1 COC(=O)CCI CS-0615889 [2,0,0,0,0,0|1,0,0]=3 190 B6R0.1 COC(=O)CCN CS-W007648 [2,0,0,0,0,0|1,0,0]=3 191 B6R0.1 COC(=O)CCO CS-0022864 [2,0,0,0,0,0|1,0,0]=3 192 B6R0.1 COC(=O)CCS CS-0000049 [2,0,0,0,0,0|1,0,0]=3 193 B6R0.1 COC(=O)OCCl CS-0067504 [2,0,0,0,0,0|2,0,0]=4 194 B6R0.4 C#CCCC(=O)O CS-W008784 [2,0,0,0,0,0|0,0,2]=4 195 B6R0.4 C=CCCC(=O)O CS-W009138 [2,0,0,0,0,0|0,0,2]=4 196 B6R0.4 CC(=O)CCCCl CS-W013569 [2,0,0,0,0,0|1,0,0]=3 197 B6R0.4 CC(=O)CCCO CS-0020001 [2,0,0,0,0,0|1,0,0]=3 198 B6R0.4 CC(=O)NCCO CS-W013689 [2,0,0,0,0,0|2,0,0]=4 199 B6R0.4 CC(=O)OCCBr CS-W007598 [2,0,0,0,0,0|2,0,0]=4 200 B6R0.4 CC(=O)OCCN CS-0657679 [2,0,0,0,0,0|2,0,0]=4 201 B6R0.4 CC(=O)OCCO CS-0154995 [2,0,0,0,0,0|2,0,0]=4 202 B6R0.4 CCC#CC(=O)O CS-W013726 [2,0,0,0,0,0|0,0,2]=4 203 B6R0.4 CCCCB(O)O CS-W000932 [2,0,0,0,0,0|1,0,1]=4 204 B6R0.4 CCCCC(=N)N CS-0122242 [2,0,0,0,0,0|2,0,0]=4 205 B6R0.4 CCCCC(N)=S CS-0248646 [2,0,0,0,0,0|1,1,0]=4 206 B6R0.4 CCCCS(=O)[O-] CS-0851776 [2,0,0,0,0,0|1,0,1]=4 207 B6R0.4 CCCC[C@@H](C)O CS-0179419 [2,0,0,0,0,0|0,0,2]=4 208 B6R0.4 CCCC[C@H](C)O CS-0179420 [2,0,0,0,0,0|0,0,2]=4 209 B6R0.4 CCCNC(C)=O CS-0246738 [2,0,0,0,0,0|1,0,0]=3 210 B6R0.4 CCCOC(N)=O CS-W019060 [2,0,0,0,0,0|2,0,0]=4 211 B6R0.4 CCNCC(=O)O CS-0201673 [2,0,0,0,0,0|1,0,0]=3 212 B6R0.4 CCOCC(=O)O CS-0071579 [2,0,0,0,0,0|1,0,0]=3 213 B6R0.4 CCSCC(=O)O CS-0197336 [2,0,0,0,0,0|1,0,0]=3 214 B6R0.4 CC\C=C\C(=O)O CS-0053528 [2,0,0,0,0,0|0,0,2]=4 215 B6R0.4 CNCCC(=O)O CS-0112815 [2,0,0,0,0,0|1,0,0]=3 216 B6R0.4 CNCCC(=O)O CS-0169148 [2,0,0,0,0,0|1,0,0]=3 217 B6R0.4 CNCCC(N)=O CS-0214971 [2,0,0,0,0,0|2,0,0]=4 218 B6R0.4 COCCC(=O)O CS-W009112 [2,0,0,0,0,0|1,0,0]=3 219 B6R0.4 CS(=O)CCCN CS-0286765 [2,0,0,0,0,0|2,0,0]=4 220 B6R0.4 CSCCC(=O)O CS-6296 [2,0,0,0,0,0|1,0,0]=3 221 B6R0.4 CSCCC(C)=O CS-0206726 [2,0,0,0,0,0|1,0,0]=3 222 B6R0.4 C\C=C\CC(=O)O CS-0129103 [2,0,0,0,0,0|0,0,2]=4 223 B6R0.4 N#CCCC(=O)O CS-W018565 [2,0,0,0,0,0|1,0,1]=4 224 B6R0.4 NCCCC(=O)O CS-W020704 [2,0,0,0,0,0|1,0,0]=3 225 B6R0.4 NCCCC(N)=O CS-0103894 [2,0,0,0,0,0|2,0,0]=4 226 B6R0.4 O=C(O)CCCBr CS-W016047 [2,0,0,0,0,0|1,0,0]=3 227 B6R0.4 O=C(O)CCCCl CS-W013545 [2,0,0,0,0,0|1,0,0]=3 228 B8R0.4 CCCCC#CCCO CS-0315148 [1,1,0,0,0,0|1,0,1]=4 229 B8R0.4 CCCCCCCCBr CS-0076039 [1,1,0,0,0,0|1,0,1]=4 230 B8R0.4 CCCCCCCCI CS-0188391 [1,1,0,0,0,0|1,0,1]=4 231 B8R0.4 CCCCCCCCN CS-0076038 [1,1,0,0,0,0|1,0,1]=4 232 B8R0.4 CCCCCCCCN CS-0179378 [1,1,0,0,0,0|1,0,1]=4 233 B8R0.4 CCCCCCCCO CS-0076037 [1,1,0,0,0,0|1,0,1]=4 234 B8R0.4 CCCCC\C=C\CO CS-0152366 [1,1,0,0,0,0|2,0,0]=4 235 B8R0.4 CCCCOCCCN CS-0130475 [1,1,0,0,0,0|2,0,0]=4 236 B8R0.4 CCCCSCCCC CS-0255960 [1,1,0,0,0,0|1,0,1]=4 237 B8R0.6 CCCCCC(O)CC CS-0152331 [1,1,0,0,0,0|1,0,1]=4 238 B8R0.6 CCCCC[C@@H](O)CC CS-0464840 [1,1,0,0,0,0|1,0,1]=4 239 B8R0.7 CCCCCCC(C)Br CS-0182749 [1,1,0,0,0,0|1,0,1]=4 240 B8R0.7 CCCCCCC(C)O CS-W011107 [1,1,0,0,0,0|1,0,1]=4 241 B8R0.7 CCCCCC[C@@H](C)N CS-0204339 [1,1,0,0,0,0|1,0,1]=4 242 B8R0.7 CCCCCC[C@@H](C)O CS-0140572 [1,1,0,0,0,0|1,0,1]=4 243 B8R0.7 CCCCCC[C@H](C)O CS-0140577 [1,1,0,0,0,0|1,0,1]=4 244 B8R0.3 C#CC[C@H](N)C(=O)OC CS-0180948 [1,1,0,0,0,0|0,0,2]=4 245 B8R0.3 CCCC(N)C(=O)OC CS-0152454 [1,1,0,0,0,0|0,0,0]=2 246 B8R0.3 CCC[C@H](N)C(=O)OC CS-0152592 [1,1,0,0,0,0|0,0,0]=2 247 B8R0.3 CCOC(=O)C(=O)CC CS-W005382 [1,1,0,0,0,0|1,0,1]=4 248 B8R0.3 COC(=O)C(C)CCCl CS-0205287 [1,1,0,0,0,0|1,0,0]=3 249 B8R0.3 COC(=O)[C@@H](N)CSC CS-0654810 [1,1,0,0,0,0|1,0,0]=3 250 B8R0.3 COC[C@@H](N)C(=O)OC CS-0162497 [1,1,0,0,0,0|1,0,0]=3 251 B8R0.8 CCCCC(=O)C(=O)O CS-0069654 [1,1,0,0,0,0|1,0,1]=4 252 B8R0.9 COC(=O)CCC(=O)O CS-W011096 [1,1,0,0,0,0|1,0,1]=4 253 B8R0.9 COC(=O)CCC(C)=O CS-0023754 [1,1,0,0,0,0|0,0,1]=3 254 B8R0.9 COC(=O)CCC(N)=O CS-0453315 [1,1,0,0,0,0|1,0,1]=4 255 B8R0.9 COC(=O)CCS(=O)[O-] CS-W008508 [1,1,0,0,0,0|2,0,0]=4 256 B8R0.9 COC(=O)CC[C@H](C)N CS-0572078 [1,1,0,0,0,0|0,0,0]=2 257 B8R0.9 COC(=O)CNC(C)=O CS-W013428 [1,1,0,0,0,0|1,0,1]=4 258 B8R0.9 COC(=O)CNC(C)C CS-0200417 [1,1,0,0,0,0|1,0,0]=3 259 B8R0.11 CCCCC(CC)CBr CS-W004392 [1,1,0,0,0,0|1,0,1]=4 260 B8R0.11 CCCCC(CC)CCl CS-W016329 [1,1,0,0,0,0|1,0,1]=4 261 B8R0.11 CCCCC(CC)CO CS-0016002 [1,1,0,0,0,0|0,0,2]=4 262 B8R0.19 CCC(=O)CC(=O)CC CS-W013466 [1,1,0,0,0,0|0,0,1]=3 263 B8R0.19 CCC(=O)CC(=O)OC CS-W011110 [1,1,0,0,0,0|0,0,1]=3 264 B8R0.19 CC[C@@H](O)CC(=O)OC CS-0852565 [1,1,0,0,0,0|0,0,0]=2 265 B8R0.19 CNC(C)CC(=O)OC CS-0124917 [1,1,0,0,0,0|1,0,0]=3 266 B8R0.19 COC(=O)CC(=O)CCl CS-0044248 [1,1,0,0,0,0|1,0,1]=4 267 B8R0.19 COC(=O)CC(=O)OC CS-0019394 [1,1,0,0,0,0|1,0,1]=4 268 B8R0.19 COC(=O)N[C@@H](C)CN CS-0010956 [1,1,0,0,0,0|2,0,0]=4 269 B8R0.25 CCCCS(=O)(=O)O[Na] CS-W017940 [1,1,0,0,0,0|2,0,0]=4 270 B8R0.5 CC(C)OC(=O)CC#N CS-W013485 [1,1,0,0,0,0|1,0,1]=4 271 B8R0.5 CC(C)OC(=O)OCCl CS-W016293 [1,1,0,0,0,0|2,0,0]=4 272 B8R0.5 CC(C)OC(=O)OCI CS-0070034 [1,1,0,0,0,0|2,0,0]=4 273 B8R0.5 CCOC(=O)CC(=N)N CS-W003345 [1,1,0,0,0,0|1,0,1]=4 274 B8R0.5 CCOC(=O)CC(=N)S CS-W005154 [1,1,0,0,0,0|1,0,1]=4 275 B8R0.5 CCOC(=O)CC(=O)O CS-0016016 [1,1,0,0,0,0|1,0,1]=4 276 B8R0.5 CCOC(=O)CC(C)=O CS-0016216 [1,1,0,0,0,0|0,0,1]=3 277 B8R0.5 CCOC(=O)CC(C)Br CS-0197403 [1,1,0,0,0,0|0,0,0]=2 278 B8R0.5 CCOC(=O)CC(C)N CS-0030781 [1,1,0,0,0,0|0,0,0]=2 279 B8R0.5 CCOC(=O)CC(C)O CS-W013417 [1,1,0,0,0,0|0,0,0]=2 280 B8R0.5 CCOC(=O)CC(N)=O CS-W002214 [1,1,0,0,0,0|1,0,1]=4 281 B8R0.5 CCOC(=O)CN(C)C CS-W013421 [1,1,0,0,0,0|1,0,0]=3 282 B8R0.5 CCOC(=O)C[C@@H](C)N CS-0162169 [1,1,0,0,0,0|0,0,0]=2 283 B8R0.5 CCOC(=O)C[C@H](C)N CS-0095476 [1,1,0,0,0,0|0,0,0]=2 284 B8R0.5 CCOC(=O)C[C@H](C)O CS-0112519 [1,1,0,0,0,0|0,0,0]=2 285 B8R0.5 CCOC(=O)C[N+](=O)[O-] CS-0000037 [1,1,0,0,0,0|2,0,0]=4 286 B8R0.5 CCOC(=O)C[S+](C)C CS-0167158 [1,1,0,0,0,0|1,0,0]=3 287 B8R0.5 CCOC(=O)OC(C)Cl CS-W016294 [1,1,0,0,0,0|1,0,0]=3 288 B8R0.5 CCOC(=O)\C=C(\C)I CS-0130425 [1,1,0,0,0,0|0,0,2]=4 289 B8R0.5 CCOC(=O)\C=C(\C)N CS-0031464 [1,1,0,0,0,0|0,0,2]=4 290 B8R0.5 CCOC(=O)\C=C(\C)N CS-W011120 [1,1,0,0,0,0|0,0,2]=4 291 B8R0.5 COCC(=O)OC(C)C CS-M1127 [1,1,0,0,0,0|1,0,0]=3 292 B8R0.5 C\C=C\C(=O)OC(C)C CS-0158289 [1,1,0,0,0,0|0,0,2]=4 293 B8R0.22 CCCN(C=O)CCC CS-W011117 [1,1,0,0,0,0|2,0,0]=4 294 B8R0.30 CCOP(=O)(O)OCC CS-6295 [1,1,0,0,0,0|2,0,0]=4 295 B8R0.30 CCOP(=O)([O-])OCC CS-0152008 [1,1,0,0,0,0|2,0,0]=4 296 B10R0.18 CCCCC(=O)CC(=O)OC CS-0152392 [0,2,0,0,0,0|1,0,1]=4 297 B10R0.18 CCOCC(=O)CC(=O)OC CS-0043415 [0,2,0,0,0,0|1,0,1]=4 298 B10R0.28 C#CCCC(=O)OC(C)(C)C CS-0088785 [0,2,0,0,0,0|0,0,2]=4 299 B10R0.28 CC(C)(C)OC(=O)CCCBr CS-W008626 [0,2,0,0,0,0|1,0,0]=3 300 B10R0.28 CC(C)(C)OC(=O)CCCN CS-0032899 [0,2,0,0,0,0|1,0,0]=3 301 B10R0.28 CC(C)(C)OC(=O)CCCN CS-W005632 [0,2,0,0,0,0|1,0,0]=3 302 B10R0.28 CC(C)(C)OC(=O)CCCO CS-W020459 [0,2,0,0,0,0|1,0,0]=3 303 B10R0.28 CC(C)(C)OC(=O)NCCCl CS-W004916 [0,2,0,0,0,0|2,0,0]=4 304 B10R0.28 CC(C)(C)OC(=O)NCCI CS-0102471 [0,2,0,0,0,0|2,0,0]=4 305 B10R0.28 CC(C)(C)OC(=O)NCCN CS-B0430 [0,2,0,0,0,0|2,0,0]=4 306 B10R0.28 CC(C)(C)OC(=O)NCCN CS-W015688 [0,2,0,0,0,0|2,0,0]=4 307 B10R0.28 CC(C)(C)OC(=O)NCCO CS-W007322 [0,2,0,0,0,0|2,0,0]=4 308 B10R0.28 CC(C)(C)OC(=O)NCCS CS-0159828 [0,2,0,0,0,0|2,0,0]=4 309 B10R0.28 CCNCC(=O)OC(C)(C)C CS-W018855 [0,2,0,0,0,0|1,0,0]=3 310 B10R0.28 CNCCC(=O)OC(C)(C)C CS-0124731 [0,2,0,0,0,0|1,0,0]=3 311 B10R0.32 CCOC(=O)C(=O)CC(C)=O CS-0007580 [0,2,0,0,0,0|0,0,2]=4 312 B10R0.32 CCOC(=O)C(O)CC(C)C CS-0172268 [0,2,0,0,0,0|0,0,0]=2 313 B10R0.32 CCOC(=O)[C@@H](N)CC(=O)O CS-0671031 [0,2,0,0,0,0|1,0,1]=4 314 B10R0.32 [C@H](N)(CC(C)C)C(=O)OCC CS-W010608 [0,2,0,0,0,0|0,0,0]=2 315 B10R0.1 C=CCCCCC(=O)OCC CS-0159602 [0,2,0,0,0,0|0,0,0]=2 316 B10R0.1 C=CCNCCC(=O)OCC CS-0124769 [0,2,0,0,0,0|0,0,1]=3 317 B10R0.1 CCCCCCC(=O)OCC CS-W010893 [0,2,0,0,0,0|0,0,0]=2 318 B10R0.1 CCOC(=O)CCCCCBr CS-W022710 [0,2,0,0,0,0|0,0,0]=2 319 B10R0.1 CCOC(=O)CCCCCO CS-W023138 [0,2,0,0,0,0|0,0,0]=2 320 B10R0.1 CCOC(=O)COCCCCl CS-0163231 [0,2,0,0,0,0|0,0,0]=2 321 B10R0.1 CCOCCCC(=O)OCC CS-0904341 [0,2,0,0,0,0|0,0,0]=2 322 B10R0.2 C(C(=O)OCC)=C(\N)OCC CS-W004856 [0,2,0,0,0,0|0,0,2]=4 323 B10R0.2 CCCC(=O)CC(=O)OCC CS-W016203 [0,2,0,0,0,0|0,0,0]=2 324 B10R0.2 CCCC(O)CC(=O)OCC CS-W013272 [0,2,0,0,0,0|0,0,0]=2 325 B10R0.2 CCC[C@H](O)CC(=O)OCC CS-0834508 [0,2,0,0,0,0|0,0,0]=2 326 B10R0.2 CCOC(=N)CC(=N)OCC CS-0039263 [0,2,0,0,0,0|1,0,1]=4 327 B10R0.2 CCOC(=N)CC(=O)OCC CS-W019993 [0,2,0,0,0,0|0,0,1]=3 328 B10R0.2 CCOC(=O)CC(=O)COC CS-W022693 [0,2,0,0,0,0|0,0,1]=3 329 B10R0.2 CCOC(=O)C[C@H](O)CC#N CS-W002591 [0,2,0,0,0,0|0,0,1]=3 330 B10R0.2 CCOC(=O)OC(=O)OCC CS-0014816 [0,2,0,0,0,0|1,0,1]=4 331 B10R0.2 C\C=C\C(=O)CC(=O)OCC CS-0700573 [0,2,0,0,0,0|0,0,2]=4 332 B10R0.3 CCCC(=O)CCCC(=O)O CS-0323350 [0,2,0,0,0,0|1,0,1]=4 333 B10R0.3 CCOC(=O)CCCC(=O)O CS-0151584 [0,2,0,0,0,0|0,0,1]=3 334 B10R0.3 CCOC(=O)CCCC(C)=O CS-W010896 [0,2,0,0,0,0|0,0,0]=2 335 B10R0.3 CCOC(=O)CCC[N+](=O)[O-] CS-0158610 [0,2,0,0,0,0|1,0,0]=3 336 B10R0.19 CCCCC(=O)C(=O)OCC CS-0049501 [0,2,0,0,0,0|0,0,0]=2 337 B10R0.19 CCOC(=O)C(N)CCSC CS-0169308 [0,2,0,0,0,0|0,0,0]=2 338 B10R0.19 CCOC(=O)[C@@H](N)CCCN CS-0101217 [0,2,0,0,0,0|0,0,0]=2 339 B10R0.19 CCOC(=O)[C@@H](N)CCSC CS-0044991 [0,2,0,0,0,0|0,0,0]=2 340 B10R0.19 CCO\C=C(/C)C(=O)OCC CS-0037394 [0,2,0,0,0,0|0,0,2]=4 341 B10R0.83 CCCCOC(=O)[C@@H](O)CC CS-0148545 [0,2,0,0,0,0|1,0,0]=3 342 B10R0.91 C#CCOC(=O)NCCCC CS-0152104 [0,2,0,0,0,0|0,0,1]=3 343 B10R0.91 C=CCOC(=O)CCCCC CS-W014336 [0,2,0,0,0,0|0,0,1]=3 344 B10R0.91 CCCCOC(=O)CCCC CS-W016199 [0,2,0,0,0,0|0,0,0]=2 345 B10R0.108 CCOC(=O)CNC(=O)CN CS-0210211 [0,2,0,0,0,0|1,0,1]=4 346 B10R0.35 CCOC(=O)C(C)C(=O)CC CS-0121777 [0,2,0,0,0,0|0,0,1]=3 347 B10R0.35 CCOC(=O)C(F)C(=O)CC CS-0020726 [0,2,0,0,0,0|0,0,1]=3 348 B10R0.16 CCCCN(C=O)CCCC CS-0187560 [0,2,0,0,0,0|2,0,0]=4 349 B10R0.26 CCOC(=O)CC(=O)C(C)C CS-W016205 [0,2,0,0,0,0|0,0,1]=3 350 B10R0.26 CCOC(=O)CC(=O)C(F)F CS-W009248 [0,2,0,0,0,0|1,0,1]=4 351 B10R0.26 CCOC(=O)CC(C)N(C)C CS-0147768 [0,2,0,0,0,0|1,0,0]=3 352 B10R0.34 CCOC(=O)CN(CC)CC CS-0205225 [0,2,0,0,0,0|1,0,0]=3 353 B10R0.33 CCOC(=O)C(C#N)CC#N CS-0022344 [0,2,0,0,0,0|1,0,1]=4 354 B10R0.129 C=CCC(F)(F)C(=O)OCC CS-0067995 [0,2,0,0,0,0|0,0,2]=4 355 B10R0.109 CCOC(=O)CCC(C)(F)F CS-0454592 [0,2,0,0,0,0|0,0,0]=2 356 