0 B11R0.124 C#CC(CC)OCCCCCC 34a_100000758843_100000210314 [0,0,0,0,0,0|3,0,1]=4 1 B11R0.124 C#CC(CC)OCCCCCC 7a_100000758843_100000210314 [0,0,0,0,0,0|3,0,1]=4 2 B11R0.124 C#CCCCNCC(OC)OC 270004a_100000718082_100000752162 [0,0,0,0,0,0|1,0,2]=3 3 B11R0.124 C#CCCCNCC(OC)OC 34a_100000718082_100000211822 [0,0,0,0,0,0|1,0,2]=3 4 B11R0.124 C#CCCCOCC(CC)OC 34a_100011934954_100000695029 [0,0,0,0,0,0|2,0,2]=4 5 B11R0.124 C#CCCCOCC(CC)OC 7a_100011934954_100011215417 [0,0,0,0,0,0|2,0,2]=4 6 B11R0.124 C#CCCCOCC(OC)OC 34a_100000215630_100000211822 [0,0,0,0,0,0|1,0,2]=3 7 B11R0.124 C#CCCCOCC(OC)OC 34a_100011216393_100000695029 [0,0,0,0,0,0|1,0,2]=3 8 B11R0.124 C#CCCCOCC(OC)OC 7a_100000215630_100000751394 [0,0,0,0,0,0|1,0,2]=3 9 B11R0.124 C#CCCCSCC(OC)OC 62a_100000751394_100011215417 [0,0,0,0,0,0|1,0,2]=3 10 B11R0.124 C#CCCCSCC(OC)OC 62a_100011215417_100000751394 [0,0,0,0,0,0|1,0,2]=3 11 B11R0.124 C#CCCNCCC(OC)OC 34a_100000755551_100000139399 [0,0,0,0,0,0|1,0,2]=3 12 B11R0.124 C#CCCOCCC(OC)OC 34a_100011215631_100000139399 [0,0,0,0,0,0|1,0,2]=3 13 B11R0.124 C#CCCSCCC(OC)OC 62a_100000139399_100000688953 [0,0,0,0,0,0|1,0,2]=3 14 B11R0.124 C#CCCSCCC(OC)OC 62a_100000688953_100000139399 [0,0,0,0,0,0|1,0,2]=3 15 B11R0.124 C#CCNCCCC(OC)OC 34a_100000212058_100000069011 [0,0,0,0,0,0|1,0,2]=3 16 B11R0.124 C#CCOCCCC(OC)OC 34a_100000210247_100000069011 [0,0,0,0,0,0|1,0,2]=3 17 B11R0.124 C#CCSCCCC(OC)OC 62a_100000038162_100000069011 [0,0,0,0,0,0|1,0,2]=3 18 B11R0.124 C/C=C/CCOCC(OC)OC 34a_100016278192_100000211822 [0,0,0,0,0,0|1,0,2]=3 19 B11R0.124 C/C=C/COCCC(OC)OC 34a_100016270725_100000139399 [0,0,0,0,0,0|1,0,2]=3 20 B11R0.124 C/C=C/CSCCC(OC)OC 62a_100000139399_100102629194 [0,0,0,0,0,0|1,0,2]=3 21 B11R0.124 C/C=C/CSCCC(OC)OC 62a_100102629194_100000139399 [0,0,0,0,0,0|1,0,2]=3 22 B11R0.124 C=CC(CC)OCCCCCC 34a_100000766422_100000210314 [0,0,0,0,0,0|3,0,1]=4 23 B11R0.124 C=CC(CC)OCCCCCC 7a_100000766422_100000210314 [0,0,0,0,0,0|3,0,1]=4 24 B11R0.124 C=CC(CCCCCCC)OC 34a_200011934235_200000210301 [0,0,0,0,0,0|1,0,1]=2 25 B11R0.124 C=CC(CCCCCCC)OC 7a_200011934235_200000210301 [0,0,0,0,0,0|1,0,1]=2 26 B11R0.124 C=CC(CCCCCCC)O[13CH3] 34a_200011934235_200025704644 [0,0,0,0,0,0|1,0,1]=2 27 B11R0.124 C=CC(CCCCCCC)O[13CH3] 7a_200011934235_200025704644 [0,0,0,0,0,0|1,0,1]=2 28 B11R0.124 C=CCCCNCC(OC)OC 2230a_100000700776_100000751394 [0,0,0,0,0,0|1,0,2]=3 29 B11R0.124 C=CCCCNCC(OC)OC 270004a_100000700776_100000752162 [0,0,0,0,0,0|1,0,2]=3 30 B11R0.124 C=CCCCNCC(OC)OC 34a_100000700776_100000211822 [0,0,0,0,0,0|1,0,2]=3 31 B11R0.124 C=CCCCOCC(CC)OC 34a_100011934954_100000757094 [0,0,0,0,0,0|2,0,2]=4 32 B11R0.124 C=CCCCOCC(CC)OC 7a_100011934954_100000757094 [0,0,0,0,0,0|2,0,2]=4 33 B11R0.124 C=CCCCOCC(OC)OC 34a_100000758997_100000211822 [0,0,0,0,0,0|1,0,2]=3 34 B11R0.124 C=CCCCOCC(OC)OC 34a_100011216393_100000757094 [0,0,0,0,0,0|1,0,2]=3 35 B11R0.124 C=CCCCOCC(OC)OC 7a_100000758997_100000751394 [0,0,0,0,0,0|1,0,2]=3 36 B11R0.124 C=CCCCSCC(OC)OC 62a_100000751394_100000757094 [0,0,0,0,0,0|1,0,2]=3 37 B11R0.124 C=CCCCSCC(OC)OC 62a_100011713584_100000751394 [0,0,0,0,0,0|1,0,2]=3 38 B11R0.124 C=CCCNCCC(OC)OC 2230a_100015191253_100009813347 [0,0,0,0,0,0|1,0,2]=3 39 B11R0.124 C=CCCOCCC(OC)OC 34a_100011205117_100000139399 [0,0,0,0,0,0|1,0,2]=3 40 B11R0.124 C=CCCSCCC(OC)OC 62a_100000139399_100000754431 [0,0,0,0,0,0|1,0,2]=3 41 B11R0.124 C=CCCSCCC(OC)OC 62a_100000754431_100000139399 [0,0,0,0,0,0|1,0,2]=3 42 B11R0.124 C=CCNCCCC(OC)OC 2230a_100020586998_100000069011 [0,0,0,0,0,0|1,0,2]=3 43 B11R0.124 C=CCOCCCC(OC)OC 34a_200000210373_100000069011 [0,0,0,0,0,0|1,0,2]=3 44 B11R0.124 C=CCSCCCC(OC)OC 62a_100000069011_100000210623 [0,0,0,0,0,0|1,0,2]=3 45 B11R0.124 C=CCSCCCC(OC)OC 62a_100000210623_100000069011 [0,0,0,0,0,0|1,0,2]=3 46 B11R0.124 C=COCCOCC(OC)OC 34a_100000033082_100000211822 [0,0,0,0,0,0|2,0,2]=4 47 B11R0.124 C=COCCOCC(OC)OC 34a_100011216393_100000039644 [0,0,0,0,0,0|2,0,2]=4 48 B11R0.124 C=COCCSCC(OC)OC 62a_100000039644_100000751394 [0,0,0,0,0,0|2,0,2]=4 49 B11R0.124 C=COCCSCC(OC)OC 62a_100000751394_100000039644 [0,0,0,0,0,0|2,0,2]=4 50 B11R0.124 CC#CCCOCC(OC)OC 34a_100000750427_100000211822 [0,0,0,0,0,0|1,0,2]=3 51 B11R0.124 CC#CCNCCC(OC)OC 2230a_100000685387_100009813347 [0,0,0,0,0,0|1,0,2]=3 52 B11R0.124 CC#CCNCCC(OC)OC 34a_100000685387_100000139399 [0,0,0,0,0,0|1,0,2]=3 53 B11R0.124 CC#CCOCCC(OC)OC 34a_100000761923_100000139399 [0,0,0,0,0,0|1,0,2]=3 54 B11R0.124 CC#CCSCCC(OC)OC 62a_100000139399_100000748600 [0,0,0,0,0,0|1,0,2]=3 55 B11R0.124 CC#CCSCCC(OC)OC 62a_100000748600_100000139399 [0,0,0,0,0,0|1,0,2]=3 56 B11R0.124 CC/C=C\COCC(CC)OC 34a_100011934954_100103147603 [0,0,0,0,0,0|2,0,2]=4 57 B11R0.124 CC/C=C\COCC(CC)OC 7a_100011934954_100103147603 [0,0,0,0,0,0|2,0,2]=4 58 B11R0.124 CC/C=C\COCC(OC)OC 34a_100011216393_100103147603 [0,0,0,0,0,0|1,0,2]=3 59 B11R0.124 CC/C=C\COCC(OC)OC 34a_100016268518_100000211822 [0,0,0,0,0,0|1,0,2]=3 60 B11R0.124 CC/C=C\CSCC(OC)OC 62a_100000751394_100103147603 [0,0,0,0,0,0|1,0,2]=3 61 B11R0.124 CC/C=C\CSCC(OC)OC 62a_100103147603_100000751394 [0,0,0,0,0,0|1,0,2]=3 62 B11R0.124 CC=CCSCCC(OC)OC 62a_100000070051_100000139399 [0,0,0,0,0,0|1,0,2]=3 63 B11R0.124 CC=CCSCCC(OC)OC 62a_100000139399_100000070051 [0,0,0,0,0,0|1,0,2]=3 64 B11R0.124 CCC#CCOCC(CC)OC 34a_100011934954_100009813939 [0,0,0,0,0,0|2,0,2]=4 65 B11R0.124 CCC#CCOCC(CC)OC 7a_100011934954_100009813939 [0,0,0,0,0,0|2,0,2]=4 66 B11R0.124 CCC#CCOCC(OC)OC 34a_100000032950_100000211822 [0,0,0,0,0,0|1,0,2]=3 67 B11R0.124 CCC#CCOCC(OC)OC 34a_100011216393_100009813939 [0,0,0,0,0,0|1,0,2]=3 68 B11R0.124 CCC#CCSCC(OC)OC 62a_100000751394_100009813939 [0,0,0,0,0,0|1,0,2]=3 69 B11R0.124 CCC#CCSCC(OC)OC 62a_100009813939_100000751394 [0,0,0,0,0,0|1,0,2]=3 70 B11R0.124 CCC(CC)CNCCCCF 2230a_100102946423_100000729493 [0,0,0,0,0,0|4,0,0]=4 71 B11R0.124 CCC(CC)CNCCCCO 2230a_100000750430_100011215472 [0,0,0,0,0,0|4,0,0]=4 72 B11R0.124 CCC(CC)CNCCCCO 2230a_100102946423_100000210776 [0,0,0,0,0,0|4,0,0]=4 73 B11R0.124 CCC(CC)CNCCCCO 269862a_100000750430_100000211137 [0,0,0,0,0,0|4,0,0]=4 74 B11R0.124 CCC(CC)CNCCCCO 270004a_100000750430_100000211137 [0,0,0,0,0,0|4,0,0]=4 75 B11R0.124 CCC(CC)CNCCCCO 34a_100000750430_100011215472 [0,0,0,0,0,0|4,0,0]=4 76 B11R0.124 CCC(CC)CNCCCOC 2230a_100102946423_100000740836 [0,0,0,0,0,0|4,0,0]=4 77 B11R0.124 CCC(CC)CNCCCOC 269862a_100150723488_100000211137 [0,0,0,0,0,0|4,0,0]=4 78 B11R0.124 CCC(CC)CNCCCOC 270004a_100150723488_100000211137 [0,0,0,0,0,0|4,0,0]=4 79 B11R0.124 CCC(CC)CNCCCOC 34a_100150723488_100011215472 [0,0,0,0,0,0|4,0,0]=4 80 B11R0.124 CCC(CC)CNCCCSC 2230a_100000749238_100011215472 [0,0,0,0,0,0|4,0,0]=4 81 B11R0.124 CCC(CC)CNCCCSC 269862a_100000749238_100000211137 [0,0,0,0,0,0|4,0,0]=4 82 B11R0.124 CCC(CC)CNCCCSC 270004a_100000749238_100000211137 [0,0,0,0,0,0|4,0,0]=4 83 B11R0.124 CCC(CC)COCCCCBr 34a_100011216708_100011215472 [0,0,0,0,0,0|4,0,0]=4 84 B11R0.124 CCC(CC)COCCCCCl 34a_100000210776_100011215472 [0,0,0,0,0,0|4,0,0]=4 85 B11R0.124 CCC(CC)COCCCCCl 7a_100000210776_100011215472 [0,0,0,0,0,0|4,0,0]=4 86 B11R0.124 CCC(CC)COCCCCF 34a_100011995726_100011215472 [0,0,0,0,0,0|4,0,0]=4 87 B11R0.124 CCC(CC)COCCCCF 7a_100000703878_100000729493 [0,0,0,0,0,0|4,0,0]=4 88 B11R0.124 CCC(CC)COCCCCF 7a_100011995726_100011215472 [0,0,0,0,0,0|4,0,0]=4 89 B11R0.124 CCC(CC)COCCCCI 34a_200012148704_100011215472 [0,0,0,0,0,0|4,0,0]=4 90 B11R0.124 CCC(CC)COCCCCN 34a_100000750430_100011215472 [0,0,0,0,0,0|4,0,0]=4 91 B11R0.124 CCC(CC)COCCCCO 7a_100000703878_100000210776 [0,0,0,0,0,0|4,0,0]=4 92 B11R0.124 CCC(CC)COCCCNC 34a_100000213112_100011215472 [0,0,0,0,0,0|4,0,0]=4 93 B11R0.124 CCC(CC)COCCCOC 34a_100000740835_100011215472 [0,0,0,0,0,0|4,0,0]=4 94 B11R0.124 CCC(CC)COCCCOC 7a_100000703878_100000740836 [0,0,0,0,0,0|4,0,0]=4 95 B11R0.124 CCC(CC)COCCCSC 34a_100000690336_100011215472 [0,0,0,0,0,0|4,0,0]=4 96 B11R0.124 CCC(CC)COCCCSC 7a_100000690336_100011215472 [0,0,0,0,0,0|4,0,0]=4 97 B11R0.124 CCC(CC)CSCCCCF 62a_100000729493_100011215472 [0,0,0,0,0,0|4,0,0]=4 98 B11R0.124 CCC(CC)CSCCCCF 62a_100011215472_100000729493 [0,0,0,0,0,0|4,0,0]=4 99 B11R0.124 CCC(CC)CSCCCCO 62a_100000210776_100011215472 [0,0,0,0,0,0|4,0,0]=4 100 B11R0.124 CCC(CC)CSCCCCO 62a_100011215472_100000210776 [0,0,0,0,0,0|4,0,0]=4 101 B11R0.124 CCC(CC)CSCCCOC 62a_100000709357_100011215472 [0,0,0,0,0,0|4,0,0]=4 102 B11R0.124 CCC(CC)CSCCCOC 62a_100011215472_100000709357 [0,0,0,0,0,0|4,0,0]=4 103 B11R0.124 CCC(CC)NCCCCCF 2230a_100000199018_100000729378 [0,0,0,0,0,0|4,0,0]=4 104 B11R0.124 CCC(CC)NCCCCCO 2230a_100000199018_100000746330 [0,0,0,0,0,0|4,0,0]=4 105 B11R0.124 CCC(CC)NCCCCCO 270004a_100000762737_100000210860 [0,0,0,0,0,0|4,0,0]=4 106 B11R0.124 CCC(CC)NCCCCOC 2230a_100000199018_100000730899 [0,0,0,0,0,0|4,0,0]=4 107 B11R0.124 CCC(CC)OCCCCCBr 7a_100000746331_100000210505 [0,0,0,0,0,0|4,0,0]=4 108 B11R0.124 CCC(CC)OCCCCCCl 7a_100000746330_100000210505 [0,0,0,0,0,0|4,0,0]=4 109 B11R0.124 CCC(CC)OCCCCCF 7a_100000688536_100000729378 [0,0,0,0,0,0|4,0,0]=4 110 B11R0.124 CCC(CC)OCCCCCI 7a_200012148887_100000210505 [0,0,0,0,0,0|4,0,0]=4 111 B11R0.124 CCC(CC)OCCCCCO 7a_100000688536_100000746330 [0,0,0,0,0,0|4,0,0]=4 112 B11R0.124 CCC(CC)OCCCCOC 7a_100000688536_100000730899 [0,0,0,0,0,0|4,0,0]=4 113 B11R0.124 CCC(CC)OCCCCSC 7a_100011217163_100000210505 [0,0,0,0,0,0|4,0,0]=4 114 B11R0.124 CCC(CC)SCCCCCF 62a_100000210505_100000729378 [0,0,0,0,0,0|4,0,0]=4 115 B11R0.124 CCC(CC)SCCCCCF 62a_100000729378_100000210505 [0,0,0,0,0,0|4,0,0]=4 116 B11R0.124 CCC(CC)SCCCCCO 62a_100000210505_100000746330 [0,0,0,0,0,0|4,0,0]=4 117 B11R0.124 CCC(CC)SCCCCCO 62a_100000746330_100000210505 [0,0,0,0,0,0|4,0,0]=4 118 B11R0.124 CCC(CC)SCCCCOC 62a_100000210505_100000730899 [0,0,0,0,0,0|4,0,0]=4 119 B11R0.124 CCC(CC)SCCCCOC 62a_100000730899_100000210505 [0,0,0,0,0,0|4,0,0]=4 120 B11R0.124 CCC(COCCCC#N)OC 7a_100011934954_100000687738 [0,0,0,0,0,0|3,0,1]=4 121 B11R0.124 CCC(COCCCC=O)OC 7a_100011934954_200011292268 [0,0,0,0,0,0|3,0,1]=4 122 B11R0.124 CCC(COCCCCF)OC 34a_100011934954_100000729493 [0,0,0,0,0,0|3,0,0]=3 123 B11R0.124 CCC(COCCCCF)OC 7a_100011934954_100000729493 [0,0,0,0,0,0|3,0,0]=3 124 B11R0.124 CCC(COCCCCO)OC 34a_100011934954_100011216708 [0,0,0,0,0,0|3,0,0]=3 125 B11R0.124 CCC(COCCCCO)OC 7a_100011934954_100000210776 [0,0,0,0,0,0|3,0,0]=3 126 B11R0.124 CCC(COCCCOC)OC 34a_100011934954_100000740836 [0,0,0,0,0,0|3,0,0]=3 127 B11R0.124 CCC(COCCCOC)OC 7a_100011934954_100000740836 [0,0,0,0,0,0|3,0,0]=3 128 B11R0.124 CCCCCCCC(CC)NC 270004a_106832991635_200011217162 [0,0,0,0,0,0|2,0,0]=2 129 B11R0.124 CCCCCCCC(CC)OC 34a_200011217053_200000210301 [0,0,0,0,0,0|1,0,0]=1 130 B11R0.124 CCCCCCCC(CC)OC 7a_200011217053_200000210301 [0,0,0,0,0,0|1,0,0]=1 131 B11R0.124 CCCCCCCC(CC)O[13CH3] 34a_200011217053_200025704644 [0,0,0,0,0,0|1,0,0]=1 132 B11R0.124 CCCCCCCC(CC)O[13CH3] 7a_200011217053_200025704644 [0,0,0,0,0,0|1,0,0]=1 133 B11R0.124 CCCCCCCN(CC)CC 2230a_100000228213_100000210202 [0,0,0,0,0,0|3,0,0]=3 134 B11R0.124 CCCCCCCN(CC)CC 2230a_100000724800_100000210681 [0,0,0,0,0,0|3,0,0]=3 135 B11R0.124 CCCCCCCN(CC)CC 269956a_100000042499_100000210614 [0,0,0,0,0,0|3,0,0]=3 136 B11R0.124 CCCCCCCN(CC)CC 269982a_100000228213_100000204670 [0,0,0,0,0,0|3,0,0]=3 137 B11R0.124 CCCCCCCN(CC)CC 269982a_100000724800_100000210681 [0,0,0,0,0,0|3,0,0]=3 138 B11R0.124 CCCCCCCN(CC)CF 269982a_100000228213_100015361967 [0,0,0,0,0,0|4,0,0]=4 139 B11R0.124 CCCCCCNC(CC)CC 2230a_100000199018_100000210314 [0,0,0,0,0,0|3,0,0]=3 140 B11R0.124 CCCCCCNC(CC)CC 270004a_100000210581_100000210860 [0,0,0,0,0,0|3,0,0]=3 141 B11R0.124 CCCCCCN[C@@H](CC)CO 2230a_100000709445_100000210314 [0,0,0,0,0,0|4,0,0]=4 142 B11R0.124 CCCCCCOC(CC)CC 7a_100000210259_100000210505 [0,0,0,0,0,0|3,0,0]=3 143 B11R0.124 CCCCCCOC(CC)CC 7a_100000688536_100000210314 [0,0,0,0,0,0|3,0,0]=3 144 B11R0.124 CCCCCCSC(CC)CC 62a_100000210314_100000210505 [0,0,0,0,0,0|3,0,0]=3 145 B11R0.124 CCCCCCSC(CC)CC 62a_100000210505_100000210757 [0,0,0,0,0,0|3,0,0]=3 146 B11R0.124 CCCCCNCC(CC)CC 2230a_100000209983_100011215472 [0,0,0,0,0,0|3,0,0]=3 147 B11R0.124 CCCCCNCC(CC)CC 2230a_100102946423_100000210326 [0,0,0,0,0,0|3,0,0]=3 148 B11R0.124 CCCCCNCC(CC)CC 269862a_100000209983_100000211137 [0,0,0,0,0,0|3,0,0]=3 149 B11R0.124 CCCCCNCC(CC)CC 270004a_100000209983_100000211137 [0,0,0,0,0,0|3,0,0]=3 150 B11R0.124 CCCCCNCC(OC)OC 2230a_100000209983_100000751394 [0,0,0,0,0,0|1,0,0]=1 151 B11R0.124 CCCCCNCC(OC)OC 270004a_100000209983_100000752162 [0,0,0,0,0,0|1,0,0]=1 152 B11R0.124 CCCCCOCC(CC)CC 34a_100000210253_100011215472 [0,0,0,0,0,0|3,0,0]=3 153 B11R0.124 CCCCCOCC(CC)CC 7a_100000210253_100011215472 [0,0,0,0,0,0|3,0,0]=3 154 B11R0.124 CCCCCOCC(CC)CC 7a_100000703878_100000210326 [0,0,0,0,0,0|3,0,0]=3 155 B11R0.124 CCCCCOCC(CC)OC 34a_100011934954_100000718602 [0,0,0,0,0,0|2,0,0]=2 156 B11R0.124 CCCCCOCC(CC)OC 7a_100011934954_100000210326 [0,0,0,0,0,0|2,0,0]=2 157 B11R0.124 CCCCCOCC(OC)OC 34a_100000210253_100000211822 [0,0,0,0,0,0|1,0,0]=1 158 B11R0.124 CCCCCOCC(OC)OC 34a_100011216393_100000718602 [0,0,0,0,0,0|1,0,0]=1 159 B11R0.124 CCCCCOCC(OC)OC 7a_100000210253_100000751394 [0,0,0,0,0,0|1,0,0]=1 160 B11R0.124 CCCCCOCN(CC)CC 7a_200015374951_100000210326 [0,0,0,0,0,0|4,0,0]=4 161 B11R0.124 CCCCCSCC(CC)CC 62a_100000210326_100011215472 [0,0,0,0,0,0|3,0,0]=3 162 B11R0.124 CCCCCSCC(CC)CC 62a_100011215472_100000210326 [0,0,0,0,0,0|3,0,0]=3 163 B11R0.124 CCCCCSCC(OC)OC 62a_100000210326_100000751394 [0,0,0,0,0,0|1,0,0]=1 164 B11R0.124 CCCCCSCC(OC)OC 62a_100000751394_100000210326 [0,0,0,0,0,0|1,0,0]=1 165 B11R0.124 CCCCNCCC(OC)OC 2230a_100000102301_100009813347 [0,0,0,0,0,0|1,0,0]=1 166 B11R0.124 CCCCNCCC(OC)OC 7a_106832991798_100009813347 [0,0,0,0,0,0|1,0,0]=1 167 B11R0.124 CCCCNCCN(CC)CC 2230a_100000102301_100000700428 [0,0,0,0,0,0|4,0,0]=4 168 B11R0.124 CCCCNCCN(CC)CC 2230a_100015382049_100000210211 [0,0,0,0,0,0|4,0,0]=4 169 B11R0.124 CCCCNCCN(CC)CC 7a_106832991798_100000700428 [0,0,0,0,0,0|4,0,0]=4 170 B11R0.124 CCCCNN=CC(OC)OC 4a_100025702795_100000752162 [0,0,0,0,0,0|2,0,1]=3 171 B11R0.124 CCCCOCCC(OC)OC 34a_100000210227_100000139399 [0,0,0,0,0,0|1,0,0]=1 172 B11R0.124 CCCCOCCC(OC)OC 7a_100000210227_100009813347 [0,0,0,0,0,0|1,0,0]=1 173 B11R0.124 CCCCOCCN(CC)CC 2230a_100000724800_100000743108 [0,0,0,0,0,0|4,0,0]=4 174 B11R0.124 CCCCOCCN(CC)CC 269956a_100000042499_100000743108 [0,0,0,0,0,0|4,0,0]=4 175 B11R0.124 CCCCOCCN(CC)CC 269982a_100000724800_100000743108 [0,0,0,0,0,0|4,0,0]=4 176 B11R0.124 CCCCOCCN(CC)CC 7a_100000210227_100000700428 [0,0,0,0,0,0|4,0,0]=4 177 B11R0.124 CCCCOCCN(CC)CC 7a_100016990331_100000210211 [0,0,0,0,0,0|4,0,0]=4 178 B11R0.124 CCCCOCNC(CC)CC 2230a_100000199018_100011995733 [0,0,0,0,0,0|4,0,0]=4 179 B11R0.124 CCCCOCSC(CC)CC 62a_100000210505_100011995733 [0,0,0,0,0,0|4,0,0]=4 180 B11R0.124 CCCCOCSC(CC)CC 62a_100011995733_100000210505 [0,0,0,0,0,0|4,0,0]=4 181 B11R0.124 CCCCSCCC(OC)OC 62a_100000139399_100000210210 [0,0,0,0,0,0|1,0,0]=1 182 B11R0.124 CCCCSCCC(OC)OC 62a_100000210211_100000139399 [0,0,0,0,0,0|1,0,0]=1 183 B11R0.124 CCCCSCCN(CC)CC 62a_100000210211_100000700428 [0,0,0,0,0,0|4,0,0]=4 184 B11R0.124 CCCOCCCC(OC)OC 34a_100000210258_100000069011 [0,0,0,0,0,0|1,0,0]=1 185 B11R0.124 CCCOCCCN(CC)CC 7a_100000212844_100000210303 [0,0,0,0,0,0|4,0,0]=4 186 B11R0.124 CCCOCCNC(CC)CC 2230a_100000199018_100011215938 [0,0,0,0,0,0|4,0,0]=4 187 B11R0.124 CCCOCCNC(CC)CC 270004a_100161115042_100000210860 [0,0,0,0,0,0|4,0,0]=4 188 B11R0.124 CCCOCCOC(CC)CC 7a_100000688536_100011215938 [0,0,0,0,0,0|4,0,0]=4 189 B11R0.124 CCCOCCOC(CC)CC 7a_100000752267_100000210505 [0,0,0,0,0,0|4,0,0]=4 190 B11R0.124 CCCOCCSC(CC)CC 62a_100000210505_100011215938 [0,0,0,0,0,0|4,0,0]=4 191 B11R0.124 CCCOCCSC(CC)CC 62a_100011215938_100000210505 [0,0,0,0,0,0|4,0,0]=4 192 B11R0.124 CCCSCCCC(OC)OC 62a_100000069011_100000210303 [0,0,0,0,0,0|1,0,0]=1 193 B11R0.124 CCCSCCCC(OC)OC 62a_100000210303_100000069011 [0,0,0,0,0,0|1,0,0]=1 194 B11R0.124 CCCSCCCN(CC)CC 62a_100000210303_100000709985 [0,0,0,0,0,0|4,0,0]=4 195 B11R0.124 CCCSCCNC(CC)CC 270004a_100020603323_100000210860 [0,0,0,0,0,0|4,0,0]=4 196 B11R0.124 CCCSCCOC(CC)CC 7a_200000230433_100000210505 [0,0,0,0,0,0|4,0,0]=4 197 B11R0.124 CCN(CC)CCCCCCF 2230a_100000724800_100015922095 [0,0,0,0,0,0|4,0,0]=4 198 B11R0.124 CCN(CC)CCCCCCF 269956a_100000042499_100015922095 [0,0,0,0,0,0|4,0,0]=4 199 B11R0.124 CCN(CC)CCCCCCF 269982a_100000724800_100015922095 [0,0,0,0,0,0|4,0,0]=4 200 B11R0.124 CCN(CC)CCCCCCO 2230a_100000724800_100000766143 [0,0,0,0,0,0|4,0,0]=4 201 B11R0.124 CCN(CC)CCCCCCO 269956a_100000042499_100000766143 [0,0,0,0,0,0|4,0,0]=4 202 B11R0.124 CCN(CC)CCCCCCO 269982a_100000724800_100000766143 [0,0,0,0,0,0|4,0,0]=4 203 B11R0.124 CCN(CC)CCCCCNC 2230a_100011491781_200000210301 [0,0,0,0,0,0|4,0,0]=4 204 B11R0.124 CCN(CC)CCCCCN[13CH3] 2230a_100011491781_200025704644 [0,0,0,0,0,0|4,0,0]=4 205 B11R0.124 CCN(CC)CCCCCOC 7a_200011629222_200000210301 [0,0,0,0,0,0|4,0,0]=4 206 B11R0.124 CCN(CC)CCCCCO[13CH3] 7a_200011629222_200025704644 [0,0,0,0,0,0|4,0,0]=4 207 B11R0.124 CCNCCCCN(CC)CC 2230a_100000743895_100000210202 [0,0,0,0,0,0|4,0,0]=4 208 B11R0.124 CCOCCCCN(CC)CC 7a_100011305530_100000210202 [0,0,0,0,0,0|4,0,0]=4 209 B11R0.124 CCOCCCNC(CC)CC 2230a_100000199018_100012232248 [0,0,0,0,0,0|4,0,0]=4 210 B11R0.124 CCOCCCNC(CC)CC 270004a_100000210961_100000210860 [0,0,0,0,0,0|4,0,0]=4 211 B11R0.124 CCOCCCOC(CC)CC 7a_100000688536_100012232248 [0,0,0,0,0,0|4,0,0]=4 212 B11R0.124 CCOCCCOC(CC)CC 7a_100000757476_100000210505 [0,0,0,0,0,0|4,0,0]=4 213 B11R0.124 CCOCCCSC(CC)CC 62a_100000210505_100012232248 [0,0,0,0,0,0|4,0,0]=4 214 B11R0.124 CCOCCCSC(CC)CC 62a_100012232248_100000210505 [0,0,0,0,0,0|4,0,0]=4 215 B11R0.124 CCOCCNCC(CC)CC 2230a_100102946423_100011215890 [0,0,0,0,0,0|4,0,0]=4 216 B11R0.124 CCOCCNCC(CC)CC 2230a_102516460346_100011215472 [0,0,0,0,0,0|4,0,0]=4 217 B11R0.124 CCOCCNCC(CC)CC 269862a_100011200944_100000211137 [0,0,0,0,0,0|4,0,0]=4 218 B11R0.124 CCOCCNCC(CC)CC 270004a_102516460346_100000211137 [0,0,0,0,0,0|4,0,0]=4 219 B11R0.124 CCOCCNCC(CC)CC 34a_102516460346_100011215472 [0,0,0,0,0,0|4,0,0]=4 220 B11R0.124 CCOCCNCC(OC)OC 2230a_102516460346_100000751394 [0,0,0,0,0,0|2,0,0]=2 221 B11R0.124 CCOCCNCC(OC)OC 270004a_102516460346_100000752162 [0,0,0,0,0,0|2,0,0]=2 222 B11R0.124 CCOCCNCC(OC)OC 34a_102516460346_100000211822 [0,0,0,0,0,0|2,0,0]=2 223 B11R0.124 CCOCCOCC(CC)CC 34a_100000210136_100011215472 [0,0,0,0,0,0|4,0,0]=4 224 B11R0.124 CCOCCOCC(CC)CC 7a_100000210136_100011215472 [0,0,0,0,0,0|4,0,0]=4 225 B11R0.124 CCOCCOCC(CC)CC 7a_100000703878_100011215890 [0,0,0,0,0,0|4,0,0]=4 226 B11R0.124 CCOCCOCC(CC)OC 34a_100011934954_100000210147 [0,0,0,0,0,0|3,0,0]=3 227 B11R0.124 CCOCCOCC(CC)OC 7a_100011934954_100011215890 [0,0,0,0,0,0|3,0,0]=3 228 B11R0.124 CCOCCOCC(OC)OC 34a_100000210136_100000211822 [0,0,0,0,0,0|2,0,0]=2 229 B11R0.124 CCOCCOCC(OC)OC 34a_100011216393_100000210147 [0,0,0,0,0,0|2,0,0]=2 230 B11R0.124 CCOCCOCC(OC)OC 7a_100000210136_100000751394 [0,0,0,0,0,0|2,0,0]=2 231 B11R0.124 CCOCCSCC(CC)CC 62a_100000210147_100011215472 [0,0,0,0,0,0|4,0,0]=4 232 B11R0.124 CCOCCSCC(CC)CC 62a_100011215472_100011215890 [0,0,0,0,0,0|4,0,0]=4 233 B11R0.124 CCOCCSCC(OC)OC 62a_100000210147_100000751394 [0,0,0,0,0,0|2,0,0]=2 234 B11R0.124 CCOCCSCC(OC)OC 62a_100000751394_100011215890 [0,0,0,0,0,0|2,0,0]=2 235 B11R0.124 CCOCSCCC(OC)OC 62a_100000139399_100000739092 [0,0,0,0,0,0|2,0,0]=2 236 B11R0.124 CCOCSCCC(OC)OC 62a_100000739092_100000139399 [0,0,0,0,0,0|2,0,0]=2 237 B11R0.124 CCSCCCOC(CC)CC 7a_100011216438_100000210505 [0,0,0,0,0,0|4,0,0]=4 238 B11R0.124 CCSCCNCC(CC)CC 2230a_100000106463_100011215472 [0,0,0,0,0,0|4,0,0]=4 239 B11R0.124 CCSCCNCC(CC)CC 2230a_100102946423_100000757381 [0,0,0,0,0,0|4,0,0]=4 240 B11R0.124 CCSCCNCC(CC)CC 269862a_100000106463_100000211137 [0,0,0,0,0,0|4,0,0]=4 241 B11R0.124 CCSCCNCC(CC)CC 270004a_100000106463_100000211137 [0,0,0,0,0,0|4,0,0]=4 242 B11R0.124 CCSCCNCC(OC)OC 2230a_100000106463_100000751394 [0,0,0,0,0,0|2,0,0]=2 243 B11R0.124 CCSCCNCC(OC)OC 270004a_100000106463_100000752162 [0,0,0,0,0,0|2,0,0]=2 244 B11R0.124 CCSCCOCC(CC)CC 34a_100000212035_100011215472 [0,0,0,0,0,0|4,0,0]=4 245 B11R0.124 CCSCCOCC(CC)CC 7a_100000212035_100011215472 [0,0,0,0,0,0|4,0,0]=4 246 B11R0.124 CCSCCOCC(CC)CC 7a_100000703878_100000757381 [0,0,0,0,0,0|4,0,0]=4 247 B11R0.124 CCSCCOCC(CC)OC 34a_100011934954_100000757381 [0,0,0,0,0,0|3,0,0]=3 248 B11R0.124 CCSCCOCC(CC)OC 7a_100011934954_100000757381 [0,0,0,0,0,0|3,0,0]=3 249 B11R0.124 CCSCCOCC(OC)OC 34a_100000212035_100000211822 [0,0,0,0,0,0|2,0,0]=2 250 B11R0.124 CCSCCOCC(OC)OC 34a_100011216393_100000757381 [0,0,0,0,0,0|2,0,0]=2 251 B11R0.124 CCSCCOCC(OC)OC 7a_100000212035_100000751394 [0,0,0,0,0,0|2,0,0]=2 252 B11R0.124 CCSCCSCC(CC)CC 62a_100000757381_100011215472 [0,0,0,0,0,0|4,0,0]=4 253 B11R0.124 CCSCCSCC(CC)CC 62a_100011215472_100000757381 [0,0,0,0,0,0|4,0,0]=4 254 B11R0.124 CCSCCSCC(OC)OC 62a_100000751394_100000757381 [0,0,0,0,0,0|2,0,0]=2 255 B11R0.124 CCSCCSCC(OC)OC 62a_100000757381_100000751394 [0,0,0,0,0,0|2,0,0]=2 256 B11R0.124 CNCCCOCC(OC)OC 34a_100000213112_100000211822 [0,0,0,0,0,0|2,0,0]=2 257 B11R0.124 COC(CCCNCCF)OC 34a_100000724931_100000069011 [0,0,0,0,0,0|2,0,0]=2 258 B11R0.124 COC(CCCNCCO)OC 2230a_100016997473_100000069011 [0,0,0,0,0,0|2,0,0]=2 259 B11R0.124 COC(CCCNCCO)OC 34a_100016990907_100000069011 [0,0,0,0,0,0|2,0,0]=2 260 B11R0.124 COC(CCCOCCBr)OC 34a_100000211926_100000069011 [0,0,0,0,0,0|2,0,0]=2 261 B11R0.124 COC(CCCOCCN)OC 34a_100000210304_100000069011 [0,0,0,0,0,0|2,0,0]=2 262 B11R0.124 COC(CCCSCC#N)OC 62a_100000069011_100011215382 [0,0,0,0,0,0|2,0,1]=3 263 B11R0.124 COC(CCCSCC#N)OC 62a_100011215382_100000069011 [0,0,0,0,0,0|2,0,1]=3 264 B11R0.124 COC(CCCSCC=O)OC 62a_100000069011_200015260668 [0,0,0,0,0,0|2,0,1]=3 265 B11R0.124 COC(CCCSCC=O)OC 62a_200015260668_100000069011 [0,0,0,0,0,0|2,0,1]=3 266 B11R0.124 COC(CCCSCCF)OC 62a_100000069011_100011217306 [0,0,0,0,0,0|2,0,0]=2 267 B11R0.124 COC(CCCSCCF)OC 62a_100011217306_100000069011 [0,0,0,0,0,0|2,0,0]=2 268 B11R0.124 COC(CCCSCCO)OC 62a_100000069011_100000211926 [0,0,0,0,0,0|2,0,0]=2 269 B11R0.124 COC(CCCSCCO)OC 62a_100000211926_100000069011 [0,0,0,0,0,0|2,0,0]=2 270 B11R0.124 COC(CCCSCSC)OC 62a_100000069011_100011218213 [0,0,0,0,0,0|2,0,0]=2 271 B11R0.124 COC(CCCSCSC)OC 62a_100011218213_100000069011 [0,0,0,0,0,0|2,0,0]=2 272 B11R0.124 COC(CCNCCCF)OC 2230a_100015189416_100009813347 [0,0,0,0,0,0|2,0,0]=2 273 B11R0.124 COC(CCNCCCF)OC 34a_100015189416_100000139399 [0,0,0,0,0,0|2,0,0]=2 274 B11R0.124 COC(CCNCCSC)OC 2230a_100020590264_100009813347 [0,0,0,0,0,0|2,0,0]=2 275 B11R0.124 COC(CCOCCCBr)OC 34a_100011217188_100000139399 [0,0,0,0,0,0|2,0,0]=2 276 B11R0.124 COC(CCOCCCCl)OC 34a_100000230001_100000139399 [0,0,0,0,0,0|2,0,0]=2 277 B11R0.124 COC(CCOCCCF)OC 34a_100000759539_100000139399 [0,0,0,0,0,0|2,0,0]=2 278 B11R0.124 COC(CCOCCCN)OC 34a_100000182051_100000139399 [0,0,0,0,0,0|2,0,0]=2 279 B11R0.124 COC(CCOCCON)OC 34a_100000700252_100000139399 [0,0,0,0,0,0|3,0,0]=3 280 B11R0.124 COC(CCOCCSC)OC 34a_100000230434_100000139399 [0,0,0,0,0,0|2,0,0]=2 281 B11R0.124 COC(CCOCCSC)OC 7a_100000230434_100009813347 [0,0,0,0,0,0|2,0,0]=2 282 B11R0.124 COC(CCSCCC#N)OC 62a_100000139399_100011215226 [0,0,0,0,0,0|2,0,1]=3 283 B11R0.124 COC(CCSCCC#N)OC 62a_100011215226_100000139399 [0,0,0,0,0,0|2,0,1]=3 284 B11R0.124 COC(CCSCCCF)OC 62a_100000139399_100011934791 [0,0,0,0,0,0|2,0,0]=2 285 B11R0.124 COC(CCSCCCF)OC 62a_100011934791_100000139399 [0,0,0,0,0,0|2,0,0]=2 286 B11R0.124 COC(CCSCCCO)OC 62a_100000139399_100011215043 [0,0,0,0,0,0|2,0,0]=2 287 B11R0.124 COC(CCSCCCO)OC 62a_100011215043_100000139399 [0,0,0,0,0,0|2,0,0]=2 288 B11R0.124 COC(CCSCCSC)OC 62a_100000139399_100000751147 [0,0,0,0,0,0|2,0,0]=2 289 B11R0.124 COC(CCSCCSC)OC 62a_100000212216_100000139399 [0,0,0,0,0,0|2,0,0]=2 290 B11R0.124 COC(CCSCSC#N)OC 62a_100000139399_100000211825 [0,0,0,0,0,0|3,0,1]=4 291 B11R0.124 COC(CCSCSC#N)OC 62a_100000211825_100000139399 [0,0,0,0,0,0|3,0,1]=4 292 B11R0.124 COC(CNCCCCO)OC 2230a_100000750430_100000751394 [0,0,0,0,0,0|2,0,0]=2 293 B11R0.124 COC(CNCCCCO)OC 270004a_100000750430_100000752162 [0,0,0,0,0,0|2,0,0]=2 294 B11R0.124 COC(CNCCCCO)OC 34a_100000750430_100000211822 [0,0,0,0,0,0|2,0,0]=2 295 B11R0.124 COC(CNCCCSC)OC 2230a_100000749238_100000751394 [0,0,0,0,0,0|2,0,0]=2 296 B11R0.124 COC(CNCCCSC)OC 270004a_100000749238_100000752162 [0,0,0,0,0,0|2,0,0]=2 297 B11R0.124 COC(COCC#CCCl)OC 34a_200000047223_100000211822 [0,0,0,0,0,0|2,0,2]=4 298 B11R0.124 COC(COCC#CCO)OC 34a_100011216393_200000047223 [0,0,0,0,0,0|2,0,2]=4 299 B11R0.124 COC(COCCCCBr)OC 34a_100011216708_100000211822 [0,0,0,0,0,0|2,0,0]=2 300 B11R0.124 COC(COCCCCCl)OC 34a_100000210776_100000211822 [0,0,0,0,0,0|2,0,0]=2 301 B11R0.124 COC(COCCCCCl)OC 7a_100000210776_100000751394 [0,0,0,0,0,0|2,0,0]=2 302 B11R0.124 COC(COCCCCF)OC 34a_100011216393_100000729493 [0,0,0,0,0,0|2,0,0]=2 303 B11R0.124 COC(COCCCCF)OC 34a_100011995726_100000211822 [0,0,0,0,0,0|2,0,0]=2 304 B11R0.124 COC(COCCCCF)OC 7a_100011995726_100000751394 [0,0,0,0,0,0|2,0,0]=2 305 B11R0.124 COC(COCCCCI)OC 34a_200012148704_100000211822 [0,0,0,0,0,0|2,0,0]=2 306 B11R0.124 COC(COCCCCN)OC 34a_100000750430_100000211822 [0,0,0,0,0,0|2,0,0]=2 307 B11R0.124 COC(COCCCCO)OC 34a_100011216393_100011216708 [0,0,0,0,0,0|2,0,0]=2 308 B11R0.124 COC(COCCCSC)OC 34a_100000690336_100000211822 [0,0,0,0,0,0|2,0,0]=2 309 B11R0.124 COC(COCCCSC)OC 7a_100000690336_100000751394 [0,0,0,0,0,0|2,0,0]=2 310 B11R0.124 COC(CSCC#CCO)OC 62a_100000751394_200000047223 [0,0,0,0,0,0|2,0,2]=4 311 B11R0.124 COC(CSCC#CCO)OC 62a_200000047223_100000751394 [0,0,0,0,0,0|2,0,2]=4 312 B11R0.124 COC(CSCCCC#N)OC 62a_100000687738_100000751394 [0,0,0,0,0,0|2,0,1]=3 313 B11R0.124 COC(CSCCCC#N)OC 62a_100000751394_100000687738 [0,0,0,0,0,0|2,0,1]=3 314 B11R0.124 COC(CSCCCC=O)OC 62a_100000751394_200011292268 [0,0,0,0,0,0|2,0,1]=3 315 B11R0.124 COC(CSCCCC=O)OC 62a_200011292268_100000751394 [0,0,0,0,0,0|2,0,1]=3 316 B11R0.124 COC(CSCCCCF)OC 62a_100000729493_100000751394 [0,0,0,0,0,0|2,0,0]=2 317 B11R0.124 COC(CSCCCCF)OC 62a_100000751394_100000729493 [0,0,0,0,0,0|2,0,0]=2 318 B11R0.124 COC(CSCCCCO)OC 62a_100000210776_100000751394 [0,0,0,0,0,0|2,0,0]=2 319 B11R0.124 COC(CSCCCCO)OC 62a_100000751394_100000210776 [0,0,0,0,0,0|2,0,0]=2 320 B11R0.124 COC(CSCCSC#N)OC 62a_100000034367_100000751394 [0,0,0,0,0,0|3,0,1]=4 321 B11R0.124 COC(CSCCSC#N)OC 62a_100000751394_100000034367 [0,0,0,0,0,0|3,0,1]=4 322 B11R0.124 COCCCNCC(OC)OC 270004a_100150723488_100000752162 [0,0,0,0,0,0|2,0,0]=2 323 B11R0.124 COCCCNCC(OC)OC 34a_100150723488_100000211822 [0,0,0,0,0,0|2,0,0]=2 324 B11R0.124 COCCCOCC(OC)OC 34a_100000740835_100000211822 [0,0,0,0,0,0|2,0,0]=2 325 B11R0.124 COCCCOCC(OC)OC 34a_100011216393_100000740836 [0,0,0,0,0,0|2,0,0]=2 326 B11R0.124 COCCCSCC(OC)OC 62a_100000709357_100000751394 [0,0,0,0,0,0|2,0,0]=2 327 B11R0.124 COCCCSCC(OC)OC 62a_100000751394_100000709357 [0,0,0,0,0,0|2,0,0]=2 328 B11R0.124 COCCNCCC(OC)OC 2230a_100000209980_100009813347 [0,0,0,0,0,0|2,0,0]=2 329 B11R0.124 COCCOCCC(OC)OC 34a_100000210237_100000139399 [0,0,0,0,0,0|2,0,0]=2 330 B11R0.124 COCCSCCC(OC)OC 62a_100000139399_100000233755 [0,0,0,0,0,0|2,0,0]=2 331 B11R0.124 COCCSCCC(OC)OC 62a_100000233755_100000139399 [0,0,0,0,0,0|2,0,0]=2 332 B11R0.124 COCSCCCC(OC)OC 62a_100000069011_100000766300 [0,0,0,0,0,0|2,0,0]=2 333 B11R0.124 COCSCCCC(OC)OC 62a_100000766300_100000069011 [0,0,0,0,0,0|2,0,0]=2 334 B10R0.41 C#CC(CCCCCBr)OC 34a_200010408556_200000210301 [1,0,0,0,0,0|2,0,1]=4 335 B10R0.41 C#CC(CCCCCBr)OC 7a_200010408556_200000210301 [1,0,0,0,0,0|2,0,1]=4 336 B10R0.41 C#CC(CCCCCBr)O[13CH3] 34a_200010408556_200025704644 [1,0,0,0,0,0|2,0,1]=4 337 B10R0.41 C#CC(CCCCCBr)O[13CH3] 7a_200010408556_200025704644 [1,0,0,0,0,0|2,0,1]=4 338 B10R0.41 C#CCCNCC(OC)OC 34a_100000755551_100000211822 [1,0,0,0,0,0|1,0,2]=4 339 B10R0.41 C#CCCOCC(OC)OC 34a_100011215631_100000211822 [1,0,0,0,0,0|1,0,2]=4 340 B10R0.41 C#CCCOCC(OC)OC 34a_100011216393_100000688953 [1,0,0,0,0,0|1,0,2]=4 341 B10R0.41 C#CCCSCC(OC)OC 62a_100000688953_100000751394 [1,0,0,0,0,0|1,0,2]=4 342 B10R0.41 C#CCCSCC(OC)OC 62a_100000751394_100000688953 [1,0,0,0,0,0|1,0,2]=4 343 B10R0.41 C#CCNCCC(OC)OC 34a_100000212058_100000139399 [1,0,0,0,0,0|1,0,2]=4 344 B10R0.41 C#CCOCCC(OC)OC 34a_100000210247_100000139399 [1,0,0,0,0,0|1,0,2]=4 345 B10R0.41 C#CCSCCC(OC)OC 62a_100000038162_100000139399 [1,0,0,0,0,0|1,0,2]=4 346 B10R0.41 C/C=C/COCC(OC)OC 34a_100011216393_100102629194 [1,0,0,0,0,0|1,0,2]=4 347 B10R0.41 C/C=C/COCC(OC)OC 34a_100016270725_100000211822 [1,0,0,0,0,0|1,0,2]=4 348 B10R0.41 C/C=C/CSCC(OC)OC 62a_100000751394_100102629194 [1,0,0,0,0,0|1,0,2]=4 349 B10R0.41 C/C=C/CSCC(OC)OC 62a_100102629194_100000751394 [1,0,0,0,0,0|1,0,2]=4 350 B10R0.41 C=CC(CCCCCC)OC 34a_200011215977_200000210301 [1,0,0,0,0,0|1,0,1]=3 351 B10R0.41 C=CC(CCCCCC)OC 7a_200011215977_200000210301 [1,0,0,0,0,0|1,0,1]=3 352 B10R0.41 C=CC(CCCCCC)O[13CH3] 34a_200011215977_200025704644 [1,0,0,0,0,0|1,0,1]=3 353 B10R0.41 C=CC(CCCCCC)O[13CH3] 7a_200011215977_200025704644 [1,0,0,0,0,0|1,0,1]=3 354 B10R0.41 C=CCCNCC(OC)OC 2230a_100015191253_100000751394 [1,0,0,0,0,0|1,0,2]=4 355 