B10R0.109 CCOC(=O)CCC(F)(F)F CS-B0243 [0,2,0,0,0,0|1,0,0]=3 357 B10R0.109 CCOC(=O)CNS(C)(=O)=O CS-0182828 [0,2,0,0,0,0|2,0,0]=4 358 B10R0.109 CCOC(=O)OCC(F)(F)F CS-0196827 [0,2,0,0,0,0|2,0,0]=4 359 B8R1.2 BrCC1CCOCC1 CS-W003105 [1,0,0,1,0,0|1,0,1]=4 360 B8R1.2 CCC1CCNCC1 CS-0147296 [1,0,0,1,0,0|1,0,1]=4 361 B8R1.2 CNC1CCOCC1 CS-D1570 [1,0,0,1,0,0|1,0,1]=4 362 B8R1.2 ClCC1CCOCC1 CS-0069602 [1,0,0,1,0,0|1,0,1]=4 363 B8R1.2 ICC1CCOCC1 CS-W001910 [1,0,0,1,0,0|1,0,1]=4 364 B8R1.2 NCC1CCOCC1 CS-0036420 [1,0,0,1,0,0|1,0,1]=4 365 B8R1.2 NCC1CCOCC1 CS-W008973 [1,0,0,1,0,0|1,0,1]=4 366 B8R1.2 OCC1CC=CCC1 CS-W013655 [1,0,0,1,0,0|2,0,0]=4 367 B8R1.2 OCC1CCOCC1 CS-D1227 [1,0,0,1,0,0|1,0,1]=4 368 B8R1.8 CCO[C@@H]1CCNC1 CS-0053329 [1,0,0,1,0,0|1,0,1]=4 369 B8R1.8 CNCC1CCOC1 CS-0048865 [1,0,0,1,0,0|1,0,1]=4 370 B8R1.8 OCCC1CCOC1 CS-0240119 [1,0,0,1,0,0|1,0,1]=4 371 B8R1.22 CC1CCCNCC1 CS-0199646 [1,0,0,1,0,0|1,0,1]=4 372 B8R1.49 C1=CCCCCCC1 CS-0035172 [1,0,0,1,0,0|1,0,0]=3 373 B8R1.49 C1CCCNCCC1 CS-0204387 [1,0,0,1,0,0|1,0,1]=4 374 B8R1.1 C=CC1COC(=O)C1 CS-B0698 [1,0,0,1,0,0|0,0,2]=4 375 B8R1.1 C=C[C@H]1COC(=O)C1 CS-0001483 [1,0,0,1,0,0|0,0,2]=4 376 B8R1.1 CCC1CCC(=O)N1 CS-0046651 [1,0,0,1,0,0|1,0,0]=3 377 B8R1.1 CCC1COC(=O)N1 CS-0447690 [1,0,0,1,0,0|1,0,0]=3 378 B8R1.1 CCC1COC(=O)O1 CS-0187002 [1,0,0,1,0,0|1,0,0]=3 379 B8R1.1 CC[C@H]1COC(=O)N1 CS-0093963 [1,0,0,1,0,0|1,0,0]=3 380 B8R1.1 N#C[C@@H]1CCC(=O)C1 CS-0056414 [1,0,0,1,0,0|1,0,1]=4 381 B8R1.1 NCC1CCC(=O)N1 CS-0029734 [1,0,0,1,0,0|2,0,0]=4 382 B8R1.1 NCC1CCC(=O)N1 CS-0075962 [1,0,0,1,0,0|2,0,0]=4 383 B8R1.1 NCC1CNC(=O)C1 CS-0051184 [1,0,0,1,0,0|2,0,0]=4 384 B8R1.1 NC[C@@H]1CCC(=O)N1 CS-0144990 [1,0,0,1,0,0|2,0,0]=4 385 B8R1.1 NC[C@H]1CCC(=O)N1 CS-0105178 [1,0,0,1,0,0|2,0,0]=4 386 B8R1.1 O=C1CC(CO)CN1 CS-0046664 [1,0,0,1,0,0|2,0,0]=4 387 B8R1.1 O=C1CC(CO)CO1 CS-0037642 [1,0,0,1,0,0|1,0,0]=3 388 B8R1.1 O=C1CCC(CO)C1 CS-0315717 [1,0,0,1,0,0|1,0,0]=3 389 B8R1.1 O=C1CCC(CO)N1 CS-W001608 [1,0,0,1,0,0|2,0,0]=4 390 B8R1.1 O=C1CCC(CO)O1 CS-0113560 [1,0,0,1,0,0|2,0,0]=4 391 B8R1.1 O=C1CC[C@@H](CBr)N1 CS-B0460 [1,0,0,1,0,0|2,0,0]=4 392 B8R1.1 O=C1CC[C@@H](CO)N1 CS-B0366 [1,0,0,1,0,0|2,0,0]=4 393 B8R1.1 O=C1CC[C@H](CO)N1 CS-W001840 [1,0,0,1,0,0|2,0,0]=4 394 B8R1.1 O=C1NC(CO)CO1 CS-0309754 [1,0,0,1,0,0|2,0,0]=4 395 B8R1.1 O=C1N[C@@H](CF)CO1 CS-0256092 [1,0,0,1,0,0|2,0,0]=4 396 B8R1.1 O=C1N[C@@H](CI)CO1 CS-0149725 [1,0,0,1,0,0|2,0,0]=4 397 B8R1.1 O=C1N[C@@H](CO)CO1 CS-0067476 [1,0,0,1,0,0|2,0,0]=4 398 B8R1.1 O=C1N[C@H](CO)CO1 CS-0216909 [1,0,0,1,0,0|2,0,0]=4 399 B8R1.1 O=C1OCC(CO)O1 CS-0158426 [1,0,0,1,0,0|2,0,0]=4 400 B8R1.3 CC1CCC(=O)CC1 CS-W013656 [1,0,0,1,0,0|0,0,0]=2 401 B8R1.3 CC1CCC(=O)NC1 CS-0009361 [1,0,0,1,0,0|1,0,0]=3 402 B8R1.3 CC1CCC(O)CC1 CS-0059254 [1,0,0,1,0,0|0,0,2]=4 403 B8R1.3 CC1CNC(=O)CO1 CS-0444103 [1,0,0,1,0,0|2,0,0]=4 404 B8R1.3 CN1CCC(=O)CC1 CS-W009198 [1,0,0,1,0,0|1,0,0]=3 405 B8R1.3 C[C@@H]1CNC(=O)CO1 CS-0478990 [1,0,0,1,0,0|2,0,0]=4 406 B8R1.3 C[C@H]1CC[C@@H](N)CC1 CS-0170852 [1,0,0,1,0,0|1,0,1]=4 407 B8R1.3 C[C@H]1CC[C@@H](O)CC1 CS-0180937 [1,0,0,1,0,0|0,0,2]=4 408 B8R1.3 C[C@H]1CC[C@H](N)CC1 CS-W003376 [1,0,0,1,0,0|1,0,1]=4 409 B8R1.3 C[C@H]1CC[C@H](N)CC1 CS-W011254 [1,0,0,1,0,0|1,0,1]=4 410 B8R1.3 C[C@H]1CC[C@H](O)CC1 CS-0180938 [1,0,0,1,0,0|0,0,2]=4 411 B8R1.3 C[C@H]1CNC(=O)CO1 CS-0478989 [1,0,0,1,0,0|2,0,0]=4 412 B8R1.3 NC1CCC(=O)CC1 CS-W005034 [1,0,0,1,0,0|1,0,0]=3 413 B8R1.3 NC1CCC(=O)NC1 CS-0050676 [1,0,0,1,0,0|2,0,0]=4 414 B8R1.3 N[C@H]1CCC(=O)NC1 CS-0185259 [1,0,0,1,0,0|2,0,0]=4 415 B8R1.3 O=C1CCC(=O)CC1 CS-W011270 [1,0,0,1,0,0|1,0,1]=4 416 B8R1.3 O=C1CCC(O)CC1 CS-D0911 [1,0,0,1,0,0|1,0,0]=3 417 B8R1.3 O=C1CCC(O)CN1 CS-D0057 [1,0,0,1,0,0|2,0,0]=4 418 B8R1.3 O=C1CCS(=O)CC1 CS-0188184 [1,0,0,1,0,0|2,0,0]=4 419 B8R1.3 O=C1CC[C@H](O)CN1 CS-D0042 [1,0,0,1,0,0|2,0,0]=4 420 B8R1.38 CCC(N)C1CCC1 CS-0655543 [1,0,0,1,0,0|1,0,1]=4 421 B8R1.38 CNC(=O)C1CNC1 CS-0184861 [1,0,0,1,0,0|2,0,0]=4 422 B8R1.38 COC(=O)C1CCC1 CS-W013640 [1,0,0,1,0,0|0,0,0]=2 423 B8R1.38 COC(=O)C1CNC1 CS-D1541 [1,0,0,1,0,0|1,0,0]=3 424 B8R1.38 COC(=O)C1COC1 CS-0045513 [1,0,0,1,0,0|1,0,0]=3 425 B8R1.38 O=C(CCl)N1CCC1 CS-0054578 [1,0,0,1,0,0|2,0,0]=4 426 B8R1.40 NCC(=O)NC1CC1 CS-0077363 [1,0,0,1,0,0|2,0,0]=4 427 B8R1.40 O=C(CBr)NC1CC1 CS-0627309 [1,0,0,1,0,0|2,0,0]=4 428 B8R1.50 CC1C(=O)CCC1=O CS-W013660 [1,0,0,1,0,0|1,0,1]=4 429 B8R1.50 CC1CCC(=O)C1=O CS-W011271 [1,0,0,1,0,0|1,0,1]=4 430 B8R1.52 CCC1(O)CCCC1 CS-W013632 [1,0,0,1,0,0|0,0,2]=4 431 B8R1.52 CC[N+]1(C)CCCC1 CS-0185898 [1,0,0,1,0,0|2,0,0]=4 432 B8R1.52 CC[N+]1(C)CCCC1 CS-W015752 [1,0,0,1,0,0|2,0,0]=4 433 B8R1.4 CC1=CC(=O)CCC1 CS-0128362 [1,0,0,1,0,0|1,0,1]=4 434 B8R1.4 CC1CC(=O)CCN1 CS-0012636 [1,0,0,1,0,0|2,0,0]=4 435 B8R1.4 CC1CC(=O)CCO1 CS-W004274 [1,0,0,1,0,0|2,0,0]=4 436 B8R1.4 CC1CCCC(=O)N1 CS-0009358 [1,0,0,1,0,0|1,0,0]=3 437 B8R1.4 CC1CCCC(=O)O1 CS-0015920 [1,0,0,1,0,0|0,0,0]=2 438 B8R1.4 CC1COCC(=O)N1 CS-0146686 [1,0,0,1,0,0|2,0,0]=4 439 B8R1.4 CN1CCNC(=O)C1 CS-W003814 [1,0,0,1,0,0|2,0,0]=4 440 B8R1.4 CN1CCOC(=O)C1 CS-W001837 [1,0,0,1,0,0|1,0,0]=3 441 B8R1.4 C[C@@H]1CC(=O)CCN1 