B10R0.41 C=CCCNCC(OC)OC 270004a_100015191253_100000752162 [1,0,0,0,0,0|1,0,2]=4 356 B10R0.41 C=CCCOCC(OC)OC 34a_100011205117_100000211822 [1,0,0,0,0,0|1,0,2]=4 357 B10R0.41 C=CCCOCC(OC)OC 34a_100011216393_100000754431 [1,0,0,0,0,0|1,0,2]=4 358 B10R0.41 C=CCCSCC(OC)OC 62a_100000751394_100000754431 [1,0,0,0,0,0|1,0,2]=4 359 B10R0.41 C=CCCSCC(OC)OC 62a_100000754431_100000751394 [1,0,0,0,0,0|1,0,2]=4 360 B10R0.41 C=CCNCCC(OC)OC 2230a_100020586998_100009813347 [1,0,0,0,0,0|1,0,2]=4 361 B10R0.41 C=CCOCCC(OC)OC 34a_200000210373_100000139399 [1,0,0,0,0,0|1,0,2]=4 362 B10R0.41 C=CCSCCC(OC)OC 62a_100000139399_100000210623 [1,0,0,0,0,0|1,0,2]=4 363 B10R0.41 C=CCSCCC(OC)OC 62a_100000210623_100000139399 [1,0,0,0,0,0|1,0,2]=4 364 B10R0.41 CC#CCNCC(OC)OC 2230a_100000685387_100000751394 [1,0,0,0,0,0|1,0,2]=4 365 B10R0.41 CC#CCNCC(OC)OC 34a_100000685387_100000211822 [1,0,0,0,0,0|1,0,2]=4 366 B10R0.41 CC#CCOCC(OC)OC 34a_100000761923_100000211822 [1,0,0,0,0,0|1,0,2]=4 367 B10R0.41 CC#CCOCC(OC)OC 34a_100011216393_100000748600 [1,0,0,0,0,0|1,0,2]=4 368 B10R0.41 CC#CCSCC(OC)OC 62a_100000748600_100000751394 [1,0,0,0,0,0|1,0,2]=4 369 B10R0.41 CC#CCSCC(OC)OC 62a_100000751394_100000748600 [1,0,0,0,0,0|1,0,2]=4 370 B10R0.41 CC=CCOCC(OC)OC 34a_100011216393_100000070051 [1,0,0,0,0,0|1,0,2]=4 371 B10R0.41 CC=CCSCC(OC)OC 62a_100000070051_100000751394 [1,0,0,0,0,0|1,0,2]=4 372 B10R0.41 CC=CCSCC(OC)OC 62a_100000751394_100000070051 [1,0,0,0,0,0|1,0,2]=4 373 B10R0.41 CCC(COCCCF)OC 34a_100011934954_100011934791 [1,0,0,0,0,0|3,0,0]=4 374 B10R0.41 CCC(COCCCF)OC 7a_100011934954_100011934791 [1,0,0,0,0,0|3,0,0]=4 375 B10R0.41 CCC(COCCCO)OC 34a_100011934954_100000230001 [1,0,0,0,0,0|3,0,0]=4 376 B10R0.41 CCC(COCCCO)OC 7a_100011934954_100011215043 [1,0,0,0,0,0|3,0,0]=4 377 B10R0.41 CCC(COCCOC)OC 34a_100011934954_100011201679 [1,0,0,0,0,0|3,0,0]=4 378 B10R0.41 CCC(COCCOC)OC 7a_100011934954_100000233755 [1,0,0,0,0,0|3,0,0]=4 379 B10R0.41 CCC(COCCSC)OC 34a_100011934954_100000212216 [1,0,0,0,0,0|3,0,0]=4 380 B10R0.41 CCC(COCCSC)OC 7a_100011934954_100000212216 [1,0,0,0,0,0|3,0,0]=4 381 B10R0.41 CCCCCCC(CC)NC 270004a_106832991635_100011219640 [1,0,0,0,0,0|2,0,0]=3 382 B10R0.41 CCCCCCC(CC)OC 34a_100011215785_200000210301 [1,0,0,0,0,0|1,0,0]=2 383 B10R0.41 CCCCCCC(CC)OC 7a_100011215785_200000210301 [1,0,0,0,0,0|1,0,0]=2 384 B10R0.41 CCCCCCC(CC)O[13CH3] 34a_100011215785_200025704644 [1,0,0,0,0,0|1,0,0]=2 385 B10R0.41 CCCCCCC(CC)O[13CH3] 7a_100011215785_200025704644 [1,0,0,0,0,0|1,0,0]=2 386 B10R0.41 CCCCCCN(CC)CC 2230a_100000724800_100000210314 [1,0,0,0,0,0|3,0,0]=4 387 B10R0.41 CCCCCCN(CC)CC 269956a_100000042499_100000210757 [1,0,0,0,0,0|3,0,0]=4 388 B10R0.41 CCCCCCN(CC)CC 269982a_100000724800_100000210757 [1,0,0,0,0,0|3,0,0]=4 389 B10R0.41 CCCCCNC(CC)CC 2230a_100000199018_100000210326 [1,0,0,0,0,0|3,0,0]=4 390 B10R0.41 CCCCCNC(CC)CC 270004a_100000209983_100000210860 [1,0,0,0,0,0|3,0,0]=4 391 B10R0.41 CCCCCOC(CC)CC 7a_100000210253_100000210505 [1,0,0,0,0,0|3,0,0]=4 392 B10R0.41 CCCCCOC(CC)CC 7a_100000688536_100000210326 [1,0,0,0,0,0|3,0,0]=4 393 B10R0.41 CCCCCSC(CC)CC 62a_100000210326_100000210505 [1,0,0,0,0,0|3,0,0]=4 394 B10R0.41 CCCCCSC(CC)CC 62a_100000210505_100000210326 [1,0,0,0,0,0|3,0,0]=4 395 B10R0.41 CCCCNCC(CC)CC 2230a_100000102301_100011215472 [1,0,0,0,0,0|3,0,0]=4 396 B10R0.41 CCCCNCC(CC)CC 2230a_100102946423_100000210211 [1,0,0,0,0,0|3,0,0]=4 397 B10R0.41 CCCCNCC(CC)CC 269862a_100000102301_100000211137 [1,0,0,0,0,0|3,0,0]=4 398 B10R0.41 CCCCNCC(CC)CC 270004a_100000102301_100000211137 [1,0,0,0,0,0|3,0,0]=4 399 B10R0.41 CCCCNCC(CC)CC 7a_106832991798_100011215472 [1,0,0,0,0,0|3,0,0]=4 400 B10R0.41 CCCCNCC(OC)OC 2230a_100000102301_100000751394 [1,0,0,0,0,0|1,0,0]=2 401 B10R0.41 CCCCNCC(OC)OC 270004a_100000102301_100000752162 [1,0,0,0,0,0|1,0,0]=2 402 B10R0.41 CCCCNCC(OC)OC 7a_106832991798_100000751394 [1,0,0,0,0,0|1,0,0]=2 403 B10R0.41 CCCCOCC(CC)CC 34a_100000210227_100011215472 [1,0,0,0,0,0|3,0,0]=4 404 B10R0.41 CCCCOCC(CC)CC 7a_100000210227_100011215472 [1,0,0,0,0,0|3,0,0]=4 405 B10R0.41 CCCCOCC(CC)CC 7a_100000703878_100000210211 [1,0,0,0,0,0|3,0,0]=4 406 B10R0.41 CCCCOCC(CC)OC 34a_100011934954_100000210210 [1,0,0,0,0,0|2,0,0]=3 407 B10R0.41 CCCCOCC(CC)OC 7a_100011934954_100000210211 [1,0,0,0,0,0|2,0,0]=3 408 B10R0.41 CCCCOCC(OC)OC 34a_100000210227_100000211822 [1,0,0,0,0,0|1,0,0]=2 409 B10R0.41 CCCCOCC(OC)OC 34a_100011216393_100000210210 [1,0,0,0,0,0|1,0,0]=2 410 B10R0.41 CCCCOCC(OC)OC 7a_100000210227_100000751394 [1,0,0,0,0,0|1,0,0]=2 411 B10R0.41 CCCCSCC(CC)CC 62a_100000210211_100011215472 [1,0,0,0,0,0|3,0,0]=4 412 B10R0.41 CCCCSCC(CC)CC 62a_100011215472_100000210210 [1,0,0,0,0,0|3,0,0]=4 413 B10R0.41 CCCCSCC(OC)OC 62a_100000210211_100000751394 [1,0,0,0,0,0|1,0,0]=2 414 B10R0.41 CCCCSCC(OC)OC 62a_100000751394_100000210210 [1,0,0,0,0,0|1,0,0]=2 415 B10R0.41 CCCNN=CC(OC)OC 4a_100000740057_100000752162 [1,0,0,0,0,0|2,0,1]=4 416 B10R0.41 CCCOCCC(OC)OC 34a_100000210258_100000139399 [1,0,0,0,0,0|1,0,0]=2 417 B10R0.41 CCCSCCC(OC)OC 62a_100000139399_100000210303 [1,0,0,0,0,0|1,0,0]=2 418 B10R0.41 CCCSCCC(OC)OC 62a_100000210303_100000139399 [1,0,0,0,0,0|1,0,0]=2 419 B10R0.41 CCNCCCC(OC)OC 2230a_100015525214_100000069011 [1,0,0,0,0,0|1,0,0]=2 420 B10R0.41 CCOCCCC(OC)OC 34a_100121572206_100000069011 [1,0,0,0,0,0|1,0,0]=2 421 B10R0.41 CCOCSCC(OC)OC 62a_100000739092_100000751394 [1,0,0,0,0,0|2,0,0]=3 422 B10R0.41 CCOCSCC(OC)OC 62a_100000751394_100000739092 [1,0,0,0,0,0|2,0,0]=3 423 B10R0.41 CCSCCCC(OC)OC 62a_100000069011_100000210202 [1,0,0,0,0,0|1,0,0]=2 424 B10R0.41 CCSCCCC(OC)OC 62a_100000210202_100000069011 [1,0,0,0,0,0|1,0,0]=2 425 B10R0.41 COC(CCCSCF)OC 62a_100000069011_100015361967 [1,0,0,0,0,0|2,0,0]=3 426 B10R0.41 COC(CCCSCF)OC 62a_100015361967_100000069011 [1,0,0,0,0,0|2,0,0]=3 427 B10R0.41 COC(CCNCCF)OC 34a_100000724931_100000139399 [1,0,0,0,0,0|2,0,0]=3 428 B10R0.41 COC(CCNCCO)OC 2230a_100016997473_100009813347 [1,0,0,0,0,0|2,0,0]=3 429 B10R0.41 COC(CCNCCO)OC 34a_100016990907_100000139399 [1,0,0,0,0,0|2,0,0]=3 430 B10R0.41 COC(CCOCCBr)OC 34a_100000211926_100000139399 [1,0,0,0,0,0|2,0,0]=3 431 B10R0.41 COC(CCOCCN)OC 34a_100000210304_100000139399 [1,0,0,0,0,0|2,0,0]=3 432 B10R0.41 COC(CCSCC#N)OC 62a_100000139399_100011215382 [1,0,0,0,0,0|2,0,1]=4 433 B10R0.41 COC(CCSCC#N)OC 62a_100011215382_100000139399 [1,0,0,0,0,0|2,0,1]=4 434 B10R0.41 COC(CCSCC=O)OC 62a_100000139399_200015260668 [1,0,0,0,0,0|2,0,1]=4 435 B10R0.41 COC(CCSCC=O)OC 62a_200015260668_100000139399 [1,0,0,0,0,0|2,0,1]=4 436 B10R0.41 COC(CCSCCF)OC 62a_100000139399_100011217306 [1,0,0,0,0,0|2,0,0]=3 437 B10R0.41 COC(CCSCCF)OC 62a_100011217306_100000139399 [1,0,0,0,0,0|2,0,0]=3 438 B10R0.41 COC(CCSCCO)OC 62a_100000139399_100000211926 [1,0,0,0,0,0|2,0,0]=3 439 B10R0.41 COC(CCSCCO)OC 62a_100000211926_100000139399 [1,0,0,0,0,0|2,0,0]=3 440 B10R0.41 COC(CCSCSC)OC 62a_100000139399_100011218213 [1,0,0,0,0,0|2,0,0]=3 441 B10R0.41 COC(CCSCSC)OC 62a_100011218213_100000139399 [1,0,0,0,0,0|2,0,0]=3 442 B10R0.41 COC(CNCCC#N)OC 270004a_100000720768_100000752162 [1,0,0,0,0,0|2,0,1]=4 443 B10R0.41 COC(CNCCCF)OC 2230a_100015189416_100000751394 [1,0,0,0,0,0|2,0,0]=3 444 B10R0.41 COC(CNCCCF)OC 270004a_100015189416_100000752162 [1,0,0,0,0,0|2,0,0]=3 445 B10R0.41 COC(CNCCCF)OC 34a_100015189416_100000211822 [1,0,0,0,0,0|2,0,0]=3 446 B10R0.41 COC(CNCCCO)OC 270004a_100000182051_100000752162 [1,0,0,0,0,0|2,0,0]=3 447 B10R0.41 COC(CNCCSC)OC 2230a_100020590264_100000751394 [1,0,0,0,0,0|2,0,0]=3 448 B10R0.41 COC(CNCCSC)OC 270004a_100020590264_100000752162 [1,0,0,0,0,0|2,0,0]=3 449 B10R0.41 COC(COCCCBr)OC 34a_100011217188_100000211822 [1,0,0,0,0,0|2,0,0]=3 450 B10R0.41 COC(COCCCCl)OC 34a_100000230001_100000211822 [1,0,0,0,0,0|2,0,0]=3 451 B10R0.41 COC(COCCCF)OC 34a_100000759539_100000211822 [1,0,0,0,0,0|2,0,0]=3 452 B10R0.41 COC(COCCCF)OC 34a_100011216393_100011934791 [1,0,0,0,0,0|2,0,0]=3 453 B10R0.41 COC(COCCCN)OC 34a_100000182051_100000211822 [1,0,0,0,0,0|2,0,0]=3 454 B10R0.41 COC(COCCCO)OC 34a_100011216393_100000230001 [1,0,0,0,0,0|2,0,0]=3 455 B10R0.41 COC(COCCON)OC 34a_100000700252_100000211822 [1,0,0,0,0,0|3,0,0]=4 456 B10R0.41 COC(COCCSC)OC 34a_100000230434_100000211822 [1,0,0,0,0,0|2,0,0]=3 457 B10R0.41 COC(COCCSC)OC 34a_100011216393_100000212216 [1,0,0,0,0,0|2,0,0]=3 458 B10R0.41 COC(COCCSC)OC 7a_100000230434_100000751394 [1,0,0,0,0,0|2,0,0]=3 459 B10R0.41 COC(CSCCC#N)OC 62a_100000751394_100011215226 [1,0,0,0,0,0|2,0,1]=4 460 B10R0.41 COC(CSCCC#N)OC 62a_100011215226_100000751394 [1,0,0,0,0,0|2,0,1]=4 461 B10R0.41 COC(CSCCCF)OC 62a_100000751394_100011934791 [1,0,0,0,0,0|2,0,0]=3 462 B10R0.41 COC(CSCCCF)OC 62a_100011934791_100000751394 [1,0,0,0,0,0|2,0,0]=3 463 B10R0.41 COC(CSCCCO)OC 62a_100000751394_100011215043 [1,0,0,0,0,0|2,0,0]=3 464 B10R0.41 COC(CSCCCO)OC 62a_100011215043_100000751394 [1,0,0,0,0,0|2,0,0]=3 465 B10R0.41 COC(CSCCSC)OC 62a_100000212216_100000751394 [1,0,0,0,0,0|2,0,0]=3 466 B10R0.41 COC(CSCCSC)OC 62a_100000751394_100000751147 [1,0,0,0,0,0|2,0,0]=3 467 B10R0.41 COCCNCC(OC)OC 2230a_100000209980_100000751394 [1,0,0,0,0,0|2,0,0]=3 468 B10R0.41 COCCNCC(OC)OC 270004a_100000209980_100000752162 [1,0,0,0,0,0|2,0,0]=3 469 B10R0.41 COCCOCC(OC)OC 34a_100000210237_100000211822 [1,0,0,0,0,0|2,0,0]=3 470 B10R0.41 COCCOCC(OC)OC 34a_100011216393_100011201679 [1,0,0,0,0,0|2,0,0]=3 471 B10R0.41 COCCSCC(OC)OC 62a_100000233755_100000751394 [1,0,0,0,0,0|2,0,0]=3 472 B10R0.41 COCCSCC(OC)OC 62a_100000751394_100000233755 [1,0,0,0,0,0|2,0,0]=3 473 B10R0.41 COCSCCC(OC)OC 62a_100000139399_100000766300 [1,0,0,0,0,0|2,0,0]=3 474 B10R0.41 COCSCCC(OC)OC 62a_100000766300_100000139399 [1,0,0,0,0,0|2,0,0]=3 475 B10R0.74 C#CC(C)NCCCCCC 2230a_100000707721_100000210314 [1,0,0,0,0,0|2,0,1]=4 476 B10R0.74 C#CC(C)NCCCCCC 34a_100000707721_100000210314 [1,0,0,0,0,0|2,0,1]=4 477 B10R0.74 C#CC(C)OCCCCCC 34a_100000210259_200000035995 [1,0,0,0,0,0|2,0,1]=4 478 B10R0.74 C#CC(C)SCCCCCC 62a_200000035995_100000210757 [1,0,0,0,0,0|2,0,1]=4 479 B10R0.74 C#CC(O)CCCCCNC 2230a_106832991635_200010408556 [1,0,0,0,0,0|2,0,1]=4 480 B10R0.74 C#CC(O)CCCCCNC 34a_100102657272_200010408556 [1,0,0,0,0,0|2,0,1]=4 481 B10R0.74 C#CC(O)CCCCCNC 7a_106832991635_200010408556 [1,0,0,0,0,0|2,0,1]=4 482 B10R0.74 C#CC(O)CCCCCOC 34a_100138415774_200010408556 [1,0,0,0,0,0|2,0,1]=4 483 B10R0.74 C#CC(O)CCCCCSC 62a_200000210301_200010408556 [1,0,0,0,0,0|2,0,1]=4 484 B10R0.74 C#CC(O)CCCCCSC 62a_200010408556_200000210301 [1,0,0,0,0,0|2,0,1]=4 485 B10R0.74 C#CC(O)CCCCCS[13CH3] 62a_200010408556_200025704644 [1,0,0,0,0,0|2,0,1]=4 486 B10R0.74 C#CC(O)CCCCCS[13CH3] 62a_200025704644_200010408556 [1,0,0,0,0,0|2,0,1]=4 487 B10R0.74 C#CCCCCSC(C)OC 62a_100009879195_100010269958 [1,0,0,0,0,0|1,0,2]=4 488 B10R0.74 C#CCCCCSC(C)OC 62a_100010269958_100009879195 [1,0,0,0,0,0|1,0,2]=4 489 B10R0.74 C#CCCCNC[C@@H](C)OC 2230a_100020591295_100000731252 [1,0,0,0,0,0|1,0,2]=4 490 B10R0.74 C#CCCCOCC(C)OC 34a_100000690652_100000695029 [1,0,0,0,0,0|1,0,2]=4 491 B10R0.74 C#CCCOCCC(C)OC 7a_100000764861_100000688953 [1,0,0,0,0,0|1,0,2]=4 492 B10R0.74 C#C[C@@H](C)OCCCCCC 34a_100009815206_100000210314 [1,0,0,0,0,0|2,0,1]=4 493 B10R0.74 C#C[C@@H](C)OCCCCCC 7a_100009815206_100000210314 [1,0,0,0,0,0|2,0,1]=4 494 B10R0.74 C/C=C/COCCC(C)OC 7a_100000764861_100102629194 [1,0,0,0,0,0|1,0,2]=4 495 B10R0.74 C=CC(C)COCCCCC 34a_100011215527_100000718602 [1,0,0,0,0,0|2,0,1]=4 496 B10R0.74 C=CC(C)COCCCCC 7a_100011215527_100000210326 [1,0,0,0,0,0|2,0,1]=4 497 B10R0.74 C=CC(C)OCCCCCC 34a_100000695699_100000210314 [1,0,0,0,0,0|2,0,1]=4 498 B10R0.74 C=CC(C)SCCCCCC 62a_100011215867_100000210757 [1,0,0,0,0,0|2,0,1]=4 499 B10R0.74 C=CC(O)CNCCCCC 2230a_100000209983_100000730141 [1,0,0,0,0,0|2,0,1]=4 500 B10R0.74 C=CC(O)COCCCCC 34a_100000210253_100000730141 [1,0,0,0,0,0|2,0,1]=4 501 B10R0.74 C=CC(O)COCCCCC 7a_100000210253_100000730141 [1,0,0,0,0,0|2,0,1]=4 502 B10R0.74 C=CC(O)CSCCCCC 62a_100000210326_100000730141 [1,0,0,0,0,0|2,0,1]=4 503 B10R0.74 C=CC(O)CSCCCCC 62a_100000730141_100000210326 [1,0,0,0,0,0|2,0,1]=4 504 B10R0.74 C=CCCCCSC(C)OC 62a_100009879195_100011215482 [1,0,0,0,0,0|1,0,2]=4 505 B10R0.74 C=CCCCCSC(C)OC 62a_100011215482_100009879195 [1,0,0,0,0,0|1,0,2]=4 506 B10R0.74 C=CCCCNC[C@@H](C)OC 2230a_100020591295_100011713584 [1,0,0,0,0,0|1,0,2]=4 507 B10R0.74 C=CCCCOCC(C)OC 34a_100000690652_100000757094 [1,0,0,0,0,0|1,0,2]=4 508 B10R0.74 C=CCCOCCC(C)OC 7a_100000764861_100000754431 [1,0,0,0,0,0|1,0,2]=4 509 B10R0.74 CC#CCOCCC(C)OC 7a_100000764861_100000748600 [1,0,0,0,0,0|1,0,2]=4 510 B10R0.74 CC/C=C\CCSC(C)OC 62a_100009879195_100015370543 [1,0,0,0,0,0|1,0,2]=4 511 B10R0.74 CC/C=C\CCSC(C)OC 62a_100015370543_100009879195 [1,0,0,0,0,0|1,0,2]=4 512 B10R0.74 CC/C=C\CNC[C@@H](C)OC 2230a_100020591295_100103147603 [1,0,0,0,0,0|1,0,2]=4 513 B10R0.74 CC/C=C\COCC(C)OC 34a_100000690652_100103147603 [1,0,0,0,0,0|1,0,2]=4 514 B10R0.74 CC=CCOCCC(C)OC 7a_100000764861_100000070051 [1,0,0,0,0,0|1,0,2]=4 515 B10R0.74 CCC#CCNC[C@@H](C)OC 2230a_100020591295_100009813939 [1,0,0,0,0,0|1,0,2]=4 516 B10R0.74 CCC#CCOCC(C)OC 34a_100000690652_100009813939 [1,0,0,0,0,0|1,0,2]=4 517 B10R0.74 CCC(C)CCCCCOC 7a_200000035636_200000210301 [1,0,0,0,0,0|2,0,0]=3 518 B10R0.74 CCC(C)CCCCCO[13CH3] 7a_200000035636_200025704644 [1,0,0,0,0,0|2,0,0]=3 519 B10R0.74 CCC(C)CCCOCCF 7a_100011216074_100011217306 [1,0,0,0,0,0|3,0,0]=4 520 B10R0.74 CCC(C)CCCOCCO 7a_100011216074_100000211926 [1,0,0,0,0,0|3,0,0]=4 521 B10R0.74 CCC(C)CCNCCCF 2230a_100020591266_100011934791 [1,0,0,0,0,0|3,0,0]=4 522 B10R0.74 CCC(C)CCNCCCO 2230a_100020591266_100000230001 [1,0,0,0,0,0|3,0,0]=4 523 B10R0.74 CCC(C)CCNCCOC 2230a_100020591266_100011201679 [1,0,0,0,0,0|3,0,0]=4 524 B10R0.74 CCC(C)CCNCCSC 2230a_100020591266_100000751147 [1,0,0,0,0,0|3,0,0]=4 525 B10R0.74 CCC(C)CCOCCCF 7a_100011215188_100011934791 [1,0,0,0,0,0|3,0,0]=4 526 B10R0.74 CCC(C)CCOCCCO 7a_100011215188_100011215043 [1,0,0,0,0,0|3,0,0]=4 527 B10R0.74 CCC(C)CCOCCOC 7a_100011215188_100000233755 [1,0,0,0,0,0|3,0,0]=4 528 B10R0.74 CCC(C)CCOCCSC 7a_100011215188_100000212216 [1,0,0,0,0,0|3,0,0]=4 529 B10R0.74 CCC(C)CNCCCCF 2230a_100020588543_100000729493 [1,0,0,0,0,0|3,0,0]=4 530 B10R0.74 CCC(C)CNCCCCO 2230a_100000750430_100000748023 [1,0,0,0,0,0|3,0,0]=4 531 B10R0.74 CCC(C)CNCCCCO 2230a_100020588543_100000210776 [1,0,0,0,0,0|3,0,0]=4 532 B10R0.74 CCC(C)CNCCCCO 270004a_100000750430_100000243153 [1,0,0,0,0,0|3,0,0]=4 533 B10R0.74 CCC(C)CNCCCCO 34a_100000750430_100000748023 [1,0,0,0,0,0|3,0,0]=4 534 B10R0.74 CCC(C)CNCCCOC 2230a_100020588543_100000740836 [1,0,0,0,0,0|3,0,0]=4 535 B10R0.74 CCC(C)CNCCCOC 270004a_100150723488_100000243153 [1,0,0,0,0,0|3,0,0]=4 536 B10R0.74 CCC(C)CNCCCOC 34a_100150723488_100000748023 [1,0,0,0,0,0|3,0,0]=4 537 B10R0.74 CCC(C)CNCCCSC 2230a_100000749238_100000748023 [1,0,0,0,0,0|3,0,0]=4 538 B10R0.74 CCC(C)CNCCCSC 270004a_100000749238_100000243153 [1,0,0,0,0,0|3,0,0]=4 539 B10R0.74 CCC(C)COCCCCBr 34a_100011216708_100000748023 [1,0,0,0,0,0|3,0,0]=4 540 B10R0.74 CCC(C)COCCCCCl 34a_100000210776_100000748023 [1,0,0,0,0,0|3,0,0]=4 541 B10R0.74 CCC(C)COCCCCCl 7a_100000210776_100000748023 [1,0,0,0,0,0|3,0,0]=4 542 B10R0.74 CCC(C)COCCCCF 34a_100011995726_100000748023 [1,0,0,0,0,0|3,0,0]=4 543 B10R0.74 CCC(C)COCCCCF 7a_100011995726_100000748023 [1,0,0,0,0,0|3,0,0]=4 544 B10R0.74 CCC(C)COCCCCI 34a_200012148704_100000748023 [1,0,0,0,0,0|3,0,0]=4 545 B10R0.74 CCC(C)COCCCCN 34a_100000750430_100000748023 [1,0,0,0,0,0|3,0,0]=4 546 B10R0.74 CCC(C)COCCCNC 34a_100000213112_100000748023 [1,0,0,0,0,0|3,0,0]=4 547 B10R0.74 CCC(C)COCCCOC 34a_100000740835_100000748023 [1,0,0,0,0,0|3,0,0]=4 548 B10R0.74 CCC(C)COCCCSC 34a_100000690336_100000748023 [1,0,0,0,0,0|3,0,0]=4 549 B10R0.74 CCC(C)COCCCSC 7a_100000690336_100000748023 [1,0,0,0,0,0|3,0,0]=4 550 B10R0.74 CCC(C)CSCCCCF 62a_100000729493_100000748023 [1,0,0,0,0,0|3,0,0]=4 551 B10R0.74 CCC(C)CSCCCCF 62a_100000748023_100000729493 [1,0,0,0,0,0|3,0,0]=4 552 B10R0.74 CCC(C)CSCCCCO 62a_100000210776_100000748023 [1,0,0,0,0,0|3,0,0]=4 553 B10R0.74 CCC(C)CSCCCCO 62a_100000748023_100000210776 [1,0,0,0,0,0|3,0,0]=4 554 B10R0.74 CCC(C)CSCCCOC 62a_100000709357_100000748023 [1,0,0,0,0,0|3,0,0]=4 555 B10R0.74 CCC(C)CSCCCOC 62a_100000748023_100000709357 [1,0,0,0,0,0|3,0,0]=4 556 B10R0.74 CCC(C)NCCCCCF 2230a_100000209981_100000729378 [1,0,0,0,0,0|3,0,0]=4 557 B10R0.74 CCC(C)NCCCCCO 2230a_100000209981_100000746330 [1,0,0,0,0,0|3,0,0]=4 558 B10R0.74 CCC(C)NCCCCCO 2230a_100000762737_100000758301 [1,0,0,0,0,0|3,0,0]=4 559 B10R0.74 CCC(C)NCCCCCO 34a_100000762737_100011215416 [1,0,0,0,0,0|3,0,0]=4 560 B10R0.74 CCC(C)NCCCCOC 2230a_100000209981_100000730899 [1,0,0,0,0,0|3,0,0]=4 561 B10R0.74 CCC(C)OCCCCCBr 34a_100000746331_100011215416 [1,0,0,0,0,0|3,0,0]=4 562 B10R0.74 CCC(C)OCCCCCBr 7a_100000746331_100000758301 [1,0,0,0,0,0|3,0,0]=4 563 B10R0.74 CCC(C)OCCCCCCl 34a_100000746330_100011215416 [1,0,0,0,0,0|3,0,0]=4 564 B10R0.74 CCC(C)OCCCCCCl 7a_100000746330_100000758301 [1,0,0,0,0,0|3,0,0]=4 565 B10R0.74 CCC(C)OCCCCCF 7a_100000210228_100000729378 [1,0,0,0,0,0|3,0,0]=4 566 B10R0.74 CCC(C)OCCCCCI 34a_200012148887_100011215416 [1,0,0,0,0,0|3,0,0]=4 567 B10R0.74 CCC(C)OCCCCCI 7a_200012148887_100000758301 [1,0,0,0,0,0|3,0,0]=4 568 B10R0.74 CCC(C)OCCCCCN 34a_100000762737_100011215416 [1,0,0,0,0,0|3,0,0]=4 569 B10R0.74 CCC(C)OCCCCCO 7a_100000210228_100000746330 [1,0,0,0,0,0|3,0,0]=4 570 B10R0.74 CCC(C)OCCCCOC 34a_100000740925_100011215416 [1,0,0,0,0,0|3,0,0]=4 571 B10R0.74 CCC(C)OCCCCOC 7a_100000210228_100000730899 [1,0,0,0,0,0|3,0,0]=4 572 B10R0.74 CCC(C)OCCCCSC 34a_100011217163_100011215416 [1,0,0,0,0,0|3,0,0]=4 573 B10R0.74 CCC(C)OCCCCSC 7a_100011217163_100000758301 [1,0,0,0,0,0|3,0,0]=4 574 B10R0.74 CCC(C)SCCCCCF 62a_100000729378_100000758301 [1,0,0,0,0,0|3,0,0]=4 575 B10R0.74 CCC(C)SCCCCCF 62a_100000758301_100000729378 [1,0,0,0,0,0|3,0,0]=4 576 B10R0.74 CCC(C)SCCCCCO 62a_100000746330_100000758301 [1,0,0,0,0,0|3,0,0]=4 577 B10R0.74 CCC(C)SCCCCCO 62a_100000758301_100000746330 [1,0,0,0,0,0|3,0,0]=4 578 B10R0.74 CCC(C)SCCCCOC 62a_100000730899_100000758301 [1,0,0,0,0,0|3,0,0]=4 579 B10R0.74 CCC(C)SCCCCOC 62a_100000758301_100000730899 [1,0,0,0,0,0|3,0,0]=4 580 B10R0.74 CCC(O)CNCCCCF 2230a_100011218483_100000729493 [1,0,0,0,0,0|3,0,0]=4 581 B10R0.74 CCC(O)CNCCCCO 2230a_100000750430_100011218378 [1,0,0,0,0,0|3,0,0]=4 582 B10R0.74 CCC(O)CNCCCCO 2230a_100011218483_100000210776 [1,0,0,0,0,0|3,0,0]=4 583 B10R0.74 CCC(O)CNCCCCO 34a_100000750430_100011218378 [1,0,0,0,0,0|3,0,0]=4 584 B10R0.74 CCC(O)CNCCCOC 2230a_100011218483_100000740836 [1,0,0,0,0,0|3,0,0]=4 585 B10R0.74 CCC(O)CNCCCOC 34a_100150723488_100011218378 [1,0,0,0,0,0|3,0,0]=4 586 B10R0.74 CCC(O)CNCCCSC 2230a_100000749238_100011218378 [1,0,0,0,0,0|3,0,0]=4 587 B10R0.74 CCC(O)COCCCCBr 34a_100011216708_100011218378 [1,0,0,0,0,0|3,0,0]=4 588 B10R0.74 CCC(O)COCCCCCl 34a_100000210776_100011218378 [1,0,0,0,0,0|3,0,0]=4 589 B10R0.74 CCC(O)COCCCCCl 7a_100000210776_100011218378 [1,0,0,0,0,0|3,0,0]=4 590 B10R0.74 CCC(O)COCCCCF 34a_100011995726_100011218378 [1,0,0,0,0,0|3,0,0]=4 591 B10R0.74 CCC(O)COCCCCF 7a_100011995726_100011218378 [1,0,0,0,0,0|3,0,0]=4 592 B10R0.74 CCC(O)COCCCCI 34a_200012148704_100011218378 [1,0,0,0,0,0|3,0,0]=4 593 B10R0.74 CCC(O)COCCCCN 34a_100000750430_100011218378 [1,0,0,0,0,0|3,0,0]=4 594 B10R0.74 CCC(O)COCCCNC 34a_100000213112_100011218378 [1,0,0,0,0,0|3,0,0]=4 595 B10R0.74 CCC(O)COCCCOC 34a_100000740835_100011218378 [1,0,0,0,0,0|3,0,0]=4 596 B10R0.74 CCC(O)COCCCSC 34a_100000690336_100011218378 [1,0,0,0,0,0|3,0,0]=4 597 B10R0.74 CCC(O)COCCCSC 7a_100000690336_100011218378 [1,0,0,0,0,0|3,0,0]=4 598 B10R0.74 CCC(O)CSCCCCF 62a_100000729493_100011218378 [1,0,0,0,0,0|3,0,0]=4 599 B10R0.74 CCC(O)CSCCCCF 62a_100011218378_100000729493 [1,0,0,0,0,0|3,0,0]=4 600 B10R0.74 CCC(O)CSCCCCO 62a_100000210776_100011218378 [1,0,0,0,0,0|3,0,0]=4 601 B10R0.74 CCC(O)CSCCCCO 62a_100011218378_100000210776 [1,0,0,0,0,0|3,0,0]=4 602 B10R0.74 CCC(O)CSCCCOC 62a_100000709357_100011218378 [1,0,0,0,0,0|3,0,0]=4 603 B10R0.74 CCC(O)CSCCCOC 62a_100011218378_100000709357 [1,0,0,0,0,0|3,0,0]=4 604 B10R0.74 CCCCCCCC(=O)CC 1458a_100000210414_100000210614 [1,0,0,0,0,0|1,0,2]=4 605 B10R0.74 CCCCCCCC(=O)CC 1458a_100000211969_100000210202 [1,0,0,0,0,0|1,0,2]=4 606 B10R0.74 CCCCCCCC(=O)NC 11a_106832991635_100000211969 [1,0,0,0,0,0|1,0,2]=4 607 B10R0.74 CCCCCCCC(=O)NC 1626a_100102657272_100000211969 [1,0,0,0,0,0|1,0,2]=4 608 B10R0.74 CCCCCCCC(=O)NC 240690a_100102657272_100000211969 [1,0,0,0,0,0|1,0,2]=4 609 B10R0.74 CCCCCCCC(=O)NC 527a_100102657272_100000211969 [1,0,0,0,0,0|1,0,2]=4 610 B10R0.74 CCCCCCCC(C)NC 2230a_106832991635_200011218727 [1,0,0,0,0,0|1,0,0]=2 611 B10R0.74 CCCCCCCC(C)NC 270004a_106832991635_100000210596 [1,0,0,0,0,0|1,0,0]=2 612 B10R0.74 CCCCCCCC(C)NC 34a_100102657272_200011218727 [1,0,0,0,0,0|1,0,0]=2 613 B10R0.74 CCCCCCCC(C)NC 7a_106832991635_200011218727 [1,0,0,0,0,0|1,0,0]=2 614 B10R0.74 CCCCCCCC(C)OC 34a_100138415774_200011218727 [1,0,0,0,0,0|0,0,0]=1 615 B10R0.74 CCCCCCCC(C)OC 34a_200011215852_200000210301 [1,0,0,0,0,0|0,0,0]=1 616 B10R0.74 CCCCCCCC(C)OC 7a_200011215852_200000210301 [1,0,0,0,0,0|0,0,0]=1 617 B10R0.74 CCCCCCCC(C)O[13CH3] 34a_200011215852_200025704644 [1,0,0,0,0,0|0,0,0]=1 618 B10R0.74 CCCCCCCC(C)O[13CH3] 7a_200011215852_200025704644 [1,0,0,0,0,0|0,0,0]=1 619 B10R0.74 CCCCCCCC(C)SC 62a_200000210301_200011218727 [1,0,0,0,0,0|0,1,0]=2 620 B10R0.74 CCCCCCCC(C)SC 62a_200011218727_200000210301 [1,0,0,0,0,0|0,1,0]=2 621 B10R0.74 CCCCCCCC(C)S[13CH3] 62a_200011218727_200025704644 [1,0,0,0,0,0|0,1,0]=2 622 B10R0.74 CCCCCCCC(C)S[13CH3] 62a_200025704644_200011218727 [1,0,0,0,0,0|0,1,0]=2 623 B10R0.74 CCCCCCCN(C)CC 2230a_100000225621_100000210681 [1,0,0,0,0,0|2,0,0]=3 624 B10R0.74 CCCCCCCN(C)CC 2230a_100000228206_100000210202 [1,0,0,0,0,0|2,0,0]=3 625 B10R0.74 CCCCCCCN(C)CC 2230a_100000228213_200000210301 [1,0,0,0,0,0|2,0,0]=3 626 B10R0.74 CCCCCCCN(C)CC 269982a_100000225621_100000210681 [1,0,0,0,0,0|2,0,0]=3 627 B10R0.74 CCCCCCCN(C)CC 269982a_100000228206_100000204670 [1,0,0,0,0,0|2,0,0]=3 628 B10R0.74 CCCCCCCN(C)CC 269982a_100000228213_200000210301 [1,0,0,0,0,0|2,0,0]=3 629 B10R0.74 CCCCCCCN(C)CF 269982a_100000228206_100015361967 [1,0,0,0,0,0|3,0,0]=4 630 B10R0.74 CCCCCCCN([13CH3])CC 2230a_100000228213_200025704644 [1,0,0,0,0,0|2,0,0]=3 631 B10R0.74 CCCCCCCN([13CH3])CC 269982a_100000228213_200025704644 [1,0,0,0,0,0|2,0,0]=3 632 B10R0.74 CCCCCCNC(C)C#N 2230a_100000210581_100000184139 [1,0,0,0,0,0|3,0,0]=4 633 B10R0.74 CCCCCCNC(C)C#N 2230a_100000737613_100000210314 [1,0,0,0,0,0|3,0,0]=4 634 B10R0.74 CCCCCCNC(C)CC 2230a_100000209981_100000210314 [1,0,0,0,0,0|2,0,0]=3 635 B10R0.74 CCCCCCNC(C)CC 2230a_100000210581_100000758301 [1,0,0,0,0,0|2,0,0]=3 636 B10R0.74 CCCCCCNC(C)CO 2230a_100000210581_100012180447 [1,0,0,0,0,0|3,0,0]=4 637 B10R0.74 CCCCCCN[C@H](C)CO 2230a_100000737577_100000210314 [1,0,0,0,0,0|3,0,0]=4 638 B10R0.74 CCCCCCOC(C)C#N 34a_100011218135_100000210314 [1,0,0,0,0,0|3,0,0]=4 639 B10R0.74 CCCCCCOC(C)C#N 7a_100000210259_100000703298 [1,0,0,0,0,0|3,0,0]=4 640 B10R0.74 CCCCCCOC(C)CC 34a_100000210259_100011215416 [1,0,0,0,0,0|2,0,0]=3 641 B10R0.74 CCCCCCOC(C)CC 7a_100000210228_100000210314 [1,0,0,0,0,0|2,0,0]=3 642 B10R0.74 CCCCCCOC(C)CC 7a_100000210259_100000758301 [1,0,0,0,0,0|2,0,0]=3 643 B10R0.74 CCCCCCOC(C)CF 34a_100016041109_100000210314 [1,0,0,0,0,0|3,0,0]=4 644 B10R0.74 CCCCCCOC(C)CF 7a_100016041109_100000210314 [1,0,0,0,0,0|3,0,0]=4 645 B10R0.74 CCCCCCOC(C)CN 34a_100000210904_100000210314 [1,0,0,0,0,0|3,0,0]=4 646 B10R0.74 CCCCCCOC(C)CO 34a_100000210259_100012180447 [1,0,0,0,0,0|3,0,0]=4 647 B10R0.74 CCCCCCOC(C)CO 7a_100000210259_100012180447 [1,0,0,0,0,0|3,0,0]=4 648 B10R0.74 CCCCCCSC(C)C#N 62a_100000210314_100000703298 [1,0,0,0,0,0|3,0,0]=4 649 B10R0.74 CCCCCCSC(C)C#N 62a_100000703298_100000210757 [1,0,0,0,0,0|3,0,0]=4 650 B10R0.74 CCCCCCSC(C)CC 62a_100000210314_100000758301 [1,0,0,0,0,0|2,0,0]=3 651 B10R0.74 CCCCCCSC(C)CC 62a_100000758301_100000210757 [1,0,0,0,0,0|2,0,0]=3 652 B10R0.74 CCCCCCSC(C)CO 62a_100012180447_100000210757 [1,0,0,0,0,0|3,0,0]=4 653 B10R0.74 CCCCCCSC(C)OC 62a_100000210314_100009879195 [1,0,0,0,0,0|1,0,0]=2 654 B10R0.74 CCCCCCSC(C)OC 62a_100009879195_100000210757 [1,0,0,0,0,0|1,0,0]=2 655 B10R0.74 CCCCCCS[C@H](C)CO 62a_100000210314_100016084084 [1,0,0,0,0,0|3,0,0]=4 656 B10R0.74 CCCCCCS[C@H](C)CO 62a_100016084084_100000210757 [1,0,0,0,0,0|3,0,0]=4 657 B10R0.74 CCCCCNCC(=O)OC 2230a_100000209983_100000747449 [1,0,0,0,0,0|1,0,2]=4 658 B10R0.74 CCCCCNCC(C)CC 2230a_100000209983_100000748023 [1,0,0,0,0,0|2,0,0]=3 659 B10R0.74 CCCCCNCC(C)CC 2230a_100020588543_100000210326 [1,0,0,0,0,0|2,0,0]=3 660 B10R0.74 CCCCCNCC(C)CC 270004a_100000209983_100000243153 [1,0,0,0,0,0|2,0,0]=3 661 B10R0.74 CCCCCNCC(C)CO 34a_100000744482_100000718602 [1,0,0,0,0,0|3,0,0]=4 662 B10R0.74 CCCCCNCC(O)CC 2230a_100000209983_100011218378 [1,0,0,0,0,0|2,0,0]=3 663 B10R0.74 CCCCCNCC(O)CC 2230a_100011218483_100000210326 [1,0,0,0,0,0|2,0,0]=3 664 B10R0.74 CCCCCNCC(O)CO 2230a_100000209983_100011219619 [1,0,0,0,0,0|3,0,0]=4 665 B10R0.74 CCCCCNC[C@@H](C)CC 2230a_100000209983_100009816398 [1,0,0,0,0,0|2,0,0]=3 666 B10R0.74 CCCCCNC[C@@H](C)CO 2230a_100000209983_100000059175 [1,0,0,0,0,0|3,0,0]=4 667 B10R0.74 CCCCCNC[C@@H](C)OC 2230a_100020591295_100000210326 [1,0,0,0,0,0|1,0,0]=2 668 B10R0.74 CCCCCNC[C@@H](O)CF 2230a_100000209983_100015614560 [1,0,0,0,0,0|3,0,0]=4 669 B10R0.74 CCCCCNC[C@@H](O)CO 2230a_100000209983_100009815848 [1,0,0,0,0,0|3,0,0]=4 670 B10R0.74 CCCCCNC[C@H](O)CO 2230a_100020644852_100000210326 [1,0,0,0,0,0|3,0,0]=4 671 B10R0.74 CCCCCOCC(=O)OC 34a_100000210253_100000747449 [1,0,0,0,0,0|1,0,2]=4 672 B10R0.74 CCCCCOCC(=O)OC 7a_100000210253_100000747449 [1,0,0,0,0,0|1,0,2]=4 673 B10R0.74 CCCCCOCC(C)CC 34a_100000210253_100000748023 [1,0,0,0,0,0|2,0,0]=3 674 B10R0.74 CCCCCOCC(C)CC 7a_100000210253_100000748023 [1,0,0,0,0,0|2,0,0]=3 675 B10R0.74 CCCCCOCC(C)CN 34a_100000744482_100000718602 [1,0,0,0,0,0|3,0,0]=4 676 B10R0.74 CCCCCOCC(C)OC 34a_100000690652_100000718602 [1,0,0,0,0,0|1,0,0]=2 677 B10R0.74 CCCCCOCC(O)CC 34a_100000210253_100011218378 [1,0,0,0,0,0|2,0,0]=3 678 B10R0.74 CCCCCOCC(O)CC 7a_100000210253_100011218378 [1,0,0,0,0,0|2,0,0]=3 679 B10R0.74 CCCCCOCC(O)CO 34a_100000210253_100011219619 [1,0,0,0,0,0|3,0,0]=4 680 B10R0.74 CCCCCOCC(O)CO 7a_100000210253_100011219619 [1,0,0,0,0,0|3,0,0]=4 681 B10R0.74 CCCCCOC[C@@H](C)CC 34a_100000210253_100009816398 [1,0,0,0,0,0|2,0,0]=3 682 B10R0.74 CCCCCOC[C@@H](C)CC 7a_100000210253_100009816398 [1,0,0,0,0,0|2,0,0]=3 683 B10R0.74 CCCCCOC[C@@H](C)CC 7a_100009816381_100000210326 [1,0,0,0,0,0|2,0,0]=3 684 B10R0.74 CCCCCOC[C@@H](C)CO 34a_100000210253_100000059175 [1,0,0,0,0,0|3,0,0]=4 685 B10R0.74 CCCCCOC[C@@H](C)CO 7a_100000210253_100000059175 [1,0,0,0,0,0|3,0,0]=4 686 B10R0.74 CCCCCOC[C@@H](O)CF 34a_100000210253_100015614560 [1,0,0,0,0,0|3,0,0]=4 687 B10R0.74 CCCCCOC[C@@H](O)CF 7a_100000210253_100015614560 [1,0,0,0,0,0|3,0,0]=4 688 B10R0.74 CCCCCOC[C@@H](O)CO 34a_100000210253_100009815848 [1,0,0,0,0,0|3,0,0]=4 689 B10R0.74 CCCCCOC[C@@H](O)CO 7a_100000210253_100009815848 [1,0,0,0,0,0|3,0,0]=4 690 B10R0.74 CCCCCSCC(=O)OC 62a_100000210326_100000747449 [1,0,0,0,0,0|1,0,2]=4 691 B10R0.74 CCCCCSCC(=O)OC 62a_100000747449_100000210326 [1,0,0,0,0,0|1,0,2]=4 692 B10R0.74 CCCCCSCC(C)CC 62a_100000210326_100000748023 [1,0,0,0,0,0|2,0,0]=3 693 B10R0.74 CCCCCSCC(C)CC 62a_100000748023_100000210326 [1,0,0,0,0,0|2,0,0]=3 694 B10R0.74 CCCCCSCC(O)CC 62a_100000210326_100011218378 [1,0,0,0,0,0|2,0,0]=3 695 B10R0.74 CCCCCSCC(O)CC 62a_100011218378_100000210326 [1,0,0,0,0,0|2,0,0]=3 696 B10R0.74 CCCCCSCC(O)CO 62a_100000210326_100011219619 [1,0,0,0,0,0|3,0,0]=4 697 B10R0.74 CCCCCSCC(O)CO 62a_100011219619_100000210326 [1,0,0,0,0,0|3,0,0]=4 698 B10R0.74 CCCCCSC[C@@H](C)CC 62a_100000210326_100009816398 [1,0,0,0,0,0|2,0,0]=3 699 B10R0.74 CCCCCSC[C@@H](C)CC 62a_100009816398_100000210326 [1,0,0,0,0,0|2,0,0]=3 700 B10R0.74 CCCCCSC[C@@H](C)CO 62a_100000059175_100000210326 [1,0,0,0,0,0|3,0,0]=4 701 B10R0.74 CCCCCSC[C@@H](C)CO 62a_100000210326_100000059175 [1,0,0,0,0,0|3,0,0]=4 702 B10R0.74 CCCCCSC[C@@H](O)CF 62a_100000210326_100015614560 [1,0,0,0,0,0|3,0,0]=4 703 B10R0.74 CCCCCSC[C@@H](O)CF 62a_100015614560_100000210326 [1,0,0,0,0,0|3,0,0]=4 704 B10R0.74 CCCCCSC[C@@H](O)CO 62a_100000210326_100009815848 [1,0,0,0,0,0|3,0,0]=4 705 B10R0.74 CCCCCSC[C@@H](O)CO 62a_100009815848_100000210326 [1,0,0,0,0,0|3,0,0]=4 706 B10R0.74 CCCCNCCC(=O)OC 2230a_100000102301_100000204255 [1,0,0,0,0,0|1,0,2]=4 707 B10R0.74 CCCCNCCC(=O)OC 7a_106832991798_100000204255 [1,0,0,0,0,0|1,0,2]=4 708 B10R0.74 CCCCNCCC(C)CC 2230a_100020591266_100000210211 [1,0,0,0,0,0|2,0,0]=3 709 B10R0.74 CCCCNCCC(C)CO 2230a_106354213184_100000210211 [1,0,0,0,0,0|3,0,0]=4 710 B10R0.74 CCCCNCCC(C)CO 34a_106354213184_100000210210 [1,0,0,0,0,0|3,0,0]=4 711 B10R0.74 CCCCOCCC(=O)OC 34a_100000210227_100000742370 [1,0,0,0,0,0|1,0,2]=4 712 B10R0.74 CCCCOCCC(=O)OC 7a_100000210227_100000204255 [1,0,0,0,0,0|1,0,2]=4 713 B10R0.74 CCCCOCCC(C)CC 7a_100011215188_100000210211 [1,0,0,0,0,0|2,0,0]=3 714 B10R0.74 CCCCOCCC(C)OC 7a_100000764861_100000210211 [1,0,0,0,0,0|1,0,0]=2 715 B10R0.74 CCCCOCCN(C)CC 2230a_100000225621_100000743108 [1,0,0,0,0,0|3,0,0]=4 716 B10R0.74 CCCCOCCN(C)CC 269982a_100000225621_100000743108 [1,0,0,0,0,0|3,0,0]=4 717 B10R0.74 CCCCOCNC(C)CC 2230a_100000209981_100011995733 [1,0,0,0,0,0|3,0,0]=4 718 B10R0.74 CCCCOCSC(C)CC 62a_100000758301_100011995733 [1,0,0,0,0,0|3,0,0]=4 719 B10R0.74 CCCCOCSC(C)CC 62a_100011995733_100000758301 [1,0,0,0,0,0|3,0,0]=4 720 B10R0.74 CCCCOCSC(C)OC 62a_100009879195_100011995733 [1,0,0,0,0,0|2,0,0]=3 721 B10R0.74 CCCCOCSC(C)OC 62a_100011995733_100009879195 [1,0,0,0,0,0|2,0,0]=3 722 B10R0.74 CCCCSCCC(=O)OC 62a_100000204255_100000210210 [1,0,0,0,0,0|1,0,2]=4 723 B10R0.74 CCCCSCCC(=O)OC 62a_100000210211_100000204255 [1,0,0,0,0,0|1,0,2]=4 724 B10R0.74 CCCOCCCC(=O)OC 34a_100000210258_100000742333 [1,0,0,0,0,0|1,0,2]=4 725 B10R0.74 CCCOCCCC(C)CC 7a_100011216074_100000210303 [1,0,0,0,0,0|2,0,0]=3 726 B10R0.74 CCCOCCC[C@@H](C)CN 34a_100160569302_100000210303 [1,0,0,0,0,0|3,0,0]=4 727 B10R0.74 CCCOCCNC(C)CC 2230a_100000209981_100011215938 [1,0,0,0,0,0|3,0,0]=4 728 B10R0.74 CCCOCCNC(C)CC 2230a_100161115042_100000758301 [1,0,0,0,0,0|3,0,0]=4 729 B10R0.74 CCCOCCNC(C)CC 34a_100161115042_100011215416 [1,0,0,0,0,0|3,0,0]=4 730 B10R0.74 CCCOCCOC(C)CC 34a_100000752267_100011215416 [1,0,0,0,0,0|3,0,0]=4 731 B10R0.74 CCCOCCOC(C)CC 7a_100000210228_100011215938 [1,0,0,0,0,0|3,0,0]=4 732 B10R0.74 CCCOCCOC(C)CC 7a_100000752267_100000758301 [1,0,0,0,0,0|3,0,0]=4 733 B10R0.74 CCCOCCSC(C)CC 62a_100000758301_100011215938 [1,0,0,0,0,0|3,0,0]=4 734 B10R0.74 CCCOCCSC(C)CC 62a_100011215938_100000758301 [1,0,0,0,0,0|3,0,0]=4 735 B10R0.74 CCCOCCSC(C)OC 62a_100009879195_100011215938 [1,0,0,0,0,0|2,0,0]=3 736 B10R0.74 CCCOCCSC(C)OC 62a_100011215938_100009879195 [1,0,0,0,0,0|2,0,0]=3 737 B10R0.74 CCCSCCCC(=O)OC 62a_100000210303_100011218270 [1,0,0,0,0,0|1,0,2]=4 738 B10R0.74 CCCSCCCC(=O)OC 62a_100011218270_100000210303 [1,0,0,0,0,0|1,0,2]=4 739 B10R0.74 CCCSCCCN(C)CC 62a_100000210303_100015186262 [1,0,0,0,0,0|3,0,0]=4 740 B10R0.74 CCCSCCNC(C)CC 2230a_100020603323_100000758301 [1,0,0,0,0,0|3,0,0]=4 741 B10R0.74 CCCSCCOC(C)CC 34a_200000230433_100011215416 [1,0,0,0,0,0|3,0,0]=4 742 B10R0.74 CCCSCCOC(C)CC 7a_200000230433_100000758301 [1,0,0,0,0,0|3,0,0]=4 743 B10R0.74 CCN(C)CCCCCCF 2230a_100000225621_100015922095 [1,0,0,0,0,0|3,0,0]=4 744 B10R0.74 CCN(C)CCCCCCF 269982a_100000225621_100015922095 [1,0,0,0,0,0|3,0,0]=4 745 B10R0.74 CCN(C)CCCCCCO 2230a_100000225621_100000766143 [1,0,0,0,0,0|3,0,0]=4 746 B10R0.74 CCN(C)CCCCCCO 269982a_100000225621_100000766143 [1,0,0,0,0,0|3,0,0]=4 747 B10R0.74 CCNCCCCC(=O)OC 2230a_100015525214_100000204269 [1,0,0,0,0,0|1,0,2]=4 748 B10R0.74 CCOCCCCC(=O)OC 34a_100000059025_100000210202 [1,0,0,0,0,0|1,0,2]=4 749 B10R0.74 CCOCCCCC(=O)OC 34a_100121572206_100000204269 [1,0,0,0,0,0|1,0,2]=4 750 B10R0.74 CCOCCCCC(=O)OC 7a_100000059025_100000210202 [1,0,0,0,0,0|1,0,2]=4 751 B10R0.74 CCOCCCNC(C)CC 2230a_100000209981_100012232248 [1,0,0,0,0,0|3,0,0]=4 752 B10R0.74 CCOCCCNC(C)CC 2230a_100000210961_100000758301 [1,0,0,0,0,0|3,0,0]=4 753 B10R0.74 CCOCCCNC(C)CC 34a_100000210961_100011215416 [1,0,0,0,0,0|3,0,0]=4 754 B10R0.74 CCOCCCOC(C)CC 34a_100000757476_100011215416 [1,0,0,0,0,0|3,0,0]=4 755 B10R0.74 CCOCCCOC(C)CC 7a_100000210228_100012232248 [1,0,0,0,0,0|3,0,0]=4 756 B10R0.74 CCOCCCOC(C)CC 7a_100000757476_100000758301 [1,0,0,0,0,0|3,0,0]=4 757 B10R0.74 CCOCCCSC(C)CC 62a_100000758301_100012232248 [1,0,0,0,0,0|3,0,0]=4 758 B10R0.74 CCOCCCSC(C)CC 62a_100012232248_100000758301 [1,0,0,0,0,0|3,0,0]=4 759 B10R0.74 CCOCCCSC(C)OC 62a_100009879195_100012232248 [1,0,0,0,0,0|2,0,0]=3 760 B10R0.74 CCOCCCSC(C)OC 62a_100012232248_100009879195 [1,0,0,0,0,0|2,0,0]=3 761 B10R0.74 CCOCCNCC(C)CC 2230a_100020588543_100011215890 [1,0,0,0,0,0|3,0,0]=4 762 B10R0.74 CCOCCNCC(C)CC 2230a_102516460346_100000748023 [1,0,0,0,0,0|3,0,0]=4 763 B10R0.74 CCOCCNCC(C)CC 270004a_102516460346_100000243153 [1,0,0,0,0,0|3,0,0]=4 764 B10R0.74 CCOCCNCC(C)CC 34a_102516460346_100000748023 [1,0,0,0,0,0|3,0,0]=4 765 B10R0.74 CCOCCNCC(O)CC 2230a_100011218483_100011215890 [1,0,0,0,0,0|3,0,0]=4 766 B10R0.74 CCOCCNCC(O)CC 2230a_102516460346_100011218378 [1,0,0,0,0,0|3,0,0]=4 767 B10R0.74 CCOCCNCC(O)CC 34a_102516460346_100011218378 [1,0,0,0,0,0|3,0,0]=4 768 B10R0.74 CCOCCNC[C@@H](C)CC 2230a_102516460346_100009816398 [1,0,0,0,0,0|3,0,0]=4 769 B10R0.74 CCOCCNC[C@@H](C)CC 34a_102516460346_100009816398 [1,0,0,0,0,0|3,0,0]=4 770 B10R0.74 CCOCCNC[C@@H](C)OC 2230a_100020591295_100011215890 [1,0,0,0,0,0|2,0,0]=3 771 B10R0.74 CCOCCOCC(C)CC 34a_100000210136_100000748023 [1,0,0,0,0,0|3,0,0]=4 772 B10R0.74 CCOCCOCC(C)CC 7a_100000210136_100000748023 [1,0,0,0,0,0|3,0,0]=4 773 B10R0.74 CCOCCOCC(C)OC 34a_100000690652_100000210147 [1,0,0,0,0,0|2,0,0]=3 774 B10R0.74 CCOCCOCC(O)CC 34a_100000210136_100011218378 [1,0,0,0,0,0|3,0,0]=4 775 B10R0.74 CCOCCOCC(O)CC 7a_100000210136_100011218378 [1,0,0,0,0,0|3,0,0]=4 776 B10R0.74 CCOCCOC[C@@H](C)CC 34a_100000210136_100009816398 [1,0,0,0,0,0|3,0,0]=4 777 B10R0.74 CCOCCOC[C@@H](C)CC 7a_100000210136_100009816398 [1,0,0,0,0,0|3,0,0]=4 778 B10R0.74 CCOCCOC[C@@H](C)CC 7a_100009816381_100011215890 [1,0,0,0,0,0|3,0,0]=4 779 B10R0.74 CCOCCSCC(C)CC 62a_100000210147_100000748023 [1,0,0,0,0,0|3,0,0]=4 780 B10R0.74 CCOCCSCC(C)CC 62a_100000748023_100011215890 [1,0,0,0,0,0|3,0,0]=4 781 B10R0.74 CCOCCSCC(O)CC 62a_100000210147_100011218378 [1,0,0,0,0,0|3,0,0]=4 782 B10R0.74 CCOCCSCC(O)CC 62a_100011218378_100011215890 [1,0,0,0,0,0|3,0,0]=4 783 B10R0.74 CCOCCSC[C@@H](C)CC 62a_100000210147_100009816398 [1,0,0,0,0,0|3,0,0]=4 784 B10R0.74 CCOCCSC[C@@H](C)CC 62a_100009816398_100011215890 [1,0,0,0,0,0|3,0,0]=4 785 B10R0.74 CCSCCCCC(=O)OC 62a_100000204269_100000210202 [1,0,0,0,0,0|1,0,2]=4 786 B10R0.74 CCSCCCCC(=O)OC 62a_100000210202_100000204269 [1,0,0,0,0,0|1,0,2]=4 787 B10R0.74 CCSCCCOC(C)CC 34a_100011216438_100011215416 [1,0,0,0,0,0|3,0,0]=4 788 B10R0.74 CCSCCCOC(C)CC 7a_100011216438_100000758301 [1,0,0,0,0,0|3,0,0]=4 789 B10R0.74 CCSCCNCC(C)CC 2230a_100000106463_100000748023 [1,0,0,0,0,0|3,0,0]=4 790 B10R0.74 CCSCCNCC(C)CC 2230a_100020588543_100000757381 [1,0,0,0,0,0|3,0,0]=4 791 B10R0.74 CCSCCNCC(C)CC 270004a_100000106463_100000243153 [1,0,0,0,0,0|3,0,0]=4 792 B10R0.74 CCSCCNCC(O)CC 2230a_100000106463_100011218378 [1,0,0,0,0,0|3,0,0]=4 793 B10R0.74 CCSCCNCC(O)CC 2230a_100011218483_100000757381 [1,0,0,0,0,0|3,0,0]=4 794 B10R0.74 CCSCCNC[C@@H](C)CC 2230a_100000106463_100009816398 [1,0,0,0,0,0|3,0,0]=4 795 B10R0.74 CCSCCNC[C@@H](C)OC 2230a_100020591295_100000757381 [1,0,0,0,0,0|2,0,0]=3 796 B10R0.74 CCSCCOCC(C)CC 34a_100000212035_100000748023 [1,0,0,0,0,0|3,0,0]=4 797 B10R0.74 CCSCCOCC(C)CC 7a_100000212035_100000748023 [1,0,0,0,0,0|3,0,0]=4 798 B10R0.74 CCSCCOCC(C)OC 34a_100000690652_100000757381 [1,0,0,0,0,0|2,0,0]=3 799 B10R0.74 CCSCCOCC(O)CC 34a_100000212035_100011218378 [1,0,0,0,0,0|3,0,0]=4 800 B10R0.74 CCSCCOCC(O)CC 7a_100000212035_100011218378 [1,0,0,0,0,0|3,0,0]=4 801 B10R0.74 CCSCCOC[C@@H](C)CC 34a_100000212035_100009816398 [1,0,0,0,0,0|3,0,0]=4 802 B10R0.74 CCSCCOC[C@@H](C)CC 7a_100000212035_100009816398 [1,0,0,0,0,0|3,0,0]=4 803 B10R0.74 CCSCCOC[C@@H](C)CC 7a_100009816381_100000757381 [1,0,0,0,0,0|3,0,0]=4 804 B10R0.74 CCSCCSCC(C)CC 62a_100000748023_100000757381 [1,0,0,0,0,0|3,0,0]=4 805 B10R0.74 CCSCCSCC(C)CC 62a_100000757381_100000748023 [1,0,0,0,0,0|3,0,0]=4 806 B10R0.74 CCSCCSCC(O)CC 62a_100000757381_100011218378 [1,0,0,0,0,0|3,0,0]=4 807 B10R0.74 CCSCCSCC(O)CC 62a_100011218378_100000757381 [1,0,0,0,0,0|3,0,0]=4 808 B10R0.74 CCSCCSC[C@@H](C)CC 62a_100000757381_100009816398 [1,0,0,0,0,0|3,0,0]=4 809 B10R0.74 CCSCCSC[C@@H](C)CC 62a_100009816398_100000757381 [1,0,0,0,0,0|3,0,0]=4 810 B10R0.74 CC[C@H](C)CNCCCCO 2230a_100000750430_100009816398 [1,0,0,0,0,0|3,0,0]=4 811 B10R0.74 CC[C@H](C)CNCCCCO 34a_100000750430_100009816398 [1,0,0,0,0,0|3,0,0]=4 812 B10R0.74 CC[C@H](C)CNCCCOC 34a_100150723488_100009816398 [1,0,0,0,0,0|3,0,0]=4 813 B10R0.74 CC[C@H](C)CNCCCSC 2230a_100000749238_100009816398 [1,0,0,0,0,0|3,0,0]=4 814 B10R0.74 CC[C@H](C)COCCCCBr 34a_100011216708_100009816398 [1,0,0,0,0,0|3,0,0]=4 815 B10R0.74 CC[C@H](C)COCCCCCl 34a_100000210776_100009816398 [1,0,0,0,0,0|3,0,0]=4 816 B10R0.74 CC[C@H](C)COCCCCCl 7a_100000210776_100009816398 [1,0,0,0,0,0|3,0,0]=4 817 B10R0.74 CC[C@H](C)COCCCCF 34a_100011995726_100009816398 [1,0,0,0,0,0|3,0,0]=4 818 B10R0.74 CC[C@H](C)COCCCCF 7a_100009816381_100000729493 [1,0,0,0,0,0|3,0,0]=4 819 B10R0.74 CC[C@H](C)COCCCCF 7a_100011995726_100009816398 [1,0,0,0,0,0|3,0,0]=4 820 B10R0.74 CC[C@H](C)COCCCCI 34a_200012148704_100009816398 [1,0,0,0,0,0|3,0,0]=4 821 B10R0.74 CC[C@H](C)COCCCCN 34a_100000750430_100009816398 [1,0,0,0,0,0|3,0,0]=4 822 B10R0.74 CC[C@H](C)COCCCCO 7a_100009816381_100000210776 [1,0,0,0,0,0|3,0,0]=4 823 B10R0.74 CC[C@H](C)COCCCNC 34a_100000213112_100009816398 [1,0,0,0,0,0|3,0,0]=4 824 B10R0.74 CC[C@H](C)COCCCOC 34a_100000740835_100009816398 [1,0,0,0,0,0|3,0,0]=4 825 B10R0.74 CC[C@H](C)COCCCOC 7a_100009816381_100000740836 [1,0,0,0,0,0|3,0,0]=4 826 B10R0.74 CC[C@H](C)COCCCSC 34a_100000690336_100009816398 [1,0,0,0,0,0|3,0,0]=4 827 B10R0.74 CC[C@H](C)COCCCSC 7a_100000690336_100009816398 [1,0,0,0,0,0|3,0,0]=4 828 B10R0.74 CC[C@H](C)CSCCCCF 62a_100000729493_100009816398 [1,0,0,0,0,0|3,0,0]=4 829 B10R0.74 CC[C@H](C)CSCCCCF 62a_100009816398_100000729493 [1,0,0,0,0,0|3,0,0]=4 830 B10R0.74 CC[C@H](C)CSCCCCO 62a_100000210776_100009816398 [1,0,0,0,0,0|3,0,0]=4 831 B10R0.74 CC[C@H](C)CSCCCCO 62a_100009816398_100000210776 [1,0,0,0,0,0|3,0,0]=4 832 B10R0.74 CC[C@H](C)CSCCCOC 62a_100000709357_100009816398 [1,0,0,0,0,0|3,0,0]=4 833 B10R0.74 CC[C@H](C)CSCCCOC 62a_100009816398_100000709357 [1,0,0,0,0,0|3,0,0]=4 834 B10R0.74 CNCCCCCC(=O)OC 2230a_106832991635_100009816466 [1,0,0,0,0,0|1,0,2]=4 835 B10R0.74 CNCCCCCC(=O)OC 34a_100102657272_100009816466 [1,0,0,0,0,0|1,0,2]=4 836 B10R0.74 CNCCCCCC(=O)OC 7a_106832991635_100009816466 [1,0,0,0,0,0|1,0,2]=4 837 B10R0.74 COC(=O)CCCCCO[13CH3] 34a_100000074720_200025704644 [1,0,0,0,0,0|1,0,2]=4 838 B10R0.74 COC(=O)CCCCCO[13CH3] 7a_100000074720_200025704644 [1,0,0,0,0,0|1,0,2]=4 839 B10R0.74 COC(=O)CCCCCSC 62a_100009816466_200000210301 [1,0,0,0,0,0|1,0,2]=4 840 B10R0.74 COC(=O)CCCCCSC 62a_200000210301_100009816466 [1,0,0,0,0,0|1,0,2]=4 841 B10R0.74 COC(=O)CCCCCS[13CH3] 62a_100009816466_200025704644 [1,0,0,0,0,0|1,0,2]=4 842 B10R0.74 COC(=O)CCCCCS[13CH3] 62a_200025704644_100009816466 [1,0,0,0,0,0|1,0,2]=4 843 B10R0.74 COC(C)CCOCCC#N 7a_100000764861_100000184422 [1,0,0,0,0,0|2,0,1]=4 844 B10R0.74 COC(C)CCOCCCF 7a_100000764861_100011934791 [1,0,0,0,0,0|2,0,0]=3 845 B10R0.74 COC(C)CCOCCCO 7a_100000764861_100011215043 [1,0,0,0,0,0|2,0,0]=3 846 B10R0.74 COC(C)CCOCCSC 7a_100000764861_100000212216 [1,0,0,0,0,0|2,0,0]=3 847 B10R0.74 COC(C)COCCCCF 34a_100000690652_100000729493 [1,0,0,0,0,0|2,0,0]=3 848 B10R0.74 COC(C)COCCCCO 34a_100000690652_100011216708 [1,0,0,0,0,0|2,0,0]=3 849 B10R0.74 COC(C)SCCCCC#N 62a_100009879195_100000211819 [1,0,0,0,0,0|2,0,1]=4 850 B10R0.74 COC(C)SCCCCC#N 62a_100011219923_100009879195 [1,0,0,0,0,0|2,0,1]=4 851 B10R0.74 COC(C)SCCCCC=O 62a_100000139335_100009879195 [1,0,0,0,0,0|2,0,1]=4 852 B10R0.74 COC(C)SCCCCC=O 62a_100009879195_100000139335 [1,0,0,0,0,0|2,0,1]=4 853 B10R0.74 COC(C)SCCCCCF 62a_100000729378_100009879195 [1,0,0,0,0,0|2,0,0]=3 854 B10R0.74 COC(C)SCCCCCF 62a_100009879195_100000729378 [1,0,0,0,0,0|2,0,0]=3 855 B10R0.74 COC(C)SCCCCCO 62a_100000746330_100009879195 [1,0,0,0,0,0|2,0,0]=3 856 B10R0.74 COC(C)SCCCCCO 62a_100009879195_100000746330 [1,0,0,0,0,0|2,0,0]=3 857 B10R0.74 COC(C)SCCOCCO 62a_100009879195_100011215305 [1,0,0,0,0,0|3,0,0]=4 858 B10R0.74 COC(C)SCCOCCO 62a_100011215305_100009879195 [1,0,0,0,0,0|3,0,0]=4 859 B10R0.74 COCCCCCC(=O)OC 34a_100000074720_200000210301 [1,0,0,0,0,0|1,0,2]=4 860 B10R0.74 COCCCCCC(=O)OC 34a_100138415774_100009816466 [1,0,0,0,0,0|1,0,2]=4 861 B10R0.74 COCCCCCC(=O)OC 7a_100000074720_200000210301 [1,0,0,0,0,0|1,0,2]=4 862 B10R0.74 COCCCCSC(C)OC 62a_100000730899_100009879195 [1,0,0,0,0,0|2,0,0]=3 863 B10R0.74 COCCCCSC(C)OC 62a_100009879195_100000730899 [1,0,0,0,0,0|2,0,0]=3 864 B10R0.74 COCCCNC[C@@H](C)OC 2230a_100020591295_100000740836 [1,0,0,0,0,0|2,0,0]=3 865 B10R0.74 COCCCOCC(C)OC 34a_100000690652_100000740836 [1,0,0,0,0,0|2,0,0]=3 866 B10R0.74 COCCOCCC(C)OC 7a_100000764861_100000233755 [1,0,0,0,0,0|2,0,0]=3 867 B10R0.74 COCCOCSC(C)OC 62a_100000231047_100009879195 [1,0,0,0,0,0|3,0,0]=4 868 B10R0.74 COCCOCSC(C)OC 62a_100009879195_100000231047 [1,0,0,0,0,0|3,0,0]=4 869 B10R0.74 CO[C@H](C)CNCCCC#N 2230a_100020591295_100000687738 [1,0,0,0,0,0|2,0,1]=4 870 B10R0.74 CO[C@H](C)CNCCCC=O 2230a_100020591295_200011292268 [1,0,0,0,0,0|2,0,1]=4 871 B10R0.74 CO[C@H](C)CNCCCCF 2230a_100020591295_100000729493 [1,0,0,0,0,0|2,0,0]=3 872 B10R0.74 CO[C@H](C)CNCCCCO 2230a_100020591295_100000210776 [1,0,0,0,0,0|2,0,0]=3 873 B12R0.35 C=C(Br)CCOCCC(OC)OC 34a_100009813270_100000139399 [0,1,0,0,0,0|1,0,2]=4 874 B12R0.35 C=C(C)CCOCCC(OC)OC 34a_100000764851_100000139399 [0,1,0,0,0,0|1,0,1]=3 875 B12R0.35 C=C(C)CCSCCC(OC)OC 62a_100000139399_100000730704 [0,1,0,0,0,0|1,0,1]=3 876 B12R0.35 C=C(C)CCSCCC(OC)OC 62a_100000730704_100000139399 [0,1,0,0,0,0|1,0,1]=3 877 B12R0.35 C=C(C)COCCCC(OC)OC 34a_100000210245_100000069011 [0,1,0,0,0,0|1,0,1]=3 878 B12R0.35 C=C(C)CSCCCC(OC)OC 62a_100000069011_100000211660 [0,1,0,0,0,0|1,0,1]=3 879 B12R0.35 C=C(C)CSCCCC(OC)OC 62a_100000748629_100000069011 [0,1,0,0,0,0|1,0,1]=3 880 B12R0.35 C=C(F)COCCCC(OC)OC 34a_200010262243_100000069011 [0,1,0,0,0,0|1,0,2]=4 881 B12R0.35 C=C(F)CSCCCC(OC)OC 62a_100000042424_100000069011 [0,1,0,0,0,0|1,0,2]=4 882 B12R0.35 C=C(F)CSCCCC(OC)OC 62a_100000069011_100000042424 [0,1,0,0,0,0|1,0,2]=4 883 B12R0.35 CCC(CC)CNCCCC(C)C 2230a_100102946423_100011214892 [0,1,0,0,0,0|3,0,0]=4 884 B12R0.35 CCC(CC)CNCCCC(C)C 2230a_200000737386_100011215472 [0,1,0,0,0,0|3,0,0]=4 885 B12R0.35 CCC(CC)CNCCCC(C)C 269862a_200000737386_100000211137 [0,1,0,0,0,0|3,0,0]=4 886 B12R0.35 CCC(CC)CNCCCC(C)C 270004a_200000737386_100000211137 [0,1,0,0,0,0|3,0,0]=4 887 B12R0.35 CCC(CC)CNCCCC(C)C 34a_200000737386_100011215472 [0,1,0,0,0,0|3,0,0]=4 888 B12R0.35 CCC(CC)CNCCCC(C)O 2230a_100102946423_200000718107 [0,1,0,0,0,0|3,0,0]=4 889 B12R0.35 CCC(CC)COCCCC(C)C 34a_100000210774_100011215472 [0,1,0,0,0,0|3,0,0]=4 890 B12R0.35 CCC(CC)COCCCC(C)C 7a_100000210774_100011215472 [0,1,0,0,0,0|3,0,0]=4 891 B12R0.35 CCC(CC)COCCCC(C)C 7a_100000703878_100011214892 [0,1,0,0,0,0|3,0,0]=4 892 B12R0.35 CCC(CC)COCCCC(C)O 7a_100000703878_200000718107 [0,1,0,0,0,0|3,0,0]=4 893 B12R0.35 CCC(CC)CSCCCC(C)C 62a_100011214892_100011215472 [0,1,0,0,0,0|3,0,0]=4 894 B12R0.35 CCC(CC)CSCCCC(C)C 62a_100011215472_100011214892 [0,1,0,0,0,0|3,0,0]=4 895 B12R0.35 CCC(CC)CSCCCC(C)O 62a_100011215472_200000718107 [0,1,0,0,0,0|3,0,0]=4 896 B12R0.35 CCC(CC)CSCCCC(C)O 62a_200000718107_100011215472 [0,1,0,0,0,0|3,0,0]=4 897 B12R0.35 CCC(CC)NCCCCC(C)C 2230a_100000199018_100011216152 [0,1,0,0,0,0|3,0,0]=4 898 B12R0.35 CCC(CC)OCCCCC(C)C 7a_100000688536_100011216152 [0,1,0,0,0,0|3,0,0]=4 899 B12R0.35 CCC(CC)OCCCCC(C)C 7a_100011214890_100000210505 [0,1,0,0,0,0|3,0,0]=4 900 B12R0.35 CCC(CC)SCCCCC(C)C 62a_100000210505_100011216152 [0,1,0,0,0,0|3,0,0]=4 901 B12R0.35 CCC(CC)SCCCCC(C)C 62a_100011216152_100000210505 [0,1,0,0,0,0|3,0,0]=4 902 B12R0.35 CCC(COCCCC(=O)C)OC 34a_100011934954_100000685027 [0,1,0,0,0,0|2,0,1]=4 903 B12R0.35 CCC(COCCCC(=O)C)OC 7a_100011934954_100011215641 [0,1,0,0,0,0|2,0,1]=4 904 B12R0.35 CCC(COCCCC(C)C)OC 34a_100011934954_100011214892 [0,1,0,0,0,0|2,0,0]=3 905 B12R0.35 CCC(COCCCC(C)C)OC 7a_100011934954_100011214892 [0,1,0,0,0,0|2,0,0]=3 906 B12R0.35 CCC(COCCCC(C)O)OC 34a_100011934954_200000718107 [0,1,0,0,0,0|2,0,0]=3 907 B12R0.35 CCC(COCCCC(C)O)OC 7a_100011934954_200000718107 [0,1,0,0,0,0|2,0,0]=3 908 B12R0.35 CCC(COCCCN(C)C)OC 7a_100011934954_100000757444 [0,1,0,0,0,0|3,0,0]=4 909 B12R0.35 CCC(COCCOC(C)C)OC 34a_100011934954_100000211751 [0,1,0,0,0,0|3,0,0]=4 910 B12R0.35 CCC(COCCOC(C)C)OC 7a_100011934954_100000211751 [0,1,0,0,0,0|3,0,0]=4 911 B12R0.35 CCC(COCCSC(C)C)OC 34a_100011934954_100000730970 [0,1,0,0,0,0|3,0,0]=4 912 B12R0.35 CCC(COCCSC(C)C)OC 7a_100011934954_100000730970 [0,1,0,0,0,0|3,0,0]=4 913 B12R0.35 CCN(CC)CCCCCC(C)C 2230a_100000724800_100000210682 [0,1,0,0,0,0|3,0,0]=4 914 B12R0.35 CCN(CC)CCCCCC(C)C 269956a_100000042499_100000210682 [0,1,0,0,0,0|3,0,0]=4 915 B12R0.35 CCN(CC)CCCCCC(C)C 269982a_100000724800_100000210682 [0,1,0,0,0,0|3,0,0]=4 916 B12R0.35 COC(CCCNCC(=O)N)OC 2230a_100000711301_100000069011 [0,1,0,0,0,0|2,0,1]=4 917 B12R0.35 COC(CCCNCC(=O)O)OC 269956a_100016091260_100000069011 [0,1,0,0,0,0|2,0,1]=4 918 B12R0.35 COC(CCCNCC(C)C)OC 2230a_100000210953_100000069011 [0,1,0,0,0,0|1,0,0]=2 919 B12R0.35 COC(CCCNCC(C)C)OC 270004a_100000034021_100000210432 [0,1,0,0,0,0|1,0,0]=2 920 B12R0.35 COC(CCCNCC(C)C)OC 34a_100000210953_100000069011 [0,1,0,0,0,0|1,0,0]=2 921 B12R0.35 COC(CCCNCC(C)O)OC 2230a_100000210904_100000069011 [0,1,0,0,0,0|1,0,0]=2 922 B12R0.35 COC(CCCNCC(C)O)OC 34a_100000210904_100000069011 [0,1,0,0,0,0|1,0,0]=2 923 B12R0.35 COC(CCCNCC(F)F)OC 34a_100000765723_100000069011 [0,1,0,0,0,0|2,0,0]=3 924 B12R0.35 COC(CCCOCC(=O)C)OC 34a_100000211253_100000069011 [0,1,0,0,0,0|1,0,1]=3 925 B12R0.35 COC(CCCOCC(C)Br)OC 34a_100012180447_100000069011 [0,1,0,0,0,0|1,0,0]=2 926 B12R0.35 COC(CCCOCC(C)C)OC 34a_100000210257_100000069011 [0,1,0,0,0,0|1,0,0]=2 927 B12R0.35 COC(CCCOCC(C)F)OC 34a_100015925927_100000069011 [0,1,0,0,0,0|1,0,0]=2 928 B12R0.35 COC(CCCOCC(F)F)OC 34a_100000743014_100000069011 [0,1,0,0,0,0|2,0,0]=3 929 B12R0.35 COC(CCCOC[C@@H](C)Cl)OC 34a_100016084084_100000069011 [0,1,0,0,0,0|1,0,0]=2 930 B12R0.35 COC(CCCOC[C@@H](C)N)OC 34a_100000737577_100000069011 [0,1,0,0,0,0|1,0,0]=2 931 B12R0.35 COC(CCCSCC(=O)N)OC 62a_100000069011_100000747473 [0,1,0,0,0,0|2,0,1]=4 932 B12R0.35 COC(CCCSCC(=O)N)OC 62a_100000747473_100000069011 [0,1,0,0,0,0|2,0,1]=4 933 B12R0.35 COC(CCCSCC(=O)[O-])OC 62a_100000069011_100020667443 [0,1,0,0,0,0|2,0,1]=4 934 B12R0.35 COC(CCCSCC(=O)[O-])OC 62a_100020667443_100000069011 [0,1,0,0,0,0|2,0,1]=4 935 B12R0.35 COC(CCCSCC(C)C)OC 62a_100000069011_100000210760 [0,1,0,0,0,0|1,0,0]=2 936 B12R0.35 COC(CCCSCC(C)C)OC 62a_100000210624_100000069011 [0,1,0,0,0,0|1,0,0]=2 937 B12R0.35 COC(CCCSCC(C)O)OC 62a_100000069011_100011218427 [0,1,0,0,0,0|1,0,0]=2 938 B12R0.35 COC(CCCSCC(C)O)OC 62a_100011218427_100000069011 [0,1,0,0,0,0|1,0,0]=2 939 B12R0.35 COC(CCCSCC(F)F)OC 62a_100000069011_100011934356 [0,1,0,0,0,0|2,0,0]=3 940 B12R0.35 COC(CCCSCC(F)F)OC 62a_100011934356_100000069011 [0,1,0,0,0,0|2,0,0]=3 941 B12R0.35 COC(CCCSC[C@@H](C)O)OC 62a_100000069011_100009817552 [0,1,0,0,0,0|1,0,0]=2 942 B12R0.35 COC(CCCSC[C@@H](C)O)OC 62a_100009817552_100000069011 [0,1,0,0,0,0|1,0,0]=2 943 B12R0.35 COC(CCCSC[N+](=O)[O-])OC 62a_100000069011_100000761209 [0,1,0,0,0,0|3,0,0]=4 944 B12R0.35 COC(CCNCC=C(C)C)OC 34a_100000718196_100000139399 [0,1,0,0,0,0|1,0,2]=4 945 B12R0.35 COC(CCNCCC(C)O)OC 2230a_200000755665_100009813347 [0,1,0,0,0,0|1,0,0]=2 946 B12R0.35 COC(CCOCC=C(C)C)OC 34a_100000753907_100000139399 [0,1,0,0,0,0|1,0,2]=4 947 B12R0.35 COC(CCOCCC(=O)C)OC 34a_100000759926_100000139399 [0,1,0,0,0,0|1,0,1]=3 948 B12R0.35 COC(CCOCCC(=O)C)OC 7a_100000759926_100009813347 [0,1,0,0,0,0|1,0,1]=3 949 B12R0.35 COC(CCOCCC(=O)N)OC 34a_100000757172_100000139399 [0,1,0,0,0,0|2,0,1]=4 950 B12R0.35 COC(CCOCCC(=O)N)OC 7a_100000757172_100009813347 [0,1,0,0,0,0|2,0,1]=4 951 B12R0.35 COC(CCOCCC(C)Br)OC 34a_100009893172_100000139399 [0,1,0,0,0,0|1,0,0]=2 952 B12R0.35 COC(CCOCCC(C)C)OC 34a_100000210254_100000139399 [0,1,0,0,0,0|1,0,0]=2 953 B12R0.35 COC(CCOCCC(C)C)OC 7a_100000210254_100009813347 [0,1,0,0,0,0|1,0,0]=2 954 B12R0.35 COC(CCOCCC(F)F)OC 34a_100103093639_100000139399 [0,1,0,0,0,0|2,0,0]=3 955 B12R0.35 COC(CCOCC[C@@H](C)N)OC 34a_100000706166_100000139399 [0,1,0,0,0,0|1,0,0]=2 956 B12R0.35 COC(CCSCC=C(C)C)OC 62a_100000139399_100000761012 [0,1,0,0,0,0|1,0,2]=4 957 B12R0.35 COC(CCSCC=C(C)C)OC 62a_100000761012_100000139399 [0,1,0,0,0,0|1,0,2]=4 958 B12R0.35 COC(CCSCCC(=O)C)OC 62a_100000053229_100000139399 [0,1,0,0,0,0|1,0,1]=3 959 B12R0.35 COC(CCSCCC(=O)C)OC 62a_100000139399_100000053229 [0,1,0,0,0,0|1,0,1]=3 960 B12R0.35 COC(CCSCCC(=O)N)OC 62a_100000139399_100000744528 [0,1,0,0,0,0|2,0,1]=4 961 B12R0.35 COC(CCSCCC(=O)N)OC 62a_100000744528_100000139399 [0,1,0,0,0,0|2,0,1]=4 962 B12R0.35 COC(CCSCCC(C)C)OC 62a_100000139399_100000210312 [0,1,0,0,0,0|1,0,0]=2 963 B12R0.35 COC(CCSCCC(C)C)OC 62a_100000210312_100000139399 [0,1,0,0,0,0|1,0,0]=2 964 B12R0.35 COC(CCSCCC(C)O)OC 62a_100000139399_100012276601 [0,1,0,0,0,0|1,0,0]=2 965 B12R0.35 COC(CCSCCC(C)O)OC 62a_100012276601_100000139399 [0,1,0,0,0,0|1,0,0]=2 966 B12R0.35 COC(CCSCCN(C)C)OC 62a_100000139399_100000755713 [0,1,0,0,0,0|2,0,0]=3 967 B12R0.35 COC(CCSCOC(=O)C)OC 62a_100000076356_100000139399 [0,1,0,0,0,0|2,0,1]=4 968 B12R0.35 COC(CCSCOC(=O)C)OC 62a_100000139399_100000076356 [0,1,0,0,0,0|2,0,1]=4 969 B12R0.35 COC(CCSCOC(C)C)OC 62a_100000139399_100000709892 [0,1,0,0,0,0|2,0,0]=3 970 B12R0.35 COC(CCSCOC(C)C)OC 62a_100000709892_100000139399 [0,1,0,0,0,0|2,0,0]=3 971 B12R0.35 COC(CNCCCC(=O)N)OC 34a_100000739312_100000211822 [0,1,0,0,0,0|2,0,1]=4 972 B12R0.35 COC(CNCCCC(C)C)OC 2230a_200000737386_100000751394 [0,1,0,0,0,0|1,0,0]=2 973 B12R0.35 COC(CNCCCC(C)C)OC 270004a_200000737386_100000752162 [0,1,0,0,0,0|1,0,0]=2 974 B12R0.35 COC(CNCCCC(C)C)OC 34a_200000737386_100000211822 [0,1,0,0,0,0|1,0,0]=2 975 B12R0.35 COC(CNCCCN(C)C)OC 270004a_102531767803_100000752162 [0,1,0,0,0,0|2,0,0]=3 976 B12R0.35 COC(CNCCCS(=O)C)OC 2230a_200000753449_100000751394 [0,1,0,0,0,0|2,0,0]=3 977 B12R0.35 COC(CNCCCS(=O)C)OC 270004a_200000753449_100000752162 [0,1,0,0,0,0|2,0,0]=3 978 B12R0.35 COC(CNCCNC(=O)C)OC 2230a_100000209853_100000751394 [0,1,0,0,0,0|2,0,1]=4 979 B12R0.35 COC(CNCCOC(C)C)OC 2230a_100000701111_100000751394 [0,1,0,0,0,0|2,0,0]=3 980 B12R0.35 COC(CNCCOC(C)C)OC 270004a_100000701111_100000752162 [0,1,0,0,0,0|2,0,0]=3 981 B12R0.35 COC(CNCCOC(C)C)OC 34a_100000701111_100000211822 [0,1,0,0,0,0|2,0,0]=3 982 B12R0.35 COC(CNCCSC(C)C)OC 2230a_100000731138_100000751394 [0,1,0,0,0,0|2,0,0]=3 983 B12R0.35 COC(CNCCSC(C)C)OC 270004a_100000731138_100000752162 [0,1,0,0,0,0|2,0,0]=3 984 B12R0.35 COC(CNCCSC(C)C)OC 34a_100000731138_100000211822 [0,1,0,0,0,0|2,0,0]=3 985 B12R0.35 COC(COCCC=C(C)C)OC 34a_100011216393_100011217483 [0,1,0,0,0,0|1,0,2]=4 986 B12R0.35 COC(COCCCC(=O)C)OC 34a_100000759063_100000211822 [0,1,0,0,0,0|1,0,1]=3 987 B12R0.35 COC(COCCCC(=O)C)OC 34a_100011216393_100000685027 [0,1,0,0,0,0|1,0,1]=3 988 B12R0.35 COC(COCCCC(=O)C)OC 7a_100000759063_100000751394 [0,1,0,0,0,0|1,0,1]=3 989 B12R0.35 COC(COCCCC(=O)N)OC 34a_100011216393_100102525003 [0,1,0,0,0,0|2,0,1]=4 990 B12R0.35 COC(COCCCC(C)C)OC 34a_100000210774_100000211822 [0,1,0,0,0,0|1,0,0]=2 991 B12R0.35 COC(COCCCC(C)C)OC 34a_100011216393_100011214892 [0,1,0,0,0,0|1,0,0]=2 992 B12R0.35 COC(COCCCC(C)C)OC 7a_100000210774_100000751394 [0,1,0,0,0,0|1,0,0]=2 993 B12R0.35 COC(COCCCC(C)O)OC 34a_100011216393_200000718107 [0,1,0,0,0,0|1,0,0]=2 994 B12R0.35 COC(COCCC[N+](=O)[O-])OC 34a_200000037920_100000211822 [0,1,0,0,0,0|3,0,0]=4 995 B12R0.35 COC(COCCNC(=O)C)OC 11a_100000692409_100015343762 [0,1,0,0,0,0|2,0,1]=4 996 B12R0.35 COC(COCCNC(=O)C)OC 1626a_100000692409_100015343762 [0,1,0,0,0,0|2,0,1]=4 997 B12R0.35 COC(COCCNC(=O)C)OC 240690a_100000692409_100015343762 [0,1,0,0,0,0|2,0,1]=4 998 B12R0.35 COC(COCCNC(=O)C)OC 34a_100000158858_100000211822 [0,1,0,0,0,0|2,0,1]=4 999 B12R0.35 COC(COCCNC(=O)C)OC 527a_100000692409_100103153847 [0,1,0,0,0,0|2,0,1]=4 1000 B12R0.35 COC(COCCNC(C)C)OC 34a_100000224655_100000211822 [0,1,0,0,0,0|2,0,0]=3 1001 B12R0.35 COC(COCCOC(=O)C)OC 34a_100011216393_100009814007 [0,1,0,0,0,0|2,0,1]=4 1002 B12R0.35 COC(COCCOC(C)C)OC 34a_100000211219_100000211822 [0,1,0,0,0,0|2,0,0]=3 1003 B12R0.35 COC(COCCOC(C)C)OC 34a_100011216393_100000211751 [0,1,0,0,0,0|2,0,0]=3 1004 B12R0.35 COC(COCCOC(C)C)OC 7a_100000211219_100000751394 [0,1,0,0,0,0|2,0,0]=3 1005 B12R0.35 COC(COCCSC(C)C)OC 34a_100011216393_100000730970 [0,1,0,0,0,0|2,0,0]=3 1006 B12R0.35 COC(COCCSC(C)C)OC 34a_200011212901_100000211822 [0,1,0,0,0,0|2,0,0]=3 1007 B12R0.35 COC(COCCSC(C)C)OC 7a_200011212901_100000751394 [0,1,0,0,0,0|2,0,0]=3 1008 B12R0.35 COC(CSCCC=C(C)C)OC 62a_100000751394_100011217483 [0,1,0,0,0,0|1,0,2]=4 1009 B12R0.35 COC(CSCCC=C(C)C)OC 62a_100011217483_100000751394 [0,1,0,0,0,0|1,0,2]=4 1010 B12R0.35 COC(CSCCCC(=O)C)OC 62a_100000751394_100011215641 [0,1,0,0,0,0|1,0,1]=3 1011 B12R0.35 COC(CSCCCC(=O)C)OC 62a_100011215641_100000751394 [0,1,0,0,0,0|1,0,1]=3 1012 B12R0.35 COC(CSCCCC(=O)N)OC 62a_100000751394_100102525003 [0,1,0,0,0,0|2,0,1]=4 1013 B12R0.35 COC(CSCCCC(=O)N)OC 62a_100102525003_100000751394 [0,1,0,0,0,0|2,0,1]=4 1014 B12R0.35 COC(CSCCCC(C)C)OC 62a_100000751394_100011214892 [0,1,0,0,0,0|1,0,0]=2 1015 B12R0.35 COC(CSCCCC(C)C)OC 62a_100011214892_100000751394 [0,1,0,0,0,0|1,0,0]=2 1016 B12R0.35 COC(CSCCCC(C)O)OC 62a_100000751394_200000718107 [0,1,0,0,0,0|1,0,0]=2 1017 B12R0.35 COC(CSCCCC(C)O)OC 62a_200000718107_100000751394 [0,1,0,0,0,0|1,0,0]=2 1018 B12R0.35 COC(CSCCCN(C)C)OC 62a_100000751394_100000757444 [0,1,0,0,0,0|2,0,0]=3 1019 B12R0.35 COC(CSCCNC(=O)C)OC 62a_100000189650_100000751394 [0,1,0,0,0,0|2,0,1]=4 1020 B12R0.35 COC(CSCCNC(=O)C)OC 62a_100000751394_100000189650 [0,1,0,0,0,0|2,0,1]=4 1021 B12R0.35 COC(CSCCOC(=O)C)OC 62a_100000751394_100009814007 [0,1,0,0,0,0|2,0,1]=4 1022 B12R0.35 COC(CSCCOC(=O)C)OC 62a_100009814007_100000751394 [0,1,0,0,0,0|2,0,1]=4 1023 B12R0.35 COC(CSCCOC(C)C)OC 62a_100000211751_100000751394 [0,1,0,0,0,0|2,0,0]=3 1024 B12R0.35 COC(CSCCOC(C)C)OC 62a_100000751394_100000211751 [0,1,0,0,0,0|2,0,0]=3 1025 B12R0.35 COC(CSCCSC(C)C)OC 62a_100000730970_100000751394 [0,1,0,0,0,0|2,0,0]=3 1026 B12R0.35 COC(CSCCSC(C)C)OC 62a_100000751394_100000730970 [0,1,0,0,0,0|2,0,0]=3 1027 B12R0.57 C#CC(CC)OCCCCCCC 34a_100000758843_100000210614 [0,1,0,0,0,0|2,0,1]=4 1028 B12R0.57 C#CC(CC)OCCCCCCC 7a_100000758843_100000210614 [0,1,0,0,0,0|2,0,1]=4 1029 B12R0.57 C#CCCCCNCC(OC)OC 2230a_100000706060_100000751394 [0,1,0,0,0,0|0,0,2]=3 1030 B12R0.57 C#CCCCCNCC(OC)OC 34a_100000706060_100000211822 [0,1,0,0,0,0|0,0,2]=3 1031 B12R0.57 C#CCCCCOCC(CC)OC 34a_100011934954_100010269958 [0,1,0,0,0,0|1,0,2]=4 1032 B12R0.57 C#CCCCCOCC(CC)OC 7a_100011934954_100010269958 [0,1,0,0,0,0|1,0,2]=4 1033 B12R0.57 C#CCCCCOCC(OC)OC 34a_100000766709_100000211822 [0,1,0,0,0,0|0,0,2]=3 1034 B12R0.57 C#CCCCCOCC(OC)OC 34a_100011216393_100010269958 [0,1,0,0,0,0|0,0,2]=3 1035 B12R0.57 C#CCCCCOCC(OC)OC 7a_100000766709_100000751394 [0,1,0,0,0,0|0,0,2]=3 1036 B12R0.57 C#CCCCCSCC(OC)OC 62a_100000751394_100010269958 [0,1,0,0,0,0|0,0,2]=3 1037 B12R0.57 C#CCCCCSCC(OC)OC 62a_100010269958_100000751394 [0,1,0,0,0,0|0,0,2]=3 1038 B12R0.57 C#CCCCNCCC(OC)OC 34a_100000718082_100000139399 [0,1,0,0,0,0|0,0,2]=3 1039 B12R0.57 C#CCCCOCCC(OC)OC 34a_100000215630_100000139399 [0,1,0,0,0,0|0,0,2]=3 1040 B12R0.57 C#CCCCOCCC(OC)OC 7a_100000215630_100009813347 [0,1,0,0,0,0|0,0,2]=3 1041 B12R0.57 C#CCCCSCCC(OC)OC 62a_100000139399_100011215417 [0,1,0,0,0,0|0,0,2]=3 1042 B12R0.57 C#CCCCSCCC(OC)OC 62a_100011215417_100000139399 [0,1,0,0,0,0|0,0,2]=3 1043 B12R0.57 C#CCCNCCCC(OC)OC 34a_100000755551_100000069011 [0,1,0,0,0,0|0,0,2]=3 1044 B12R0.57 C#CCCOCCCC(OC)OC 34a_100011215631_100000069011 [0,1,0,0,0,0|0,0,2]=3 1045 B12R0.57 C#CCCSCCCC(OC)OC 62a_100000069011_100000688953 [0,1,0,0,0,0|0,0,2]=3 1046 B12R0.57 C#CCCSCCCC(OC)OC 62a_100000688953_100000069011 [0,1,0,0,0,0|0,0,2]=3 1047 B12R0.57 C#CCOCCNCC(OC)OC 2230a_100000700922_100000751394 [0,1,0,0,0,0|1,0,2]=4 1048 B12R0.57 C#CCOCCNCC(OC)OC 34a_100000700922_100000211822 [0,1,0,0,0,0|1,0,2]=4 1049 B12R0.57 C#CCOCCOCC(OC)OC 34a_100000054580_100000211822 [0,1,0,0,0,0|1,0,2]=4 1050 B12R0.57 C#CCOCCOCC(OC)OC 34a_100011216393_100010402529 [0,1,0,0,0,0|1,0,2]=4 1051 B12R0.57 C#CCOCCOCC(OC)OC 7a_100000054580_100000751394 [0,1,0,0,0,0|1,0,2]=4 1052 B12R0.57 C#CCOCCSCC(OC)OC 62a_100000751394_100010402529 [0,1,0,0,0,0|1,0,2]=4 1053 B12R0.57 C#CCOCCSCC(OC)OC 62a_100010402529_100000751394 [0,1,0,0,0,0|1,0,2]=4 1054 B12R0.57 C/C=C/CCOCCC(OC)OC 34a_100016278192_100000139399 [0,1,0,0,0,0|0,0,2]=3 1055 B12R0.57 C/C=C/COCCCC(OC)OC 34a_100016270725_100000069011 [0,1,0,0,0,0|0,0,2]=3 1056 B12R0.57 C/C=C/CSCCCC(OC)OC 62a_100000069011_100102629194 [0,1,0,0,0,0|0,0,2]=3 1057 B12R0.57 C/C=C/CSCCCC(OC)OC 62a_100102629194_100000069011 [0,1,0,0,0,0|0,0,2]=3 1058 B12R0.57 C=CC(CC)OCCCCCCC 34a_100000766422_100000210614 [0,1,0,0,0,0|2,0,1]=4 1059 B12R0.57 C=CC(CC)OCCCCCCC 7a_100000766422_100000210614 [0,1,0,0,0,0|2,0,1]=4 1060 B12R0.57 C=CCCCCNCC(OC)OC 2230a_100000703577_100000751394 [0,1,0,0,0,0|0,0,2]=3 1061 B12R0.57 C=CCCCCNCC(OC)OC 270004a_100000703577_100000752162 [0,1,0,0,0,0|0,0,2]=3 1062 B12R0.57 C=CCCCCNCC(OC)OC 34a_100000703577_100000211822 [0,1,0,0,0,0|0,0,2]=3 1063 B12R0.57 C=CCCCCOCC(CC)OC 34a_100011934954_100011215482 [0,1,0,0,0,0|1,0,2]=4 1064 B12R0.57 C=CCCCCOCC(CC)OC 7a_100011934954_100011215482 [0,1,0,0,0,0|1,0,2]=4 1065 B12R0.57 C=CCCCCOCC(OC)OC 34a_100000766645_100000211822 [0,1,0,0,0,0|0,0,2]=3 1066 B12R0.57 C=CCCCCOCC(OC)OC 