CS-0053488 [1,0,0,1,0,0|2,0,0]=4 442 B8R1.4 C[C@@H]1CCCC(=O)N1 CS-0312406 [1,0,0,1,0,0|1,0,0]=3 443 B8R1.4 C[C@@H]1COCC(=O)N1 CS-0059832 [1,0,0,1,0,0|2,0,0]=4 444 B8R1.4 C[C@H]1CC(=O)CCN1 CS-0053435 [1,0,0,1,0,0|2,0,0]=4 445 B8R1.4 C[C@H]1COCC(=O)N1 CS-W023097 [1,0,0,1,0,0|2,0,0]=4 446 B8R1.4 NC1CCNC(=O)C1 CS-0051036 [1,0,0,1,0,0|2,0,0]=4 447 B8R1.4 O=C1CC(O)CCN1 CS-W003628 [1,0,0,1,0,0|2,0,0]=4 448 B8R1.4 O=C1C[C@@H](O)CCN1 CS-W021175 [1,0,0,1,0,0|2,0,0]=4 449 B8R1.4 O=C1C[C@H](O)CCN1 CS-0105946 [1,0,0,1,0,0|2,0,0]=4 450 B8R1.18 CC1CC(=O)OC1=O CS-Z0015 [1,0,0,1,0,0|1,0,1]=4 451 B8R1.37 CCOC(=N)C1CC1 CS-0122277 [1,0,0,1,0,0|1,0,0]=3 452 B8R1.37 O=C(OCCl)C1CC1 CS-0723020 [1,0,0,1,0,0|1,0,0]=3 453 B10R1.61 CC(=O)C1CCCCC1=O CS-D1351 [0,1,0,1,0,0|1,0,1]=4 454 B10R1.61 CC(C)N1CCNCC1=O CS-0154193 [0,1,0,1,0,0|2,0,0]=4 455 B10R1.130 CCCC1=CC(=O)OC1O CS-B0865 [0,1,0,1,0,0|1,0,1]=4 456 B10R1.10 CCCC1CCCC(=O)O1 CS-W018288 [0,1,0,1,0,0|1,0,0]=3 457 B10R1.10 CCOC1=CC(=O)CCC1 CS-0100015 [0,1,0,1,0,0|1,0,1]=4 458 B10R1.11 CCNC(=O)[C@@H]1CCCN1 CS-0151982 [0,1,0,1,0,0|1,0,0]=3 459 B10R1.11 CCOC(=O)C1=CCCC1 CS-0199679 [0,1,0,1,0,0|0,0,1]=3 460 B10R1.11 CCOC(=O)C1CCCC1 CS-0235375 [0,1,0,1,0,0|0,0,0]=2 461 B10R1.11 CCOC(=O)C1CCCO1 CS-0109401 [0,1,0,1,0,0|0,0,0]=2 462 B10R1.11 CCOC(=O)C1CCNC1 CS-W003865 [0,1,0,1,0,0|0,0,0]=2 463 B10R1.11 CCOC(=O)[C@@H]1CCCN1 CS-0120026 [0,1,0,1,0,0|0,0,0]=2 464 B10R1.11 CCOC(=O)[C@@H]1CCNC1 CS-0187945 [0,1,0,1,0,0|0,0,0]=2 465 B10R1.11 CCOC(=O)[C@@H]1CSCN1 CS-0043107 [0,1,0,1,0,0|1,0,0]=3 466 B10R1.11 CCOC(=O)[C@H]1CCCN1 CS-0120429 [0,1,0,1,0,0|0,0,0]=2 467 B10R1.19 CCN1CCCCCC1=O CS-0999264 [0,1,0,1,0,0|1,0,0]=3 468 B10R1.21 BrCCCCC1OCCO1 CS-D0360 [0,1,0,1,0,0|0,0,2]=4 469 B10R1.21 CCCCOB1CCCO1 CS-0311905 [0,1,0,1,0,0|2,0,0]=4 470 B10R1.21 ClCCCCC1OCCO1 CS-0158365 [0,1,0,1,0,0|0,0,2]=4 471 B10R1.29 CCCCN1CCCC1=O CS-W016436 [0,1,0,1,0,0|1,0,0]=3 472 B10R1.29 N#CCCC1CCCC1=O CS-0511196 [0,1,0,1,0,0|1,0,1]=4 473 B10R1.29 NCCCN1CCCC1=O CS-0071095 [0,1,0,1,0,0|2,0,0]=4 474 B10R1.29 O=C1CCCN1CCCO CS-W013319 [0,1,0,1,0,0|2,0,0]=4 475 B10R1.78 O=C1CCCCCCCN1 CS-0090258 [0,1,0,1,0,0|1,0,0]=3 476 B10R1.135 CCOC(=O)C1CC1C#N CS-0049506 [0,1,0,1,0,0|0,0,1]=3 477 B10R1.135 CCOC(=O)C1CC1C=O CS-0106625 [0,1,0,1,0,0|0,0,1]=3 478 B10R1.135 CCOC(=O)[C@@H]1C[C@@H]1C#N CS-0049662 [0,1,0,1,0,0|0,0,1]=3 479 B10R1.135 CCOC(=O)[C@@H]1C[C@H]1C#N CS-0054373 [0,1,0,1,0,0|0,0,1]=3 480 B10R1.137 CCOC(=O)C=C1CCC1 CS-0038534 [0,1,0,1,0,0|0,0,1]=3 481 B10R1.137 CCOC(=O)C=C1COC1 CS-0006466 [0,1,0,1,0,0|0,0,2]=4 482 B10R1.137 CCOC(=O)C=C1CSC1 CS-0056274 [0,1,0,1,0,0|0,0,2]=4 483 B10R1.137 CCOC(=O)CC1COC1 CS-W000466 [0,1,0,1,0,0|0,0,0]=2 484 B10R1.138 CCCC(=O)OC[C@@H]1CO1 CS-0135409 [0,1,0,1,0,0|2,0,0]=4 485 B10R1.138 CCCC(=O)OC[C@H]1CO1 CS-D1790 [0,1,0,1,0,0|2,0,0]=4 486 B10R1.138 CCOC(=O)CNC1CC1 CS-0249130 [0,1,0,1,0,0|0,0,0]=2 487 B10R1.138 CCOC(=O)\C=C\C1CC1 CS-0198295 [0,1,0,1,0,0|0,0,1]=3 488 B10R1.30 CCN1C[C@H](C)NCC1=O CS-0062093 [0,1,0,1,0,0|2,0,0]=4 489 B10R1.182 CON(C)C(=O)C1CCC1 CS-0036219 [0,1,0,1,0,0|2,0,0]=4 490 B10R1.4 N#CCC1CCCCC1=O CS-0197222 [0,1,0,1,0,0|1,0,1]=4 491 B10R1.17 BrCCOC1CCCCC1 CS-0139366 [0,1,0,1,0,0|1,0,1]=4 492 B10R1.17 BrCCOC1CCCCO1 CS-W015177 [0,1,0,1,0,0|0,0,2]=4 493 B10R1.17 ClCCOC1CCCCO1 CS-W013242 [0,1,0,1,0,0|0,0,2]=4 494 B10R1.17 OCCOC1CCCCC1 CS-0216198 [0,1,0,1,0,0|1,0,1]=4 495 B10R1.17 OCCOC1CCCCO1 CS-0096278 [0,1,0,1,0,0|0,0,2]=4 496 B10R1.149 COC(=O)C1CCOC1=O CS-0077660 [0,1,0,1,0,0|1,0,1]=4 497 B10R1.140 C=C1CC(C(=O)OCC)C1 CS-0183659 [0,1,0,1,0,0|0,0,1]=3 498 B10R1.140 CCOC(=O)C1CC(=O)C1 CS-W008814 [0,1,0,1,0,0|0,0,1]=3 499 B10R1.140 CCOC(=O)C1CC(F)C1 CS-0475866 [0,1,0,1,0,0|0,0,0]=2 500 B10R1.140 CCOC(=O)C1CC(O)C1 CS-0044007 [0,1,0,1,0,0|0,0,0]=2 501 B10R1.140 CCOC(=O)[C@H]1C[C@@H](N)C1 CS-0040108 [0,1,0,1,0,0|0,0,0]=2 502 B10R1.140 CCOC(=O)[C@H]1C[C@@H](O)C1 CS-0053099 [0,1,0,1,0,0|0,0,0]=2 503 B10R1.140 CCOC(=O)[C@H]1C[C@H](N)C1 CS-0356458 [0,1,0,1,0,0|0,0,0]=2 504 B10R1.212 CCOC(=O)C(Br)C1CC1 CS-0042467 [0,1,0,1,0,0|0,0,0]=2 505 B10R1.401 CCOC(=O)C1(Br)CCC1 CS-0034793 [0,1,0,1,0,0|0,0,0]=2 506 B10R1.401 CCOC(=O)C1(C)CCC1 CS-0045362 [0,1,0,1,0,0|0,0,0]=2 507 B10R1.401 CCOC(=O)C1(N)CCC1 CS-M2531 [0,1,0,1,0,0|0,0,0]=2 508 B10R1.1 CCO[C@H]1CC[C@H](N)CC1 CS-0434286 [0,1,0,1,0,0|1,0,1]=4 509 B10R1.161 ON=C1CCCCCCC1 CS-0368253 [0,1,0,1,0,0|1,0,1]=4 510 B10R1.63 CC1(C)CCC(=O)OC1=O CS-0153793 [0,1,0,1,0,0|1,0,1]=4 511 B10R1.113 CC(C)C1CC(=O)CCO1 CS-0464877 [0,1,0,1,0,0|2,0,0]=4 512 B10R2.62 O=C1NC2CCC1CC2 CS-0052042 [0,0,0,2,0,0|2,0,0]=4 513 B10R2.71 O=C1CC2CCC(C1)N2 CS-M0611 [0,0,0,2,0,0|2,0,0]=4 514 B10R2.71 O=C1CC2CCC(C1)O2 CS-0049936 [0,0,0,2,0,0|2,0,0]=4 515 B10R2.534 O=C1CCCC2(CC2)C1 CS-0048695 [0,0,0,2,0,0|1,0,0]=3 516 B10R2.2 O=C1CC2C=CCC2O1 CS-0473135 [0,0,0,2,0,0|0,0,2]=4 517 B10R2.2 [C@H]12CC=C[C@H]1CC(=O)O2 CS-0045251 [0,0,0,2,0,0|0,0,2]=4 518 B10R2.32 O=C1CCN2CCCC12 CS-0628873 [0,0,0,2,0,0|2,0,0]=4 519 B10R2.178 O=C1CCC2CCC1N2 CS-0049978 [0,0,0,2,0,0|2,0,0]=4 520 B10R2.42 O=C1OC(=O)C2CCC12 CS-0051229 [0,0,0,2,0,0|1,0,1]=4