34a_100011216393_100011215482 [0,1,0,0,0,0|0,0,2]=3 1067 B12R0.57 C=CCCCCOCC(OC)OC 7a_100000766645_100000751394 [0,1,0,0,0,0|0,0,2]=3 1068 B12R0.57 C=CCCCCSCC(OC)OC 62a_100000751394_100011215482 [0,1,0,0,0,0|0,0,2]=3 1069 B12R0.57 C=CCCCCSCC(OC)OC 62a_100011215482_100000751394 [0,1,0,0,0,0|0,0,2]=3 1070 B12R0.57 C=CCCCNCCC(OC)OC 2230a_100000700776_100009813347 [0,1,0,0,0,0|0,0,2]=3 1071 B12R0.57 C=CCCCNCCC(OC)OC 34a_100000700776_100000139399 [0,1,0,0,0,0|0,0,2]=3 1072 B12R0.57 C=CCCCOCCC(OC)OC 34a_100000758997_100000139399 [0,1,0,0,0,0|0,0,2]=3 1073 B12R0.57 C=CCCCOCCC(OC)OC 7a_100000758997_100009813347 [0,1,0,0,0,0|0,0,2]=3 1074 B12R0.57 C=CCCCSCCC(OC)OC 62a_100000139399_100000757094 [0,1,0,0,0,0|0,0,2]=3 1075 B12R0.57 C=CCCCSCCC(OC)OC 62a_100011713584_100000139399 [0,1,0,0,0,0|0,0,2]=3 1076 B12R0.57 C=CCCNCCCC(OC)OC 2230a_100015191253_100000069011 [0,1,0,0,0,0|0,0,2]=3 1077 B12R0.57 C=CCCOCCCC(OC)OC 34a_100011205117_100000069011 [0,1,0,0,0,0|0,0,2]=3 1078 B12R0.57 C=CCCSCCCC(OC)OC 62a_100000069011_100000754431 [0,1,0,0,0,0|0,0,2]=3 1079 B12R0.57 C=CCCSCCCC(OC)OC 62a_100000754431_100000069011 [0,1,0,0,0,0|0,0,2]=3 1080 B12R0.57 C=CCOCCOCC(OC)OC 34a_100000037705_100000211822 [0,1,0,0,0,0|1,0,2]=4 1081 B12R0.57 C=CCOCCOCC(OC)OC 7a_100000037705_100000751394 [0,1,0,0,0,0|1,0,2]=4 1082 B12R0.57 C=COCCCNCC(OC)OC 2230a_100000210767_100000751394 [0,1,0,0,0,0|1,0,2]=4 1083 B12R0.57 C=COCCCNCC(OC)OC 270004a_100000210767_100000752162 [0,1,0,0,0,0|1,0,2]=4 1084 B12R0.57 C=COCCCNCC(OC)OC 34a_100000210767_100000211822 [0,1,0,0,0,0|1,0,2]=4 1085 B12R0.57 C=COCCOCCC(OC)OC 34a_100000033082_100000139399 [0,1,0,0,0,0|1,0,2]=4 1086 B12R0.57 C=COCCSCCC(OC)OC 62a_100000039644_100000139399 [0,1,0,0,0,0|1,0,2]=4 1087 B12R0.57 C=COCCSCCC(OC)OC 62a_100000139399_100000039644 [0,1,0,0,0,0|1,0,2]=4 1088 B12R0.57 CC#CCCOCCC(OC)OC 34a_100000750427_100000139399 [0,1,0,0,0,0|0,0,2]=3 1089 B12R0.57 CC#CCNCCCC(OC)OC 2230a_100000685387_100000069011 [0,1,0,0,0,0|0,0,2]=3 1090 B12R0.57 CC#CCNCCCC(OC)OC 34a_100000685387_100000069011 [0,1,0,0,0,0|0,0,2]=3 1091 B12R0.57 CC#CCOCCCC(OC)OC 34a_100000761923_100000069011 [0,1,0,0,0,0|0,0,2]=3 1092 B12R0.57 CC#CCSCCCC(OC)OC 62a_100000069011_100000748600 [0,1,0,0,0,0|0,0,2]=3 1093 B12R0.57 CC#CCSCCCC(OC)OC 62a_100000748600_100000069011 [0,1,0,0,0,0|0,0,2]=3 1094 B12R0.57 CC/C=C\CCOCC(CC)OC 34a_100011934954_100015370543 [0,1,0,0,0,0|1,0,2]=4 1095 B12R0.57 CC/C=C\CCOCC(CC)OC 7a_100011934954_100015370543 [0,1,0,0,0,0|1,0,2]=4 1096 B12R0.57 CC/C=C\CCOCC(OC)OC 34a_100011216393_100015370543 [0,1,0,0,0,0|0,0,2]=3 1097 B12R0.57 CC/C=C\CCOCC(OC)OC 34a_100016288707_100000211822 [0,1,0,0,0,0|0,0,2]=3 1098 B12R0.57 CC/C=C\CCOCC(OC)OC 7a_100016288707_100000751394 [0,1,0,0,0,0|0,0,2]=3 1099 B12R0.57 CC/C=C\CCSCC(OC)OC 62a_100000751394_100015370543 [0,1,0,0,0,0|0,0,2]=3 1100 B12R0.57 CC/C=C\CCSCC(OC)OC 62a_100015370543_100000751394 [0,1,0,0,0,0|0,0,2]=3 1101 B12R0.57 CC/C=C\COCCC(OC)OC 34a_100016268518_100000139399 [0,1,0,0,0,0|0,0,2]=3 1102 B12R0.57 CC/C=C\CSCCC(OC)OC 62a_100000139399_100103147603 [0,1,0,0,0,0|0,0,2]=3 1103 B12R0.57 CC/C=C\CSCCC(OC)OC 62a_100103147603_100000139399 [0,1,0,0,0,0|0,0,2]=3 1104 B12R0.57 CC=C=CCCOCC(OC)OC 34a_100011020354_100000211822 [0,1,0,0,0,0|0,0,3]=4 1105 B12R0.57 CC=CCCCOCC(OC)OC 34a_100020645299_100000211822 [0,1,0,0,0,0|0,0,2]=3 1106 B12R0.57 CC=CCSCCCC(OC)OC 62a_100000069011_100000070051 [0,1,0,0,0,0|0,0,2]=3 1107 B12R0.57 CC=CCSCCCC(OC)OC 62a_100000070051_100000069011 [0,1,0,0,0,0|0,0,2]=3 1108 B12R0.57 CCC#CCCOCC(OC)OC 34a_100000036655_100000211822 [0,1,0,0,0,0|0,0,2]=3 1109 B12R0.57 CCC#CCCOCC(OC)OC 7a_100000036655_100000751394 [0,1,0,0,0,0|0,0,2]=3 1110 B12R0.57 CCC#CCOCCC(OC)OC 34a_100000032950_100000139399 [0,1,0,0,0,0|0,0,2]=3 1111 B12R0.57 CCC#CCSCCC(OC)OC 62a_100000139399_100009813939 [0,1,0,0,0,0|0,0,2]=3 1112 B12R0.57 CCC#CCSCCC(OC)OC 62a_100009813939_100000139399 [0,1,0,0,0,0|0,0,2]=3 1113 B12R0.57 CCC(CC)CNCCCCCF 2230a_100102946423_100000729378 [0,1,0,0,0,0|3,0,0]=4 1114 B12R0.57 CCC(CC)CNCCCCCO 2230a_100000762737_100011215472 [0,1,0,0,0,0|3,0,0]=4 1115 B12R0.57 CCC(CC)CNCCCCCO 2230a_100102946423_100000746330 [0,1,0,0,0,0|3,0,0]=4 1116 B12R0.57 CCC(CC)CNCCCCCO 269862a_100000762737_100000211137 [0,1,0,0,0,0|3,0,0]=4 1117 B12R0.57 CCC(CC)CNCCCCCO 270004a_100000762737_100000211137 [0,1,0,0,0,0|3,0,0]=4 1118 B12R0.57 CCC(CC)CNCCCCCO 34a_100000762737_100011215472 [0,1,0,0,0,0|3,0,0]=4 1119 B12R0.57 CCC(CC)CNCCCCOC 2230a_100102946423_100000730899 [0,1,0,0,0,0|3,0,0]=4 1120 B12R0.57 CCC(CC)COCCCCCBr 34a_100000746331_100011215472 [0,1,0,0,0,0|3,0,0]=4 1121 B12R0.57 CCC(CC)COCCCCCBr 7a_100000746331_100011215472 [0,1,0,0,0,0|3,0,0]=4 1122 B12R0.57 CCC(CC)COCCCCCCl 34a_100000746330_100011215472 [0,1,0,0,0,0|3,0,0]=4 1123 B12R0.57 CCC(CC)COCCCCCCl 7a_100000746330_100011215472 [0,1,0,0,0,0|3,0,0]=4 1124 B12R0.57 CCC(CC)COCCCCCF 7a_100000703878_100000729378 [0,1,0,0,0,0|3,0,0]=4 1125 B12R0.57 CCC(CC)COCCCCCI 34a_200012148887_100011215472 [0,1,0,0,0,0|3,0,0]=4 1126 B12R0.57 CCC(CC)COCCCCCI 7a_200012148887_100011215472 [0,1,0,0,0,0|3,0,0]=4 1127 B12R0.57 CCC(CC)COCCCCCN 34a_100000762737_100011215472 [0,1,0,0,0,0|3,0,0]=4 1128 B12R0.57 CCC(CC)COCCCCCO 7a_100000703878_100000746330 [0,1,0,0,0,0|3,0,0]=4 1129 B12R0.57 CCC(CC)COCCCCOC 34a_100000740925_100011215472 [0,1,0,0,0,0|3,0,0]=4 1130 B12R0.57 CCC(CC)COCCCCOC 7a_100000703878_100000730899 [0,1,0,0,0,0|3,0,0]=4 1131 B12R0.57 CCC(CC)COCCCCSC 34a_100011217163_100011215472 [0,1,0,0,0,0|3,0,0]=4 1132 B12R0.57 CCC(CC)COCCCCSC 7a_100011217163_100011215472 [0,1,0,0,0,0|3,0,0]=4 1133 B12R0.57 CCC(CC)CSCCCCCF 62a_100000729378_100011215472 [0,1,0,0,0,0|3,0,0]=4 1134 B12R0.57 CCC(CC)CSCCCCCF 62a_100011215472_100000729378 [0,1,0,0,0,0|3,0,0]=4 1135 B12R0.57 CCC(CC)CSCCCCCO 62a_100000746330_100011215472 [0,1,0,0,0,0|3,0,0]=4 1136 B12R0.57 CCC(CC)CSCCCCCO 62a_100011215472_100000746330 [0,1,0,0,0,0|3,0,0]=4 1137 B12R0.57 CCC(CC)CSCCCCOC 62a_100000730899_100011215472 [0,1,0,0,0,0|3,0,0]=4 1138 B12R0.57 CCC(CC)CSCCCCOC 62a_100011215472_100000730899 [0,1,0,0,0,0|3,0,0]=4 1139 B12R0.57 CCC(CC)NCCCCCCF 2230a_100000199018_100015922095 [0,1,0,0,0,0|3,0,0]=4 1140 B12R0.57 CCC(CC)NCCCCCCO 2230a_100000199018_100000766143 [0,1,0,0,0,0|3,0,0]=4 1141 B12R0.57 CCC(CC)NCCCCCCO 270004a_100000686447_100000210860 [0,1,0,0,0,0|3,0,0]=4 1142 B12R0.57 CCC(CC)NCCCCCOC 270004a_100000747528_100000210860 [0,1,0,0,0,0|3,0,0]=4 1143 B12R0.57 CCC(CC)OCCCCCCBr 7a_100011215345_100000210505 [0,1,0,0,0,0|3,0,0]=4 1144 B12R0.57 CCC(CC)OCCCCCCCl 7a_100000766143_100000210505 [0,1,0,0,0,0|3,0,0]=4 1145 B12R0.57 CCC(CC)OCCCCCCF 7a_100000688536_100015922095 [0,1,0,0,0,0|3,0,0]=4 1146 B12R0.57 CCC(CC)OCCCCCCF 7a_100000732779_100000210505 [0,1,0,0,0,0|3,0,0]=4 1147 B12R0.57 CCC(CC)OCCCCCCO 7a_100000688536_100000766143 [0,1,0,0,0,0|3,0,0]=4 1148 B12R0.57 CCC(CC)SCCCCCCF 62a_100000210505_100015922095 [0,1,0,0,0,0|3,0,0]=4 1149 B12R0.57 CCC(CC)SCCCCCCF 62a_100015922095_100000210505 [0,1,0,0,0,0|3,0,0]=4 1150 B12R0.57 CCC(CC)SCCCCCCO 62a_100000210505_100000766143 [0,1,0,0,0,0|3,0,0]=4 1151 B12R0.57 CCC(CC)SCCCCCCO 62a_100000766143_100000210505 [0,1,0,0,0,0|3,0,0]=4 1152 B12R0.57 CCC(COCCCCC#N)OC 7a_100011934954_100000211819 [0,1,0,0,0,0|2,0,1]=4 1153 B12R0.57 CCC(COCCCCC=O)OC 7a_100011934954_100000139335 [0,1,0,0,0,0|2,0,1]=4 1154 B12R0.57 CCC(COCCCCCF)OC 34a_100011934954_100000729378 [0,1,0,0,0,0|2,0,0]=3 1155 B12R0.57 CCC(COCCCCCF)OC 7a_100011934954_100000729378 [0,1,0,0,0,0|2,0,0]=3 1156 B12R0.57 CCC(COCCCCCO)OC 34a_100011934954_100000746330 [0,1,0,0,0,0|2,0,0]=3 1157 B12R0.57 CCC(COCCCCCO)OC 7a_100011934954_100000746330 [0,1,0,0,0,0|2,0,0]=3 1158 B12R0.57 CCC(COCCCCOC)OC 34a_100011934954_100000755781 [0,1,0,0,0,0|2,0,0]=3 1159 B12R0.57 CCC(COCCCCOC)OC 7a_100011934954_100000730899 [0,1,0,0,0,0|2,0,0]=3 1160 B12R0.57 CCC(COCCOCCO)OC 34a_100011934954_100000692535 [0,1,0,0,0,0|3,0,0]=4 1161 B12R0.57 CCC(COCCOCCO)OC 7a_100011934954_100011215305 [0,1,0,0,0,0|3,0,0]=4 1162 B12R0.57 CCC/C=C/COCC(OC)OC 34a_100016278788_100000211822 [0,1,0,0,0,0|0,0,2]=3 1163 B12R0.57 CCC/C=C/COCC(OC)OC 7a_100016278788_100000751394 [0,1,0,0,0,0|0,0,2]=3 1164 B12R0.57 CCCC#CCOCC(OC)OC 34a_100000034806_100000211822 [0,1,0,0,0,0|0,0,2]=3 1165 B12R0.57 CCCC#CCOCC(OC)OC 7a_100000034806_100000751394 [0,1,0,0,0,0|0,0,2]=3 1166 B12R0.57 CCCCCCCCC(CC)NC 270004a_106832991635_200011217995 [0,1,0,0,0,0|2,0,0]=3 1167 B12R0.57 CCCCCCCCC(CC)OC 34a_200011216270_200000210301 [0,1,0,0,0,0|1,0,0]=2 1168 B12R0.57 CCCCCCCCC(CC)OC 7a_200011216270_200000210301 [0,1,0,0,0,0|1,0,0]=2 1169 B12R0.57 CCCCCCCCC(CC)O[13CH3] 34a_200011216270_200025704644 [0,1,0,0,0,0|1,0,0]=2 1170 B12R0.57 CCCCCCCCC(CC)O[13CH3] 7a_200011216270_200025704644 [0,1,0,0,0,0|1,0,0]=2 1171 B12R0.57 CCCCCCCCN(CC)CC 2230a_100000724800_100000210759 [0,1,0,0,0,0|3,0,0]=4 1172 B12R0.57 CCCCCCCCN(CC)CC 269956a_100000042499_100000210759 [0,1,0,0,0,0|3,0,0]=4 1173 B12R0.57 CCCCCCCCN(CC)CC 269982a_100000724800_100000210759 [0,1,0,0,0,0|3,0,0]=4 1174 B12R0.57 CCCCCCCNC(CC)CC 2230a_100000199018_100000210681 [0,1,0,0,0,0|2,0,0]=3 1175 B12R0.57 CCCCCCCNC(CC)CC 270004a_100000229938_100000210860 [0,1,0,0,0,0|2,0,0]=3 1176 B12R0.57 CCCCCCCN[C@@H](CC)CO 2230a_100000709445_100000210681 [0,1,0,0,0,0|3,0,0]=4 1177 B12R0.57 CCCCCCCOC(CC)CC 7a_100000210272_100000210505 [0,1,0,0,0,0|2,0,0]=3 1178 B12R0.57 CCCCCCCOC(CC)CC 7a_100000688536_100000210614 [0,1,0,0,0,0|2,0,0]=3 1179 B12R0.57 CCCCCCCSC(CC)CC 62a_100000210505_100000210316 [0,1,0,0,0,0|2,0,0]=3 1180 B12R0.57 CCCCCCCSC(CC)CC 62a_100000210614_100000210505 [0,1,0,0,0,0|2,0,0]=3 1181 B12R0.57 CCCCCCNCC(CC)CC 2230a_100000210581_100011215472 [0,1,0,0,0,0|2,0,0]=3 1182 B12R0.57 CCCCCCNCC(CC)CC 2230a_100102946423_100000210314 [0,1,0,0,0,0|2,0,0]=3 1183 B12R0.57 CCCCCCNCC(CC)CC 269862a_100000210581_100000211137 [0,1,0,0,0,0|2,0,0]=3 1184 B12R0.57 CCCCCCNCC(CC)CC 270004a_100000210581_100000211137 [0,1,0,0,0,0|2,0,0]=3 1185 B12R0.57 CCCCCCNCC(OC)OC 2230a_100000210581_100000751394 [0,1,0,0,0,0|0,0,0]=1 1186 B12R0.57 CCCCCCNCC(OC)OC 270004a_100000210581_100000752162 [0,1,0,0,0,0|0,0,0]=1 1187 B12R0.57 CCCCCCOCC(CC)CC 34a_100000210259_100011215472 [0,1,0,0,0,0|2,0,0]=3 1188 B12R0.57 CCCCCCOCC(CC)CC 7a_100000210259_100011215472 [0,1,0,0,0,0|2,0,0]=3 1189 B12R0.57 CCCCCCOCC(CC)CC 7a_100000703878_100000210314 [0,1,0,0,0,0|2,0,0]=3 1190 B12R0.57 CCCCCCOCC(CC)OC 34a_100011934954_100000210314 [0,1,0,0,0,0|1,0,0]=2 1191 B12R0.57 CCCCCCOCC(CC)OC 7a_100011934954_100000210314 [0,1,0,0,0,0|1,0,0]=2 1192 B12R0.57 CCCCCCOCC(OC)OC 34a_100000210259_100000211822 [0,1,0,0,0,0|0,0,0]=1 1193 B12R0.57 CCCCCCOCC(OC)OC 34a_100011216393_100000210314 [0,1,0,0,0,0|0,0,0]=1 1194 B12R0.57 CCCCCCOCC(OC)OC 7a_100000210259_100000751394 [0,1,0,0,0,0|0,0,0]=1 1195 B12R0.57 CCCCCCOCN(CC)CC 7a_200015374951_100000210314 [0,1,0,0,0,0|3,0,0]=4 1196 B12R0.57 CCCCCCSCC(CC)CC 62a_100000210314_100011215472 [0,1,0,0,0,0|2,0,0]=3 1197 B12R0.57 CCCCCCSCC(CC)CC 62a_100011215472_100000210757 [0,1,0,0,0,0|2,0,0]=3 1198 B12R0.57 CCCCCCSCC(OC)OC 62a_100000210314_100000751394 [0,1,0,0,0,0|0,0,0]=1 1199 B12R0.57 CCCCCCSCC(OC)OC 62a_100000751394_100000210757 [0,1,0,0,0,0|0,0,0]=1 1200 B12R0.57 CCCCCNCCC(OC)OC 2230a_100000209983_100009813347 [0,1,0,0,0,0|0,0,0]=1 1201 B12R0.57 CCCCCNCCN(CC)CC 2230a_100000209983_100000700428 [0,1,0,0,0,0|3,0,0]=4 1202 B12R0.57 CCCCCNCCN(CC)CC 2230a_100015382049_100000210326 [0,1,0,0,0,0|3,0,0]=4 1203 B12R0.57 CCCCCNN=CC(OC)OC 4a_100000694160_100000752162 [0,1,0,0,0,0|1,0,1]=3 1204 B12R0.57 CCCCCOCCC(OC)OC 34a_100000210253_100000139399 [0,1,0,0,0,0|0,0,0]=1 1205 B12R0.57 CCCCCOCCC(OC)OC 7a_100000210253_100009813347 [0,1,0,0,0,0|0,0,0]=1 1206 B12R0.57 CCCCCOCCN(CC)CC 7a_100000210253_100000700428 [0,1,0,0,0,0|3,0,0]=4 1207 B12R0.57 CCCCCOCCN(CC)CC 7a_100016990331_100000210326 [0,1,0,0,0,0|3,0,0]=4 1208 B12R0.57 CCCCCSCCC(OC)OC 62a_100000139399_100000210326 [0,1,0,0,0,0|0,0,0]=1 1209 B12R0.57 CCCCCSCCC(OC)OC 62a_100000210326_100000139399 [0,1,0,0,0,0|0,0,0]=1 1210 B12R0.57 CCCCCSCCN(CC)CC 62a_100000210326_100000700428 [0,1,0,0,0,0|3,0,0]=4 1211 B12R0.57 CCCCNCCCC(OC)OC 2230a_100000102301_100000069011 [0,1,0,0,0,0|0,0,0]=1 1212 B12R0.57 CCCCNCCCC(OC)OC 7a_106832991798_100000069011 [0,1,0,0,0,0|0,0,0]=1 1213 B12R0.57 CCCCNCCCN(CC)CC 2230a_100000102301_100000709985 [0,1,0,0,0,0|3,0,0]=4 1214 B12R0.57 CCCCNCCCN(CC)CC 7a_106832991798_100000709985 [0,1,0,0,0,0|3,0,0]=4 1215 B12R0.57 CCCCOCCCC(OC)OC 34a_100000210227_100000069011 [0,1,0,0,0,0|0,0,0]=1 1216 B12R0.57 CCCCOCCCC(OC)OC 7a_100000210227_100000069011 [0,1,0,0,0,0|0,0,0]=1 1217 B12R0.57 CCCCOCCCN(CC)CC 7a_100000210227_100000709985 [0,1,0,0,0,0|3,0,0]=4 1218 B12R0.57 CCCCOCCCN(CC)CC 7a_100000212844_100000210211 [0,1,0,0,0,0|3,0,0]=4 1219 B12R0.57 CCCCOCCNC(CC)CC 2230a_100000199018_100000743108 [0,1,0,0,0,0|3,0,0]=4 1220 B12R0.57 CCCCOCCOC(CC)CC 7a_100000210238_100000210505 [0,1,0,0,0,0|3,0,0]=4 1221 B12R0.57 CCCCOCCOC(CC)CC 7a_100000688536_100000743108 [0,1,0,0,0,0|3,0,0]=4 1222 B12R0.57 CCCCOCCSC(CC)CC 62a_100000210505_100000743108 [0,1,0,0,0,0|3,0,0]=4 1223 B12R0.57 CCCCOCCSC(CC)CC 62a_100000743108_100000210505 [0,1,0,0,0,0|3,0,0]=4 1224 B12R0.57 CCCCOCNCC(CC)CC 2230a_100102946423_100011995733 [0,1,0,0,0,0|3,0,0]=4 1225 B12R0.57 CCCCOCOCC(CC)OC 34a_100011934954_100011995733 [0,1,0,0,0,0|2,0,0]=3 1226 B12R0.57 CCCCOCOCC(OC)OC 34a_100011216393_100011995733 [0,1,0,0,0,0|1,0,0]=2 1227 B12R0.57 CCCCOCSCC(CC)CC 62a_100011215472_100011995733 [0,1,0,0,0,0|3,0,0]=4 1228 B12R0.57 CCCCOCSCC(CC)CC 62a_100011995733_100011215472 [0,1,0,0,0,0|3,0,0]=4 1229 B12R0.57 CCCCOCSCC(OC)OC 62a_100000751394_100011995733 [0,1,0,0,0,0|1,0,0]=2 1230 B12R0.57 CCCCOCSCC(OC)OC 62a_100011995733_100000751394 [0,1,0,0,0,0|1,0,0]=2 1231 B12R0.57 CCCCSCCCC(OC)OC 62a_100000069011_100000210210 [0,1,0,0,0,0|0,0,0]=1 1232 B12R0.57 CCCCSCCCC(OC)OC 62a_100000210211_100000069011 [0,1,0,0,0,0|0,0,0]=1 1233 B12R0.57 CCCCSCCCN(CC)CC 62a_100000210211_100000709985 [0,1,0,0,0,0|3,0,0]=4 1234 B12R0.57 CCCCSCCNC(CC)CC 270004a_100025743550_100000210860 [0,1,0,0,0,0|3,0,0]=4 1235 B12R0.57 CCCCSCCOC(CC)CC 7a_200000230436_100000210505 [0,1,0,0,0,0|3,0,0]=4 1236 B12R0.57 CCCNCCCCN(CC)CC 2230a_100000743895_100000210303 [0,1,0,0,0,0|3,0,0]=4 1237 B12R0.57 CCCOCCCCN(CC)CC 7a_100011305530_100000210303 [0,1,0,0,0,0|3,0,0]=4 1238 B12R0.57 CCCOCCCNC(CC)CC 270004a_100011217757_100000210860 [0,1,0,0,0,0|3,0,0]=4 1239 B12R0.57 CCCOCCNCC(CC)CC 2230a_100102946423_100011215938 [0,1,0,0,0,0|3,0,0]=4 1240 B12R0.57 CCCOCCNCC(CC)CC 2230a_100161115042_100011215472 [0,1,0,0,0,0|3,0,0]=4 1241 B12R0.57 CCCOCCNCC(CC)CC 269862a_100161115042_100000211137 [0,1,0,0,0,0|3,0,0]=4 1242 B12R0.57 CCCOCCNCC(CC)CC 270004a_100161115042_100000211137 [0,1,0,0,0,0|3,0,0]=4 1243 B12R0.57 CCCOCCNCC(CC)CC 34a_100161115042_100011215472 [0,1,0,0,0,0|3,0,0]=4 1244 B12R0.57 CCCOCCNCC(OC)OC 2230a_100161115042_100000751394 [0,1,0,0,0,0|1,0,0]=2 1245 B12R0.57 CCCOCCNCC(OC)OC 270004a_100161115042_100000752162 [0,1,0,0,0,0|1,0,0]=2 1246 B12R0.57 CCCOCCNCC(OC)OC 34a_100161115042_100000211822 [0,1,0,0,0,0|1,0,0]=2 1247 B12R0.57 CCCOCCOCC(CC)CC 34a_100000752267_100011215472 [0,1,0,0,0,0|3,0,0]=4 1248 B12R0.57 CCCOCCOCC(CC)CC 7a_100000703878_100011215938 [0,1,0,0,0,0|3,0,0]=4 1249 B12R0.57 CCCOCCOCC(CC)CC 7a_100000752267_100011215472 [0,1,0,0,0,0|3,0,0]=4 1250 B12R0.57 CCCOCCOCC(CC)OC 34a_100011934954_100011215938 [0,1,0,0,0,0|2,0,0]=3 1251 B12R0.57 CCCOCCOCC(CC)OC 7a_100011934954_100011215938 [0,1,0,0,0,0|2,0,0]=3 1252 B12R0.57 CCCOCCOCC(OC)OC 34a_100000752267_100000211822 [0,1,0,0,0,0|1,0,0]=2 1253 B12R0.57 CCCOCCOCC(OC)OC 34a_100011216393_100011215938 [0,1,0,0,0,0|1,0,0]=2 1254 B12R0.57 CCCOCCOCC(OC)OC 7a_100000752267_100000751394 [0,1,0,0,0,0|1,0,0]=2 1255 B12R0.57 CCCOCCSCC(CC)CC 62a_100011215472_100011215938 [0,1,0,0,0,0|3,0,0]=4 1256 B12R0.57 CCCOCCSCC(CC)CC 62a_100011215938_100011215472 [0,1,0,0,0,0|3,0,0]=4 1257 B12R0.57 CCCOCCSCC(OC)OC 62a_100000751394_100011215938 [0,1,0,0,0,0|1,0,0]=2 1258 B12R0.57 CCCOCCSCC(OC)OC 62a_100011215938_100000751394 [0,1,0,0,0,0|1,0,0]=2 1259 B12R0.57 CCCSCCNCC(CC)CC 2230a_100020603323_100011215472 [0,1,0,0,0,0|3,0,0]=4 1260 B12R0.57 CCCSCCNCC(CC)CC 269862a_100020603323_100000211137 [0,1,0,0,0,0|3,0,0]=4 1261 B12R0.57 CCCSCCNCC(CC)CC 270004a_100020603323_100000211137 [0,1,0,0,0,0|3,0,0]=4 1262 B12R0.57 CCCSCCNCC(OC)OC 2230a_100020603323_100000751394 [0,1,0,0,0,0|1,0,0]=2 1263 B12R0.57 CCCSCCNCC(OC)OC 270004a_100020603323_100000752162 [0,1,0,0,0,0|1,0,0]=2 1264 B12R0.57 CCCSCCOCC(CC)CC 34a_200000230433_100011215472 [0,1,0,0,0,0|3,0,0]=4 1265 B12R0.57 CCCSCCOCC(CC)CC 7a_200000230433_100011215472 [0,1,0,0,0,0|3,0,0]=4 1266 B12R0.57 CCCSCCOCC(OC)OC 34a_200000230433_100000211822 [0,1,0,0,0,0|1,0,0]=2 1267 B12R0.57 CCCSCCOCC(OC)OC 7a_200000230433_100000751394 [0,1,0,0,0,0|1,0,0]=2 1268 B12R0.57 CCN(CC)CCCCCCCO 2230a_100000724800_100000760002 [0,1,0,0,0,0|3,0,0]=4 1269 B12R0.57 CCN(CC)CCCCCCCO 269956a_100000042499_100000760002 [0,1,0,0,0,0|3,0,0]=4 1270 B12R0.57 CCN(CC)CCCCCCCO 269982a_100000724800_100000760002 [0,1,0,0,0,0|3,0,0]=4 1271 B12R0.57 CCN(CC)CCCCCCOC 2230a_100000724800_100011998445 [0,1,0,0,0,0|3,0,0]=4 1272 B12R0.57 CCN(CC)CCCCCCOC 269956a_100000042499_100011998445 [0,1,0,0,0,0|3,0,0]=4 1273 B12R0.57 CCN(CC)CCCCCCOC 269982a_100000724800_100011998445 [0,1,0,0,0,0|3,0,0]=4 1274 B12R0.57 CCN(CC)CCCCCCOC 7a_100011632896_200000210301 [0,1,0,0,0,0|3,0,0]=4 1275 B12R0.57 CCN(CC)CCCCCCO[13CH3] 7a_100011632896_200025704644 [0,1,0,0,0,0|3,0,0]=4 1276 B12R0.57 CCNCCCCCN(CC)CC 2230a_100011491781_100000210202 [0,1,0,0,0,0|3,0,0]=4 1277 B12R0.57 CCOCCCCCN(CC)CC 7a_200011629222_100000210202 [0,1,0,0,0,0|3,0,0]=4 1278 B12R0.57 CCOCCCNCC(CC)CC 2230a_100000210961_100011215472 [0,1,0,0,0,0|3,0,0]=4 1279 B12R0.57 CCOCCCNCC(CC)CC 2230a_100102946423_100012232248 [0,1,0,0,0,0|3,0,0]=4 1280 B12R0.57 CCOCCCNCC(CC)CC 269862a_100000210961_100000211137 [0,1,0,0,0,0|3,0,0]=4 1281 B12R0.57 CCOCCCNCC(CC)CC 270004a_100000210961_100000211137 [0,1,0,0,0,0|3,0,0]=4 1282 B12R0.57 CCOCCCNCC(CC)CC 34a_100000210961_100011215472 [0,1,0,0,0,0|3,0,0]=4 1283 B12R0.57 CCOCCCNCC(OC)OC 2230a_100000210961_100000751394 [0,1,0,0,0,0|1,0,0]=2 1284 B12R0.57 CCOCCCNCC(OC)OC 270004a_100000210961_100000752162 [0,1,0,0,0,0|1,0,0]=2 1285 B12R0.57 CCOCCCNCC(OC)OC 34a_100000210961_100000211822 [0,1,0,0,0,0|1,0,0]=2 1286 B12R0.57 CCOCCCOCC(CC)CC 34a_100000757476_100011215472 [0,1,0,0,0,0|3,0,0]=4 1287 B12R0.57 CCOCCCOCC(CC)CC 7a_100000703878_100012232248 [0,1,0,0,0,0|3,0,0]=4 1288 B12R0.57 CCOCCCOCC(CC)CC 7a_100000757476_100011215472 [0,1,0,0,0,0|3,0,0]=4 1289 B12R0.57 CCOCCCOCC(CC)OC 34a_100011934954_100012232248 [0,1,0,0,0,0|2,0,0]=3 1290 B12R0.57 CCOCCCOCC(CC)OC 7a_100011934954_100012232248 [0,1,0,0,0,0|2,0,0]=3 1291 B12R0.57 CCOCCCOCC(OC)OC 34a_100000757476_100000211822 [0,1,0,0,0,0|1,0,0]=2 1292 B12R0.57 CCOCCCOCC(OC)OC 34a_100011216393_100012232248 [0,1,0,0,0,0|1,0,0]=2 1293 B12R0.57 CCOCCCOCC(OC)OC 7a_100000757476_100000751394 [0,1,0,0,0,0|1,0,0]=2 1294 B12R0.57 CCOCCCSCC(CC)CC 62a_100011215472_100012232248 [0,1,0,0,0,0|3,0,0]=4 1295 B12R0.57 CCOCCCSCC(CC)CC 62a_100012232248_100011215472 [0,1,0,0,0,0|3,0,0]=4 1296 B12R0.57 CCOCCCSCC(OC)OC 62a_100000751394_100012232248 [0,1,0,0,0,0|1,0,0]=2 1297 B12R0.57 CCOCCCSCC(OC)OC 62a_100012232248_100000751394 [0,1,0,0,0,0|1,0,0]=2 1298 B12R0.57 CCOCCNCCC(OC)OC 2230a_102516460346_100009813347 [0,1,0,0,0,0|1,0,0]=2 1299 B12R0.57 CCOCCNCCC(OC)OC 34a_102516460346_100000139399 [0,1,0,0,0,0|1,0,0]=2 1300 B12R0.57 CCOCCNN=CC(OC)OC 4a_100000732670_100000752162 [0,1,0,0,0,0|2,0,1]=4 1301 B12R0.57 CCOCCOCCC(OC)OC 34a_100000210136_100000139399 [0,1,0,0,0,0|1,0,0]=2 1302 B12R0.57 CCOCCOCCC(OC)OC 7a_100000210136_100009813347 [0,1,0,0,0,0|1,0,0]=2 1303 B12R0.57 CCOCCSCCC(OC)OC 62a_100000139399_100011215890 [0,1,0,0,0,0|1,0,0]=2 1304 B12R0.57 CCOCCSCCC(OC)OC 62a_100000210147_100000139399 [0,1,0,0,0,0|1,0,0]=2 1305 B12R0.57 CCOCSCCCC(OC)OC 62a_100000069011_100000739092 [0,1,0,0,0,0|1,0,0]=2 1306 B12R0.57 CCOCSCCCC(OC)OC 62a_100000739092_100000069011 [0,1,0,0,0,0|1,0,0]=2 1307 B12R0.57 CCSCCCOCC(CC)CC 34a_100011216438_100011215472 [0,1,0,0,0,0|3,0,0]=4 1308 B12R0.57 CCSCCCOCC(CC)CC 7a_100011216438_100011215472 [0,1,0,0,0,0|3,0,0]=4 1309 B12R0.57 CCSCCCOCC(OC)OC 34a_100011216438_100000211822 [0,1,0,0,0,0|1,0,0]=2 1310 B12R0.57 CCSCCCOCC(OC)OC 7a_100011216438_100000751394 [0,1,0,0,0,0|1,0,0]=2 1311 B12R0.57 CCSCCNCCC(OC)OC 2230a_100000106463_100009813347 [0,1,0,0,0,0|1,0,0]=2 1312 B12R0.57 CCSCCOCCC(OC)OC 34a_100000212035_100000139399 [0,1,0,0,0,0|1,0,0]=2 1313 B12R0.57 CCSCCOCCC(OC)OC 7a_100000212035_100009813347 [0,1,0,0,0,0|1,0,0]=2 1314 B12R0.57 CCSCCSCCC(OC)OC 62a_100000139399_100000757381 [0,1,0,0,0,0|1,0,0]=2 1315 B12R0.57 CCSCCSCCC(OC)OC 62a_100000757381_100000139399 [0,1,0,0,0,0|1,0,0]=2 1316 B12R0.57 CNCCCOCCC(OC)OC 34a_100000213112_100000139399 [0,1,0,0,0,0|1,0,0]=2 1317 B12R0.57 COC(CCCNCCCF)OC 2230a_100015189416_100000069011 [0,1,0,0,0,0|1,0,0]=2 1318 B12R0.57 COC(CCCNCCCF)OC 34a_100015189416_100000069011 [0,1,0,0,0,0|1,0,0]=2 1319 B12R0.57 COC(CCCNCCSC)OC 2230a_100020590264_100000069011 [0,1,0,0,0,0|1,0,0]=2 1320 B12R0.57 COC(CCCOCCCBr)OC 34a_100011217188_100000069011 [0,1,0,0,0,0|1,0,0]=2 1321 B12R0.57 COC(CCCOCCCCl)OC 34a_100000230001_100000069011 [0,1,0,0,0,0|1,0,0]=2 1322 B12R0.57 COC(CCCOCCCF)OC 34a_100000759539_100000069011 [0,1,0,0,0,0|1,0,0]=2 1323 B12R0.57 COC(CCCOCCCN)OC 34a_100000182051_100000069011 [0,1,0,0,0,0|1,0,0]=2 1324 B12R0.57 COC(CCCOCCON)OC 34a_100000700252_100000069011 [0,1,0,0,0,0|2,0,0]=3 1325 B12R0.57 COC(CCCOCCSC)OC 34a_100000230434_100000069011 [0,1,0,0,0,0|1,0,0]=2 1326 B12R0.57 COC(CCCOCCSC)OC 7a_100000230434_100000069011 [0,1,0,0,0,0|1,0,0]=2 1327 B12R0.57 COC(CCCSCCC#N)OC 62a_100000069011_100011215226 [0,1,0,0,0,0|1,0,1]=3 1328 B12R0.57 COC(CCCSCCC#N)OC 62a_100011215226_100000069011 [0,1,0,0,0,0|1,0,1]=3 1329 B12R0.57 COC(CCCSCCCF)OC 62a_100000069011_100011934791 [0,1,0,0,0,0|1,0,0]=2 1330 B12R0.57 COC(CCCSCCCF)OC 62a_100011934791_100000069011 [0,1,0,0,0,0|1,0,0]=2 1331 B12R0.57 COC(CCCSCCCO)OC 62a_100000069011_100011215043 [0,1,0,0,0,0|1,0,0]=2 1332 B12R0.57 COC(CCCSCCCO)OC 62a_100011215043_100000069011 [0,1,0,0,0,0|1,0,0]=2 1333 B12R0.57 COC(CCCSCCSC)OC 62a_100000069011_100000751147 [0,1,0,0,0,0|1,0,0]=2 1334 B12R0.57 COC(CCCSCCSC)OC 62a_100000212216_100000069011 [0,1,0,0,0,0|1,0,0]=2 1335 B12R0.57 COC(CCCSCSC#N)OC 62a_100000069011_100000211825 [0,1,0,0,0,0|2,0,1]=4 1336 B12R0.57 COC(CCCSCSC#N)OC 62a_100000211825_100000069011 [0,1,0,0,0,0|2,0,1]=4 1337 B12R0.57 COC(CCNCCCCO)OC 2230a_100000750430_100009813347 [0,1,0,0,0,0|1,0,0]=2 1338 B12R0.57 COC(CCNCCCCO)OC 34a_100000750430_100000139399 [0,1,0,0,0,0|1,0,0]=2 1339 B12R0.57 COC(CCNCCCSC)OC 2230a_100000749238_100009813347 [0,1,0,0,0,0|1,0,0]=2 1340 B12R0.57 COC(CCOCC#CCCl)OC 34a_200000047223_100000139399 [0,1,0,0,0,0|1,0,2]=4 1341 B12R0.57 COC(CCOCCCCBr)OC 34a_100011216708_100000139399 [0,1,0,0,0,0|1,0,0]=2 1342 B12R0.57 COC(CCOCCCCCl)OC 34a_100000210776_100000139399 [0,1,0,0,0,0|1,0,0]=2 1343 B12R0.57 COC(CCOCCCCCl)OC 7a_100000210776_100009813347 [0,1,0,0,0,0|1,0,0]=2 1344 B12R0.57 COC(CCOCCCCF)OC 34a_100011995726_100000139399 [0,1,0,0,0,0|1,0,0]=2 1345 B12R0.57 COC(CCOCCCCF)OC 7a_100011995726_100009813347 [0,1,0,0,0,0|1,0,0]=2 1346 B12R0.57 COC(CCOCCCCI)OC 34a_200012148704_100000139399 [0,1,0,0,0,0|1,0,0]=2 1347 B12R0.57 COC(CCOCCCCN)OC 34a_100000750430_100000139399 [0,1,0,0,0,0|1,0,0]=2 1348 B12R0.57 COC(CCOCCCSC)OC 34a_100000690336_100000139399 [0,1,0,0,0,0|1,0,0]=2 1349 B12R0.57 COC(CCOCCCSC)OC 7a_100000690336_100009813347 [0,1,0,0,0,0|1,0,0]=2 1350 B12R0.57 COC(CCSCC#CCO)OC 62a_100000139399_200000047223 [0,1,0,0,0,0|1,0,2]=4 1351 B12R0.57 COC(CCSCC#CCO)OC 62a_200000047223_100000139399 [0,1,0,0,0,0|1,0,2]=4 1352 B12R0.57 COC(CCSCCCC#N)OC 62a_100000139399_100000687738 [0,1,0,0,0,0|1,0,1]=3 1353 B12R0.57 COC(CCSCCCC#N)OC 62a_100000687738_100000139399 [0,1,0,0,0,0|1,0,1]=3 1354 B12R0.57 COC(CCSCCCC=O)OC 62a_100000139399_200011292268 [0,1,0,0,0,0|1,0,1]=3 1355 B12R0.57 COC(CCSCCCC=O)OC 62a_200011292268_100000139399 [0,1,0,0,0,0|1,0,1]=3 1356 B12R0.57 COC(CCSCCCCF)OC 62a_100000139399_100000729493 [0,1,0,0,0,0|1,0,0]=2 1357 B12R0.57 COC(CCSCCCCF)OC 62a_100000729493_100000139399 [0,1,0,0,0,0|1,0,0]=2 1358 B12R0.57 COC(CCSCCCCO)OC 62a_100000139399_100000210776 [0,1,0,0,0,0|1,0,0]=2 1359 B12R0.57 COC(CCSCCCCO)OC 62a_100000210776_100000139399 [0,1,0,0,0,0|1,0,0]=2 1360 B12R0.57 COC(CCSCCSC#N)OC 62a_100000034367_100000139399 [0,1,0,0,0,0|2,0,1]=4 1361 B12R0.57 COC(CCSCCSC#N)OC 62a_100000139399_100000034367 [0,1,0,0,0,0|2,0,1]=4 1362 B12R0.57 COC(CNCCCCC#N)OC 270004a_100000751965_100000752162 [0,1,0,0,0,0|1,0,1]=3 1363 B12R0.57 COC(CNCCCCCO)OC 2230a_100000762737_100000751394 [0,1,0,0,0,0|1,0,0]=2 1364 B12R0.57 COC(CNCCCCCO)OC 270004a_100000762737_100000752162 [0,1,0,0,0,0|1,0,0]=2 1365 B12R0.57 COC(CNCCCCCO)OC 34a_100000762737_100000211822 [0,1,0,0,0,0|1,0,0]=2 1366 B12R0.57 COC(CNCCCN=[N+]=[N-])OC 2230a_100000744732_100000751394 [0,1,0,0,0,0|3,0,0]=4 1367 B12R0.57 COC(CNCCCN=[N+]=[N-])OC 270004a_100000744732_100000752162 [0,1,0,0,0,0|3,0,0]=4 1368 B12R0.57 COC(CNCCOCCO)OC 2230a_100000211614_100000751394 [0,1,0,0,0,0|2,0,0]=3 1369 B12R0.57 COC(CNCCOCCO)OC 270004a_100000211614_100000752162 [0,1,0,0,0,0|2,0,0]=3 1370 B12R0.57 COC(CNCCOCCO)OC 34a_100000211614_100000211822 [0,1,0,0,0,0|2,0,0]=3 1371 B12R0.57 COC(CNCCSCCO)OC 2230a_100011219999_100000751394 [0,1,0,0,0,0|2,0,0]=3 1372 B12R0.57 COC(CNCCSCCO)OC 270004a_100011219999_100000752162 [0,1,0,0,0,0|2,0,0]=3 1373 B12R0.57 COC(COCCCCCBr)OC 34a_100000746331_100000211822 [0,1,0,0,0,0|1,0,0]=2 1374 B12R0.57 COC(COCCCCCBr)OC 7a_100000746331_100000751394 [0,1,0,0,0,0|1,0,0]=2 1375 B12R0.57 COC(COCCCCCCl)OC 34a_100000746330_100000211822 [0,1,0,0,0,0|1,0,0]=2 1376 B12R0.57 COC(COCCCCCCl)OC 7a_100000746330_100000751394 [0,1,0,0,0,0|1,0,0]=2 1377 B12R0.57 COC(COCCCCCF)OC 34a_100011216393_100000729378 [0,1,0,0,0,0|1,0,0]=2 1378 B12R0.57 COC(COCCCCCI)OC 34a_200012148887_100000211822 [0,1,0,0,0,0|1,0,0]=2 1379 B12R0.57 COC(COCCCCCI)OC 7a_200012148887_100000751394 [0,1,0,0,0,0|1,0,0]=2 1380 B12R0.57 COC(COCCCCCN)OC 34a_100000762737_100000211822 [0,1,0,0,0,0|1,0,0]=2 1381 B12R0.57 COC(COCCCCCO)OC 34a_100011216393_100000746330 [0,1,0,0,0,0|1,0,0]=2 1382 B12R0.57 COC(COCCCCSC)OC 34a_100011217163_100000211822 [0,1,0,0,0,0|1,0,0]=2 1383 B12R0.57 COC(COCCCCSC)OC 7a_100011217163_100000751394 [0,1,0,0,0,0|1,0,0]=2 1384 B12R0.57 COC(COCCOCCBr)OC 34a_100000692535_100000211822 [0,1,0,0,0,0|2,0,0]=3 1385 B12R0.57 COC(COCCOCCBr)OC 7a_100000692535_100000751394 [0,1,0,0,0,0|2,0,0]=3 1386 B12R0.57 COC(COCCOCCCl)OC 34a_100011215305_100000211822 [0,1,0,0,0,0|2,0,0]=3 1387 B12R0.57 COC(COCCOCCCl)OC 7a_100011215305_100000751394 [0,1,0,0,0,0|2,0,0]=3 1388 B12R0.57 COC(COCCOCCF)OC 34a_200015357709_100000211822 [0,1,0,0,0,0|2,0,0]=3 1389 B12R0.57 COC(COCCOCCF)OC 7a_200015357709_100000751394 [0,1,0,0,0,0|2,0,0]=3 1390 B12R0.57 COC(COCCOCCI)OC 34a_100012149058_100000211822 [0,1,0,0,0,0|2,0,0]=3 1391 B12R0.57 COC(COCCOCCI)OC 7a_100012149058_100000751394 [0,1,0,0,0,0|2,0,0]=3 1392 B12R0.57 COC(COCCOCCN)OC 34a_100000211614_100000211822 [0,1,0,0,0,0|2,0,0]=3 1393 B12R0.57 COC(COCCOCCO)OC 34a_100011216393_100000692535 [0,1,0,0,0,0|2,0,0]=3 1394 B12R0.57 COC(CSCCCCC#N)OC 62a_100000751394_100000211819 [0,1,0,0,0,0|1,0,1]=3 1395 B12R0.57 COC(CSCCCCC#N)OC 62a_100011219923_100000751394 [0,1,0,0,0,0|1,0,1]=3 1396 B12R0.57 COC(CSCCCCC=O)OC 62a_100000139335_100000751394 [0,1,0,0,0,0|1,0,1]=3 1397 B12R0.57 COC(CSCCCCC=O)OC 62a_100000751394_100000139335 [0,1,0,0,0,0|1,0,1]=3 1398 B12R0.57 COC(CSCCCCCF)OC 62a_100000729378_100000751394 [0,1,0,0,0,0|1,0,0]=2 1399 B12R0.57 COC(CSCCCCCF)OC 62a_100000751394_100000729378 [0,1,0,0,0,0|1,0,0]=2 1400 B12R0.57 COC(CSCCCCCO)OC 62a_100000746330_100000751394 [0,1,0,0,0,0|1,0,0]=2 1401 B12R0.57 COC(CSCCCCCO)OC 62a_100000751394_100000746330 [0,1,0,0,0,0|1,0,0]=2 1402 B12R0.57 COC(CSCCOCC#N)OC 62a_100000751394_200000047693 [0,1,0,0,0,0|2,0,1]=4 1403 B12R0.57 COC(CSCCOCC#N)OC 62a_200000047693_100000751394 [0,1,0,0,0,0|2,0,1]=4 1404 B12R0.57 COC(CSCCOCCO)OC 62a_100000751394_100011215305 [0,1,0,0,0,0|2,0,0]=3 1405 B12R0.57 COC(CSCCOCCO)OC 62a_100011215305_100000751394 [0,1,0,0,0,0|2,0,0]=3 1406 B12R0.57 COCCCCOCC(OC)OC 34a_100000740925_100000211822 [0,1,0,0,0,0|1,0,0]=2 1407 B12R0.57 COCCCCOCC(OC)OC 34a_100011216393_100000755781 [0,1,0,0,0,0|1,0,0]=2 1408 B12R0.57 COCCCCSCC(OC)OC 62a_100000730899_100000751394 [0,1,0,0,0,0|1,0,0]=2 1409 B12R0.57 COCCCCSCC(OC)OC 62a_100000751394_100000730899 [0,1,0,0,0,0|1,0,0]=2 1410 B12R0.57 COCCCNCCC(OC)OC 34a_100150723488_100000139399 [0,1,0,0,0,0|1,0,0]=2 1411 B12R0.57 COCCCOCCC(OC)OC 34a_100000740835_100000139399 [0,1,0,0,0,0|1,0,0]=2 1412 B12R0.57 COCCCSCCC(OC)OC 62a_100000139399_100000709357 [0,1,0,0,0,0|1,0,0]=2 1413 B12R0.57 COCCCSCCC(OC)OC 62a_100000709357_100000139399 [0,1,0,0,0,0|1,0,0]=2 1414 B12R0.57 COCCNCCCC(OC)OC 2230a_100000209980_100000069011 [0,1,0,0,0,0|1,0,0]=2 1415 B12R0.57 COCCOCCCC(OC)OC 34a_100000210237_100000069011 [0,1,0,0,0,0|1,0,0]=2 1416 B12R0.57 COCCOCSCC(OC)OC 62a_100000231047_100000751394 [0,1,0,0,0,0|2,0,0]=3 1417 B12R0.57 COCCOCSCC(OC)OC 62a_100000751394_100000231047 [0,1,0,0,0,0|2,0,0]=3 1418 B12R0.57 COCCSCCCC(OC)OC 62a_100000069011_100000233755 [0,1,0,0,0,0|1,0,0]=2 1419 B12R0.57 COCCSCCCC(OC)OC 62a_100000233755_100000069011 [0,1,0,0,0,0|1,0,0]=2 1420 B12R0.116 C#CCCCCC(=O)C(OC)OC 1458a_100000046285_100010269958 [0,1,0,0,0,0|0,0,3]=4 1421 B12R0.116 C#CCCCNC(C)C(OC)OC 270004a_100000718082_100000211384 [0,1,0,0,0,0|1,0,2]=4 1422 B12R0.116 C#CCCCNC(C)C(OC)OC 34a_100000718082_100011222894 [0,1,0,0,0,0|1,0,2]=4 1423 B12R0.116 C#CCCCOC(C)C(OC)OC 34a_100000215630_100011222894 [0,1,0,0,0,0|1,0,2]=4 1424 B12R0.116 C#CCCCOC(C)C(OC)OC 34a_100000754440_100000695029 [0,1,0,0,0,0|1,0,2]=4 1425 B12R0.116 C#CCCCOC(C)C(OC)OC 7a_100000754440_100011215417 [0,1,0,0,0,0|1,0,2]=4 1426 B12R0.116 C#CCCCSC(C)C(OC)OC 62a_100011215417_100011222894 [0,1,0,0,0,0|1,0,2]=4 1427 B12R0.116 C#CCCCSC(C)C(OC)OC 62a_100011222894_100011215417 [0,1,0,0,0,0|1,0,2]=4 1428 B12R0.116 C/C=C/CCOC(C)C(OC)OC 34a_100016278192_100011222894 [0,1,0,0,0,0|1,0,2]=4 1429 B12R0.116 C=CCCCCC(=O)C(OC)OC 1458a_100000046285_100011215482 [0,1,0,0,0,0|0,0,3]=4 1430 B12R0.116 C=CCCCNC(C)C(OC)OC 270004a_100000700776_100000211384 [0,1,0,0,0,0|1,0,2]=4 1431 B12R0.116 C=CCCCNC(C)C(OC)OC 34a_100000700776_100011222894 [0,1,0,0,0,0|1,0,2]=4 1432 B12R0.116 C=CCCCOC(C)C(OC)OC 34a_100000754440_100000757094 [0,1,0,0,0,0|1,0,2]=4 1433 B12R0.116 C=CCCCOC(C)C(OC)OC 34a_100000758997_100011222894 [0,1,0,0,0,0|1,0,2]=4 1434 B12R0.116 C=CCCCOC(C)C(OC)OC 7a_100000754440_100000757094 [0,1,0,0,0,0|1,0,2]=4 1435 B12R0.116 C=CCCCSC(C)C(OC)OC 62a_100011222894_100000757094 [0,1,0,0,0,0|1,0,2]=4 1436 B12R0.116 C=CCCCSC(C)C(OC)OC 62a_100011713584_100011222894 [0,1,0,0,0,0|1,0,2]=4 1437 B12R0.116 CC#CCCOC(C)C(OC)OC 34a_100000750427_100011222894 [0,1,0,0,0,0|1,0,2]=4 1438 B12R0.116 CC/C=C\CCC(=O)C(OC)OC 1458a_100000046285_100015370543 [0,1,0,0,0,0|0,0,3]=4 1439 B12R0.116 CC/C=C\COC(C)C(OC)OC 34a_100000754440_100103147603 [0,1,0,0,0,0|1,0,2]=4 1440 B12R0.116 CC/C=C\COC(C)C(OC)OC 34a_100016268518_100011222894 [0,1,0,0,0,0|1,0,2]=4 1441 B12R0.116 CC/C=C\COC(C)C(OC)OC 7a_100000754440_100103147603 [0,1,0,0,0,0|1,0,2]=4 1442 B12R0.116 CC/C=C\CSC(C)C(OC)OC 62a_100011222894_100103147603 [0,1,0,0,0,0|1,0,2]=4 1443 B12R0.116 CC/C=C\CSC(C)C(OC)OC 62a_100103147603_100011222894 [0,1,0,0,0,0|1,0,2]=4 1444 B12R0.116 CCC#CCOC(C)C(OC)OC 34a_100000032950_100011222894 [0,1,0,0,0,0|1,0,2]=4 1445 B12R0.116 CCC#CCOC(C)C(OC)OC 34a_100000754440_100009813939 [0,1,0,0,0,0|1,0,2]=4 1446 B12R0.116 CCC#CCOC(C)C(OC)OC 7a_100000754440_100009813939 [0,1,0,0,0,0|1,0,2]=4 1447 B12R0.116 CCC#CCSC(C)C(OC)OC 62a_100009813939_100011222894 [0,1,0,0,0,0|1,0,2]=4 1448 B12R0.116 CCC#CCSC(C)C(OC)OC 62a_100011222894_100009813939 [0,1,0,0,0,0|1,0,2]=4 1449 B12R0.116 CCC(OC)C(=O)CCCCCF 1458a_100000747056_100000729378 [0,1,0,0,0,0|2,0,1]=4 1450 B12R0.116 CCC(OC)C(=O)CCCCCO 1458a_100000747056_100000746330 [0,1,0,0,0,0|2,0,1]=4 1451 B12R0.116 CCC(OC)C(=O)CCCCOC 1458a_100000747056_100000755781 [0,1,0,0,0,0|2,0,1]=4 1452 B12R0.116 CCCCCCC(=O)C(CC)CC 1458a_100000211163_100000210757 [0,1,0,0,0,0|2,0,1]=4 1453 B12R0.116 CCCCCCC(=O)C(CC)CC 1458a_100102632555_100000210505 [0,1,0,0,0,0|2,0,1]=4 1454 B12R0.116 CCCCCCC(=O)C(CC)OC 1458a_100000747056_100000210757 [0,1,0,0,0,0|1,0,1]=3 1455 B12R0.116 CCCCCCC(=O)C(OC)OC 1458a_100000046285_100000210757 [0,1,0,0,0,0|0,0,1]=2 1456 B12R0.116 CCCCCCC(C)N(CC)CC 2230a_100000724800_100011215978 [0,1,0,0,0,0|3,0,0]=4 1457 B12R0.116 CCCCCCC(C)N(CC)CC 269956a_100000042499_100011215978 [0,1,0,0,0,0|3,0,0]=4 1458 B12R0.116 CCCCCCC(C)N(CC)CC 269982a_100000724800_100011215978 [0,1,0,0,0,0|3,0,0]=4 1459 B12R0.116 CCCCCCC(C)N(CC)CC 270004a_100000724800_100000210826 [0,1,0,0,0,0|3,0,0]=4 1460 B12R0.116 CCCCCCN(C)C(CC)CC 2230a_100000737045_100000210314 [0,1,0,0,0,0|3,0,0]=4 1461 B12R0.116 CCCCCCN(C)C(CC)CC 269982a_100000737045_100000210757 [0,1,0,0,0,0|3,0,0]=4 1462 B12R0.116 CCCCCCN(C)C(CC)CC 269982a_106256046315_100000210505 [0,1,0,0,0,0|3,0,0]=4 1463 B12R0.116 CCCCCCN(C)C(CC)CC 270004a_106256046315_100000210860 [0,1,0,0,0,0|3,0,0]=4 1464 B12R0.116 CCCCCNC(=O)C(CC)OC 11a_100000209983_100000747056 [0,1,0,0,0,0|2,0,1]=4 1465 B12R0.116 CCCCCNC(=O)C(CC)OC 1626a_100000209983_100000747056 [0,1,0,0,0,0|2,0,1]=4 1466 B12R0.116 CCCCCNC(=O)C(CC)OC 240690a_100000209983_100000747056 [0,1,0,0,0,0|2,0,1]=4 1467 B12R0.116 CCCCCNC(=O)C(CC)OC 527a_100000209983_100000747056 [0,1,0,0,0,0|2,0,1]=4 1468 B12R0.116 CCCCCNC(=O)C(OC)OC 11a_100000209983_100000046285 [0,1,0,0,0,0|1,0,1]=3 1469 B12R0.116 CCCCCNC(=O)C(OC)OC 240690a_100000209983_100000046285 [0,1,0,0,0,0|1,0,1]=3 1470 B12R0.116 CCCCCNC(=O)C(OC)OC 527a_100000209983_100000046285 [0,1,0,0,0,0|1,0,1]=3 1471 B12R0.116 CCCCCNC(C)C(CC)CC 269862a_100000209983_100011393642 [0,1,0,0,0,0|3,0,0]=4 1472 B12R0.116 CCCCCNC(C)C(CC)CC 270004a_100000209983_100011393642 [0,1,0,0,0,0|3,0,0]=4 1473 B12R0.116 CCCCCNC(C)C(OC)OC 270004a_100000209983_100000211384 [0,1,0,0,0,0|1,0,0]=2 1474 B12R0.116 CCCCCOC(C)C(OC)OC 34a_100000210253_100011222894 [0,1,0,0,0,0|1,0,0]=2 1475 B12R0.116 CCCCCOC(C)C(OC)OC 34a_100000754440_100000718602 [0,1,0,0,0,0|1,0,0]=2 1476 B12R0.116 CCCCCOC(C)C(OC)OC 7a_100000754440_100000210326 [0,1,0,0,0,0|1,0,0]=2 1477 B12R0.116 CCCCCSC(C)C(OC)OC 62a_100000210326_100011222894 [0,1,0,0,0,0|1,0,0]=2 1478 B12R0.116 CCCCCSC(C)C(OC)OC 62a_100011222894_100000210326 [0,1,0,0,0,0|1,0,0]=2 1479 B12R0.116 CCCCNN=C(C)C(OC)OC 4a_100025702795_100000211384 [0,1,0,0,0,0|2,0,1]=4 1480 B12R0.116 CCCCNNC(=O)C(OC)OC 22a_100025702795_100000046285 [0,1,0,0,0,0|2,0,1]=4 1481 B12R0.116 CCCCOCC(=O)C(CC)OC 1458a_100000747056_100011995733 [0,1,0,0,0,0|2,0,1]=4 1482 B12R0.116 CCCCOCC(=O)C(OC)OC 1458a_100000046285_100011995733 [0,1,0,0,0,0|1,0,1]=3 1483 B12R0.116 CCCOCCC(=O)C(CC)OC 1458a_100000747056_100011215938 [0,1,0,0,0,0|2,0,1]=4 1484 B12R0.116 CCCOCCC(=O)C(OC)OC 1458a_100000046285_100011215938 [0,1,0,0,0,0|1,0,1]=3 1485 B12R0.116 CCOCCCC(=O)C(CC)OC 1458a_100000747056_100012232248 [0,1,0,0,0,0|2,0,1]=4 1486 B12R0.116 CCOCCCC(=O)C(OC)OC 1458a_100000046285_100012232248 [0,1,0,0,0,0|1,0,1]=3 1487 B12R0.116 CCOCCNC(=O)C(OC)OC 11a_100011200944_100000046285 [0,1,0,0,0,0|2,0,1]=4 1488 B12R0.116 CCOCCNC(=O)C(OC)OC 240690a_100011200944_100000046285 [0,1,0,0,0,0|2,0,1]=4 1489 B12R0.116 CCOCCNC(=O)C(OC)OC 527a_100011200944_100000046285 [0,1,0,0,0,0|2,0,1]=4 1490 B12R0.116 CCOCCNC(C)C(OC)OC 270004a_102516460346_100000211384 [0,1,0,0,0,0|2,0,0]=3 1491 B12R0.116 CCOCCNC(C)C(OC)OC 34a_102516460346_100011222894 [0,1,0,0,0,0|2,0,0]=3 1492 B12R0.116 CCOCCOC(C)C(OC)OC 34a_100000210136_100011222894 [0,1,0,0,0,0|2,0,0]=3 1493 B12R0.116 CCOCCOC(C)C(OC)OC 34a_100000754440_100000210147 [0,1,0,0,0,0|2,0,0]=3 1494 B12R0.116 CCOCCOC(C)C(OC)OC 7a_100000754440_100011215890 [0,1,0,0,0,0|2,0,0]=3 1495 B12R0.116 CCOCCSC(C)C(OC)OC 62a_100000210147_100011222894 [0,1,0,0,0,0|2,0,0]=3 1496 B12R0.116 CCOCCSC(C)C(OC)OC 62a_100011222894_100011215890 [0,1,0,0,0,0|2,0,0]=3 1497 B12R0.116 CCSCCNC(=O)C(OC)OC 11a_100000106463_100000046285 [0,1,0,0,0,0|2,0,1]=4 1498 B12R0.116 CCSCCNC(=O)C(OC)OC 240690a_100000106463_100000046285 [0,1,0,0,0,0|2,0,1]=4 1499 B12R0.116 CCSCCNC(=O)C(OC)OC 527a_100000106463_100000046285 [0,1,0,0,0,0|2,0,1]=4 1500 B12R0.116 CCSCCNC(C)C(OC)OC 270004a_100000106463_100000211384 [0,1,0,0,0,0|2,0,0]=3 1501 B12R0.116 CCSCCOC(C)C(OC)OC 34a_100000212035_100011222894 [0,1,0,0,0,0|2,0,0]=3 1502 B12R0.116 CCSCCOC(C)C(OC)OC 34a_100000754440_100000757381 [0,1,0,0,0,0|2,0,0]=3 1503 B12R0.116 CCSCCOC(C)C(OC)OC 7a_100000754440_100000757381 [0,1,0,0,0,0|2,0,0]=3 1504 B12R0.116 CCSCCSC(C)C(OC)OC 62a_100000757381_100011222894 [0,1,0,0,0,0|2,0,0]=3 1505 B12R0.116 CCSCCSC(C)C(OC)OC 62a_100011222894_100000757381 [0,1,0,0,0,0|2,0,0]=3 1506 B12R0.116 CNCCCOC(C)C(OC)OC 34a_100000213112_100011222894 [0,1,0,0,0,0|2,0,0]=3 1507 B12R0.116 COC(OC)C(=O)CCCCC#N 1458a_100000046285_100000211819 [0,1,0,0,0,0|1,0,2]=4 1508 B12R0.116 COC(OC)C(=O)CCCCCF 1458a_100000046285_100000729378 [0,1,0,0,0,0|1,0,1]=3 1509 B12R0.116 COC(OC)C(=O)CCCCCO 1458a_100000046285_100000746330 [0,1,0,0,0,0|1,0,1]=3 1510 B12R0.116 COC(OC)C(=O)CCOCCO 1458a_100000046285_100011215305 [0,1,0,0,0,0|2,0,1]=4 1511 B12R0.116 COC(OC)C(=O)NCCCCO 240690a_100000750430_100000046285 [0,1,0,0,0,0|2,0,1]=4 1512 B12R0.116 COC(OC)C(=O)NCCCCO 527a_100000750430_100000046285 [0,1,0,0,0,0|2,0,1]=4 1513 B12R0.116 COC(OC)C(=O)NCCCSC 11a_100000749238_100000046285 [0,1,0,0,0,0|2,0,1]=4 1514 B12R0.116 COC(OC)C(=O)NCCCSC 240690a_100000749238_100000046285 [0,1,0,0,0,0|2,0,1]=4 1515 B12R0.116 COC(OC)C(=O)NCCCSC 527a_100000749238_100000046285 [0,1,0,0,0,0|2,0,1]=4 1516 B12R0.116 COC(OC)C(C)NCCCCO 270004a_100000750430_100000211384 [0,1,0,0,0,0|2,0,0]=3 1517 B12R0.116 COC(OC)C(C)NCCCCO 34a_100000750430_100011222894 [0,1,0,0,0,0|2,0,0]=3 1518 B12R0.116 COC(OC)C(C)NCCCSC 270004a_100000749238_100000211384 [0,1,0,0,0,0|2,0,0]=3 1519 B12R0.116 COC(OC)C(C)OCCCC#N 7a_100000754440_100000687738 [0,1,0,0,0,0|2,0,1]=4 1520 B12R0.116 COC(OC)C(C)OCCCC=O 7a_100000754440_200011292268 [0,1,0,0,0,0|2,0,1]=4 1521 B12R0.116 COC(OC)C(C)OCCCCBr 34a_100011216708_100011222894 [0,1,0,0,0,0|2,0,0]=3 1522 B12R0.116 COC(OC)C(C)OCCCCCl 34a_100000210776_100011222894 [0,1,0,0,0,0|2,0,0]=3 1523 B12R0.116 COC(OC)C(C)OCCCCF 34a_100000754440_100000729493 [0,1,0,0,0,0|2,0,0]=3 1524 B12R0.116 COC(OC)C(C)OCCCCF 34a_100011995726_100011222894 [0,1,0,0,0,0|2,0,0]=3 1525 B12R0.116 COC(OC)C(C)OCCCCF 7a_100000754440_100000729493 [0,1,0,0,0,0|2,0,0]=3 1526 B12R0.116 COC(OC)C(C)OCCCCI 34a_200012148704_100011222894 [0,1,0,0,0,0|2,0,0]=3 1527 B12R0.116 COC(OC)C(C)OCCCCN 34a_100000750430_100011222894 [0,1,0,0,0,0|2,0,0]=3 1528 B12R0.116 COC(OC)C(C)OCCCCO 34a_100000754440_100011216708 [0,1,0,0,0,0|2,0,0]=3 1529 B12R0.116 COC(OC)C(C)OCCCCO 7a_100000754440_100000210776 [0,1,0,0,0,0|2,0,0]=3 1530 B12R0.116 COC(OC)C(C)OCCCSC 34a_100000690336_100011222894 [0,1,0,0,0,0|2,0,0]=3 1531 B12R0.116 COC(OC)C(C)SCCCC#N 62a_100000687738_100011222894 [0,1,0,0,0,0|2,0,1]=4 1532 B12R0.116 COC(OC)C(C)SCCCC#N 62a_100011222894_100000687738 [0,1,0,0,0,0|2,0,1]=4 1533 B12R0.116 COC(OC)C(C)SCCCC=O 62a_100011222894_200011292268 [0,1,0,0,0,0|2,0,1]=4 1534 B12R0.116 COC(OC)C(C)SCCCC=O 62a_200011292268_100011222894 [0,1,0,0,0,0|2,0,1]=4 1535 B12R0.116 COC(OC)C(C)SCCCCF 62a_100000729493_100011222894 [0,1,0,0,0,0|2,0,0]=3 1536 B12R0.116 COC(OC)C(C)SCCCCF 62a_100011222894_100000729493 [0,1,0,0,0,0|2,0,0]=3 1537 B12R0.116 COC(OC)C(C)SCCCCO 62a_100000210776_100011222894 [0,1,0,0,0,0|2,0,0]=3 1538 B12R0.116 COC(OC)C(C)SCCCCO 62a_100011222894_100000210776 [0,1,0,0,0,0|2,0,0]=3 1539 B12R0.116 COCCCCC(=O)C(OC)OC 1458a_100000046285_100000755781 [0,1,0,0,0,0|1,0,1]=3 1540 B12R0.116 COCCCNC(=O)C(OC)OC 240690a_100150723488_100000046285 [0,1,0,0,0,0|2,0,1]=4 1541 B12R0.116 COCCCNC(=O)C(OC)OC 527a_100150723488_100000046285 [0,1,0,0,0,0|2,0,1]=4 1542 B12R0.116 COCCCNC(C)C(OC)OC 270004a_100150723488_100000211384 [0,1,0,0,0,0|2,0,0]=3 1543 B12R0.116 COCCCNC(C)C(OC)OC 34a_100150723488_100011222894 [0,1,0,0,0,0|2,0,0]=3 1544 B12R0.116 COCCCOC(C)C(OC)OC 34a_100000740835_100011222894 [0,1,0,0,0,0|2,0,0]=3 1545 B12R0.116 COCCCOC(C)C(OC)OC 34a_100000754440_100000740836 [0,1,0,0,0,0|2,0,0]=3 1546 B12R0.116 COCCCOC(C)C(OC)OC 7a_100000754440_100000740836 [0,1,0,0,0,0|2,0,0]=3 1547 B12R0.116 COCCCSC(C)C(OC)OC 62a_100000709357_100011222894 [0,1,0,0,0,0|2,0,0]=3 1548 B12R0.116 COCCCSC(C)C(OC)OC 62a_100011222894_100000709357 [0,1,0,0,0,0|2,0,0]=3 1549 B12R0.121 C=CC(CCCCCCC)OCC 34a_200011934235_100000210202 [0,1,0,0,0,0|1,0,1]=3 1550 B12R0.121 C=CC(CCCCCCC)OCC 7a_200011934235_100000210202 [0,1,0,0,0,0|1,0,1]=3 1551 B12R0.121 C=CC(CCCCCCC)OCF 34a_200011934235_100015361967 [0,1,0,0,0,0|1,0,1]=3 1552 B12R0.121 C=CC(CCCCCCC)OCF 7a_200011934235_100015361967 [0,1,0,0,0,0|1,0,1]=3 1553 B12R0.121 CC#CC(CC)OCCCCCC 34a_200011219922_100000210314 [0,1,0,0,0,0|3,0,0]=4 1554 B12R0.121 CC#CC(CC)OCCCCCC 7a_200011219922_100000210314 [0,1,0,0,0,0|3,0,0]=4 1555 B12R0.121 CCC(COC)NCCCCCF 2230a_100000757820_100000729378 [0,1,0,0,0,0|3,0,0]=4 1556 B12R0.121 CCC(COC)NCCCCCO 2230a_100000757820_100000746330 [0,1,0,0,0,0|3,0,0]=4 1557 B12R0.121 CCC(COC)NCCCCCO 270004a_100000762737_100000757811 [0,1,0,0,0,0|3,0,0]=4 1558 B12R0.121 CCC(COC)NCCCCOC 2230a_100000757820_100000730899 [0,1,0,0,0,0|3,0,0]=4 1559 B12R0.121 CCC(COC)OCCCCCF 7a_200011214946_100000729378 [0,1,0,0,0,0|3,0,0]=4 1560 B12R0.121 CCC(COC)OCCCCCO 7a_200011214946_100000746330 [0,1,0,0,0,0|3,0,0]=4 1561 B12R0.121 CCC(COC)OCCCCOC 7a_200011214946_100000730899 [0,1,0,0,0,0|3,0,0]=4 1562 B12R0.121 CCCCCCCC(CC)NCC 270004a_100015525214_200011217162 [0,1,0,0,0,0|2,0,0]=3 1563 B12R0.121 CCCCCCCC(CC)OCC 34a_200011217053_100000210202 [0,1,0,0,0,0|1,0,0]=2 1564 B12R0.121 CCCCCCCC(CC)OCC 7a_200011217053_100000210202 [0,1,0,0,0,0|1,0,0]=2 1565 B12R0.121 CCCCCCCC(CC)OCF 34a_200011217053_100015361967 [0,1,0,0,0,0|1,0,0]=2 1566 B12R0.121 CCCCCCCC(CC)OCF 7a_200011217053_100015361967 [0,1,0,0,0,0|1,0,0]=2 1567 B12R0.121 CCCCCCCC(CCC)NC 270004a_106832991635_200011216337 [0,1,0,0,0,0|2,0,0]=3 1568 B12R0.121 CCCCCCCN(CC)CCC 2230a_100000226822_100000210681 [0,1,0,0,0,0|3,0,0]=4 1569 B12R0.121 CCCCCCCN(CC)CCC 2230a_100000228213_100000210303 [0,1,0,0,0,0|3,0,0]=4 1570 B12R0.121 CCCCCCCN(CC)CCC 269982a_100000226822_100000210681 [0,1,0,0,0,0|3,0,0]=4 1571 B12R0.121 CCCCCCCN(CC)CCC 269982a_100000228213_100000210303 [0,1,0,0,0,0|3,0,0]=4 1572 B12R0.121 CCCCCCCN(CC)CCF 2230a_100000228213_100011217306 [0,1,0,0,0,0|3,0,0]=4 1573 B12R0.121 CCCCCCCN(CC)CCF 269982a_100000228213_100011217306 [0,1,0,0,0,0|3,0,0]=4 1574 B12R0.121 CCCCCCCN(CC)CCO 2230a_100000210973_100000210681 [0,1,0,0,0,0|3,0,0]=4 1575 B12R0.121 CCCCCCCN(CC)CCO 2230a_100000228213_100000211926 [0,1,0,0,0,0|3,0,0]=4 1576 B12R0.121 CCCCCCCN(CC)CCO 269982a_100000210973_100000210681 [0,1,0,0,0,0|3,0,0]=4 1577 B12R0.121 CCCCCCCN(CC)CCO 269982a_100000228213_100000211926 [0,1,0,0,0,0|3,0,0]=4 1578 B12R0.121 CCCCCCCN(CC)COC 2230a_100000228213_100000766300 [0,1,0,0,0,0|2,0,0]=3 1579 B12R0.121 CCCCCCCN(CC)COC 269982a_100000228213_100000766300 [0,1,0,0,0,0|2,0,0]=3 1580 B12R0.121 CCCCCCCN(CC)CSC 2230a_100000228213_100011218213 [0,1,0,0,0,0|2,1,0]=4 1581 B12R0.121 CCCCCCCN(CC)CSC 269982a_100000228213_100011218213 [0,1,0,0,0,0|2,1,0]=4 1582 B12R0.121 CCCCCCNC(CC)CCC 2230a_100000747048_100000210314 [0,1,0,0,0,0|3,0,0]=4 1583 B12R0.121 CCCCCCNC(CC)CCC 270004a_100000210581_100000687865 [0,1,0,0,0,0|3,0,0]=4 1584 B12R0.121 CCCCCCNC(CC)COC 2230a_100000757820_100000210314 [0,1,0,0,0,0|2,0,0]=3 1585 B12R0.121 CCCCCCNC(CC)COC 270004a_100000210581_100000757811 [0,1,0,0,0,0|2,0,0]=3 1586 B12R0.121 CCCCCCNC(CO)COC 2230a_100000724102_100000210314 [0,1,0,0,0,0|3,0,0]=4 1587 B12R0.121 CCCCCCNC(CO)COC 34a_100000724102_100000210314 [0,1,0,0,0,0|3,0,0]=4 1588 B12R0.121 CCCCCCOC(CC)CCC 34a_100000687864_100000210314 [0,1,0,0,0,0|3,0,0]=4 1589 B12R0.121 CCCCCCOC(CC)CCC 7a_100000210259_100011219200 [0,1,0,0,0,0|3,0,0]=4 1590 B12R0.121 CCCCCCOC(CC)CCC 7a_100000687864_100000210314 [0,1,0,0,0,0|3,0,0]=4 1591 B12R0.121 CCCCCCOC(CC)COC 7a_200011214946_100000210314 [0,1,0,0,0,0|2,0,0]=3 1592 B12R0.121 CCCCCCOC(CCl)COC 34a_100011215053_100000210314 [0,1,0,0,0,0|3,0,0]=4 1593 B12R0.121 CCCCCCOC(CN)COC 34a_100000756049_100000210314 [0,1,0,0,0,0|3,0,0]=4 1594 B12R0.121 CCCCCCSC(CC)CCC 62a_100000210314_100011219200 [0,1,0,0,0,0|3,0,0]=4 1595 B12R0.121 CCCCCCSC(CC)CCC 62a_100011219200_100000210757 [0,1,0,0,0,0|3,0,0]=4 1596 B12R0.121 CCCCCNCC(CC)OCC 2230a_100015183923_100000210326 [0,1,0,0,0,0|2,0,0]=3 1597 B12R0.121 CCCCCNCC(CC)OCC 34a_100015183923_100000718602 [0,1,0,0,0,0|2,0,0]=3 1598 B12R0.121 CCCCOCCC(CCC)SC 34a_100000032865_100000210210 [0,1,0,0,0,0|2,1,0]=4 1599 B12R0.121 CCCCOCCC(CCC)SC 7a_100000032865_100000210211 [0,1,0,0,0,0|2,1,0]=4 1600 B12R0.121 CCCCOCNC(CC)COC 2230a_100000757820_100011995733 [0,1,0,0,0,0|3,0,0]=4 1601 B12R0.121 CCCOCCNC(CC)COC 2230a_100000757820_100011215938 [0,1,0,0,0,0|3,0,0]=4 1602 B12R0.121 CCCOCCNC(CC)COC 270004a_100161115042_100000757811 [0,1,0,0,0,0|3,0,0]=4 1603 B12R0.121 CCCOCCOC(CC)COC 7a_200011214946_100011215938 [0,1,0,0,0,0|3,0,0]=4 1604 B12R0.121 CCCSCCNC(CC)COC 270004a_100020603323_100000757811 [0,1,0,0,0,0|3,0,0]=4 1605 B12R0.121 CCOC(CC)CNCCCCF 2230a_100015183923_100000729493 [0,1,0,0,0,0|3,0,0]=4 1606 B12R0.121 CCOC(CC)CNCCCCF 34a_100015183923_100000729493 [0,1,0,0,0,0|3,0,0]=4 1607 B12R0.121 CCOC(CC)CNCCCCO 2230a_100015183923_100000210776 [0,1,0,0,0,0|3,0,0]=4 1608 B12R0.121 CCOC(CC)CNCCCCO 34a_100015183923_100011216708 [0,1,0,0,0,0|3,0,0]=4 1609 B12R0.121 CCOC(CC)CNCCCOC 2230a_100015183923_100000740836 [0,1,0,0,0,0|3,0,0]=4 1610 B12R0.121 CCOC(CC)CNCCCOC 34a_100015183923_100000740836 [0,1,0,0,0,0|3,0,0]=4 1611 B12R0.121 CCOC(CC)CNCCSCC 2230a_100015183923_100000757381 [0,1,0,0,0,0|3,0,0]=4 1612 B12R0.121 CCOC(CC)CNCCSCC 34a_100015183923_100000757381 [0,1,0,0,0,0|3,0,0]=4 1613 B12R0.121 CCOCCCNC(CC)COC 2230a_100000757820_100012232248 [0,1,0,0,0,0|3,0,0]=4 1614 B12R0.121 CCOCCCNC(CC)COC 270004a_100000210961_100000757811 [0,1,0,0,0,0|3,0,0]=4 1615 B12R0.121 CCOCCCOC(CC)COC 7a_200011214946_100012232248 [0,1,0,0,0,0|3,0,0]=4 1616 B12R0.121 CCOCCNCC(CC)OCC 2230a_100015183923_100011215890 [0,1,0,0,0,0|3,0,0]=4 1617 B12R0.121 CCOCCNCC(CC)OCC 34a_100015183923_100000210147 [0,1,0,0,0,0|3,0,0]=4 1618 B12R0.130 C#CC(C)NCCCC(OC)OC 2230a_100000707721_100000069011 [0,1,0,0,0,0|1,0,2]=4 1619 B12R0.130 C#CC(C)NCCCC(OC)OC 34a_100000707721_100000069011 [0,1,0,0,0,0|1,0,2]=4 1620 B12R0.130 C#CC(C)SCCCC(OC)OC 62a_200000035995_100000069011 [0,1,0,0,0,0|1,0,2]=4 1621 B12R0.130 C#C[C@@H](C)OCCCC(OC)OC 34a_100009815206_100000069011 [0,1,0,0,0,0|1,0,2]=4 1622 B12R0.130 C#C[C@@H](C)OCCCC(OC)OC 7a_100009815206_100000069011 [0,1,0,0,0,0|1,0,2]=4 1623 B12R0.130 C=CC(C)COCCC(OC)OC 34a_100011215527_100000139399 [0,1,0,0,0,0|1,0,2]=4 1624 B12R0.130 C=CC(C)COCCC(OC)OC 7a_100011215527_100009813347 [0,1,0,0,0,0|1,0,2]=4 1625 B12R0.130 C=CC(C)OCCCC(OC)OC 34a_100000695699_100000069011 [0,1,0,0,0,0|1,0,2]=4 1626 B12R0.130 C=CC(C)SCCCC(OC)OC 62a_100011215867_100000069011 [0,1,0,0,0,0|1,0,2]=4 1627 B12R0.130 C=CC(O)CSCCC(OC)OC 62a_100000139399_100000730141 [0,1,0,0,0,0|1,0,2]=4 1628 B12R0.130 C=CC(O)CSCCC(OC)OC 62a_100000730141_100000139399 [0,1,0,0,0,0|1,0,2]=4 1629 B12R0.130 C=C[C@H](N)COCCC(OC)OC 34a_100016989147_100000139399 [0,1,0,0,0,0|1,0,2]=4 1630 B12R0.130 CCC(=O)COCCC(OC)OC 34a_100000725409_100000139399 [0,1,0,0,0,0|1,0,1]=3 1631 B12R0.130 CCC(=O)CSCCC(OC)OC 62a_100000139399_100000747405 [0,1,0,0,0,0|1,0,1]=3 1632 B12R0.130 CCC(=O)CSCCC(OC)OC 62a_100000747405_100000139399 [0,1,0,0,0,0|1,0,1]=3 1633 B12R0.130 CCC(=O)NCCCC(OC)OC 11a_100000034021_100000210414 [0,1,0,0,0,0|1,0,1]=3 1634 B12R0.130 CCC(=O)NCCCC(OC)OC 1626a_100000034021_100000210414 [0,1,0,0,0,0|1,0,1]=3 1635 B12R0.130 CCC(=O)NCCCC(OC)OC 240690a_100000034021_100000210414 [0,1,0,0,0,0|1,0,1]=3 1636 B12R0.130 CCC(=O)NCCCC(OC)OC 527a_100000034021_100000210414 [0,1,0,0,0,0|1,0,1]=3 1637 B12R0.130 CCC(C)CCCOC(CC)CC 7a_100011216074_100000210505 [0,1,0,0,0,0|3,0,0]=4 1638 B12R0.130 CCC(C)CCNCC(CC)CC 2230a_100020591266_100011215472 [0,1,0,0,0,0|3,0,0]=4 1639 B12R0.130 CCC(C)CCNCC(CC)CC 269862a_100020591266_100000211137 [0,1,0,0,0,0|3,0,0]=4 1640 B12R0.130 CCC(C)CCNCC(CC)CC 270004a_100020591266_100000211137 [0,1,0,0,0,0|3,0,0]=4 1641 B12R0.130 CCC(C)CCNCC(OC)OC 2230a_100020591266_100000751394 [0,1,0,0,0,0|1,0,0]=2 1642 B12R0.130 CCC(C)CCNCC(OC)OC 270004a_100020591266_100000752162 [0,1,0,0,0,0|1,0,0]=2 1643 B12R0.130 CCC(C)CCOCC(CC)CC 7a_100011215188_100011215472 [0,1,0,0,0,0|3,0,0]=4 1644 B12R0.130 CCC(C)CCOCC(OC)OC 7a_100011215188_100000751394 [0,1,0,0,0,0|1,0,0]=2 1645 B12R0.130 CCC(C)CNCCC(OC)OC 2230a_100020588543_100009813347 [0,1,0,0,0,0|1,0,0]=2 1646 B12R0.130 CCC(C)CSCCC(OC)OC 62a_100000139399_100000748023 [0,1,0,0,0,0|1,0,0]=2 1647 B12R0.130 CCC(C)CSCCC(OC)OC 62a_100000748023_100000139399 [0,1,0,0,0,0|1,0,0]=2 1648 B12R0.130 CCC(C)NCCCC(OC)OC 2230a_100000209981_100000069011 [0,1,0,0,0,0|1,0,0]=2 1649 B12R0.130 CCC(C)OCCCC(OC)OC 7a_100000210228_100000069011 [0,1,0,0,0,0|1,0,0]=2 1650 B12R0.130 CCC(C)SCCCC(OC)OC 62a_100000069011_100000758301 [0,1,0,0,0,0|1,0,0]=2 1651 B12R0.130 CCC(C)SCCCC(OC)OC 62a_100000758301_100000069011 [0,1,0,0,0,0|1,0,0]=2 1652 B12R0.130 CCC(O)CNCCC(OC)OC 2230a_100011218483_100009813347 [0,1,0,0,0,0|1,0,0]=2 1653 B12R0.130 CCC(O)CNN=CC(OC)OC 4a_100015206393_100000752162 [0,1,0,0,0,0|2,0,1]=4 1654 B12R0.130 CCC(O)CSCCC(OC)OC 62a_100000139399_100011218378 [0,1,0,0,0,0|1,0,0]=2 1655 B12R0.130 CCC(O)CSCCC(OC)OC 62a_100011218378_100000139399 [0,1,0,0,0,0|1,0,0]=2 1656 B12R0.130 CC[C@H](C)COCCC(OC)OC 7a_100009816381_100009813347 [0,1,0,0,0,0|1,0,0]=2 1657 B12R0.130 CC[C@H](C)CSCCC(OC)OC 62a_100000139399_100009816398 [0,1,0,0,0,0|1,0,0]=2 1658 B12R0.130 CC[C@H](C)CSCCC(OC)OC 62a_100009816398_100000139399 [0,1,0,0,0,0|1,0,0]=2 1659 B12R0.130 CNC(=O)CCNCC(OC)OC 2230a_100000738227_100000751394 [0,1,0,0,0,0|2,0,1]=4 1660 B12R0.130 CNC(=O)CCNCC(OC)OC 270004a_100000738227_100000752162 [0,1,0,0,0,0|2,0,1]=4 1661 B12R0.130 CNC(=O)CCNCC(OC)OC 34a_100000738227_100000211822 [0,1,0,0,0,0|2,0,1]=4 1662 B12R0.130 CNC(=O)CCOCC(OC)OC 34a_100000754576_100000211822 [0,1,0,0,0,0|2,0,1]=4 1663 B12R0.130 CNC(=O)CCOCC(OC)OC 34a_100011216393_100012179268 [0,1,0,0,0,0|2,0,1]=4 1664 B12R0.130 CNC(=O)CCSCC(OC)OC 62a_100000737683_100000751394 [0,1,0,0,0,0|2,0,1]=4 1665 B12R0.130 CNC(=O)CCSCC(OC)OC 62a_100000751394_100000737683 [0,1,0,0,0,0|2,0,1]=4 1666 B12R0.130 CNC(=O)CNCCC(OC)OC 2230a_100000693194_100009813347 [0,1,0,0,0,0|2,0,1]=4 1667 B12R0.130 CNC(=O)COCCC(OC)OC 34a_100000750040_100000139399 [0,1,0,0,0,0|2,0,1]=4 1668 B12R0.130 CNC(=O)CSCCC(OC)OC 62a_100000139399_100000183359 [0,1,0,0,0,0|2,0,1]=4 1669 B12R0.130 CNC(=O)CSCCC(OC)OC 62a_100000183359_100000139399 [0,1,0,0,0,0|2,0,1]=4 1670 B12R0.130 CNC(=O)NCCCC(OC)OC 2708a_100000034021_106832991635 [0,1,0,0,0,0|2,0,1]=4 1671 B12R0.130 CNC(=O)NCCCC(OC)OC 273464a_100000034021_100102657272 [0,1,0,0,0,0|2,0,1]=4 1672 B12R0.130 CNC(=O)NCCCC(OC)OC 273464a_100102657272_100000034021 [0,1,0,0,0,0|2,0,1]=4 1673 B12R0.130 CNC(=O)NCCCC(OC)OC 512a_100000034021_100102657272 [0,1,0,0,0,0|2,0,1]=4 1674 B12R0.130 CNC(=O)NCCCC(OC)OC 512a_106832991638_100000034021 [0,1,0,0,0,0|2,0,1]=4 1675 B12R0.130 COC(=O)CCOCC(OC)OC 34a_100011216393_100000742370 [0,1,0,0,0,0|2,0,1]=4 1676 B12R0.130 COC(=O)CCSCC(OC)OC 62a_100000204255_100000751394 [0,1,0,0,0,0|2,0,1]=4 1677 B12R0.130 COC(=O)CCSCC(OC)OC 62a_100000751394_100000204255 [0,1,0,0,0,0|2,0,1]=4 1678 B12R0.130 COC(=O)CSCCC(OC)OC 62a_100000139399_100000747449 [0,1,0,0,0,0|2,0,1]=4 1679 B12R0.130 COC(=O)CSCCC(OC)OC 62a_100000747449_100000139399 [0,1,0,0,0,0|2,0,1]=4 1680 B12R0.130 COC(C)CCOCC(OC)OC 7a_100000764861_100000751394 [0,1,0,0,0,0|2,0,0]=3 1681 B12R0.130 COC(C)COCCC(OC)OC 34a_100000690652_100000139399 [0,1,0,0,0,0|2,0,0]=3 1682 B12R0.130 COC(CCCNC(=O)CO)OC 240690a_100000034021_100000210174 [0,1,0,0,0,0|2,0,1]=4 1683 B12R0.130 COC(CCCNC(=O)CO)OC 527a_100000034021_100000210174 [0,1,0,0,0,0|2,0,1]=4 1684 B12R0.130 COC(CCCNC(C)C#N)OC 2230a_100000737613_100000069011 [0,1,0,0,0,0|2,0,1]=4 1685 B12R0.130 COC(CCCN[C@H](C)CO)OC 2230a_100000737577_100000069011 [0,1,0,0,0,0|2,0,0]=3 1686 B12R0.130 COC(CCCOC(C)C#N)OC 34a_100011218135_100000069011 [0,1,0,0,0,0|2,0,1]=4 1687 B12R0.130 COC(CCCOC(C)CF)OC 34a_100016041109_100000069011 [0,1,0,0,0,0|2,0,0]=3 1688 B12R0.130 COC(CCCOC(C)CF)OC 7a_100016041109_100000069011 [0,1,0,0,0,0|2,0,0]=3 1689 B12R0.130 COC(CCCOC(C)CN)OC 34a_100000210904_100000069011 [0,1,0,0,0,0|2,0,0]=3 1690 B12R0.130 COC(CCCSC(C)C#N)OC 62a_100000069011_100000703298 [0,1,0,0,0,0|2,0,1]=4 1691 B12R0.130 COC(CCCSC(C)C#N)OC 62a_100000703298_100000069011 [0,1,0,0,0,0|2,0,1]=4 1692 B12R0.130 COC(CCCSC(C)CO)OC 62a_100012180447_100000069011 [0,1,0,0,0,0|2,0,0]=3 1693 B12R0.130 COC(CCCSC(C)OC)OC 62a_100000069011_100009879195 [0,1,0,0,0,0|2,0,0]=3 1694 B12R0.130 COC(CCCSC(C)OC)OC 62a_100009879195_100000069011 [0,1,0,0,0,0|2,0,0]=3 1695 B12R0.130 COC(CCCSC(F)C#N)OC 62a_100000069011_200000117898 [0,1,0,0,0,0|2,0,1]=4 1696 B12R0.130 COC(CCCSC(F)C#N)OC 62a_200000117898_100000069011 [0,1,0,0,0,0|2,0,1]=4 1697 B12R0.130 COC(CCCS[C@H](C)CO)OC 62a_100000069011_100016084084 [0,1,0,0,0,0|2,0,0]=3 1698 B12R0.130 COC(CCCS[C@H](C)CO)OC 62a_100016084084_100000069011 [0,1,0,0,0,0|2,0,0]=3 1699 B12R0.130 COC(CCNCC(C)CO)OC 34a_100000744482_100000139399 [0,1,0,0,0,0|2,0,0]=3 1700 B12R0.130 COC(CCNC[C@@H](C)OC)OC 2230a_100020591295_100009813347 [0,1,0,0,0,0|2,0,0]=3 1701 B12R0.130 COC(CCNC[C@@H](F)CO)OC 34a_100015665980_100000139399 [0,1,0,0,0,0|2,0,0]=3 1702 B12R0.130 COC(CCNC[C@H](O)CO)OC 2230a_100020644852_100009813347 [0,1,0,0,0,0|2,0,0]=3 1703 B12R0.130 COC(CCOCC(C)CN)OC 34a_100000744482_100000139399 [0,1,0,0,0,0|2,0,0]=3 1704 B12R0.130 COC(CCOCC(Cl)CCl)OC 34a_100000033668_100000139399 [0,1,0,0,0,0|2,0,0]=3 1705 B12R0.130 COC(CCOC[C@H](F)CN)OC 34a_100015665980_100000139399 [0,1,0,0,0,0|2,0,0]=3 1706 B12R0.130 COC(CCSCC(O)CO)OC 62a_100000139399_100011219619 [0,1,0,0,0,0|2,0,0]=3 1707 B12R0.130 COC(CCSCC(O)CO)OC 62a_100011219619_100000139399 [0,1,0,0,0,0|2,0,0]=3 1708 B12R0.130 COC(CCSC[C@@H](C)CO)OC 62a_100000059175_100000139399 [0,1,0,0,0,0|2,0,0]=3 1709 B12R0.130 COC(CCSC[C@@H](C)CO)OC 62a_100000139399_100000059175 [0,1,0,0,0,0|2,0,0]=3 1710 B12R0.130 COC(CCSC[C@@H](O)CF)OC 62a_100000139399_100015614560 [0,1,0,0,0,0|2,0,0]=3 1711 B12R0.130 COC(CCSC[C@@H](O)CF)OC 62a_100015614560_100000139399 [0,1,0,0,0,0|2,0,0]=3 1712 B12R0.130 COC(CCSC[C@@H](O)CO)OC 62a_100000139399_100009815848 [0,1,0,0,0,0|2,0,0]=3 1713 B12R0.130 COC(CCSC[C@@H](O)CO)OC 62a_100009815848_100000139399 [0,1,0,0,0,0|2,0,0]=3 1714 B12R0.130 COC(CNCCC(C)CO)OC 2230a_106354213184_100000751394 [0,1,0,0,0,0|2,0,0]=3 1715 B12R0.130 COC(CNCCC(C)CO)OC 270004a_106354213184_100000752162 [0,1,0,0,0,0|2,0,0]=3 1716 B12R0.130 COC(CNCCC(C)CO)OC 34a_106354213184_100000211822 [0,1,0,0,0,0|2,0,0]=3 1717 B12R0.133 C#CCCC(=O)CCC(OC)OC 1458a_100000692101_100000139399 [0,1,0,0,0,0|0,0,3]=4 1718 B12R0.133 C#CCCC(=O)CCC(OC)OC 1458a_200000082759_100000753159 [0,1,0,0,0,0|0,0,3]=4 1719 B12R0.133 C/C=C/CC(=O)CCC(OC)OC 1458a_200000082759_100102629194 [0,1,0,0,0,0|0,0,3]=4 1720 B12R0.133 C=CCCC(=O)CCC(OC)OC 1458a_100000749702_100000139399 [0,1,0,0,0,0|0,0,3]=4 1721 B12R0.133 C=CCCC(=O)CCC(OC)OC 1458a_200000082759_100000754431 [0,1,0,0,0,0|0,0,3]=4 1722 B12R0.133 C=CCCC(C)NCC(OC)OC 270004a_100000210479_100000762624 [0,1,0,0,0,0|1,0,2]=4 1723 B12R0.133 C=CCCC(C)OCC(OC)OC 34a_100000765329_100000211822 [0,1,0,0,0,0|1,0,2]=4 1724 B12R0.133 C=CCCC(C)OCC(OC)OC 7a_100000765329_100000751394 [0,1,0,0,0,0|1,0,2]=4 1725 B12R0.133 C=CCCN(C)CCC(OC)OC 2230a_100020639649_100009813347 [0,1,0,0,0,0|1,0,2]=4 1726 B12R0.133 C=CCCN(C)CCC(OC)OC 269982a_100020639649_100000139399 [0,1,0,0,0,0|1,0,2]=4 1727 B12R0.133 CC#CCC(=O)CCC(OC)OC 1458a_200000082759_100000748600 [0,1,0,0,0,0|0,0,3]=4 1728 B12R0.133 CC=CCC(=O)CCC(OC)OC 1458a_100121576822_100000139399 [0,1,0,0,0,0|0,0,3]=4 1729 B12R0.133 CC=CCC(=O)CCC(OC)OC 1458a_200000082759_100000070051 [0,1,0,0,0,0|0,0,3]=4 1730 B12R0.133 CCC#CC(=O)CCC(OC)OC 1458a_100011827653_100000139399 [0,1,0,0,0,0|0,0,3]=4 1731 B12R0.133 CCC#CC(C)OCC(OC)OC 34a_100000033903_100000211822 [0,1,0,0,0,0|1,0,2]=4 1732 B12R0.133 CCC#CC(C)OCC(OC)OC 7a_100000033903_100000751394 [0,1,0,0,0,0|1,0,2]=4 1733 B12R0.133 CCC(CNC(C)CCOC)OC 270004a_100000731041_100000742357 [0,1,0,0,0,0|3,0,0]=4 1734 B12R0.133 CCC(CNC(C)CCSC)OC 270004a_100000731041_100011217047 [0,1,0,0,0,0|3,0,0]=4 1735 B12R0.133 CCC=CC(=O)CCC(OC)OC 1458a_100000212282_100000139399 [0,1,0,0,0,0|0,0,3]=4 1736 B12R0.133 CCCCC(=O)CCC(OC)OC 1458a_100000210183_100000139399 [0,1,0,0,0,0|0,0,1]=2 1737 B12R0.133 CCCCC(=O)CCC(OC)OC 1458a_200000082759_100000210211 [0,1,0,0,0,0|0,0,1]=2 1738 B12R0.133 CCCCC(=O)NCC(CC)OC 11a_100000731041_100000210183 [0,1,0,0,0,0|2,0,1]=4 1739 B12R0.133 CCCCC(=O)NCC(CC)OC 1626a_100000731041_100000210183 [0,1,0,0,0,0|2,0,1]=4 1740 B12R0.133 CCCCC(=O)NCC(CC)OC 240690a_100000731041_100000210183 [0,1,0,0,0,0|2,0,1]=4 1741 B12R0.133 CCCCC(=O)NCC(CC)OC 527a_100000731041_100000210183 [0,1,0,0,0,0|2,0,1]=4 1742 B12R0.133 CCCCC(=O)NCC(OC)OC 11a_100000210479_100000210183 [0,1,0,0,0,0|1,0,1]=3 1743 B12R0.133 CCCCC(=O)NCC(OC)OC 1626a_100000210479_100000210183 [0,1,0,0,0,0|1,0,1]=3 1744 B12R0.133 CCCCC(=O)NCC(OC)OC 240690a_100000210479_100000210183 [0,1,0,0,0,0|1,0,1]=3 1745 B12R0.133 CCCCC(=O)NCC(OC)OC 527a_100000210479_100000210183 [0,1,0,0,0,0|1,0,1]=3 1746 B12R0.133 CCCCC(C)COC(CC)CC 7a_100011995851_100000210505 [0,1,0,0,0,0|3,0,0]=4 1747 B12R0.133 CCCCC(C)NCC(CC)CC 2230a_100000126638_100011215472 [0,1,0,0,0,0|3,0,0]=4 1748 B12R0.133 CCCCC(C)NCC(CC)CC 2230a_100102946423_200011215066 [0,1,0,0,0,0|3,0,0]=4 1749 B12R0.133 CCCCC(C)NCC(CC)CC 269862a_100000126638_100000211137 [0,1,0,0,0,0|3,0,0]=4 1750 B12R0.133 CCCCC(C)NCC(CC)CC 270004a_100000126638_100000211137 [0,1,0,0,0,0|3,0,0]=4 1751 B12R0.133 CCCCC(C)NCC(CC)CC 270004a_100102946423_100000210087 [0,1,0,0,0,0|3,0,0]=4 1752 B12R0.133 CCCCC(C)NCC(CC)OC 270004a_100000731041_100000210087 [0,1,0,0,0,0|2,0,0]=3 1753 B12R0.133 CCCCC(C)NCC(OC)OC 2230a_100000126638_100000751394 [0,1,0,0,0,0|1,0,0]=2 1754 B12R0.133 CCCCC(C)NCC(OC)OC 270004a_100000126638_100000752162 [0,1,0,0,0,0|1,0,0]=2 1755 B12R0.133 CCCCC(C)NCC(OC)OC 270004a_100000210479_100000210087 [0,1,0,0,0,0|1,0,0]=2 1756 B12R0.133 CCCCC(C)OCC(CC)CC 34a_100000687866_100011215472 [0,1,0,0,0,0|3,0,0]=4 1757 B12R0.133 CCCCC(C)OCC(CC)CC 7a_100000687866_100011215472 [0,1,0,0,0,0|3,0,0]=4 1758 B12R0.133 CCCCC(C)OCC(CC)CC 7a_100000703878_200011215066 [0,1,0,0,0,0|3,0,0]=4 1759 B12R0.133 CCCCC(C)OCC(CC)OC 34a_100011934954_200011215066 [0,1,0,0,0,0|2,0,0]=3 1760 B12R0.133 CCCCC(C)OCC(CC)OC 7a_100011934954_200011215066 [0,1,0,0,0,0|2,0,0]=3 1761 B12R0.133 CCCCC(C)OCC(OC)OC 34a_100000687866_100000211822 [0,1,0,0,0,0|1,0,0]=2 1762 B12R0.133 CCCCC(C)OCC(OC)OC 34a_100011216393_200011215066 [0,1,0,0,0,0|1,0,0]=2 1763 B12R0.133 CCCCC(C)OCC(OC)OC 7a_100000687866_100000751394 [0,1,0,0,0,0|1,0,0]=2 1764 B12R0.133 CCCCC(C)SCC(CC)CC 62a_100011215472_200011215066 [0,1,0,0,0,0|3,0,0]=4 1765 B12R0.133 CCCCC(C)SCC(CC)CC 62a_200011215066_100011215472 [0,1,0,0,0,0|3,0,0]=4 1766 B12R0.133 CCCCC(C)SCC(OC)OC 62a_100000751394_200011215066 [0,1,0,0,0,0|1,0,0]=2 1767 B12R0.133 CCCCC(C)SCC(OC)OC 62a_200011215066_100000751394 [0,1,0,0,0,0|1,0,0]=2 1768 B12R0.133 CCCCN(C)CCC(OC)OC 2230a_100000207549_100009813347 [0,1,0,0,0,0|1,0,0]=2 1769 B12R0.133 CCCCN(C)CCC(OC)OC 269982a_100000207549_100000139399 [0,1,0,0,0,0|1,0,0]=2 1770 B12R0.133 CCCNC(=O)CCC(OC)OC 11a_100020643023_200000082759 [0,1,0,0,0,0|1,0,1]=3 1771 B12R0.133 CCCNC(=O)CCC(OC)OC 1626a_100020643023_200000082759 [0,1,0,0,0,0|1,0,1]=3 1772 B12R0.133 CCCNC(=O)CCC(OC)OC 240690a_100020643023_200000082759 [0,1,0,0,0,0|1,0,1]=3 1773 B12R0.133 CCCNC(=O)CCC(OC)OC 527a_100020643023_200000082759 [0,1,0,0,0,0|1,0,1]=3 1774 B12R0.133 CCCNC(=O)NCC(OC)OC 2708a_100000210479_100020643023 [0,1,0,0,0,0|2,0,1]=4 1775 B12R0.133 CCCNC(=O)NCC(OC)OC 273464a_100000210479_100020643023 [0,1,0,0,0,0|2,0,1]=4 1776 B12R0.133 CCCNC(=O)NCC(OC)OC 273464a_100020643023_100000210479 [0,1,0,0,0,0|2,0,1]=4 1777 B12R0.133 CCCNC(=O)NCC(OC)OC 512a_100000210479_100020643023 [0,1,0,0,0,0|2,0,1]=4 1778 B12R0.133 CCCNC(=O)NCC(OC)OC 512a_100020643023_100000210479 [0,1,0,0,0,0|2,0,1]=4 1779 B12R0.133 CCNNC(=O)CCC(OC)OC 22a_100000756455_200000082759 [0,1,0,0,0,0|2,0,1]=4 1780 B12R0.133 CCOCC(=O)CCC(OC)OC 1458a_100000211967_100000139399 [0,1,0,0,0,0|1,0,1]=3 1781 B12R0.133 CCOCC(=O)NCC(OC)OC 11a_100000210479_100000211967 [0,1,0,0,0,0|2,0,1]=4 1782 B12R0.133 CCOCC(=O)NCC(OC)OC 1626a_100000210479_100000211967 [0,1,0,0,0,0|2,0,1]=4 1783 B12R0.133 CCOCC(=O)NCC(OC)OC 240690a_100000210479_100000211967 [0,1,0,0,0,0|2,0,1]=4 1784 B12R0.133 CCOCC(=O)NCC(OC)OC 527a_100000210479_100000211967 [0,1,0,0,0,0|2,0,1]=4 1785 B12R0.133 CCOCC(C)OCC(OC)OC 34a_100000718985_100000211822 [0,1,0,0,0,0|2,0,0]=3 1786 B12R0.133 CCOCC(C)OCC(OC)OC 7a_100000718985_100000751394 [0,1,0,0,0,0|2,0,0]=3 1787 B12R0.133 CCSCC(=O)CCC(OC)OC 1458a_100000230394_100000139399 [0,1,0,0,0,0|1,0,1]=3 1788 B12R0.133 CCSCC(=O)NCC(OC)OC 11a_100000210479_100000230394 [0,1,0,0,0,0|2,0,1]=4 1789 B12R0.133 CCSCC(=O)NCC(OC)OC 1626a_100000210479_100000230394 [0,1,0,0,0,0|2,0,1]=4 1790 B12R0.133 CCSCC(=O)NCC(OC)OC 240690a_100000210479_100000230394 [0,1,0,0,0,0|2,0,1]=4 1791 B12R0.133 CCSCC(=O)NCC(OC)OC 527a_100000210479_100000230394 [0,1,0,0,0,0|2,0,1]=4 1792 B12R0.133 CCSCC(C)NCC(CC)OC 270004a_100000731041_200011216171 [0,1,0,0,0,0|3,0,0]=4 1793 B12R0.133 CCSCC(C)NCC(OC)OC 270004a_100000210479_200011216171 [0,1,0,0,0,0|2,0,0]=3 1794 B12R0.133 COC(CCC(=O)CCC#N)OC 1458a_100011934036_100000139399 [0,1,0,0,0,0|1,0,2]=4 1795 B12R0.133 COC(CCC(=O)CCC#N)OC 1458a_200000082759_100011215226 [0,1,0,0,0,0|1,0,2]=4 1796 B12R0.133 COC(CCC(=O)CCCF)OC 1458a_200000082759_100011934791 [0,1,0,0,0,0|1,0,1]=3 1797 B12R0.133 COC(CCC(=O)CCCO)OC 1458a_200000082759_100011215043 [0,1,0,0,0,0|1,0,1]=3 1798 B12R0.133 COC(CCC(=O)CCSC)OC 1458a_100000174002_100000139399 [0,1,0,0,0,0|1,0,1]=3 1799 B12R0.133 COC(CCC(=O)CCSC)OC 1458a_200000082759_100000751147 [0,1,0,0,0,0|1,0,1]=3 1800 B12R0.133 COC(CCC(=O)NCCF)OC 11a_100000724931_200000082759 [0,1,0,0,0,0|2,0,1]=4 1801 B12R0.133 COC(CCC(=O)NCCF)OC 1626a_100000724931_200000082759 [0,1,0,0,0,0|2,0,1]=4 1802 B12R0.133 COC(CCC(=O)NCCF)OC 240690a_100000724931_200000082759 [0,1,0,0,0,0|2,0,1]=4 1803 B12R0.133 COC(CCC(=O)NCCF)OC 527a_100000724931_200000082759 [0,1,0,0,0,0|2,0,1]=4 1804 B12R0.133 COC(CCC(=O)NCCO)OC 240690a_100000210304_200000082759 [0,1,0,0,0,0|2,0,1]=4 1805 B12R0.133 COC(CCC(=O)NCCO)OC 527a_100000210304_200000082759 [0,1,0,0,0,0|2,0,1]=4 1806 B12R0.133 COC(CCN(C)CCC#N)OC 2230a_100000184479_100009813347 [0,1,0,0,0,0|2,0,1]=4 1807 B12R0.133 COC(CCN(C)CCCO)OC 2230a_100000213112_100009813347 [0,1,0,0,0,0|2,0,0]=3 1808 B12R0.133 COC(CCN(C)CCCO)OC 269982a_100000213112_100000139399 [0,1,0,0,0,0|2,0,0]=3 1809 B12R0.133 COC(CCN(C)CCSC)OC 2230a_100000686725_100009813347 [0,1,0,0,0,0|2,0,0]=3 1810 B12R0.133 COC(CCN(C)CCSC)OC 269982a_100000686725_100000139399 [0,1,0,0,0,0|2,0,0]=3 1811 B12R0.133 COC(CNC(=O)CCSC)OC 11a_100000210479_100000174002 [0,1,0,0,0,0|2,0,1]=4 1812 B12R0.133 COC(CNC(=O)CCSC)OC 1626a_100000210479_100000174002 [0,1,0,0,0,0|2,0,1]=4 1813 B12R0.133 COC(CNC(=O)CCSC)OC 240690a_100000210479_100000174002 [0,1,0,0,0,0|2,0,1]=4 1814 B12R0.133 COC(CNC(=O)CCSC)OC 527a_100000210479_100000174002 [0,1,0,0,0,0|2,0,1]=4 1815 B12R0.133 COC(CNC(C)CCSC)OC 270004a_100000210479_100011217047 [0,1,0,0,0,0|2,0,0]=3 1816 B12R0.133 COC(COC(C)CCCCl)OC 34a_200000718107_100000211822 [0,1,0,0,0,0|2,0,0]=3 1817 B12R0.133 COC(COC(C)CCCCl)OC 7a_200000718107_100000751394 [0,1,0,0,0,0|2,0,0]=3 1818 B12R0.133 COCCC(=O)CCC(OC)OC 1458a_100000749529_100000139399 [0,1,0,0,0,0|1,0,1]=3 1819 B12R0.133 COCCC(=O)CCC(OC)OC 1458a_200000082759_100000233755 [0,1,0,0,0,0|1,0,1]=3 1820 B12R0.133 COCCC(=O)NCC(OC)OC 11a_100000210479_100000749529 [0,1,0,0,0,0|2,0,1]=4 1821 B12R0.133 COCCC(=O)NCC(OC)OC 1626a_100000210479_100000749529 [0,1,0,0,0,0|2,0,1]=4 1822 B12R0.133 COCCC(=O)NCC(OC)OC 240690a_100000210479_100000749529 [0,1,0,0,0,0|2,0,1]=4 1823 B12R0.133 COCCC(=O)NCC(OC)OC 527a_100000210479_100000749529 [0,1,0,0,0,0|2,0,1]=4 1824 B12R0.133 COCCC(C)NCC(OC)OC 270004a_100000210479_100000742357 [0,1,0,0,0,0|2,0,0]=3 1825 B12R0.133 COCCN(C)CCC(OC)OC 2230a_100000743101_100009813347 [0,1,0,0,0,0|2,0,0]=3 1826 B12R0.133 COCCN(C)CCC(OC)OC 269982a_100000743101_100000139399 [0,1,0,0,0,0|2,0,0]=3 1827 B12R0.144 C#CCCCC(=O)CC(OC)OC 1458a_100000082724_100000731252 [0,1,0,0,0,0|0,0,3]=4 1828 B12R0.144 C#CCCCC(=O)CC(OC)OC 1458a_100000690238_100000751394 [0,1,0,0,0,0|0,0,3]=4 1829 B12R0.144 C#CCCCN(C)CC(OC)OC 269982a_100000225562_100011215417 [0,1,0,0,0,0|1,0,2]=4 1830 B12R0.144 C#CCCOC(C)CC(OC)OC 7a_100011018202_100000688953 [0,1,0,0,0,0|1,0,2]=4 1831 B12R0.144 C/C=C/COC(C)CC(OC)OC 7a_100011018202_100102629194 [0,1,0,0,0,0|1,0,2]=4 1832 B12R0.144 C=CCCCC(=O)CC(OC)OC 1458a_100000082724_100000757094 [0,1,0,0,0,0|0,0,3]=4 1833 B12R0.144 C=CCCCC(=O)CC(OC)OC 1458a_100000766728_100000751394 [0,1,0,0,0,0|0,0,3]=4 1834 B12R0.144 C=CCCCN(C)CC(OC)OC 269982a_100000225562_100000757094 [0,1,0,0,0,0|1,0,2]=4 1835 B12R0.144 C=CCCNC(C)CC(OC)OC 270004a_100015191253_100000210484 [0,1,0,0,0,0|1,0,2]=4 1836 B12R0.144 C=CCCOC(C)CC(OC)OC 7a_100011018202_100000754431 [0,1,0,0,0,0|1,0,2]=4 1837 B12R0.144 CC#CCOC(C)CC(OC)OC 7a_100011018202_100000748600 [0,1,0,0,0,0|1,0,2]=4 1838 B12R0.144 CC/C=C/CC(=O)CC(OC)OC 1458a_100016274230_100000751394 [0,1,0,0,0,0|0,0,3]=4 1839 B12R0.144 CC/C=C\CC(=O)CC(OC)OC 1458a_100000082724_100103147603 [0,1,0,0,0,0|0,0,3]=4 1840 B12R0.144 CC/C=C\CN(C)CC(OC)OC 269982a_100000225562_100103147603 [0,1,0,0,0,0|1,0,2]=4 1841 B12R0.144 CC=CCOC(C)CC(OC)OC 7a_100011018202_100000070051 [0,1,0,0,0,0|1,0,2]=4 1842 B12R0.144 CCC#CCC(=O)CC(OC)OC 1458a_100000082724_100009813939 [0,1,0,0,0,0|0,0,3]=4 1843 B12R0.144 CCCC#CC(=O)CC(OC)OC 1458a_200011218047_100000751394 [0,1,0,0,0,0|0,0,3]=4 1844 B12R0.144 CCCC=CC(=O)CC(OC)OC 1458a_100000212230_100000751394 [0,1,0,0,0,0|0,0,3]=4 1845 B12R0.144 CCCCCC(=O)CC(CC)CC 1458a_100000212188_100011215472 [0,1,0,0,0,0|2,0,1]=4 1846 B12R0.144 CCCCCC(=O)CC(OC)OC 1458a_100000082724_100000210326 [0,1,0,0,0,0|0,0,1]=2 1847 B12R0.144 CCCCCC(=O)CC(OC)OC 1458a_100000212188_100000751394 [0,1,0,0,0,0|0,0,1]=2 1848 B12R0.144 CCCCCC(C)NC(CC)CC 2230a_100000199018_200011218191 [0,1,0,0,0,0|3,0,0]=4 1849 B12R0.144 CCCCCC(C)NC(CC)CC 270004a_100000199018_100000211708 [0,1,0,0,0,0|3,0,0]=4 1850 B12R0.144 CCCCCC(C)NC(CC)CC 270004a_100000211957_100000210860 [0,1,0,0,0,0|3,0,0]=4 1851 B12R0.144 CCCCCC(C)OC(CC)CC 7a_100000688536_200011218191 [0,1,0,0,0,0|3,0,0]=4 1852 B12R0.144 CCCCCC(C)OC(CC)CC 7a_100011215632_100000210505 [0,1,0,0,0,0|3,0,0]=4 1853 B12R0.144 CCCCCC(C)SC(CC)CC 62a_100000210505_200011218191 [0,1,0,0,0,0|3,0,0]=4 1854 B12R0.144 CCCCCC(C)SC(CC)CC 62a_200011218191_100000210505 [0,1,0,0,0,0|3,0,0]=4 1855 B12R0.144 CCCCCN(C)CC(CC)CC 2230a_100000223495_100011215472 [0,1,0,0,0,0|3,0,0]=4 1856 B12R0.144 CCCCCN(C)CC(CC)CC 269982a_100000223495_100011215472 [0,1,0,0,0,0|3,0,0]=4 1857 B12R0.144 CCCCCN(C)CC(CC)CC 270004a_100000223495_100000211137 [0,1,0,0,0,0|3,0,0]=4 1858 B12R0.144 CCCCCN(C)CC(OC)OC 2230a_100000223495_100000751394 [0,1,0,0,0,0|1,0,0]=2 1859 B12R0.144 CCCCCN(C)CC(OC)OC 269982a_100000225562_100000210215 [0,1,0,0,0,0|1,0,0]=2 1860 B12R0.144 CCCCCN(C)CC(OC)OC 270004a_100000223495_100000752162 [0,1,0,0,0,0|1,0,0]=2 1861 B12R0.144 CCCCNC(=O)CC(OC)OC 11a_100000102301_100000082724 [0,1,0,0,0,0|1,0,1]=3 1862 B12R0.144 CCCCNC(=O)CC(OC)OC 1626a_100000102301_100000082724 [0,1,0,0,0,0|1,0,1]=3 1863 B12R0.144 CCCCNC(=O)CC(OC)OC 240690a_100000102301_100000082724 [0,1,0,0,0,0|1,0,1]=3 1864 B12R0.144 CCCCNC(=O)CC(OC)OC 527a_100000102301_100000082724 [0,1,0,0,0,0|1,0,1]=3 1865 B12R0.144 CCCCNC(C)CC(OC)OC 270004a_100000102301_100000210484 [0,1,0,0,0,0|1,0,0]=2 1866 B12R0.144 CCCCOC(C)CC(OC)OC 7a_100011018202_100000210211 [0,1,0,0,0,0|1,0,0]=2 1867 B12R0.144 CCCNN=C(C)CC(OC)OC 4a_100000740057_100000210484 [0,1,0,0,0,0|2,0,1]=4 1868 B12R0.144 CCCNNC(=O)CC(OC)OC 22a_100000740057_100000082724 [0,1,0,0,0,0|2,0,1]=4 1869 B12R0.144 CCCOCC(=O)CC(OC)OC 1458a_100000745993_100000751394 [0,1,0,0,0,0|1,0,1]=3 1870 B12R0.144 CCCSCC(=O)CC(OC)OC 1458a_100000217233_100000751394 [0,1,0,0,0,0|1,0,1]=3 1871 B12R0.144 CCOCCC(=O)CC(OC)OC 1458a_100000082724_100011215890 [0,1,0,0,0,0|1,0,1]=3 1872 B12R0.144 CCOCCC(=O)CC(OC)OC 1458a_100000749530_100000751394 [0,1,0,0,0,0|1,0,1]=3 1873 B12R0.144 CCOCCN(C)CC(OC)OC 269982a_100000225562_100011215890 [0,1,0,0,0,0|2,0,0]=3 1874 B12R0.144 CCSCCC(=O)CC(OC)OC 1458a_100000082724_100000757381 [0,1,0,0,0,0|1,0,1]=3 1875 B12R0.144 CCSCCC(=O)CC(OC)OC 1458a_100000230768_100000751394 [0,1,0,0,0,0|1,0,1]=3 1876 B12R0.144 CCSCCN(C)CC(OC)OC 269982a_100000225562_100000757381 [0,1,0,0,0,0|2,0,0]=3 1877 B12R0.144 COC(CC(=O)CCCC#N)OC 1458a_100000075515_100000751394 [0,1,0,0,0,0|1,0,2]=4 1878 B12R0.144 COC(CC(=O)CCCC#N)OC 1458a_100000082724_100000211468 [0,1,0,0,0,0|1,0,2]=4 1879 B12R0.144 COC(CC(=O)CCCCF)OC 1458a_100000082724_100000729493 [0,1,0,0,0,0|1,0,1]=3 1880 B12R0.144 COC(CC(=O)CCCCO)OC 1458a_100000082724_100000210776 [0,1,0,0,0,0|1,0,1]=3 1881 B12R0.144 COC(CC(=O)CCCCO)OC 1458a_100000695505_100000751394 [0,1,0,0,0,0|1,0,1]=3 1882 B12R0.144 COC(CC(=O)CCCSC)OC 1458a_100000173376_100000751394 [0,1,0,0,0,0|1,0,1]=3 1883 B12R0.144 COC(CC(=O)COCCO)OC 1458a_100000708028_100000751394 [0,1,0,0,0,0|2,0,1]=4 1884 B12R0.144 COC(CC(=O)NCCCF)OC 11a_100015189416_100000082724 [0,1,0,0,0,0|2,0,1]=4 1885 B12R0.144 COC(CC(=O)NCCCF)OC 1626a_100015189416_100000082724 [0,1,0,0,0,0|2,0,1]=4 1886 B12R0.144 COC(CC(=O)NCCCF)OC 240690a_100015189416_100000082724 [0,1,0,0,0,0|2,0,1]=4 1887 B12R0.144 COC(CC(=O)NCCCF)OC 527a_100015189416_100000082724 [0,1,0,0,0,0|2,0,1]=4 1888 B12R0.144 COC(CC(=O)NCCCO)OC 240690a_100000182051_100000082724 [0,1,0,0,0,0|2,0,1]=4 1889 B12R0.144 COC(CC(=O)NCCCO)OC 527a_100000182051_100000082724 [0,1,0,0,0,0|2,0,1]=4 1890 B12R0.144 COC(CC(=O)NCCSC)OC 11a_100020590264_100000082724 [0,1,0,0,0,0|2,0,1]=4 1891 B12R0.144 COC(CC(=O)NCCSC)OC 1626a_100020590264_100000082724 [0,1,0,0,0,0|2,0,1]=4 1892 B12R0.144 COC(CC(=O)NCCSC)OC 240690a_100020590264_100000082724 [0,1,0,0,0,0|2,0,1]=4 1893 B12R0.144 COC(CC(=O)NCCSC)OC 527a_100020590264_100000082724 [0,1,0,0,0,0|2,0,1]=4 1894 B12R0.144 COC(CC(C)NCCC#N)OC 270004a_100000720768_100000210484 [0,1,0,0,0,0|2,0,1]=4 1895 B12R0.144 COC(CC(C)NCCCF)OC 270004a_100015189416_100000210484 [0,1,0,0,0,0|2,0,0]=3 1896 B12R0.144 COC(CC(C)NCCCO)OC 270004a_100000182051_100000210484 [0,1,0,0,0,0|2,0,0]=3 1897 B12R0.144 COC(CC(C)NCCSC)OC 270004a_100020590264_100000210484 [0,1,0,0,0,0|2,0,0]=3 1898 B12R0.144 COC(CC(C)OCCC#N)OC 7a_100011018202_100000184422 [0,1,0,0,0,0|2,0,1]=4 1899 B12R0.144 COC(CC(C)OCCCF)OC 7a_100011018202_100011934791 [0,1,0,0,0,0|2,0,0]=3 1900 B12R0.144 COC(CC(C)OCCCO)OC 7a_100011018202_100011215043 [0,1,0,0,0,0|2,0,0]=3 1901 B12R0.144 COC(CC(C)OCCSC)OC 7a_100011018202_100000212216 [0,1,0,0,0,0|2,0,0]=3 1902 B12R0.144 COC(CN(C)CCCC#N)OC 269982a_100000225562_100000687738 [0,1,0,0,0,0|2,0,1]=4 1903 B12R0.144 COC(CN(C)CCCC=O)OC 269982a_100000225562_200011292268 [0,1,0,0,0,0|2,0,1]=4 1904 B12R0.144 COC(CN(C)CCCCF)OC 269982a_100000225562_100000729493 [0,1,0,0,0,0|2,0,0]=3 1905 B12R0.144 COC(CN(C)CCCCO)OC 2230a_100000717598_100000751394 [0,1,0,0,0,0|2,0,0]=3 1906 B12R0.144 COC(CN(C)CCCCO)OC 269982a_100000225562_100000210776 [0,1,0,0,0,0|2,0,0]=3 1907 B12R0.144 COC(CN(C)CCCCO)OC 270004a_100000717598_100000752162 [0,1,0,0,0,0|2,0,0]=3 1908 B12R0.144 COCCCC(=O)CC(OC)OC 1458a_100000082724_100000740836 [0,1,0,0,0,0|1,0,1]=3 1909 B12R0.144 COCCCC(=O)CC(OC)OC 1458a_100000741012_100000751394 [0,1,0,0,0,0|1,0,1]=3 1910 B12R0.144 COCCCN(C)CC(OC)OC 2230a_100000224831_100000751394 [0,1,0,0,0,0|2,0,0]=3 1911 B12R0.144 COCCCN(C)CC(OC)OC 269982a_100000225562_100000740836 [0,1,0,0,0,0|2,0,0]=3 1912 B12R0.144 COCCCN(C)CC(OC)OC 270004a_100000224831_100000752162 [0,1,0,0,0,0|2,0,0]=3 1913 B12R0.144 COCCNC(=O)CC(OC)OC 1626a_100000209980_100000082724 [0,1,0,0,0,0|2,0,1]=4 1914 B12R0.144 COCCNC(=O)CC(OC)OC 240690a_100000209980_100000082724 [0,1,0,0,0,0|2,0,1]=4 1915 B12R0.144 COCCNC(=O)CC(OC)OC 527a_100000209980_100000082724 [0,1,0,0,0,0|2,0,1]=4 1916 B12R0.144 COCCNC(C)CC(OC)OC 270004a_100000209980_100000210484 [0,1,0,0,0,0|2,0,0]=3 1917 B12R0.144 COCCOC(C)CC(OC)OC 7a_100011018202_100000233755 [0,1,0,0,0,0|2,0,0]=3 1918 B12R0.201 CCCCCCCC(CC)N(C)C 270004a_100102631434_200011217162 [0,1,0,0,0,0|2,0,0]=3 1919 B12R0.201 CCCCCCCN(CC)C(=O)C 11a_100000228213_100015343762 [0,1,0,0,0,0|3,0,0]=4 1920 B12R0.201 CCCCCCCN(CC)C(=O)C 1626a_100000228213_100015343762 [0,1,0,0,0,0|3,0,0]=4 1921 B12R0.201 CCCCCCCN(CC)C(=O)C 240690a_100000228213_100015343762 [0,1,0,0,0,0|3,0,0]=4 1922 B12R0.201 CCCCCCCN(CC)C(=O)C 527a_100000228213_100103153847 [0,1,0,0,0,0|3,0,0]=4 1923 B12R0.201 CCCCCCCN(CC)C(C)C 2230a_100000223864_100000210681 [0,1,0,0,0,0|3,0,0]=4 1924 B12R0.201 CCCCCCCN(CC)C(C)C 2230a_100000228213_100000210206 [0,1,0,0,0,0|3,0,0]=4 1925 B12R0.201 CCCCCCCN(CC)C(C)C 269982a_100000223864_100000210681 [0,1,0,0,0,0|3,0,0]=4 1926 B12R0.201 CCCCCCCN(CC)C(C)C 269982a_100000228213_100000210206 [0,1,0,0,0,0|3,0,0]=4 1927 B12R0.201 CCCCCCNC(CC)C(C)C 270004a_100000210581_100000210600 [0,1,0,0,0,0|3,0,0]=4 1928 B12R0.201 CCCCCCN[C@@H](CC)[C@@H](C)O 2230a_100161114882_100000210314 [0,1,0,0,0,0|3,0,0]=4 1929 B12R0.201 CCCCCCN[C@@H](CC)[C@@H](C)O 34a_100161114882_100000210314 [0,1,0,0,0,0|3,0,0]=4 1930 B12R0.201 CCCCCCOC(CC)C(C)C 34a_100011218073_100000210314 [0,1,0,0,0,0|3,0,0]=4 1931 B12R0.201 CCCCCCOC(CC)C(C)C 7a_100011218073_100000210314 [0,1,0,0,0,0|3,0,0]=4 1932 B12R0.201 CCCCCNCC(CC)C(C)C 269862a_100000209983_100011214906 [0,1,0,0,0,0|3,0,0]=4 1933 B12R0.201 CCCCCOCC(CC)C(C)C 34a_100011995916_100000718602 [0,1,0,0,0,0|3,0,0]=4 1934 B12R0.201 CCCCCOCC(CC)C(C)C 7a_100011995916_100000210326 [0,1,0,0,0,0|3,0,0]=4 1935 B12R0.265 C#CCC(=O)CCCC(OC)OC 1458a_100011220946_100000069011 [0,1,0,0,0,0|0,0,3]=4 1936 B12R0.265 C#CCC(C)OCCC(OC)OC 34a_100000685586_100000139399 [0,1,0,0,0,0|1,0,2]=4 1937 B12R0.265 C#CCC(C)OCCC(OC)OC 7a_100000685586_100009813347 [0,1,0,0,0,0|1,0,2]=4 1938 B12R0.265 C#CCN(C)CCCC(OC)OC 2230a_100000225692_100000069011 [0,1,0,0,0,0|1,0,2]=4 1939 B12R0.265 C#CCN(C)CCCC(OC)OC 34a_100000225692_100000069011 [0,1,0,0,0,0|1,0,2]=4 1940 B12R0.265 C/C=C/C(C)OCCC(OC)OC 34a_200102604097_100000139399 [0,1,0,0,0,0|1,0,2]=4 1941 B12R0.265 C=CCC(=O)CCCC(OC)OC 1458a_100000210193_100000069011 [0,1,0,0,0,0|0,0,3]=4 1942 B12R0.265 C=CCC(C)COCC(OC)OC 34a_100009832082_100000211822 [0,1,0,0,0,0|1,0,2]=4 1943 B12R0.265 C=CCC(C)COCC(OC)OC 7a_100009832082_100000751394 [0,1,0,0,0,0|1,0,2]=4 1944 B12R0.265 C=CCN(C)CCCC(OC)OC 2230a_100000225617_100000069011 [0,1,0,0,0,0|1,0,2]=4 1945 B12R0.265 C=CCN(C)CCCC(OC)OC 269982a_100000225617_100000069011 [0,1,0,0,0,0|1,0,2]=4 1946 B12R0.265 C=CC[C@@H](C)OCCC(OC)OC 34a_100000731007_100000139399 [0,1,0,0,0,0|1,0,2]=4 1947 B12R0.265 C=CC[C@@H](C)OCCC(OC)OC 7a_100000731007_100009813347 [0,1,0,0,0,0|1,0,2]=4 1948 B12R0.265 C=CC[C@@H](N)COCC(OC)OC 34a_100020615467_100000211822 [0,1,0,0,0,0|1,0,2]=4 1949 B12R0.265 CC#CC(=O)CCCC(OC)OC 1458a_100000763181_100000069011 [0,1,0,0,0,0|0,0,3]=4 1950 B12R0.265 CC#CC(C)OCCC(OC)OC 34a_100011216543_100000139399 [0,1,0,0,0,0|1,0,2]=4 1951 B12R0.265 CC=CC(=O)CCCC(OC)OC 1458a_100000210699_100000069011 [0,1,0,0,0,0|0,0,3]=4 1952 B12R0.265 CCC(COCC(O)COC)OC 34a_100011934954_100011215053 [0,1,0,0,0,0|3,0,0]=4 1953 B12R0.265 CCC(COCC(O)COC)OC 7a_100011934954_100011215053 [0,1,0,0,0,0|3,0,0]=4 1954 B12R0.265 CCCC(=O)CCCC(OC)OC 1458a_100000211992_100000069011 [0,1,0,0,0,0|0,0,1]=2 1955 B12R0.265 CCCC(=O)COCC(CC)OC 7a_100011934954_100000747444 [0,1,0,0,0,0|2,0,1]=4 1956 B12R0.265 CCCC(=O)CSCC(OC)OC 62a_100000747444_100000751394 [0,1,0,0,0,0|1,0,1]=3 1957 B12R0.265 CCCC(=O)CSCC(OC)OC 62a_100000751394_100000747444 [0,1,0,0,0,0|1,0,1]=3 1958 B12R0.265 CCCC(C)CCOC(CC)CC 7a_100011217855_100000210505 [0,1,0,0,0,0|3,0,0]=4 1959 B12R0.265 CCCC(C)CNCC(CC)CC 2230a_100102946423_100011216630 [0,1,0,0,0,0|3,0,0]=4 1960 B12R0.265 CCCC(C)CNCC(CC)CC 270004a_100102946423_100000243154 [0,1,0,0,0,0|3,0,0]=4 1961 B12R0.265 CCCC(C)CNCC(CC)OC 270004a_100000731041_100000243154 [0,1,0,0,0,0|2,0,0]=3 1962 B12R0.265 CCCC(C)CNCC(OC)OC 270004a_100000210479_100000243154 [0,1,0,0,0,0|1,0,0]=2 1963 B12R0.265 CCCC(C)COCC(CC)CC 34a_100000688023_100011215472 [0,1,0,0,0,0|3,0,0]=4 1964 B12R0.265 CCCC(C)COCC(CC)CC 7a_100000688023_100011215472 [0,1,0,0,0,0|3,0,0]=4 1965 B12R0.265 CCCC(C)COCC(CC)CC 7a_100000703878_100011216630 [0,1,0,0,0,0|3,0,0]=4 1966 B12R0.265 CCCC(C)COCC(CC)OC 34a_100011934954_100011216630 [0,1,0,0,0,0|2,0,0]=3 1967 B12R0.265 CCCC(C)COCC(CC)OC 7a_100011934954_100011216630 [0,1,0,0,0,0|2,0,0]=3 1968 B12R0.265 CCCC(C)COCC(OC)OC 34a_100000688023_100000211822 [0,1,0,0,0,0|1,0,0]=2 1969 B12R0.265 CCCC(C)COCC(OC)OC 34a_100011216393_100011216630 [0,1,0,0,0,0|1,0,0]=2 1970 B12R0.265 CCCC(C)COCC(OC)OC 7a_100000688023_100000751394 [0,1,0,0,0,0|1,0,0]=2 1971 B12R0.265 CCCC(C)CSCC(CC)CC 62a_100011215472_100011216630 [0,1,0,0,0,0|3,0,0]=4 1972 B12R0.265 CCCC(C)CSCC(CC)CC 62a_100011216630_100011215472 [0,1,0,0,0,0|3,0,0]=4 1973 B12R0.265 CCCC(C)CSCC(OC)OC 62a_100000751394_100011216630 [0,1,0,0,0,0|1,0,0]=2 1974 B12R0.265 CCCC(C)CSCC(OC)OC 62a_100011216630_100000751394 [0,1,0,0,0,0|1,0,0]=2 1975 B12R0.265 CCCC(C)NCCC(OC)OC 2230a_100000741246_100009813347 [0,1,0,0,0,0|1,0,0]=2 1976 B12R0.265 CCCC(C)OCCC(OC)OC 34a_100000764384_100000139399 [0,1,0,0,0,0|1,0,0]=2 1977 B12R0.265 CCCC(C)OCCC(OC)OC 7a_100000764384_100009813347 [0,1,0,0,0,0|1,0,0]=2 1978 B12R0.265 CCCC(C)SCCC(OC)OC 62a_100000139399_100000766640 [0,1,0,0,0,0|1,0,0]=2 1979 B12R0.265 CCCC(C)SCCC(OC)OC 62a_100000766640_100000139399 [0,1,0,0,0,0|1,0,0]=2 1980 B12R0.265 CCCN(C)CCCC(OC)OC 2230a_100000747261_100000069011 [0,1,0,0,0,0|1,0,0]=2 1981 B12R0.265 CCCN(C)CCCC(OC)OC 269982a_100000747261_100000069011 [0,1,0,0,0,0|1,0,0]=2 1982 B12R0.265 CCC[C@H](N)COCC(CC)CC 34a_100000732646_100011215472 [0,1,0,0,0,0|3,0,0]=4 1983 B12R0.265 CCC[C@H](N)COCC(OC)OC 34a_100000732646_100000211822 [0,1,0,0,0,0|1,0,0]=2 1984 B12R0.265 CCNC(=O)CNCC(OC)OC 2230a_100016988866_100000751394 [0,1,0,0,0,0|2,0,1]=4 1985 B12R0.265 CCNC(=O)CNCC(OC)OC 270004a_100016988866_100000752162 [0,1,0,0,0,0|2,0,1]=4 1986 B12R0.265 CCNC(=O)COCC(OC)OC 34a_100011216393_100000183381 [0,1,0,0,0,0|2,0,1]=4 1987 B12R0.265 CCNC(=O)CSCC(OC)OC 62a_100000183381_100000751394 [0,1,0,0,0,0|2,0,1]=4 1988 B12R0.265 CCNC(=O)CSCC(OC)OC 62a_100000751394_100000183381 [0,1,0,0,0,0|2,0,1]=4 1989 B12R0.265 CCOC(=O)COCC(OC)OC 34a_100011216393_100000188475 [0,1,0,0,0,0|2,0,1]=4 1990 B12R0.265 CCOC(=O)CSCC(OC)OC 62a_100000188475_100000751394 [0,1,0,0,0,0|2,0,1]=4 1991 B12R0.265 CCOC(=O)CSCC(OC)OC 62a_100000751394_100000188475 [0,1,0,0,0,0|2,0,1]=4 1992 B12R0.265 COC(CCCC(=O)CC#N)OC 1458a_100051588842_100000069011 [0,1,0,0,0,0|1,0,2]=4 1993 B12R0.265 COC(CCCC(=O)CCO)OC 1458a_100011216618_100000069011 [0,1,0,0,0,0|1,0,1]=3 1994 B12R0.265 COC(CCCC(=O)CSC)OC 1458a_100000184570_100000069011 [0,1,0,0,0,0|1,0,1]=3 1995 B12R0.265 COC(CCCN(C)CC#N)OC 2230a_100000748184_100000069011 [0,1,0,0,0,0|2,0,1]=4 1996 B12R0.265 COC(CCCN(C)CCO)OC 2230a_100000210263_100000069011 [0,1,0,0,0,0|2,0,0]=3 1997 B12R0.265 COC(CCCN(C)CCO)OC 269982a_100000210263_100000069011 [0,1,0,0,0,0|2,0,0]=3 1998 B12R0.265 COC(CCN[C@@H](C)CC#N)OC 2230a_100016994482_100009813347 [0,1,0,0,0,0|2,0,1]=4 1999 B12R0.265 COC(CCN[C@H](C)CCO)OC 2230a_100000706166_100009813347 [0,1,0,0,0,0|2,0,0]=3 2000 B12R0.265 COC(CCN[C@H](C)CCO)OC 34a_100000706166_100000139399 [0,1,0,0,0,0|2,0,0]=3 2001 B12R0.265 COC(CCOC(C)CCBr)OC 34a_100012276601_100000139399 [0,1,0,0,0,0|2,0,0]=3 2002 B12R0.265 COC(CCSC(C)CC#N)OC 62a_100000139399_100009813641 [0,1,0,0,0,0|2,0,1]=4 2003 B12R0.265 COC(CCSC(C)CC#N)OC 62a_100009813641_100000139399 [0,1,0,0,0,0|2,0,1]=4 2004 B12R0.265 COC(CCSC(C)CCO)OC 62a_100000139399_100009893172 [0,1,0,0,0,0|2,0,0]=3 2005 B12R0.265 COC(CCSC(C)CCO)OC 62a_100009893172_100000139399 [0,1,0,0,0,0|2,0,0]=3 2006 B12R0.265 COC(COCC(C)CCN)OC 34a_106354213184_100000211822 [0,1,0,0,0,0|2,0,0]=3 2007 B12R0.265 COC(CSC[C@@H](O)CC#N)OC 62a_100000001066_100000751394 [0,1,0,0,0,0|2,0,1]=4 2008 B12R0.265 COC(CSC[C@@H](O)CC#N)OC 62a_100000751394_100000001066 [0,1,0,0,0,0|2,0,1]=4 2009 B12R0.265 COCC(=O)CCCC(OC)OC 1458a_100000210968_100000069011 [0,1,0,0,0,0|1,0,1]=3 2010 B12R0.265 COCC(C)SCCC(OC)OC 62a_100000139399_100000765312 [0,1,0,0,0,0|2,0,0]=3 2011 B12R0.265 COCC(C)SCCC(OC)OC 62a_100000765312_100000139399 [0,1,0,0,0,0|2,0,0]=3 2012 B12R0.265 COCC(N)COCC(OC)OC 34a_100000724102_100000211822 [0,1,0,0,0,0|2,0,0]=3 2013 B12R0.265 COCC(O)CNCC(OC)OC 2230a_100000756049_100000751394 [0,1,0,0,0,0|2,0,0]=3 2014 B12R0.265 COCC(O)CNCC(OC)OC 270004a_100000756049_100000752162 [0,1,0,0,0,0|2,0,0]=3 2015 B12R0.265 COCC(O)CNCC(OC)OC 34a_100000756049_100000211822 [0,1,0,0,0,0|2,0,0]=3 2016 B12R0.265 COCC(O)COCC(OC)OC 34a_100011216393_100011215053 [0,1,0,0,0,0|2,0,0]=3 2017 B12R0.265 COCC(O)CSCC(OC)OC 62a_100000751394_100011215053 [0,1,0,0,0,0|2,0,0]=3 2018 B12R0.265 COCC(O)CSCC(OC)OC 62a_100011215053_100000751394 [0,1,0,0,0,0|2,0,0]=3 2019 B12R0.265 COC[C@@H](C)NCCC(OC)OC 2230a_100000764878_100009813347 [0,1,0,0,0,0|2,0,0]=3 2020 B12R0.265 COC[C@@H](C)OCCC(OC)OC 34a_100011934205_100000139399 [0,1,0,0,0,0|2,0,0]=3 2021 B12R0.435 C#CCCCNCC(C)(OC)OC 2230a_100000732740_100000731252 [0,1,0,0,0,0|1,0,2]=4 2022 B12R0.435 C#CCCCNCC(C)(OC)OC 34a_100000718082_100000766008 [0,1,0,0,0,0|1,0,2]=4 2023 B12R0.435 C#CCCCOCC(C)(OC)OC 34a_100000215630_100000766008 [0,1,0,0,0,0|1,0,2]=4 2024 B12R0.435 C#CCCCSCC(C)(OC)OC 62a_100000766008_100011215417 [0,1,0,0,0,0|1,0,2]=4 2025 B12R0.435 C#CCCCSCC(C)(OC)OC 62a_100011215417_100000766008 [0,1,0,0,0,0|1,0,2]=4 2026 B12R0.435 C/C=C/CCOCC(C)(OC)OC 34a_100016278192_100000766008 [0,1,0,0,0,0|1,0,2]=4 2027 B12R0.435 C=CCCCNCC(C)(OC)OC 2230a_100000700776_100000064154 [0,1,0,0,0,0|1,0,2]=4 2028 B12R0.435 C=CCCCNCC(C)(OC)OC 2230a_100000732740_100011713584 [0,1,0,0,0,0|1,0,2]=4 2029 B12R0.435 C=CCCCNCC(C)(OC)OC 34a_100000700776_100000766008 [0,1,0,0,0,0|1,0,2]=4 2030 B12R0.435 C=CCCCOCC(C)(OC)OC 34a_100000758997_100000766008 [0,1,0,0,0,0|1,0,2]=4 2031 B12R0.435 C=CCCCSCC(C)(OC)OC 62a_100000766008_100000757094 [0,1,0,0,0,0|1,0,2]=4 2032 B12R0.435 C=CCCCSCC(C)(OC)OC 62a_100011713584_100000766008 [0,1,0,0,0,0|1,0,2]=4 2033 B12R0.435 CC#CCCOCC(C)(OC)OC 34a_100000750427_100000766008 [0,1,0,0,0,0|1,0,2]=4 2034 B12R0.435 CC/C=C\CNCC(C)(OC)OC 2230a_100000732740_100103147603 [0,1,0,0,0,0|1,0,2]=4 2035 B12R0.435 CC/C=C\COCC(C)(OC)OC 34a_100016268518_100000766008 [0,1,0,0,0,0|1,0,2]=4 2036 B12R0.435 CC/C=C\CSCC(C)(OC)OC 62a_100000766008_100103147603 [0,1,0,0,0,0|1,0,2]=4 2037 B12R0.435 CC/C=C\CSCC(C)(OC)OC 62a_100103147603_100000766008 [0,1,0,0,0,0|1,0,2]=4 2038 B12R0.435 CCC#CCNCC(C)(OC)OC 2230a_100000732740_100009813939 [0,1,0,0,0,0|1,0,2]=4 2039 B12R0.435 CCC#CCOCC(C)(OC)OC 34a_100000032950_100000766008 [0,1,0,0,0,0|1,0,2]=4 2040 B12R0.435 CCC#CCSCC(C)(OC)OC 62a_100000766008_100009813939 [0,1,0,0,0,0|1,0,2]=4 2041 B12R0.435 CCC#CCSCC(C)(OC)OC 62a_100009813939_100000766008 [0,1,0,0,0,0|1,0,2]=4 2042 B12R0.435 CCCCCCOC(C)(CC)CC 7a_100000210259_100009817345 [0,1,0,0,0,0|3,0,0]=4 2043 B12R0.435 CCCCCCOC(C)(CC)CC 7a_100000755174_100000210314 [0,1,0,0,0,0|3,0,0]=4 2044 B12R0.435 CCCCCCSC(C)(CC)CC 62a_100000210314_100009817345 [0,1,0,0,0,0|3,0,0]=4 2045 B12R0.435 CCCCCCSC(C)(CC)CC 62a_100009817345_100000210757 [0,1,0,0,0,0|3,0,0]=4 2046 B12R0.435 CCCCCNCC(C)(OC)OC 2230a_100000209983_100000064154 [0,1,0,0,0,0|1,0,0]=2 2047 B12R0.435 CCCCCNCC(C)(OC)OC 2230a_100000732740_100000210326 [0,1,0,0,0,0|1,0,0]=2 2048 B12R0.435 CCCCCOCC(C)(OC)OC 34a_100000210253_100000766008 [0,1,0,0,0,0|1,0,0]=2 2049 B12R0.435 CCCCCOCP(=O)(OC)OC 34a_100000101693_100000718602 [0,1,0,0,0,0|2,0,0]=3 2050 B12R0.435 CCCCCSCC(C)(OC)OC 62a_100000210326_100000766008 [0,1,0,0,0,0|1,0,0]=2 2051 B12R0.435 CCCCCSCC(C)(OC)OC 62a_100000766008_100000210326 [0,1,0,0,0,0|1,0,0]=2 2052 B12R0.435 CCCCCSC[Si](C)(OC)OC 62a_100000067953_100000210326 [0,1,0,0,0,0|1,1,0]=3 2053 B12R0.435 CCCCCSC[Si](C)(OC)OC 62a_100000210326_100000067953 [0,1,0,0,0,0|1,1,0]=3 2054 B12R0.435 CCCCOCCP(=O)(OC)OC 34a_200000043213_100000210210 [0,1,0,0,0,0|2,0,0]=3 2055 B12R0.435 CCCOCCC[Si](C)(OC)OC 34a_100000210258_100000031653 [0,1,0,0,0,0|1,1,0]=3 2056 B12R0.435 CCCSCCC[Si](C)(OC)OC 62a_100000031653_100000210303 [0,1,0,0,0,0|1,1,0]=3 2057 B12R0.435 CCCSCCC[Si](C)(OC)OC 62a_100000210303_100000031653 [0,1,0,0,0,0|1,1,0]=3 2058 B12R0.435 CCOCCNCC(C)(OC)OC 2230a_100000732740_100011215890 [0,1,0,0,0,0|2,0,0]=3 2059 B12R0.435 CCOCCNCC(C)(OC)OC 2230a_102516460346_100000064154 [0,1,0,0,0,0|2,0,0]=3 2060 B12R0.435 CCOCCNCC(C)(OC)OC 34a_102516460346_100000766008 [0,1,0,0,0,0|2,0,0]=3 2061 B12R0.435 CCOCCOCC(C)(OC)OC 34a_100000210136_100000766008 [0,1,0,0,0,0|2,0,0]=3 2062 B12R0.435 CCOCCOCP(=O)(OC)OC 34a_100000101693_100000210147 [0,1,0,0,0,0|3,0,0]=4 2063 B12R0.435 CCOCCSCC(C)(OC)OC 62a_100000210147_100000766008 [0,1,0,0,0,0|2,0,0]=3 2064 B12R0.435 CCOCCSCC(C)(OC)OC 62a_100000766008_100011215890 [0,1,0,0,0,0|2,0,0]=3 2065 B12R0.435 CCOCCSC[Si](C)(OC)OC 62a_100000067953_100011215890 [0,1,0,0,0,0|2,1,0]=4 2066 B12R0.435 CCOCCSC[Si](C)(OC)OC 62a_100000210147_100000067953 [0,1,0,0,0,0|2,1,0]=4 2067 B12R0.435 CCSCCNCC(C)(OC)OC 2230a_100000106463_100000064154 [0,1,0,0,0,0|2,0,0]=3 2068 B12R0.435 CCSCCNCC(C)(OC)OC 2230a_100000732740_100000757381 [0,1,0,0,0,0|2,0,0]=3 2069 B12R0.435 CCSCCOCC(C)(OC)OC 34a_100000212035_100000766008 [0,1,0,0,0,0|2,0,0]=3 2070 B12R0.435 CCSCCOCP(=O)(OC)OC 34a_100000101693_100000757381 [0,1,0,0,0,0|3,0,0]=4 2071 B12R0.435 CCSCCSCC(C)(OC)OC 62a_100000757381_100000766008 [0,1,0,0,0,0|2,0,0]=3 2072 B12R0.435 CCSCCSCC(C)(OC)OC 62a_100000766008_100000757381 [0,1,0,0,0,0|2,0,0]=3 2073 B12R0.435 CCSCCSC[Si](C)(OC)OC 62a_100000067953_100000757381 [0,1,0,0,0,0|2,1,0]=4 2074 B12R0.435 CCSCCSC[Si](C)(OC)OC 62a_100000757381_100000067953 [0,1,0,0,0,0|2,1,0]=4 2075 B12R0.435 CNCCCOCC(C)(OC)OC 34a_100000213112_100000766008 [0,1,0,0,0,0|2,0,0]=3 2076 B12R0.435 COC(C)(CNCCCC#N)OC 2230a_100000732740_100000687738 [0,1,0,0,0,0|2,0,1]=4 2077 B12R0.435 COC(C)(CNCCCC=O)OC 2230a_100000732740_200011292268 [0,1,0,0,0,0|2,0,1]=4 2078 B12R0.435 COC(C)(CNCCCCF)OC 2230a_100000732740_100000729493 [0,1,0,0,0,0|2,0,0]=3 2079 B12R0.435 COC(C)(CNCCCCO)OC 2230a_100000732740_100000210776 [0,1,0,0,0,0|2,0,0]=3 2080 B12R0.435 COC(C)(CNCCCCO)OC 2230a_100000750430_100000064154 [0,1,0,0,0,0|2,0,0]=3 2081 B12R0.435 COC(C)(CNCCCCO)OC 34a_100000750430_100000766008 [0,1,0,0,0,0|2,0,0]=3 2082 B12R0.435 COC(C)(CNCCCSC)OC 2230a_100000749238_100000064154 [0,1,0,0,0,0|2,0,0]=3 2083 B12R0.435 COC(C)(COCCCCBr)OC 34a_100011216708_100000766008 [0,1,0,0,0,0|2,0,0]=3 2084 B12R0.435 COC(C)(COCCCCCl)OC 34a_100000210776_100000766008 [0,1,0,0,0,0|2,0,0]=3 2085 B12R0.435 COC(C)(COCCCCF)OC 34a_100011995726_100000766008 [0,1,0,0,0,0|2,0,0]=3 2086 B12R0.435 COC(C)(COCCCCI)OC 34a_200012148704_100000766008 [0,1,0,0,0,0|2,0,0]=3 2087 B12R0.435 COC(C)(COCCCCN)OC 34a_100000750430_100000766008 [0,1,0,0,0,0|2,0,0]=3 2088 B12R0.435 COC(C)(COCCCSC)OC 34a_100000690336_100000766008 [0,1,0,0,0,0|2,0,0]=3 2089 B12R0.435 COC(C)(CSCCCC#N)OC 62a_100000687738_100000766008 [0,1,0,0,0,0|2,0,1]=4 2090 B12R0.435 COC(C)(CSCCCC#N)OC 62a_100000766008_100000687738 [0,1,0,0,0,0|2,0,1]=4 2091 B12R0.435 COC(C)(CSCCCC=O)OC 62a_100000766008_200011292268 [0,1,0,0,0,0|2,0,1]=4 2092 B12R0.435 COC(C)(CSCCCC=O)OC 62a_200011292268_100000766008 [0,1,0,0,0,0|2,0,1]=4 2093 B12R0.435 COC(C)(CSCCCCF)OC 62a_100000729493_100000766008 [0,1,0,0,0,0|2,0,0]=3 2094 B12R0.435 COC(C)(CSCCCCF)OC 62a_100000766008_100000729493 [0,1,0,0,0,0|2,0,0]=3 2095 B12R0.435 COC(C)(CSCCCCO)OC 62a_100000210776_100000766008 [0,1,0,0,0,0|2,0,0]=3 2096 B12R0.435 COC(C)(CSCCCCO)OC 62a_100000766008_100000210776 [0,1,0,0,0,0|2,0,0]=3 2097 B12R0.435 COCCCNCC(C)(OC)OC 2230a_100000732740_100000740836 [0,1,0,0,0,0|2,0,0]=3 2098 B12R0.435 COCCCNCC(C)(OC)OC 34a_100150723488_100000766008 [0,1,0,0,0,0|2,0,0]=3 2099 B12R0.435 COCCCOCC(C)(OC)OC 34a_100000740835_100000766008 [0,1,0,0,0,0|2,0,0]=3 2100 B12R0.435 COCCCOCP(=O)(OC)OC 34a_100000101693_100000740836 [0,1,0,0,0,0|3,0,0]=4 2101 B12R0.435 COCCCSCC(C)(OC)OC 62a_100000709357_100000766008 [0,1,0,0,0,0|2,0,0]=3 2102 B12R0.435 COCCCSCC(C)(OC)OC 62a_100000766008_100000709357 [0,1,0,0,0,0|2,0,0]=3 2103 B12R0.435 COCCCSC[Si](C)(OC)OC 62a_100000067953_100000709357 [0,1,0,0,0,0|2,1,0]=4 2104 B12R0.435 COCCCSC[Si](C)(OC)OC 62a_100000709357_100000067953 [0,1,0,0,0,0|2,1,0]=4 2105 B12R0.435 COCCOCCP(=O)(OC)OC 34a_200000043213_100011201679 [0,1,0,0,0,0|3,0,0]=4 2106 B12R0.435 COCSCCC[Si](C)(OC)OC 62a_100000031653_100000766300 [0,1,0,0,0,0|2,1,0]=4 2107 B12R0.435 COCSCCC[Si](C)(OC)OC 62a_100000766300_100000031653 [0,1,0,0,0,0|2,1,0]=4 2108 B12R0.435 COP(=O)(CCOCCCF)OC 34a_200000043213_100011934791 [0,1,0,0,0,0|3,0,0]=4 2109 B12R0.435 COP(=O)(CCOCCCO)OC 34a_200000043213_100000230001 [0,1,0,0,0,0|3,0,0]=4 2110 B12R0.435 COP(=O)(CCOCCSC)OC 34a_200000043213_100000212216 [0,1,0,0,0,0|3,0,0]=4 2111 B12R0.435 COP(=O)(COCCCCF)OC 34a_100000101693_100000729493 [0,1,0,0,0,0|3,0,0]=4 2112 B12R0.435 COP(=O)(COCCCCO)OC 34a_100000101693_100011216708 [0,1,0,0,0,0|3,0,0]=4 2113 B12R0.435 CO[Si](C)(CCCNCCF)OC 34a_100000724931_100000031653 [0,1,0,0,0,0|2,1,0]=4 2114 B12R0.435 CO[Si](C)(CCCNCCO)OC 34a_100016990907_100000031653 [0,1,0,0,0,0|2,1,0]=4 2115 B12R0.435 CO[Si](C)(CCCOCCBr)OC 34a_100000211926_100000031653 [0,1,0,0,0,0|2,1,0]=4 2116 B12R0.435 CO[Si](C)(CCCOCCN)OC 34a_100000210304_100000031653 [0,1,0,0,0,0|2,1,0]=4 2117 B12R0.435 CO[Si](C)(CCCSCCF)OC 62a_100000031653_100011217306 [0,1,0,0,0,0|2,1,0]=4 2118 B12R0.435 CO[Si](C)(CCCSCCF)OC 62a_100011217306_100000031653 [0,1,0,0,0,0|2,1,0]=4 2119 B12R0.435 CO[Si](C)(CCCSCCO)OC 62a_100000031653_100000211926 [0,1,0,0,0,0|2,1,0]=4 2120 B12R0.435 CO[Si](C)(CCCSCCO)OC 62a_100000211926_100000031653 [0,1,0,0,0,0|2,1,0]=4 2121 B12R0.435 CO[Si](C)(CCCSCSC)OC 62a_100000031653_100011218213 [0,1,0,0,0,0|2,1,0]=4 2122 B12R0.435 CO[Si](C)(CCCSCSC)OC 62a_100011218213_100000031653 [0,1,0,0,0,0|2,1,0]=4 2123 B12R0.435 CO[Si](C)(CSCCCCF)OC 62a_100000067953_100000729493 [0,1,0,0,0,0|2,1,0]=4 2124 B12R0.435 CO[Si](C)(CSCCCCF)OC 62a_100000729493_100000067953 [0,1,0,0,0,0|2,1,0]=4 2125 B12R0.435 CO[Si](C)(CSCCCCO)OC 62a_100000067953_100000210776 [0,1,0,0,0,0|2,1,0]=4 2126 B12R0.435 CO[Si](C)(CSCCCCO)OC 62a_100000210776_100000067953 [0,1,0,0,0,0|2,1,0]=4 2127 B12R1.37 BrCCCCOCC1OCCO1 34a_100011216708_100000755774 [0,0,0,1,0,0|2,0,0]=3 2128 B12R1.37 BrCCCOCCC1OCCO1 34a_100011217188_100000740749 [0,0,0,1,0,0|2,0,0]=3 2129 B12R1.37 BrCCOCCCC1OCCO1 34a_100000211926_100009861162 [0,0,0,1,0,0|2,0,0]=3 2130 B12R1.37 C#CCCCNCC1OCCO1 2230a_100000036311_100000731252 [0,0,0,1,0,0|1,0,2]=4 2131 B12R1.37 C#CCCCNCC1OCCO1 34a_100000036311_100000695029 [0,0,0,1,0,0|1,0,2]=4 2132 B12R1.37 C#CCCCNCC1OCCO1 34a_100000718082_100000755774 [0,0,0,1,0,0|1,0,2]=4 2133 B12R1.37 C#CCCCOCC1OCCO1 34a_100000087154_100000695029 [0,0,0,1,0,0|1,0,2]=4 2134 B12R1.37 C#CCCCOCC1OCCO1 34a_100000215630_100000755774 [0,0,0,1,0,0|1,0,2]=4 2135 B12R1.37 C#CCCCOCC1OCCO1 7a_100000215630_100000755774 [0,0,0,1,0,0|1,0,2]=4 2136 B12R1.37 C#CCCCSCC1OCCO1 62a_100000755774_100011215417 [0,0,0,1,0,0|1,0,2]=4 2137 B12R1.37 C#CCCCSCC1OCCO1 62a_100011215417_100000755774 [0,0,0,1,0,0|1,0,2]=4 2138 B12R1.37 C#CCCNCCC1OCCO1 2230a_100000034215_100000688953 [0,0,0,1,0,0|1,0,2]=4 2139 B12R1.37 C#CCCNCCC1OCCO1 34a_100000034215_100000688953 [0,0,0,1,0,0|1,0,2]=4 2140 B12R1.37 C#CCCNCCC1OCCO1 34a_100000755551_100000740749 [0,0,0,1,0,0|1,0,2]=4 2141 B12R1.37 C#CCCOCCC1OCCO1 34a_100011215631_100000740749 [0,0,0,1,0,0|1,0,2]=4 2142 B12R1.37 C#CCCSCCC1OCCO1 62a_100000688953_100000740749 [0,0,0,1,0,0|1,0,2]=4 2143 B12R1.37 C#CCNCCCC1OCCO1 34a_100000212058_100009861162 [0,0,0,1,0,0|1,0,2]=4 2144 B12R1.37 C#CCOCCCC1OCCO1 34a_100000210247_100009861162 [0,0,0,1,0,0|1,0,2]=4 2145 B12R1.37 C#CCOCCCC1OCCO1 34a_100009871617_100000184674 [0,0,0,1,0,0|1,0,2]=4 2146 B12R1.37 C#CCOCCCC1OCCO1 7a_100009871617_100000038162 [0,0,0,1,0,0|1,0,2]=4 2147 B12R1.37 C#CCSCCCC1OCCO1 62a_100000038162_100000042513 [0,0,0,1,0,0|1,0,2]=4 2148 B12R1.37 C/C=C/CCOCC1OCCO1 34a_100016278192_100000755774 [0,0,0,1,0,0|1,0,2]=4 2149 B12R1.37 C/C=C/CNCCC1OCCO1 34a_100000034215_100102629194 [0,0,0,1,0,0|1,0,2]=4 2150 B12R1.37 C/C=C/COCCC1OCCO1 34a_100016270725_100000740749 [0,0,0,1,0,0|1,0,2]=4 2151 B12R1.37 C/C=C/CSCCC1OCCO1 62a_100102629194_100000740749 [0,0,0,1,0,0|1,0,2]=4 2152 B12R1.37 C=CCCCNCC1OCCO1 2230a_100000036311_100011713584 [0,0,0,1,0,0|1,0,2]=4 2153 B12R1.37 C=CCCCNCC1OCCO1 2230a_100000700776_100000755774 [0,0,0,1,0,0|1,0,2]=4 2154 B12R1.37 C=CCCCNCC1OCCO1 34a_100000036311_100000757094 [0,0,0,1,0,0|1,0,2]=4 2155 B12R1.37 C=CCCCNCC1OCCO1 34a_100000700776_100000755774 [0,0,0,1,0,0|1,0,2]=4 2156 B12R1.37 C=CCCCOCC1OCCO1 34a_100000087154_100000757094 [0,0,0,1,0,0|1,0,2]=4 2157 B12R1.37 C=CCCCOCC1OCCO1 34a_100000758997_100000755774 [0,0,0,1,0,0|1,0,2]=4 2158 B12R1.37 C=CCCCOCC1OCCO1 7a_100000758997_100000755774 [0,0,0,1,0,0|1,0,2]=4 2159 B12R1.37 C=CCCCSCC1OCCO1 62a_100000755774_100000757094 [0,0,0,1,0,0|1,0,2]=4 2160 B12R1.37 C=CCCCSCC1OCCO1 62a_100011713584_100000755774 [0,0,0,1,0,0|1,0,2]=4 2161 B12R1.37 C=CCCNCCC1OCCO1 2230a_100000034215_100000754431 [0,0,0,1,0,0|1,0,2]=4 2162 B12R1.37 C=CCCNCCC1OCCO1 2230a_100015191253_100000740749 [0,0,0,1,0,0|1,0,2]=4 2163 B12R1.37 C=CCCNCCC1OCCO1 34a_100000034215_100000754431 [0,0,0,1,0,0|1,0,2]=4 2164 B12R1.37 C=CCCOCCC1OCCO1 34a_100011205117_100000740749 [0,0,0,1,0,0|1,0,2]=4 2165 B12R1.37 C=CCCSCCC1OCCO1 62a_100000754431_100000740749 [0,0,0,1,0,0|1,0,2]=4 2166 B12R1.37 C=CCNCCCC1OCCO1 2230a_100020586998_100000042513 [0,0,0,1,0,0|1,0,2]=4 2167 B12R1.37 C=CCOCCCC1OCCO1 34a_100009871617_100015514636 [0,0,0,1,0,0|1,0,2]=4 2168 B12R1.37 C=CCOCCCC1OCCO1 34a_200000210373_100009861162 [0,0,0,1,0,0|1,0,2]=4 2169 B12R1.37 C=CCOCCCC1OCCO1 7a_100009871617_100015514636 [0,0,0,1,0,0|1,0,2]=4 2170 B12R1.37 C=CCSCCCC1OCCO1 62a_100000210623_100000042513 [0,0,0,1,0,0|1,0,2]=4 2171 B12R1.37 CC#CCCOCC1OCCO1 34a_100000750427_100000755774 [0,0,0,1,0,0|1,0,2]=4 2172 B12R1.37 CC#CCNCCC1OCCO1 2230a_100000034215_100000748600 [0,0,0,1,0,0|1,0,2]=4 2173 B12R1.37 CC#CCNCCC1OCCO1 2230a_100000685387_100000740749 [0,0,0,1,0,0|1,0,2]=4 2174 B12R1.37 CC#CCNCCC1OCCO1 34a_100000034215_100000748600 [0,0,0,1,0,0|1,0,2]=4 2175 B12R1.37 CC#CCNCCC1OCCO1 34a_100000685387_100000740749 [0,0,0,1,0,0|1,0,2]=4 2176 B12R1.37 CC#CCOCCC1OCCO1 34a_100000761923_100000740749 [0,0,0,1,0,0|1,0,2]=4 2177 B12R1.37 CC#CCSCCC1OCCO1 62a_100000748600_100000740749 [0,0,0,1,0,0|1,0,2]=4 2178 B12R1.37 CC/C=C\CNCC1OCCO1 2230a_100000036311_100103147603 [0,0,0,1,0,0|1,0,2]=4 2179 B12R1.37 CC/C=C\CNCC1OCCO1 34a_100000036311_100103147603 [0,0,0,1,0,0|1,0,2]=4 2180 B12R1.37 CC/C=C\COCC1OCCO1 34a_100000087154_100103147603 [0,0,0,1,0,0|1,0,2]=4 2181 B12R1.37 CC/C=C\COCC1OCCO1 34a_100016268518_100000755774 [0,0,0,1,0,0|1,0,2]=4 2182 B12R1.37 CC/C=C\CSCC1OCCO1 62a_100000755774_100103147603 [0,0,0,1,0,0|1,0,2]=4 2183 B12R1.37 CC/C=C\CSCC1OCCO1 62a_100103147603_100000755774 [0,0,0,1,0,0|1,0,2]=4 2184 B12R1.37 CC=CCNCCC1OCCO1 2230a_100000034215_100000070051 [0,0,0,1,0,0|1,0,2]=4 2185 B12R1.37 CC=CCNCCC1OCCO1 34a_100000034215_100000070051 [0,0,0,1,0,0|1,0,2]=4 2186 B12R1.37 CC=CCSCCC1OCCO1 62a_100000070051_100000740749 [0,0,0,1,0,0|1,0,2]=4 2187 B12R1.37 CCC#CCNCC1OCCO1 2230a_100000036311_100009813939 [0,0,0,1,0,0|1,0,2]=4 2188 B12R1.37 CCC#CCNCC1OCCO1 34a_100000036311_100009813939 [0,0,0,1,0,0|1,0,2]=4 2189 B12R1.37 CCC#CCOCC1OCCO1 34a_100000032950_100000755774 [0,0,0,1,0,0|1,0,2]=4 2190 B12R1.37 CCC#CCOCC1OCCO1 34a_100000087154_100009813939 [0,0,0,1,0,0|1,0,2]=4 2191 B12R1.37 CCC#CCSCC1OCCO1 62a_100000755774_100009813939 [0,0,0,1,0,0|1,0,2]=4 2192 B12R1.37 CCC#CCSCC1OCCO1 62a_100009813939_100000755774 [0,0,0,1,0,0|1,0,2]=4 2193 B12R1.37 CCCCCCCN1CCCC1 2230a_100000188435_100000210681 [0,0,0,1,0,0|3,0,0]=4 2194 B12R1.37 CCCCCCCN1CCCC1 269982a_100000188435_100000210681 [0,0,0,1,0,0|3,0,0]=4 2195 B12R1.37 CCCCCCNC1CCCC1 2230a_100000210581_100000179811 [0,0,0,1,0,0|3,0,0]=4 2196 B12R1.37 CCCCCCNC1CCCC1 2230a_100000211070_100000210314 [0,0,0,1,0,0|3,0,0]=4 2197 B12R1.37 CCCCCCNC1CCCC1 270004a_100000210581_100000210133 [0,0,0,1,0,0|3,0,0]=4 2198 B12R1.37 CCCCCCNC1CCCC1 34a_100000211070_100000210314 [0,0,0,1,0,0|3,0,0]=4 2199 B12R1.37 CCCCCCOC1CCCC1 34a_100000210259_100000179811 [0,0,0,1,0,0|3,0,0]=4 2200 B12R1.37 CCCCCCOC1CCCC1 34a_100000210269_100000210314 [0,0,0,1,0,0|3,0,0]=4 2201 B12R1.37 CCCCCCOC1CCCC1 7a_100000210259_100000179811 [0,0,0,1,0,0|3,0,0]=4 2202 B12R1.37 CCCCCCOC1CCCC1 7a_100000210269_100000210314 [0,0,0,1,0,0|3,0,0]=4 2203 B12R1.37 CCCCCCOC1CCCO1 34a_100000085407_100000210314 [0,0,0,1,0,0|2,0,0]=3 2204 B12R1.37 CCCCCCSC1CCCC1 62a_100000210314_100000179811 [0,0,0,1,0,0|3,0,0]=4 2205 B12R1.37 CCCCCCSC1CCCC1 62a_100011217020_100000210757 [0,0,0,1,0,0|3,0,0]=4 2206 B12R1.37 CCCCCNCC1CCCC1 2230a_100000209983_100000740388 [0,0,0,1,0,0|3,0,0]=4 2207 B12R1.37 CCCCCNCC1CCCC1 2230a_100000737975_100000210326 [0,0,0,1,0,0|3,0,0]=4 2208 B12R1.37 CCCCCNCC1CCCC1 269862a_100000209983_100000746403 [0,0,0,1,0,0|3,0,0]=4 2209 B12R1.37 CCCCCNCC1CCCC1 34a_100000737975_100000718602 [0,0,0,1,0,0|3,0,0]=4 2210 B12R1.37 CCCCCNCC1CCCO1 2230a_100000209983_100000203698 [0,0,0,1,0,0|2,0,0]=3 2211 B12R1.37 CCCCCNCC1OCCO1 2230a_100000036311_100000210326 [0,0,0,1,0,0|1,0,0]=2 2212 B12R1.37 CCCCCNCC1OCCO1 2230a_100000209983_100000755774 [0,0,0,1,0,0|1,0,0]=2 2213 B12R1.37 CCCCCNCC1OCCO1 34a_100000036311_100000718602 [0,0,0,1,0,0|1,0,0]=2 2214 B12R1.37 CCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210326 [0,0,0,1,0,0|2,0,0]=3 2215 B12R1.37 CCCCCNC[C@@H]1CCCO1 34a_100020590478_100000718602 [0,0,0,1,0,0|2,0,0]=3 2216 B12R1.37 CCCCCOCC1CCCC1 34a_100000210253_100000740388 [0,0,0,1,0,0|3,0,0]=4 2217 B12R1.37 CCCCCOCC1CCCC1 34a_100000742336_100000718602 [0,0,0,1,0,0|3,0,0]=4 2218 B12R1.37 CCCCCOCC1CCCC1 7a_100000210253_100000740388 [0,0,0,1,0,0|3,0,0]=4 2219 B12R1.37 CCCCCOCC1CCCC1 7a_100000742336_100000210326 [0,0,0,1,0,0|3,0,0]=4 2220 B12R1.37 CCCCCOCC1CCCO1 34a_100000210270_100000718602 [0,0,0,1,0,0|2,0,0]=3 2221 B12R1.37 CCCCCOCC1CCCO1 7a_100000210253_100000203698 [0,0,0,1,0,0|2,0,0]=3 2222 B12R1.37 CCCCCOCC1CCCO1 7a_100000210270_100000210326 [0,0,0,1,0,0|2,0,0]=3 2223 B12R1.37 CCCCCOCC1COCO1 34a_100011216627_100000718602 [0,0,0,1,0,0|3,0,0]=4 2224 B12R1.37 CCCCCOCC1OCCO1 34a_100000087154_100000718602 [0,0,0,1,0,0|1,0,0]=2 2225 B12R1.37 CCCCCOCC1OCCO1 34a_100000210253_100000755774 [0,0,0,1,0,0|1,0,0]=2 2226 B12R1.37 CCCCCOCC1OCCO1 7a_100000210253_100000755774 [0,0,0,1,0,0|1,0,0]=2 2227 B12R1.37 CCCCCOC[C@H]1CCCN1 34a_100000745186_100000718602 [0,0,0,1,0,0|3,0,0]=4 2228 B12R1.37 CCCCCSCC1CCCC1 62a_100000210326_100000740388 [0,0,0,1,0,0|3,0,0]=4 2229 B12R1.37 CCCCCSCC1CCCC1 62a_100000740388_100000210326 [0,0,0,1,0,0|3,0,0]=4 2230 B12R1.37 CCCCCSCC1CCCO1 62a_100000203698_100000210326 [0,0,0,1,0,0|2,0,0]=3 2231 B12R1.37 CCCCCSCC1CCCO1 62a_100000210326_100000203698 [0,0,0,1,0,0|2,0,0]=3 2232 B12R1.37 CCCCCSCC1OCCO1 62a_100000210326_100000755774 [0,0,0,1,0,0|1,0,0]=2 2233 B12R1.37 CCCCCSCC1OCCO1 62a_100000755774_100000210326 [0,0,0,1,0,0|1,0,0]=2 2234 B12R1.37 CCCCNCCC1CCCC1 2230a_100000102301_100000760354 [0,0,0,1,0,0|3,0,0]=4 2235 B12R1.37 CCCCNCCC1CCCC1 2230a_100000739158_100000210211 [0,0,0,1,0,0|3,0,0]=4 2236 B12R1.37 CCCCNCCC1CCCC1 34a_100000739158_100000210210 [0,0,0,1,0,0|3,0,0]=4 2237 B12R1.37 CCCCNCCC1CCCC1 7a_106832991798_100000760354 [0,0,0,1,0,0|3,0,0]=4 2238 B12R1.37 CCCCNCCC1OCCO1 2230a_100000034215_100000210211 [0,0,0,1,0,0|1,0,0]=2 2239 B12R1.37 CCCCNCCC1OCCO1 2230a_100000102301_100000740749 [0,0,0,1,0,0|1,0,0]=2 2240 B12R1.37 CCCCNCCC1OCCO1 34a_100000034215_100000210210 [0,0,0,1,0,0|1,0,0]=2 2241 B12R1.37 CCCCNCCC1OCCO1 7a_106832991798_100000740749 [0,0,0,1,0,0|1,0,0]=2 2242 B12R1.37 CCCCOCCC1CCCC1 34a_100000210227_100000760354 [0,0,0,1,0,0|3,0,0]=4 2243 B12R1.37 CCCCOCCC1CCCC1 34a_100000749090_100000210210 [0,0,0,1,0,0|3,0,0]=4 2244 B12R1.37 CCCCOCCC1CCCC1 7a_100000210227_100000760354 [0,0,0,1,0,0|3,0,0]=4 2245 B12R1.37 CCCCOCCC1CCCC1 7a_100000749090_100000210211 [0,0,0,1,0,0|3,0,0]=4 2246 B12R1.37 CCCCOCCC1OCCO1 34a_100000210227_100000740749 [0,0,0,1,0,0|1,0,0]=2 2247 B12R1.37 CCCCOCCC1OCCO1 7a_100000210227_100000740749 [0,0,0,1,0,0|1,0,0]=2 2248 B12R1.37 CCCCOCOC1CCCO1 34a_100000085407_100011995733 [0,0,0,1,0,0|3,0,0]=4 2249 B12R1.37 CCCCSCCC1CCCC1 62a_100000210211_100000760354 [0,0,0,1,0,0|3,0,0]=4 2250 B12R1.37 CCCCSCCC1CCCC1 62a_100000760354_100000210210 [0,0,0,1,0,0|3,0,0]=4 2251 B12R1.37 CCCCSCCC1OCCO1 62a_100000210211_100000740749 [0,0,0,1,0,0|1,0,0]=2 2252 B12R1.37 CCCNCCCC1CCCC1 2230a_100000736752_100000210303 [0,0,0,1,0,0|3,0,0]=4 2253 B12R1.37 CCCNCCCC1CCCC1 34a_100000736752_100000210303 [0,0,0,1,0,0|3,0,0]=4 2254 B12R1.37 CCCOCCCC1CCCC1 34a_100000210258_100011713738 [0,0,0,1,0,0|3,0,0]=4 2255 B12R1.37 CCCOCCCC1CCCC1 34a_100011215328_100000210303 [0,0,0,1,0,0|3,0,0]=4 2256 B12R1.37 CCCOCCCC1CCCC1 7a_100011215328_100000210303 [0,0,0,1,0,0|3,0,0]=4 2257 B12R1.37 CCCOCCCC1OCCO1 34a_100000210258_100009861162 [0,0,0,1,0,0|1,0,0]=2 2258 B12R1.37 CCCOCCCC1OCCO1 34a_100009871617_100000210303 [0,0,0,1,0,0|1,0,0]=2 2259 B12R1.37 CCCOCCCC1OCCO1 7a_100009871617_100000210303 [0,0,0,1,0,0|1,0,0]=2 2260 B12R1.37 CCCOCCOC1CCCO1 34a_100000085407_100011215938 [0,0,0,1,0,0|3,0,0]=4 2261 B12R1.37 CCCSCCCC1CCCC1 62a_100000210303_100011713738 [0,0,0,1,0,0|3,0,0]=4 2262 B12R1.37 CCCSCCCC1CCCC1 62a_100011713738_100000210303 [0,0,0,1,0,0|3,0,0]=4 2263 B12R1.37 CCCSCCCC1OCCO1 62a_100000210303_100000042513 [0,0,0,1,0,0|1,0,0]=2 2264 B12R1.37 CCNCCCCC1OCCO1 2230a_100015525214_100000034956 [0,0,0,1,0,0|1,0,0]=2 2265 B12R1.37 CCOCCCCC1OCCO1 34a_100121572206_200009813554 [0,0,0,1,0,0|1,0,0]=2 2266 B12R1.37 CCOCCCOC1CCCO1 34a_100000085407_100012232248 [0,0,0,1,0,0|3,0,0]=4 2267 B12R1.37 CCOCCNCC1CCCO1 2230a_102516460346_100000203698 [0,0,0,1,0,0|3,0,0]=4 2268 B12R1.37 CCOCCNCC1OCCO1 2230a_100000036311_100011215890 [0,0,0,1,0,0|2,0,0]=3 2269 B12R1.37 CCOCCNCC1OCCO1 2230a_102516460346_100000755774 [0,0,0,1,0,0|2,0,0]=3 2270 B12R1.37 CCOCCNCC1OCCO1 34a_100000036311_100000210147 [0,0,0,1,0,0|2,0,0]=3 2271 B12R1.37 CCOCCNCC1OCCO1 34a_102516460346_100000755774 [0,0,0,1,0,0|2,0,0]=3 2272 B12R1.37 CCOCCNC[C@@H]1CCCO1 2230a_100020590478_100011215890 [0,0,0,1,0,0|3,0,0]=4 2273 B12R1.37 CCOCCNC[C@@H]1CCCO1 34a_100020590478_100000210147 [0,0,0,1,0,0|3,0,0]=4 2274 B12R1.37 CCOCCOCC1CCCO1 34a_100000210270_100000210147 [0,0,0,1,0,0|3,0,0]=4 2275 B12R1.37 CCOCCOCC1CCCO1 7a_100000210136_100000203698 [0,0,0,1,0,0|3,0,0]=4 2276 B12R1.37 CCOCCOCC1CCCO1 7a_100000210270_100011215890 [0,0,0,1,0,0|3,0,0]=4 2277 B12R1.37 CCOCCOCC1OCCO1 34a_100000087154_100000210147 [0,0,0,1,0,0|2,0,0]=3 2278 B12R1.37 CCOCCOCC1OCCO1 34a_100000210136_100000755774 [0,0,0,1,0,0|2,0,0]=3 2279 B12R1.37 CCOCCOCC1OCCO1 7a_100000210136_100000755774 [0,0,0,1,0,0|2,0,0]=3 2280 B12R1.37 CCOCCSCC1CCCO1 62a_100000203698_100011215890 [0,0,0,1,0,0|3,0,0]=4 2281 B12R1.37 CCOCCSCC1CCCO1 62a_100000210147_100000203698 [0,0,0,1,0,0|3,0,0]=4 2282 B12R1.37 CCOCCSCC1OCCO1 62a_100000210147_100000755774 [0,0,0,1,0,0|2,0,0]=3 2283 B12R1.37 CCOCCSCC1OCCO1 62a_100000755774_100011215890 [0,0,0,1,0,0|2,0,0]=3 2284 B12R1.37 CCOCSCCC1OCCO1 62a_100000739092_100000740749 [0,0,0,1,0,0|2,0,0]=3 2285 B12R1.37 CCSCCCCC1OCCO1 62a_100000210202_100000034956 [0,0,0,1,0,0|1,0,0]=2 2286 B12R1.37 CCSCCNCC1CCCO1 2230a_100000106463_100000203698 [0,0,0,1,0,0|3,0,0]=4 2287 B12R1.37 CCSCCNCC1OCCO1 2230a_100000036311_100000757381 [0,0,0,1,0,0|2,0,0]=3 2288 B12R1.37 CCSCCNCC1OCCO1 2230a_100000106463_100000755774 [0,0,0,1,0,0|2,0,0]=3 2289 B12R1.37 CCSCCNCC1OCCO1 34a_100000036311_100000757381 [0,0,0,1,0,0|2,0,0]=3 2290 B12R1.37 CCSCCNC[C@@H]1CCCO1 2230a_100020590478_100000757381 [0,0,0,1,0,0|3,0,0]=4 2291 B12R1.37 CCSCCNC[C@@H]1CCCO1 34a_100020590478_100000757381 [0,0,0,1,0,0|3,0,0]=4 2292 B12R1.37 CCSCCOCC1CCCO1 34a_100000210270_100000757381 [0,0,0,1,0,0|3,0,0]=4 2293 B12R1.37 CCSCCOCC1CCCO1 7a_100000210270_100000757381 [0,0,0,1,0,0|3,0,0]=4 2294 B12R1.37 CCSCCOCC1CCCO1 7a_100000212035_100000203698 [0,0,0,1,0,0|3,0,0]=4 2295 B12R1.37 CCSCCOCC1OCCO1 34a_100000087154_100000757381 [0,0,0,1,0,0|2,0,0]=3 2296 B12R1.37 CCSCCOCC1OCCO1 34a_100000212035_100000755774 [0,0,0,1,0,0|2,0,0]=3 2297 B12R1.37 CCSCCOCC1OCCO1 7a_100000212035_100000755774 [0,0,0,1,0,0|2,0,0]=3 2298 B12R1.37 CCSCCSCC1CCCO1 62a_100000203698_100000757381 [0,0,0,1,0,0|3,0,0]=4 2299 B12R1.37 CCSCCSCC1CCCO1 62a_100000757381_100000203698 [0,0,0,1,0,0|3,0,0]=4 2300 B12R1.37 CCSCCSCC1OCCO1 62a_100000755774_100000757381 [0,0,0,1,0,0|2,0,0]=3 2301 B12R1.37 CCSCCSCC1OCCO1 62a_100000757381_100000755774 [0,0,0,1,0,0|2,0,0]=3 2302 B12R1.37 CNCCCOCC1OCCO1 34a_100000213112_100000755774 [0,0,0,1,0,0|2,0,0]=3 2303 B12R1.37 COCCCCOC1CCCO1 34a_100000085407_100000755781 [0,0,0,1,0,0|3,0,0]=4 2304 B12R1.37 COCCCCOC1CCCO1 34a_100011018183_200000210301 [0,0,0,1,0,0|3,0,0]=4 2305 B12R1.37 COCCCCOC1CCCO1 7a_100011018183_200000210301 [0,0,0,1,0,0|3,0,0]=4 2306 B12R1.37 COCCCNCC1OCCO1 2230a_100000036311_100000740836 [0,0,0,1,0,0|2,0,0]=3 2307 B12R1.37 COCCCNCC1OCCO1 34a_100000036311_100000740836 [0,0,0,1,0,0|2,0,0]=3 2308 B12R1.37 COCCCNCC1OCCO1 34a_100150723488_100000755774 [0,0,0,1,0,0|2,0,0]=3 2309 B12R1.37 COCCCNC[C@@H]1CCCO1 2230a_100020590478_100000740836 [0,0,0,1,0,0|3,0,0]=4 2310 B12R1.37 COCCCNC[C@@H]1CCCO1 34a_100020590478_100000740836 [0,0,0,1,0,0|3,0,0]=4 2311 B12R1.37 COCCCOCC1CCCO1 34a_100000210270_100000740836 [0,0,0,1,0,0|3,0,0]=4 2312 B12R1.37 COCCCOCC1CCCO1 7a_100000210270_100000740836 [0,0,0,1,0,0|3,0,0]=4 2313 B12R1.37 COCCCOCC1OCCO1 34a_100000087154_100000740836 [0,0,0,1,0,0|2,0,0]=3 2314 B12R1.37 COCCCOCC1OCCO1 34a_100000740835_100000755774 [0,0,0,1,0,0|2,0,0]=3 2315 B12R1.37 COCCCSCC1CCCO1 62a_100000203698_100000709357 [0,0,0,1,0,0|3,0,0]=4 2316 B12R1.37 COCCCSCC1CCCO1 62a_100000709357_100000203698 [0,0,0,1,0,0|3,0,0]=4 2317 B12R1.37 COCCCSCC1OCCO1 62a_100000709357_100000755774 [0,0,0,1,0,0|2,0,0]=3 2318 B12R1.37 COCCCSCC1OCCO1 62a_100000755774_100000709357 [0,0,0,1,0,0|2,0,0]=3 2319 B12R1.37 COCCNCCC1OCCO1 2230a_100000034215_100011201679 [0,0,0,1,0,0|2,0,0]=3 2320 B12R1.37 COCCNCCC1OCCO1 2230a_100000209980_100000740749 [0,0,0,1,0,0|2,0,0]=3 2321 B12R1.37 COCCNCCC1OCCO1 34a_100000034215_100011201679 [0,0,0,1,0,0|2,0,0]=3 2322 B12R1.37 COCCOCCC1OCCO1 34a_100000210237_100000740749 [0,0,0,1,0,0|2,0,0]=3 2323 B12R1.37 COCCSCCC1OCCO1 62a_100000233755_100000740749 [0,0,0,1,0,0|2,0,0]=3 2324 B12R1.37 COCSCCCC1OCCO1 62a_100000766300_100000042513 [0,0,0,1,0,0|2,0,0]=3 2325 B12R1.37 CSCCCNCC1CCCO1 2230a_100000749238_100000203698 [0,0,0,1,0,0|3,0,0]=4 2326 B12R1.37 CSCCCNCC1OCCO1 2230a_100000749238_100000755774 [0,0,0,1,0,0|2,0,0]=3 2327 B12R1.37 CSCCCOCC1CCCO1 7a_100000690336_100000203698 [0,0,0,1,0,0|3,0,0]=4 2328 B12R1.37 CSCCCOCC1OCCO1 34a_100000690336_100000755774 [0,0,0,1,0,0|2,0,0]=3 2329 B12R1.37 CSCCCOCC1OCCO1 7a_100000690336_100000755774 [0,0,0,1,0,0|2,0,0]=3 2330 B12R1.37 CSCCNCCC1OCCO1 2230a_100000034215_100000751147 [0,0,0,1,0,0|2,0,0]=3 2331 B12R1.37 CSCCNCCC1OCCO1 2230a_100020590264_100000740749 [0,0,0,1,0,0|2,0,0]=3 2332 B12R1.37 CSCCNCCC1OCCO1 34a_100000034215_100000212216 [0,0,0,1,0,0|2,0,0]=3 2333 B12R1.37 CSCCOCCC1OCCO1 34a_100000230434_100000740749 [0,0,0,1,0,0|2,0,0]=3 2334 B12R1.37 CSCCOCCC1OCCO1 7a_100000230434_100000740749 [0,0,0,1,0,0|2,0,0]=3 2335 B12R1.37 CSCCSCCC1OCCO1 62a_100000212216_100000740749 [0,0,0,1,0,0|2,0,0]=3 2336 B12R1.37 CSCOCCCC1OCCO1 34a_100009871617_100011218213 [0,0,0,1,0,0|2,0,0]=3 2337 B12R1.37 CSCSCCCC1OCCO1 62a_100011218213_100000042513 [0,0,0,1,0,0|2,0,0]=3 2338 B12R1.37 ClCCCCOCC1CCCO1 7a_100000210776_100000203698 [0,0,0,1,0,0|3,0,0]=4 2339 B12R1.37 ClCCCCOCC1OCCO1 34a_100000210776_100000755774 [0,0,0,1,0,0|2,0,0]=3 2340 B12R1.37 ClCCCCOCC1OCCO1 7a_100000210776_100000755774 [0,0,0,1,0,0|2,0,0]=3 2341 B12R1.37 ClCCCOCCC1OCCO1 34a_100000230001_100000740749 [0,0,0,1,0,0|2,0,0]=3 2342 B12R1.37 FCCCCCOC1CCCO1 34a_100000085407_100000729378 [0,0,0,1,0,0|3,0,0]=4 2343 B12R1.37 FCCCCNCC1OCCO1 2230a_100000036311_100000729493 [0,0,0,1,0,0|2,0,0]=3 2344 B12R1.37 FCCCCNCC1OCCO1 34a_100000036311_100000729493 [0,0,0,1,0,0|2,0,0]=3 2345 B12R1.37 FCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000729493 [0,0,0,1,0,0|3,0,0]=4 2346 B12R1.37 FCCCCNC[C@@H]1CCCO1 34a_100020590478_100000729493 [0,0,0,1,0,0|3,0,0]=4 2347 B12R1.37 FCCCCOCC1CCCO1 34a_100000210270_100000729493 [0,0,0,1,0,0|3,0,0]=4 2348 B12R1.37 FCCCCOCC1CCCO1 7a_100000210270_100000729493 [0,0,0,1,0,0|3,0,0]=4 2349 B12R1.37 FCCCCOCC1CCCO1 7a_100011995726_100000203698 [0,0,0,1,0,0|3,0,0]=4 2350 B12R1.37 FCCCCOCC1OCCO1 34a_100000087154_100000729493 [0,0,0,1,0,0|2,0,0]=3 2351 B12R1.37 FCCCCOCC1OCCO1 34a_100011995726_100000755774 [0,0,0,1,0,0|2,0,0]=3 2352 B12R1.37 FCCCCOCC1OCCO1 7a_100011995726_100000755774 [0,0,0,1,0,0|2,0,0]=3 2353 B12R1.37 FCCCCSCC1CCCO1 62a_100000203698_100000729493 [0,0,0,1,0,0|3,0,0]=4 2354 B12R1.37 FCCCCSCC1CCCO1 62a_100000729493_100000203698 [0,0,0,1,0,0|3,0,0]=4 2355 B12R1.37 FCCCCSCC1OCCO1 62a_100000729493_100000755774 [0,0,0,1,0,0|2,0,0]=3 2356 B12R1.37 FCCCCSCC1OCCO1 62a_100000755774_100000729493 [0,0,0,1,0,0|2,0,0]=3 2357 B12R1.37 FCCCNCCC1OCCO1 2230a_100000034215_100011934791 [0,0,0,1,0,0|2,0,0]=3 2358 B12R1.37 FCCCNCCC1OCCO1 2230a_100015189416_100000740749 [0,0,0,1,0,0|2,0,0]=3 2359 B12R1.37 FCCCNCCC1OCCO1 34a_100000034215_100011934791 [0,0,0,1,0,0|2,0,0]=3 2360 B12R1.37 FCCCNCCC1OCCO1 34a_100015189416_100000740749 [0,0,0,1,0,0|2,0,0]=3 2361 B12R1.37 FCCCOCCC1OCCO1 34a_100000759539_100000740749 [0,0,0,1,0,0|2,0,0]=3 2362 B12R1.37 FCCCSCCC1OCCO1 62a_100011934791_100000740749 [0,0,0,1,0,0|2,0,0]=3 2363 B12R1.37 FCCNCCCC1OCCO1 34a_100000724931_100009861162 [0,0,0,1,0,0|2,0,0]=3 2364 B12R1.37 FCCOCCCC1OCCO1 34a_100009871617_100011217306 [0,0,0,1,0,0|2,0,0]=3 2365 B12R1.37 FCCOCCCC1OCCO1 7a_100009871617_100011217306 [0,0,0,1,0,0|2,0,0]=3 2366 B12R1.37 FCCSCCCC1OCCO1 62a_100011217306_100000042513 [0,0,0,1,0,0|2,0,0]=3 2367 B12R1.37 FCSCCCCC1OCCO1 62a_100015361967_100000034956 [0,0,0,1,0,0|2,0,0]=3 2368 B12R1.37 ICCCCOCC1OCCO1 34a_200012148704_100000755774 [0,0,0,1,0,0|2,0,0]=3 2369 B12R1.37 N#CCCCNCC1OCCO1 2230a_100000036311_100000687738 [0,0,0,1,0,0|2,0,1]=4 2370 B12R1.37 N#CCCCSCC1OCCO1 62a_100000687738_100000755774 [0,0,0,1,0,0|2,0,1]=4 2371 B12R1.37 N#CCCCSCC1OCCO1 62a_100000755774_100000687738 [0,0,0,1,0,0|2,0,1]=4 2372 B12R1.37 N#CCCNCCC1OCCO1 2230a_100000034215_100011215226 [0,0,0,1,0,0|2,0,1]=4 2373 B12R1.37 N#CCCSCCC1OCCO1 62a_100011215226_100000740749 [0,0,0,1,0,0|2,0,1]=4 2374 B12R1.37 N#CCOCCCC1OCCO1 7a_100009871617_100011215382 [0,0,0,1,0,0|2,0,1]=4 2375 B12R1.37 N#CCSCCCC1OCCO1 62a_100011215382_100000042513 [0,0,0,1,0,0|2,0,1]=4 2376 B12R1.37 NCCCCOCC1OCCO1 34a_100000750430_100000755774 [0,0,0,1,0,0|2,0,0]=3 2377 B12R1.37 NCCCOCCC1OCCO1 34a_100000182051_100000740749 [0,0,0,1,0,0|2,0,0]=3 2378 B12R1.37 NCCOCCCC1OCCO1 34a_100000210304_100009861162 [0,0,0,1,0,0|2,0,0]=3 2379 B12R1.37 NOCCOCCC1OCCO1 34a_100000700252_100000740749 [0,0,0,1,0,0|3,0,0]=4 2380 B12R1.37 O=CCCCNCC1OCCO1 2230a_100000036311_200011292268 [0,0,0,1,0,0|2,0,1]=4 2381 B12R1.37 O=CCCCSCC1OCCO1 62a_100000755774_200011292268 [0,0,0,1,0,0|2,0,1]=4 2382 B12R1.37 O=CCCCSCC1OCCO1 62a_200011292268_100000755774 [0,0,0,1,0,0|2,0,1]=4 2383 B12R1.37 O=CCOCCCC1OCCO1 34a_100009871617_200009817547 [0,0,0,1,0,0|2,0,1]=4 2384 B12R1.37 O=CCOCCCC1OCCO1 7a_100009871617_200015260668 [0,0,0,1,0,0|2,0,1]=4 2385 B12R1.37 O=CCSCCCC1OCCO1 62a_200015260668_100000042513 [0,0,0,1,0,0|2,0,1]=4 2386 B12R1.37 OCCCCCOC1CCCO1 34a_100000085407_100000746330 [0,0,0,1,0,0|3,0,0]=4 2387 B12R1.37 OCCCCNCC1CCCO1 2230a_100000750430_100000203698 [0,0,0,1,0,0|3,0,0]=4 2388 B12R1.37 OCCCCNCC1OCCO1 2230a_100000036311_100000210776 [0,0,0,1,0,0|2,0,0]=3 2389 B12R1.37 OCCCCNCC1OCCO1 2230a_100000750430_100000755774 [0,0,0,1,0,0|2,0,0]=3 2390 B12R1.37 OCCCCNCC1OCCO1 34a_100000036311_100011216708 [0,0,0,1,0,0|2,0,0]=3 2391 B12R1.37 OCCCCNCC1OCCO1 34a_100000750430_100000755774 [0,0,0,1,0,0|2,0,0]=3 2392 B12R1.37 OCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210776 [0,0,0,1,0,0|3,0,0]=4 2393 B12R1.37 OCCCCNC[C@@H]1CCCO1 34a_100020590478_100011216708 [0,0,0,1,0,0|3,0,0]=4 2394 B12R1.37 OCCCCOCC1CCCO1 34a_100000210270_100011216708 [0,0,0,1,0,0|3,0,0]=4 2395 B12R1.37 OCCCCOCC1CCCO1 7a_100000210270_100000210776 [0,0,0,1,0,0|3,0,0]=4 2396 B12R1.37 OCCCCOCC1OCCO1 34a_100000087154_100011216708 [0,0,0,1,0,0|2,0,0]=3 2397 B12R1.37 OCCCCSCC1CCCO1 62a_100000203698_100000210776 [0,0,0,1,0,0|3,0,0]=4 2398 B12R1.37 OCCCCSCC1CCCO1 62a_100000210776_100000203698 [0,0,0,1,0,0|3,0,0]=4 2399 B12R1.37 OCCCCSCC1OCCO1 62a_100000210776_100000755774 [0,0,0,1,0,0|2,0,0]=3 2400 B12R1.37 OCCCCSCC1OCCO1 62a_100000755774_100000210776 [0,0,0,1,0,0|2,0,0]=3 2401 B12R1.37 OCCCNCCC1OCCO1 2230a_100000034215_100000230001 [0,0,0,1,0,0|2,0,0]=3 2402 B12R1.37 OCCCNCCC1OCCO1 34a_100000034215_100000230001 [0,0,0,1,0,0|2,0,0]=3 2403 B12R1.37 OCCCSCCC1OCCO1 62a_100011215043_100000740749 [0,0,0,1,0,0|2,0,0]=3 2404 B12R1.37 OCCNCCCC1OCCO1 2230a_100016997473_100000042513 [0,0,0,1,0,0|2,0,0]=3 2405 B12R1.37 OCCNCCCC1OCCO1 34a_100016990907_100009861162 [0,0,0,1,0,0|2,0,0]=3 2406 B12R1.37 OCCOCCCC1OCCO1 34a_100009871617_100000211926 [0,0,0,1,0,0|2,0,0]=3 2407 B12R1.37 OCCOCCCC1OCCO1 7a_100009871617_100000211926 [0,0,0,1,0,0|2,0,0]=3 2408 B12R1.37 OCCSCCCC1OCCO1 62a_100000211926_100000042513 [0,0,0,1,0,0|2,0,0]=3 2409 B12R1.37 [13CH3]OCCCCOC1CCCO1 34a_100011018183_200025704644 [0,0,0,1,0,0|3,0,0]=4 2410 B12R1.37 [13CH3]OCCCCOC1CCCO1 7a_100011018183_200025704644 [0,0,0,1,0,0|3,0,0]=4 2411 B12R1.71 CCCCC1CCC(CC1)NC 2230a_100000745173_200000210301 [0,0,0,1,0,0|2,0,0]=3 2412 B12R1.71 CCCCC1CCC(CC1)NC 34a_100000745173_200000210301 [0,0,0,1,0,0|2,0,0]=3 2413 B12R1.71 CCCCC1CCC(CC1)N[13CH3] 2230a_100000745173_200025704644 [0,0,0,1,0,0|2,0,0]=3 2414 B12R1.71 CCCCC1CCC(CC1)N[13CH3] 34a_100000745173_200025704644 [0,0,0,1,0,0|2,0,0]=3 2415 B12R1.71 CCCCC1CCC(CC1)OC 34a_200000035503_200000210301 [0,0,0,1,0,0|1,0,0]=2 2416 B12R1.71 CCCCC1CCC(CC1)OC 7a_200000035503_200000210301 [0,0,0,1,0,0|1,0,0]=2 2417 B12R1.71 CCCCC1CCC(CC1)O[13CH3] 34a_200000035503_200025704644 [0,0,0,1,0,0|1,0,0]=2 2418 B12R1.71 CCCCC1CCC(CC1)O[13CH3] 7a_200000035503_200025704644 [0,0,0,1,0,0|1,0,0]=2 2419 B12R1.71 CCCCC1CCN(CC1)CC 2230a_200016987432_100000210202 [0,0,0,1,0,0|3,0,0]=4 2420 B12R1.71 CCCCC1CCN(CC1)CC 269982a_200016987432_100000204670 [0,0,0,1,0,0|3,0,0]=4 2421 B12R1.71 CCCCC1CCN(CC1)CC 34a_200016987432_100000210202 [0,0,0,1,0,0|3,0,0]=4 2422 B12R1.71 CCCCN1CCC(CC1)CC 2230a_100000754474_100000210211 [0,0,0,1,0,0|3,0,0]=4 2423 B12R1.71 CCCCN1CCC(CC1)CC 269982a_100000754474_100000210211 [0,0,0,1,0,0|3,0,0]=4 2424 B12R1.71 CCCCN1CCC(CC1)CC 34a_100000754474_100000210210 [0,0,0,1,0,0|3,0,0]=4 2425 B12R1.71 CCCCN1CCC(CC1)NC 2230a_100000746687_200000210301 [0,0,0,1,0,0|3,0,0]=4 2426 B12R1.71 CCCCN1CCC(CC1)NC 270004a_106832991635_100000228144 [0,0,0,1,0,0|3,0,0]=4 2427 B12R1.71 CCCCN1CCC(CC1)N[13CH3] 2230a_100000746687_200025704644 [0,0,0,1,0,0|3,0,0]=4 2428 B12R1.71 CCCCN1CCC(CC1)OC 2230a_100000234800_100000210211 [0,0,0,1,0,0|2,0,0]=3 2429 B12R1.71 CCCCN1CCC(CC1)OC 269982a_100000234800_100000210211 [0,0,0,1,0,0|2,0,0]=3 2430 B12R1.71 CCCCN1CCC(CC1)OC 34a_100000234800_100000210210 [0,0,0,1,0,0|2,0,0]=3 2431 B12R1.71 CCCCN1CCC(CC1)SC 2230a_100015202541_100000210211 [0,0,0,1,0,0|2,1,0]=4 2432 B12R1.71 CCCCN1CCC(CC1)SC 269982a_100015202541_100000210211 [0,0,0,1,0,0|2,1,0]=4 2433 B12R1.71 CCCCN1CCC(CC1)SC 34a_100015202541_100000210210 [0,0,0,1,0,0|2,1,0]=4 2434 B12R1.71 CCCNC1CCC(CC1)CC 2230a_100011194317_100000210303 [0,0,0,1,0,0|3,0,0]=4 2435 B12R1.71 CCCNC1CCC(CC1)CC 270004a_100020643023_100000210631 [0,0,0,1,0,0|3,0,0]=4 2436 B12R1.71 CCCNC1CCC(CC1)CC 34a_100011194317_100000210303 [0,0,0,1,0,0|3,0,0]=4 2437 B12R1.71 CCCNC1CCC(CC1)NC 270004a_100020643023_200016988011 [0,0,0,1,0,0|3,0,0]=4 2438 B12R1.71 CCCNC1CCC(CC1)OC 270004a_100020643023_100000747084 [0,0,0,1,0,0|2,0,0]=3 2439 B12R1.71 CCCNC1CCC(CC1)OC 34a_100015205214_100000210303 [0,0,0,1,0,0|2,0,0]=3 2440 B12R1.71 CCCOC1CCC(CC1)CC 34a_100011215326_100000210303 [0,0,0,1,0,0|3,0,0]=4 2441 B12R1.71 CCCOC1CCC(CC1)CC 7a_100011215326_100000210303 [0,0,0,1,0,0|3,0,0]=4 2442 B12R1.71 CCCOC1CCC(CC1)OC 34a_100011581665_100000210303 [0,0,0,1,0,0|2,0,0]=3 2443 B12R1.71 CCCOC1CCC(CC1)OC 7a_100011581665_100000210303 [0,0,0,1,0,0|2,0,0]=3 2444 B12R1.71 CCCO[C@H]1CC[C@H](CC1)NC 34a_100020636401_100000210303 [0,0,0,1,0,0|3,0,0]=4 2445 B12R1.71 CCNCC1CCC(CC1)OC 2230a_100015525214_100013032858 [0,0,0,1,0,0|2,0,0]=3 2446 B12R1.71 CCOCC1CCC(CC1)OC 34a_100121572206_100013032858 [0,0,0,1,0,0|2,0,0]=3 2447 B12R1.71 CCOCN1CCC(CC1)OC 269982a_100000234800_100000739092 [0,0,0,1,0,0|3,0,0]=4 2448 B12R1.71 CCOC[C@H]1CC[C@@H](CC1)NC 34a_100009831571_100000210202 [0,0,0,1,0,0|3,0,0]=4 2449 B12R1.71 CCSCC1CCC(CC1)OC 62a_100000210202_100013032858 [0,0,0,1,0,0|2,0,0]=3 2450 B12R1.71 CCSCC1CCC(CC1)OC 62a_100013032858_100000210202 [0,0,0,1,0,0|2,0,0]=3 2451 B12R1.71 CNCCC1CCC(CC1)OC 34a_100011998350_200000210301 [0,0,0,1,0,0|2,0,0]=3 2452 B12R1.71 COC1CCC(CC1)CCN[13CH3] 34a_100011998350_200025704644 [0,0,0,1,0,0|2,0,0]=3 2453 B12R1.71 COC1CCC(CC1)CSCF 62a_100013032858_100015361967 [0,0,0,1,0,0|3,0,0]=4 2454 B12R1.71 COC1CCC(CC1)CSCF 62a_100015361967_100013032858 [0,0,0,1,0,0|3,0,0]=4 2455 B12R1.71 COC1CCC(CC1)NCCF 34a_100015205214_100011217306 [0,0,0,1,0,0|3,0,0]=4 2456 B12R1.71 COC1CCC(CC1)NCCO 270004a_100000210304_100000747084 [0,0,0,1,0,0|3,0,0]=4 2457 B12R1.71 COC1CCC(CC1)NCCO 34a_100015205214_100000211926 [0,0,0,1,0,0|3,0,0]=4 2458 B12R1.71 COC1CCC(CC1)NCSC 34a_100015205214_100011218213 [0,0,0,1,0,0|3,0,0]=4 2459 B12R1.71 COC1CCC(CC1)OCCF 34a_100011581665_100011217306 [0,0,0,1,0,0|3,0,0]=4 2460 B12R1.71 COC1CCC(CC1)OCCF 7a_100011581665_100011217306 [0,0,0,1,0,0|3,0,0]=4 2461 B12R1.71 COC1CCC(CC1)OCCO 34a_100011581665_100000211926 [0,0,0,1,0,0|3,0,0]=4 2462 B12R1.71 COC1CCC(CC1)OCCO 7a_100011581665_100000211926 [0,0,0,1,0,0|3,0,0]=4 2463 B12R1.71 COC1CCC(CC1)OCSC 34a_100011581665_100011218213 [0,0,0,1,0,0|3,0,0]=4 2464 B12R1.71 COC1CCN(CC1)CCCF 2230a_100000234800_100011934791 [0,0,0,1,0,0|3,0,0]=4 2465 B12R1.71 COC1CCN(CC1)CCCF 269982a_100000234800_100011934791 [0,0,0,1,0,0|3,0,0]=4 2466 B12R1.71 COC1CCN(CC1)CCCF 34a_100000234800_100011934791 [0,0,0,1,0,0|3,0,0]=4 2467 B12R1.71 COC1CCN(CC1)CCCO 2230a_100000234800_100000230001 [0,0,0,1,0,0|3,0,0]=4 2468 B12R1.71 COC1CCN(CC1)CCCO 269982a_100000234800_100011215043 [0,0,0,1,0,0|3,0,0]=4 2469 B12R1.71 COC1CCN(CC1)CCCO 34a_100000234800_100000230001 [0,0,0,1,0,0|3,0,0]=4 2470 B12R1.71 COC1CCN(CC1)CCSC 2230a_100000234800_100000751147 [0,0,0,1,0,0|3,0,0]=4 2471 B12R1.71 COC1CCN(CC1)CCSC 269982a_100000234800_100000212216 [0,0,0,1,0,0|3,0,0]=4 2472 B12R1.71 COC1CCN(CC1)CCSC 34a_100000234800_100000212216 [0,0,0,1,0,0|3,0,0]=4 2473 B12R1.71 COCCN1CCC(CC1)OC 2230a_100000234800_100011201679 [0,0,0,1,0,0|3,0,0]=4 2474 B12R1.71 COCCN1CCC(CC1)OC 269982a_100000234800_100000233755 [0,0,0,1,0,0|3,0,0]=4 2475 B12R1.71 COCCN1CCC(CC1)OC 34a_100000234800_100011201679 [0,0,0,1,0,0|3,0,0]=4 2476 B12R1.83 CCC(CC)N1CCCC1CC 269982a_100000754278_100000210505 [0,0,0,1,0,0|3,0,0]=4 2477 B12R1.83 CCC(CC)N1CCCC1CC 270004a_100000754278_100000210860 [0,0,0,1,0,0|3,0,0]=4 2478 B12R1.83 CCC1CCCC1N(CC)CC 270004a_100000724800_100000749056 [0,0,0,1,0,0|3,0,0]=4 2479 B12R1.118 CCC(CC)NC1CCCCC1 270004a_100000182618_100000210860 [0,0,0,1,0,0|3,0,0]=4 2480 B12R1.118 CCC(CC)NC1CCCCC1 270004a_100000199018_100000210434 [0,0,0,1,0,0|3,0,0]=4 2481 B12R1.118 CCC(CC)OC1CCCCC1 7a_100000210231_100000210505 [0,0,0,1,0,0|3,0,0]=4 2482 B12R1.118 CCC(CC)OC1CCCCC1 7a_100000688536_100000210327 [0,0,0,1,0,0|3,0,0]=4 2483 B12R1.118 CCC(CC)SC1CCCCC1 62a_100000210327_100000210505 [0,0,0,1,0,0|3,0,0]=4 2484 B12R1.118 CCC(CC)SC1CCCCC1 62a_100000210505_100000210327 [0,0,0,1,0,0|3,0,0]=4 2485 B12R1.118 CCN(CC)CC1CCCCC1 2230a_100000724800_100000211423 [0,0,0,1,0,0|3,0,0]=4 2486 B12R1.118 CCN(CC)CC1CCCCC1 269956a_100000042499_100000211423 [0,0,0,1,0,0|3,0,0]=4 2487 B12R1.118 CCN(CC)CC1CCCCC1 269982a_100000724800_100000211423 [0,0,0,1,0,0|3,0,0]=4 2488 B12R1.118 CN[C@H](CO)CC1CCCCC1 2230a_100015184289_200000210301 [0,0,0,1,0,0|3,0,0]=4 2489 B12R1.118 CN[C@H](CO)CC1CCCCC1 34a_100015184289_200000210301 [0,0,0,1,0,0|3,0,0]=4 2490 B12R1.118 COC(CN1CC=CCC1)OC 2230a_100000698166_100000751394 [0,0,0,1,0,0|1,0,2]=4 2491 B12R1.118 COC(CN1CC=CCC1)OC 270004a_100000698166_100000752162 [0,0,0,1,0,0|1,0,2]=4 2492 B12R1.118 COC(CN1CC=CCC1)OC 34a_100000698166_100000211822 [0,0,0,1,0,0|1,0,2]=4 2493 B12R1.118 COC(CN1CCCOC1)OC 2230a_100000131196_100000751394 [0,0,0,1,0,0|2,0,0]=3 2494 B12R1.118 COC(CN1CCCOC1)OC 270004a_100000131196_100000752162 [0,0,0,1,0,0|2,0,0]=3 2495 B12R1.118 COC(CN1CCCOC1)OC 34a_100000131196_100000211822 [0,0,0,1,0,0|2,0,0]=3 2496 B12R1.118 COC(CN1CCOCC1)OC 2230a_100015191051_100000751394 [0,0,0,1,0,0|2,0,0]=3 2497 B12R1.118 COC(CN1CCOCC1)OC 270004a_100015191051_100000752162 [0,0,0,1,0,0|2,0,0]=3 2498 B12R1.118 COC(CN1CCOCC1)OC 34a_100015191051_100000211822 [0,0,0,1,0,0|2,0,0]=3 2499 B12R1.118 COC(CN1CCSCC1)OC 2230a_100000737611_100000751394 [0,0,0,1,0,0|2,0,0]=3 2500 B12R1.118 COC(CN1CCSCC1)OC 270004a_100000737611_100000752162 [0,0,0,1,0,0|2,0,0]=3 2501 B12R1.118 [13CH3]N[C@H](CO)CC1CCCCC1 2230a_100015184289_200025704644 [0,0,0,1,0,0|3,0,0]=4 2502 B12R1.118 [13CH3]N[C@H](CO)CC1CCCCC1 34a_100015184289_200025704644 [0,0,0,1,0,0|3,0,0]=4 2503 B12R1.243 CCC(CC)N1CCCCC1C 269982a_100000211376_100000210505 [0,0,0,1,0,0|3,0,0]=4 2504 B12R1.243 CCC(CC)N1CCCCC1C 270004a_100000211376_100000210860 [0,0,0,1,0,0|3,0,0]=4 2505 B12R1.243 CCN(CC)C1CCCCC1C 270004a_100000724800_100000210921 [0,0,0,1,0,0|3,0,0]=4 2506 B12R1.244 CCC(CC)CNCCC1CC1 2230a_100102946423_100000694398 [0,0,0,1,0,0|3,0,0]=4 2507 B12R1.244 CCC(CC)CNCCC1CC1 269862a_100000764129_100000211137 [0,0,0,1,0,0|3,0,0]=4 2508 B12R1.244 CCC(CC)CNCCC1CC1 270004a_100000764129_100000211137 [0,0,0,1,0,0|3,0,0]=4 2509 B12R1.244 CCC(CC)CNCCC1CC1 34a_100000764129_100011215472 [0,0,0,1,0,0|3,0,0]=4 2510 B12R1.244 CCC(CC)COCCC1CC1 34a_100000754188_100011215472 [0,0,0,1,0,0|3,0,0]=4 2511 B12R1.244 CCC(CC)COCCC1CC1 7a_100000703878_100000764125 [0,0,0,1,0,0|3,0,0]=4 2512 B12R1.244 CCC(CC)COCCC1CC1 7a_100000754188_100011215472 [0,0,0,1,0,0|3,0,0]=4 2513 B12R1.244 CCC(CC)CSCCC1CC1 62a_100000764125_100011215472 [0,0,0,1,0,0|3,0,0]=4 2514 B12R1.244 CCC(CC)CSCCC1CC1 62a_100011215472_100000764125 [0,0,0,1,0,0|3,0,0]=4 2515 B12R1.244 CCC(COCCC1CC1)OC 34a_100011934954_100000694398 [0,0,0,1,0,0|2,0,0]=3 2516 B12R1.244 CCC(COCCC1CC1)OC 7a_100011934954_100000764125 [0,0,0,1,0,0|2,0,0]=3 2517 B12R1.244 CCC(COCCC1CO1)OC 34a_100011934954_100000732470 [0,0,0,1,0,0|3,0,0]=4 2518 B12R1.244 CCC(COCCC1CO1)OC 7a_100011934954_100000732470 [0,0,0,1,0,0|3,0,0]=4 2519 B12R1.244 COC(C=NNCC1CC1)OC 4a_100000736359_100000752162 [0,0,0,1,0,0|2,0,1]=4 2520 B12R1.244 COC(CCCNC1CC1)OC 34a_100000212008_100000069011 [0,0,0,1,0,0|1,0,0]=2 2521 B12R1.244 COC(CCCSC1CC1)OC 62a_100000069011_100000211595 [0,0,0,1,0,0|1,0,0]=2 2522 B12R1.244 COC(CCNCC1CC1)OC 2230a_100000735609_100009813347 [0,0,0,1,0,0|1,0,0]=2 2523 B12R1.244 COC(CCNCC1CC1)OC 34a_100000735609_100000139399 [0,0,0,1,0,0|1,0,0]=2 2524 B12R1.244 COC(CCOCC1CC1)OC 34a_100000211283_100000139399 [0,0,0,1,0,0|1,0,0]=2 2525 B12R1.244 COC(CCOC[C@@H]1CO1)OC 34a_100000757423_100000139399 [0,0,0,1,0,0|2,0,0]=3 2526 B12R1.244 COC(CCSCC1CC1)OC 62a_100000139399_100000742324 [0,0,0,1,0,0|1,0,0]=2 2527 B12R1.244 COC(CCSCC1CC1)OC 62a_100000756562_100000139399 [0,0,0,1,0,0|1,0,0]=2 2528 B12R1.244 COC(CCSCC1CO1)OC 62a_100000139399_102125554688 [0,0,0,1,0,0|2,0,0]=3 2529 B12R1.244 COC(CCSCC1CO1)OC 62a_102125554688_100000139399 [0,0,0,1,0,0|2,0,0]=3 2530 B12R1.244 COC(CCSCC1CS1)OC 62a_100000031435_100000139399 [0,0,0,1,0,0|2,0,0]=3 2531 B12R1.244 COC(CCSCC1CS1)OC 62a_100000139399_100000031435 [0,0,0,1,0,0|2,0,0]=3 2532 B12R1.244 COC(CCSC[C@@H]1CO1)OC 62a_100000139399_100000745022 [0,0,0,1,0,0|2,0,0]=3 2533 B12R1.244 COC(CCSC[C@@H]1CO1)OC 62a_100000745022_100000139399 [0,0,0,1,0,0|2,0,0]=3 2534 B12R1.244 COC(CNCCC1CC1)OC 270004a_100000764129_100000752162 [0,0,0,1,0,0|1,0,0]=2 2535 B12R1.244 COC(CNCCC1CC1)OC 34a_100000764129_100000211822 [0,0,0,1,0,0|1,0,0]=2 2536 B12R1.244 COC(COCCC1CC1)OC 34a_100000754188_100000211822 [0,0,0,1,0,0|1,0,0]=2 2537 B12R1.244 COC(COCCC1CC1)OC 34a_100011216393_100000694398 [0,0,0,1,0,0|1,0,0]=2 2538 B12R1.244 COC(COCCC1CC1)OC 7a_100000754188_100000751394 [0,0,0,1,0,0|1,0,0]=2 2539 B12R1.244 COC(COCCC1CO1)OC 34a_100011216393_100000732470 [0,0,0,1,0,0|2,0,0]=3 2540 B12R1.244 COC(COCC[C@@H]1CO1)OC 34a_100009820653_100000211822 [0,0,0,1,0,0|2,0,0]=3 2541 B12R1.244 COC(CSCCC1CC1)OC 62a_100000751394_100000764125 [0,0,0,1,0,0|1,0,0]=2 2542 B12R1.244 COC(CSCCC1CC1)OC 62a_100000764125_100000751394 [0,0,0,1,0,0|1,0,0]=2 2543 B12R1.244 COC(CSCCC1CO1)OC 62a_100000732470_100000751394 [0,0,0,1,0,0|2,0,0]=3 2544 B12R1.244 COC(CSCCC1CO1)OC 62a_100000751394_100000732470 [0,0,0,1,0,0|2,0,0]=3 2545 B12R1.245 COC(CCN1CCC1C)OC 269982a_100000755817_100000139399 [0,0,0,1,0,0|1,0,0]=2 2546 B12R1.245 COC(CCN1CCC1C)OC 34a_100000755817_100000139399 [0,0,0,1,0,0|1,0,0]=2 2547 B12R1.245 COC(COC1CCC1=O)OC 34a_100011216393_100009892977 [0,0,0,1,0,0|2,0,1]=4 2548 B12R1.245 COC(CSC1CCC1=O)OC 62a_100000751394_100009892977 [0,0,0,1,0,0|2,0,1]=4 2549 B12R1.245 COC(CSC1CCC1=O)OC 62a_100009892977_100000751394 [0,0,0,1,0,0|2,0,1]=4 2550 B12R1.249 CCC(CC)CNCC1CCC1 2230a_100000738700_100011215472 [0,0,0,1,0,0|3,0,0]=4 2551 B12R1.249 CCC(CC)CNCC1CCC1 2230a_100102946423_100000763275 [0,0,0,1,0,0|3,0,0]=4 2552 B12R1.249 CCC(CC)CNCC1CCC1 269862a_100000738700_100000211137 [0,0,0,1,0,0|3,0,0]=4 2553 B12R1.249 CCC(CC)CNCC1CCC1 269862a_100102946423_100000753134 [0,0,0,1,0,0|3,0,0]=4 2554 B12R1.249 CCC(CC)CNCC1CCC1 270004a_100000738700_100000211137 [0,0,0,1,0,0|3,0,0]=4 2555 B12R1.249 CCC(CC)CNCC1CCC1 34a_100000738700_100011215472 [0,0,0,1,0,0|3,0,0]=4 2556 B12R1.249 CCC(CC)COCC1CCC1 34a_100000760304_100011215472 [0,0,0,1,0,0|3,0,0]=4 2557 B12R1.249 CCC(CC)COCC1CCC1 7a_100000703878_100000763275 [0,0,0,1,0,0|3,0,0]=4 2558 B12R1.249 CCC(CC)CSCC1CCC1 62a_100000763275_100011215472 [0,0,0,1,0,0|3,0,0]=4 2559 B12R1.249 CCC(CC)CSCC1CCC1 62a_100011215472_100000763275 [0,0,0,1,0,0|3,0,0]=4 2560 B12R1.249 CCC(CNCC1CCC1)OC 269862a_100000731041_100000753134 [0,0,0,1,0,0|2,0,0]=3 2561 B12R1.249 CCC(COCC1CCC1)OC 34a_100011934954_100000763275 [0,0,0,1,0,0|2,0,0]=3 2562 B12R1.249 CCC(COCC1CCC1)OC 7a_100011934954_100000763275 [0,0,0,1,0,0|2,0,0]=3 2563 B12R1.249 CCC(COCC1CCO1)OC 34a_100011934954_100000103362 [0,0,0,1,0,0|3,0,0]=4 2564 B12R1.249 CCC(COCC1CCO1)OC 7a_100011934954_100000103362 [0,0,0,1,0,0|3,0,0]=4 2565 B12R1.249 CCC(COCC1COC1)OC 34a_100011934954_100010264016 [0,0,0,1,0,0|3,0,0]=4 2566 B12R1.249 CCC(COCC1COC1)OC 7a_100011934954_100010264016 [0,0,0,1,0,0|3,0,0]=4 2567 B12R1.249 COC(C=NNC1CCC1)OC 4a_100000736358_100000752162 [0,0,0,1,0,0|2,0,1]=4 2568 B12R1.249 COC(CCCN1CCC1)OC 269982a_100000754969_100000069011 [0,0,0,1,0,0|1,0,0]=2 2569 B12R1.249 COC(CCNC1CCC1)OC 2230a_100000749019_100009813347 [0,0,0,1,0,0|1,0,0]=2 2570 B12R1.249 COC(CCNC1CCC1)OC 34a_100000749019_100000139399 [0,0,0,1,0,0|1,0,0]=2 2571 B12R1.249 COC(CCNC1COC1)OC 2230a_100016991112_100009813347 [0,0,0,1,0,0|2,0,0]=3 2572 B12R1.249 COC(CCOC1CCC1)OC 34a_100000748187_100000139399 [0,0,0,1,0,0|1,0,0]=2 2573 B12R1.249 COC(CCOC1CSC1)OC 7a_100000072292_100009813347 [0,0,0,1,0,0|2,0,0]=3 2574 B12R1.249 COC(CCSC1CCC1)OC 62a_100000139399_100000749161 [0,0,0,1,0,0|1,0,0]=2 2575 B12R1.249 COC(CCSC1COC1)OC 62a_100000139399_100009818527 [0,0,0,1,0,0|2,0,0]=3 2576 B12R1.249 COC(CNCC1CCC1)OC 2230a_100000738700_100000751394 [0,0,0,1,0,0|1,0,0]=2 2577 B12R1.249 COC(CNCC1CCC1)OC 270004a_100000738700_100000752162 [0,0,0,1,0,0|1,0,0]=2 2578 B12R1.249 COC(CNCC1CCC1)OC 34a_100000738700_100000211822 [0,0,0,1,0,0|1,0,0]=2 2579 B12R1.249 COC(CNCC1COC1)OC 2230a_100015281925_100000751394 [0,0,0,1,0,0|2,0,0]=3 2580 B12R1.249 COC(CNCC1COC1)OC 270004a_100015281925_100000752162 [0,0,0,1,0,0|2,0,0]=3 2581 B12R1.249 COC(CNCC1COC1)OC 34a_100015281925_100000211822 [0,0,0,1,0,0|2,0,0]=3 2582 B12R1.249 COC(CNC[C@@H]1CCO1)OC 2230a_100020831831_100000751394 [0,0,0,1,0,0|2,0,0]=3 2583 B12R1.249 COC(CNC[C@@H]1CCO1)OC 270004a_100020831831_100000752162 [0,0,0,1,0,0|2,0,0]=3 2584 B12R1.249 COC(CNC[C@@H]1CCO1)OC 34a_100020831831_100000211822 [0,0,0,1,0,0|2,0,0]=3 2585 B12R1.249 COC(COCC1CCC1)OC 34a_100000760304_100000211822 [0,0,0,1,0,0|1,0,0]=2 2586 B12R1.249 COC(COCC1CCC1)OC 34a_100011216393_100000763275 [0,0,0,1,0,0|1,0,0]=2 2587 B12R1.249 COC(COCC1CCO1)OC 34a_100000039022_100000211822 [0,0,0,1,0,0|2,0,0]=3 2588 B12R1.249 COC(COCC1CCO1)OC 34a_100011216393_100000103362 [0,0,0,1,0,0|2,0,0]=3 2589 B12R1.249 COC(COCC1CNC1)OC 34a_100016987283_100000211822 [0,0,0,1,0,0|2,0,0]=3 2590 B12R1.249 COC(COCC1COC1)OC 34a_100000060846_100000211822 [0,0,0,1,0,0|2,0,0]=3 2591 B12R1.249 COC(COCC1COC1)OC 34a_100011216393_100010264016 [0,0,0,1,0,0|2,0,0]=3 2592 B12R1.249 COC(CSCC1CCC1)OC 62a_100000751394_100000763275 [0,0,0,1,0,0|1,0,0]=2 2593 B12R1.249 COC(CSCC1CCC1)OC 62a_100000763275_100000751394 [0,0,0,1,0,0|1,0,0]=2 2594 B12R1.249 COC(CSCC1CCO1)OC 62a_100000103362_100000751394 [0,0,0,1,0,0|2,0,0]=3 2595 B12R1.249 COC(CSCC1CCO1)OC 62a_100000751394_100000103362 [0,0,0,1,0,0|2,0,0]=3 2596 B12R1.249 COC(CSCC1COC1)OC 62a_100000751394_100010264016 [0,0,0,1,0,0|2,0,0]=3 2597 B12R1.249 COC(CSCC1COC1)OC 62a_100010264016_100000751394 [0,0,0,1,0,0|2,0,0]=3 2598 B12R1.251 CCC(CC)CN1CCC[C@@H]1C 2230a_100020605311_100011215472 [0,0,0,1,0,0|3,0,0]=4 2599 B12R1.251 CCC(CC)CN1CCC[C@@H]1C 269982a_100020605311_100011215472 [0,0,0,1,0,0|3,0,0]=4 2600 B12R1.251 CCC(CC)CN1CCC[C@@H]1C 270004a_100020605311_100000211137 [0,0,0,1,0,0|3,0,0]=4 2601 B12R1.251 CCC(CC)CN1CCC[C@H]1C 2230a_100015189458_100011215472 [0,0,0,1,0,0|3,0,0]=4 2602 B12R1.251 CCC(CC)CN1CCC[C@H]1C 269982a_100015189458_100011215472 [0,0,0,1,0,0|3,0,0]=4 2603 B12R1.251 CCC(CC)CN1CCC[C@H]1C 270004a_100015189458_100000211137 [0,0,0,1,0,0|3,0,0]=4 2604 B12R1.251 CCC(CC)CN1CCC[C@H]1C 34a_100015189458_100011215472 [0,0,0,1,0,0|3,0,0]=4 2605 B12R1.251 CCC(CC)NC1CCCC1C 269862a_100000199018_100000752053 [0,0,0,1,0,0|3,0,0]=4 2606 B12R1.251 CCC(CC)OC1CCCC1C 7a_100011216460_100000210505 [0,0,0,1,0,0|3,0,0]=4 2607 B12R1.251 COC(CN1CCC[C@@H]1C)OC 2230a_100020605311_100000751394 [0,0,0,1,0,0|1,0,0]=2 2608 B12R1.251 COC(CN1CCC[C@@H]1C)OC 270004a_100020605311_100000752162 [0,0,0,1,0,0|1,0,0]=2 2609 B12R1.251 COC(CN1CCC[C@H]1C)OC 2230a_100015189458_100000751394 [0,0,0,1,0,0|1,0,0]=2 2610 B12R1.251 COC(CN1CCC[C@H]1C)OC 270004a_100015189458_100000752162 [0,0,0,1,0,0|1,0,0]=2 2611 B12R1.251 COC(CN1CCC[C@H]1C)OC 34a_100015189458_100000211822 [0,0,0,1,0,0|1,0,0]=2 2612 B12R1.251 COC(CN1CCSC1C)OC 2230a_200011216479_100000751394 [0,0,0,1,0,0|2,0,0]=3 2613 B12R1.251 COC(CN1CCSC1C)OC 270004a_200011216479_100000752162 [0,0,0,1,0,0|2,0,0]=3 2614 B12R1.251 COC(CN1CCSC1C)OC 34a_200011216479_100000211822 [0,0,0,1,0,0|2,0,0]=3 2615 B12R1.297 CCC(CC)CNC1CCCC1 2230a_100000211070_100011215472 [0,0,0,1,0,0|3,0,0]=4 2616 B12R1.297 CCC(CC)CNC1CCCC1 2230a_100102946423_100000179811 [0,0,0,1,0,0|3,0,0]=4 2617 B12R1.297 CCC(CC)CNC1CCCC1 269862a_100000211070_100000211137 [0,0,0,1,0,0|3,0,0]=4 2618 B12R1.297 CCC(CC)CNC1CCCC1 270004a_100000211070_100000211137 [0,0,0,1,0,0|3,0,0]=4 2619 B12R1.297 CCC(CC)CNC1CCCC1 270004a_100102946423_100000210133 [0,0,0,1,0,0|3,0,0]=4 2620 B12R1.297 CCC(CC)CNC1CCCC1 34a_100000211070_100011215472 [0,0,0,1,0,0|3,0,0]=4 2621 B12R1.297 CCC(CC)COC1CCCC1 34a_100000210269_100011215472 [0,0,0,1,0,0|3,0,0]=4 2622 B12R1.297 CCC(CC)COC1CCCC1 7a_100000210269_100011215472 [0,0,0,1,0,0|3,0,0]=4 2623 B12R1.297 CCC(CC)COC1CCCC1 7a_100000703878_100000179811 [0,0,0,1,0,0|3,0,0]=4 2624 B12R1.297 CCC(CC)CSC1CCCC1 62a_100011215472_100000179811 [0,0,0,1,0,0|3,0,0]=4 2625 B12R1.297 CCC(CC)CSC1CCCC1 62a_100011217020_100011215472 [0,0,0,1,0,0|3,0,0]=4 2626 B12R1.297 CCC(CC)NCC1CCCC1 2230a_100000199018_100000740388 [0,0,0,1,0,0|3,0,0]=4 2627 B12R1.297 CCC(CC)NCC1CCCC1 269862a_100000199018_100000746403 [0,0,0,1,0,0|3,0,0]=4 2628 B12R1.297 CCC(CC)NCC1CCCC1 270004a_100000737975_100000210860 [0,0,0,1,0,0|3,0,0]=4 2629 B12R1.297 CCC(CC)OCC1CCCC1 7a_100000688536_100000740388 [0,0,0,1,0,0|3,0,0]=4 2630 B12R1.297 CCC(CC)OCC1CCCC1 7a_100000742336_100000210505 [0,0,0,1,0,0|3,0,0]=4 2631 B12R1.297 CCC(CC)SCC1CCCC1 62a_100000210505_100000740388 [0,0,0,1,0,0|3,0,0]=4 2632 B12R1.297 CCC(CC)SCC1CCCC1 62a_100000740388_100000210505 [0,0,0,1,0,0|3,0,0]=4 2633 B12R1.297 CCC(CNC1CCCC1)OC 270004a_100000731041_100000210133 [0,0,0,1,0,0|2,0,0]=3 2634 B12R1.297 CCC(CNC1CCOC1)OC 270004a_100000731041_100000752484 [0,0,0,1,0,0|3,0,0]=4 2635 B12R1.297 CCC(CNC1CCSC1)OC 270004a_100000731041_100000212027 [0,0,0,1,0,0|3,0,0]=4 2636 B12R1.297 CCC(COC1CCCC1)OC 34a_100011934954_100000179811 [0,0,0,1,0,0|2,0,0]=3 2637 B12R1.297 CCC(COC1CCCC1)OC 7a_100011934954_100000179811 [0,0,0,1,0,0|2,0,0]=3 2638 B12R1.297 CCC(COC1CCOC1)OC 34a_100011934954_100000690089 [0,0,0,1,0,0|3,0,0]=4 2639 B12R1.297 CCC(COC1CCOC1)OC 7a_100011934954_100000731011 [0,0,0,1,0,0|3,0,0]=4 2640 B12R1.297 CCN(CC)CCC1CCCC1 2230a_100000724800_100000760354 [0,0,0,1,0,0|3,0,0]=4 2641 B12R1.297 CCN(CC)CCC1CCCC1 269956a_100000042499_100000760354 [0,0,0,1,0,0|3,0,0]=4 2642 B12R1.297 CCN(CC)CCC1CCCC1 269982a_100000724800_100000760354 [0,0,0,1,0,0|3,0,0]=4 2643 B12R1.297 COC(CCN1CC=CC1)OC 269982a_100015195280_100000139399 [0,0,0,1,0,0|1,0,2]=4 2644 B12R1.297 COC(CCN1CCCC1)OC 2230a_100000188435_100009813347 [0,0,0,1,0,0|1,0,0]=2 2645 B12R1.297 COC(CCN1CCCC1)OC 269982a_100000188435_100000139399 [0,0,0,1,0,0|1,0,0]=2 2646 B12R1.297 COC(CCN1CCSC1)OC 2230a_100011215254_100009813347 [0,0,0,1,0,0|2,0,0]=3 2647 B12R1.297 COC(CCN1CCSC1)OC 269982a_100011215254_100000139399 [0,0,0,1,0,0|2,0,0]=3 2648 B12R1.297 COC(CNC1CC=CC1)OC 2230a_100015188752_100000751394 [0,0,0,1,0,0|1,0,2]=4 2649 B12R1.297 COC(CNC1CC=CC1)OC 270004a_100015188752_100000752162 [0,0,0,1,0,0|1,0,2]=4 2650 B12R1.297 COC(CNC1CCCC1)OC 2230a_100000211070_100000751394 [0,0,0,1,0,0|1,0,0]=2 2651 B12R1.297 COC(CNC1CCCC1)OC 270004a_100000210479_100000210133 [0,0,0,1,0,0|1,0,0]=2 2652 B12R1.297 COC(CNC1CCCC1)OC 270004a_100000211070_100000752162 [0,0,0,1,0,0|1,0,0]=2 2653 B12R1.297 COC(CNC1CCCC1)OC 34a_100000211070_100000211822 [0,0,0,1,0,0|1,0,0]=2 2654 B12R1.297 COC(CNC1CCOC1)OC 270004a_100000210479_100000752484 [0,0,0,1,0,0|2,0,0]=3 2655 B12R1.297 COC(CNC1CCSC1)OC 270004a_100000210479_100000212027 [0,0,0,1,0,0|2,0,0]=3 2656 B12R1.297 COC(CN[C@@H]1CCOC1)OC 2230a_200015188469_100000751394 [0,0,0,1,0,0|2,0,0]=3 2657 B12R1.297 COC(CN[C@@H]1CCOC1)OC 270004a_200015188469_100000752162 [0,0,0,1,0,0|2,0,0]=3 2658 B12R1.297 COC(CN[C@H]1CCOC1)OC 2230a_100015188467_100000751394 [0,0,0,1,0,0|2,0,0]=3 2659 B12R1.297 COC(CN[C@H]1CCOC1)OC 270004a_100015188467_100000752162 [0,0,0,1,0,0|2,0,0]=3 2660 B12R1.297 COC(CN[C@H]1CCOC1)OC 34a_100015188467_100000211822 [0,0,0,1,0,0|2,0,0]=3 2661 B12R1.297 COC(COC1CCCC1)OC 34a_100000210269_100000211822 [0,0,0,1,0,0|1,0,0]=2 2662 B12R1.297 COC(COC1CCCC1)OC 34a_100011216393_100000179811 [0,0,0,1,0,0|1,0,0]=2 2663 B12R1.297 COC(COC1CCCC1)OC 7a_100000210269_100000751394 [0,0,0,1,0,0|1,0,0]=2 2664 B12R1.297 COC(COC1CCCO1)OC 34a_100000085407_100000211822 [0,0,0,1,0,0|2,0,0]=3 2665 B12R1.297 COC(COC1CCOC1)OC 34a_100011216393_100000690089 [0,0,0,1,0,0|2,0,0]=3 2666 B12R1.297 COC(COC1CCSC1)OC 7a_100011232664_100000751394 [0,0,0,1,0,0|2,0,0]=3 2667 B12R1.297 COC(CO[C@H]1CCOC1)OC 34a_100000717292_100000211822 [0,0,0,1,0,0|2,0,0]=3 2668 B12R1.297 COC(CSC1CCCC1)OC 62a_100000751394_100000179811 [0,0,0,1,0,0|1,0,0]=2 2669 B12R1.297 COC(CSC1CCCC1)OC 62a_100011217020_100000751394 [0,0,0,1,0,0|1,0,0]=2 2670 B12R1.297 COC(CSC1CCOC1)OC 62a_100000751394_100000690089 [0,0,0,1,0,0|2,0,0]=3 2671 B12R1.383 CCCCCCCN1CCC1C 269982a_100000755817_100000210681 [0,0,0,1,0,0|3,0,0]=4 2672 B12R1.383 CCCCCCCN1CCC1C 34a_100000755817_100000210614 [0,0,0,1,0,0|3,0,0]=4 2673 B12R1.455 CCCCCN1CC[C@H](C1)OC 2230a_100000766984_100000210326 [0,0,0,1,0,0|2,0,0]=3 2674 B12R1.455 CCCCCN1CC[C@H](C1)OC 269982a_100000766984_100000210215 [0,0,0,1,0,0|2,0,0]=3 2675 B12R1.455 CCCCNC1CCC(C1)CC 270004a_100000102301_100011218773 [0,0,0,1,0,0|3,0,0]=4 2676 B12R1.455 CCOCCN1CC[C@H](C1)OC 2230a_100000766984_100011215890 [0,0,0,1,0,0|3,0,0]=4 2677 B12R1.455 CCOCCN1CC[C@H](C1)OC 269982a_100000766984_100011215890 [0,0,0,1,0,0|3,0,0]=4 2678 B12R1.455 CCSCCN1CC[C@H](C1)OC 2230a_100000766984_100000757381 [0,0,0,1,0,0|3,0,0]=4 2679 B12R1.455 CCSCCN1CC[C@H](C1)OC 269982a_100000766984_100000757381 [0,0,0,1,0,0|3,0,0]=4 2680 B12R1.455 COCCCN1CC[C@H](C1)OC 2230a_100000766984_100000740836 [0,0,0,1,0,0|3,0,0]=4 2681 B12R1.455 COCCCN1CC[C@H](C1)OC 269982a_100000766984_100000740836 [0,0,0,1,0,0|3,0,0]=4 2682 B12R1.455 CO[C@@H]1CCN(C1)CCCCF 2230a_100000766984_100000729493 [0,0,0,1,0,0|3,0,0]=4 2683 B12R1.455 CO[C@@H]1CCN(C1)CCCCF 269982a_100000766984_100000729493 [0,0,0,1,0,0|3,0,0]=4 2684 B12R1.455 CO[C@@H]1CCN(C1)CCCCO 2230a_100000766984_100000210776 [0,0,0,1,0,0|3,0,0]=4 2685 B12R1.455 CO[C@@H]1CCN(C1)CCCCO 269982a_100000766984_100000210776 [0,0,0,1,0,0|3,0,0]=4 2686 B12R1.1143 CCCN1CCCC(CC1)CC 2230a_100000757272_100000210303 [0,0,0,1,0,0|3,0,0]=4 2687 B12R1.1143 CCCN1CCCC(CC1)CC 269982a_100000757272_100000210303 [0,0,0,1,0,0|3,0,0]=4 2688 B12R1.1143 CCCN1CCCC(CC1)CC 34a_100000757272_100000210303 [0,0,0,1,0,0|3,0,0]=4 2689 B12R1.1143 CCCN1CCCC(CC1)OC 2230a_100016993962_100000210303 [0,0,0,1,0,0|2,0,0]=3 2690 B12R1.1143 CCCN1CCCC(CC1)OC 269982a_100016993962_100000210303 [0,0,0,1,0,0|2,0,0]=3 2691 B12R1.1143 CCCN1CCCC(CC1)OC 34a_100016993962_100000210303 [0,0,0,1,0,0|2,0,0]=3 2692 B12R1.1143 COC1CCCN(CC1)CCF 2230a_100016993962_100011217306 [0,0,0,1,0,0|3,0,0]=4 2693 B12R1.1143 COC1CCCN(CC1)CCF 269982a_100016993962_100011217306 [0,0,0,1,0,0|3,0,0]=4 2694 B12R1.1143 COC1CCCN(CC1)CCF 34a_100016993962_100011217306 [0,0,0,1,0,0|3,0,0]=4 2695 B12R1.1143 COC1CCCN(CC1)CCO 2230a_100016993962_100000211926 [0,0,0,1,0,0|3,0,0]=4 2696 B12R1.1143 COC1CCCN(CC1)CCO 269982a_100016993962_100000211926 [0,0,0,1,0,0|3,0,0]=4 2697 B12R1.1143 COC1CCCN(CC1)CCO 34a_100016993962_100000211926 [0,0,0,1,0,0|3,0,0]=4 2698 B12R1.1143 COC1CCCN(CC1)CSC 2230a_100016993962_100011218213 [0,0,0,1,0,0|3,0,0]=4 2699 B12R1.1143 COC1CCCN(CC1)CSC 269982a_100016993962_100011218213 [0,0,0,1,0,0|3,0,0]=4 2700 B12R1.1143 COC1CCCN(CC1)CSC 34a_100016993962_100011218213 [0,0,0,1,0,0|3,0,0]=4 2701 B12R1.1143 COCN1CCCC(CC1)OC 2230a_100016993962_100000766300 [0,0,0,1,0,0|3,0,0]=4 2702 B12R1.1143 COCN1CCCC(CC1)OC 269982a_100016993962_100000766300 [0,0,0,1,0,0|3,0,0]=4 2703 B12R1.1287 CCC(CC)N1CCCCCC1 269982a_100000185865_100000210505 [0,0,0,1,0,0|3,0,0]=4 2704 B12R1.1287 CCC(CC)N1CCCCCC1 270004a_100000185865_100000210860 [0,0,0,1,0,0|3,0,0]=4 2705 B12R1.1287 CCN(CC)C1CCCCCC1 2230a_114901603759_100000210202 [0,0,0,1,0,0|3,0,0]=4 2706 B12R1.1287 CCN(CC)C1CCCCCC1 269956a_100000042499_100011217769 [0,0,0,1,0,0|3,0,0]=4 2707 B12R1.1287 CCN(CC)C1CCCCCC1 269982a_100000724800_100011217769 [0,0,0,1,0,0|3,0,0]=4 2708 B12R1.1287 CCN(CC)C1CCCCCC1 269982a_114901603759_100000204670 [0,0,0,1,0,0|3,0,0]=4 2709 B12R1.1287 CCN(CC)C1CCCCCC1 270004a_100000724800_100000210131 [0,0,0,1,0,0|3,0,0]=4 2710 B12R1.1287 CCN(CC)C1CCCCCC1 34a_114901603759_100000210202 [0,0,0,1,0,0|3,0,0]=4 2711 B12R1.1533 CCC(CC)COCC1CC1C 34a_100000744939_100011215472 [0,0,0,1,0,0|3,0,0]=4 2712 B12R1.1533 CCC(CC)COCC1CC1C 7a_100000744939_100011215472 [0,0,0,1,0,0|3,0,0]=4 2713 B12R1.1533 COC(CCN[C@@H]1C[C@@H]1F)OC 2230a_100015190264_100009813347 [0,0,0,1,0,0|2,0,0]=3 2714 B12R1.1533 COC(CCN[C@@H]1C[C@H]1F)OC 2230a_100025746932_100009813347 [0,0,0,1,0,0|2,0,0]=3 2715 B12R1.1533 COC(CCN[C@@H]1C[C@H]1F)OC 34a_100025746932_100000139399 [0,0,0,1,0,0|2,0,0]=3 2716 B12R1.1533 COC(COCC1CC1C)OC 34a_100000744939_100000211822 [0,0,0,1,0,0|1,0,0]=2 2717 B12R1.1533 COC(COCC1CC1C)OC 7a_100000744939_100000751394 [0,0,0,1,0,0|1,0,0]=2 2718 B12R1.3670 CCC1(CO1)CNCCCCO 34a_100000750430_200000139556 [0,0,0,1,0,0|3,0,0]=4 2719 B12R1.3670 CCC1(CO1)CNCCCOC 34a_100150723488_200000139556 [0,0,0,1,0,0|3,0,0]=4 2720 B12R1.3670 CCC1(CO1)COCCCCBr 34a_100011216708_200000139556 [0,0,0,1,0,0|3,0,0]=4 2721 B12R1.3670 CCC1(CO1)COCCCCCl 34a_100000210776_200000139556 [0,0,0,1,0,0|3,0,0]=4 2722 B12R1.3670 CCC1(CO1)COCCCCCl 7a_100000210776_200000139556 [0,0,0,1,0,0|3,0,0]=4 2723 B12R1.3670 CCC1(CO1)COCCCCF 34a_100011995726_200000139556 [0,0,0,1,0,0|3,0,0]=4 2724 B12R1.3670 CCC1(CO1)COCCCCF 7a_100011995726_200000139556 [0,0,0,1,0,0|3,0,0]=4 2725 B12R1.3670 CCC1(CO1)COCCCCI 34a_200012148704_200000139556 [0,0,0,1,0,0|3,0,0]=4 2726 B12R1.3670 CCC1(CO1)COCCCCN 34a_100000750430_200000139556 [0,0,0,1,0,0|3,0,0]=4 2727 B12R1.3670 CCC1(CO1)COCCCNC 34a_100000213112_200000139556 [0,0,0,1,0,0|3,0,0]=4 2728 B12R1.3670 CCC1(CO1)COCCCOC 34a_100000740835_200000139556 [0,0,0,1,0,0|3,0,0]=4 2729 B12R1.3670 CCC1(CO1)COCCCSC 34a_100000690336_200000139556 [0,0,0,1,0,0|3,0,0]=4 2730 B12R1.3670 CCC1(CO1)COCCCSC 7a_100000690336_200000139556 [0,0,0,1,0,0|3,0,0]=4 2731 B12R1.3670 CCC1(CO1)CSCCCCF 62a_100000729493_200000139556 [0,0,0,1,0,0|3,0,0]=4 2732 B12R1.3670 CCC1(CO1)CSCCCCF 62a_200000139556_100000729493 [0,0,0,1,0,0|3,0,0]=4 2733 B12R1.3670 CCC1(CO1)CSCCCCO 62a_100000210776_200000139556 [0,0,0,1,0,0|3,0,0]=4 2734 B12R1.3670 CCC1(CO1)CSCCCCO 62a_200000139556_100000210776 [0,0,0,1,0,0|3,0,0]=4 2735 B12R1.3670 CCC1(CO1)CSCCCOC 62a_100000709357_200000139556 [0,0,0,1,0,0|3,0,0]=4 2736 B12R1.3670 CCC1(CO1)CSCCCOC 62a_200000139556_100000709357 [0,0,0,1,0,0|3,0,0]=4 2737 B12R1.3670 CCCCCCNC1(CC1)CC 2230a_100000732774_100000210314 [0,0,0,1,0,0|3,0,0]=4 2738 B12R1.3670 CCCCCOCC1(CO1)CC 34a_100000210253_200000139556 [0,0,0,1,0,0|2,0,0]=3 2739 B12R1.3670 CCCCCOCC1(CO1)CC 7a_100000210253_200000139556 [0,0,0,1,0,0|2,0,0]=3 2740 B12R1.3670 CCCCCSCC1(CO1)CC 62a_100000210326_200000139556 [0,0,0,1,0,0|2,0,0]=3 2741 B12R1.3670 CCCCCSCC1(CO1)CC 62a_200000139556_100000210326 [0,0,0,1,0,0|2,0,0]=3 2742 B12R1.3670 CCOCCNCC1(CO1)CC 34a_102516460346_200000139556 [0,0,0,1,0,0|3,0,0]=4 2743 B12R1.3670 CCOCCOCC1(CO1)CC 34a_100000210136_200000139556 [0,0,0,1,0,0|3,0,0]=4 2744 B12R1.3670 CCOCCOCC1(CO1)CC 7a_100000210136_200000139556 [0,0,0,1,0,0|3,0,0]=4 2745 B12R1.3670 CCOCCSCC1(CO1)CC 62a_100000210147_200000139556 [0,0,0,1,0,0|3,0,0]=4 2746 B12R1.3670 CCOCCSCC1(CO1)CC 62a_200000139556_100011215890 [0,0,0,1,0,0|3,0,0]=4 2747 B12R1.3670 CCSCCOCC1(CO1)CC 34a_100000212035_200000139556 [0,0,0,1,0,0|3,0,0]=4 2748 B12R1.3670 CCSCCOCC1(CO1)CC 7a_100000212035_200000139556 [0,0,0,1,0,0|3,0,0]=4 2749 B12R1.3670 CCSCCSCC1(CO1)CC 62a_100000757381_200000139556 [0,0,0,1,0,0|3,0,0]=4 2750 B12R1.3670 CCSCCSCC1(CO1)CC 62a_200000139556_100000757381 [0,0,0,1,0,0|3,0,0]=4 2751 B9R0.46 CCCCCCC(C)NC 2230a_100000210919_200000210301 [2,0,0,0,0,0|1,0,0]=3 2752 B9R0.46 CCCCCCC(C)NC 2230a_106832991635_100011215978 [2,0,0,0,0,0|1,0,0]=3 2753 B9R0.46 CCCCCCC(C)NC 270004a_106832991635_100000210826 [2,0,0,0,0,0|1,0,0]=3 2754 B9R0.46 CCCCCCC(C)NC 34a_100000210919_200000210301 [2,0,0,0,0,0|1,0,0]=3 2755 B9R0.46 CCCCCCC(C)NC 34a_100102657272_100011215978 [2,0,0,0,0,0|1,0,0]=3 2756 B9R0.46 CCCCCCC(C)NC 7a_106832991635_100011215978 [2,0,0,0,0,0|1,0,0]=3 2757 B9R0.46 CCCCCCC(C)N[13CH3] 2230a_100000210919_200025704644 [2,0,0,0,0,0|1,0,0]=3 2758 B9R0.46 CCCCCCC(C)N[13CH3] 34a_100000210919_200025704644 [2,0,0,0,0,0|1,0,0]=3 2759 B9R0.46 CCCCCCC(C)OC 34a_100000210265_200000210301 [2,0,0,0,0,0|0,0,0]=2 2760 B9R0.46 CCCCCCC(C)OC 34a_100138415774_100011215978 [2,0,0,0,0,0|0,0,0]=2 2761 B9R0.46 CCCCCCC(C)OC 7a_100000210265_200000210301 [2,0,0,0,0,0|0,0,0]=2 2762 B9R0.46 CCCCCCC(C)O[13CH3] 34a_100000210265_200025704644 [2,0,0,0,0,0|0,0,0]=2 2763 B9R0.46 CCCCCCC(C)O[13CH3] 7a_100000210265_200025704644 [2,0,0,0,0,0|0,0,0]=2 2764 B9R0.46 CCCCCCC(C)SC 62a_100011215978_200000210301 [2,0,0,0,0,0|0,1,0]=3 2765 B9R0.46 CCCCCCC(C)SC 62a_200000210301_100011215978 [2,0,0,0,0,0|0,1,0]=3 2766 B9R0.46 CCCCCCC(C)S[13CH3] 62a_100011215978_200025704644 [2,0,0,0,0,0|0,1,0]=3 2767 B9R0.46 CCCCCCC(C)S[13CH3] 62a_200025704644_100011215978 [2,0,0,0,0,0|0,1,0]=3 2768 B9R0.46 CCCCCCN(C)CC 2230a_100000225621_100000210314 [2,0,0,0,0,0|2,0,0]=4 2769 B9R0.46 CCCCCCN(C)CC 2230a_106256046315_100000210202 [2,0,0,0,0,0|2,0,0]=4 2770 B9R0.46 CCCCCCN(C)CC 269982a_100000225621_100000210757 [2,0,0,0,0,0|2,0,0]=4 2771 B9R0.46 CCCCCCN(C)CC 269982a_106256046315_100000204670 [2,0,0,0,0,0|2,0,0]=4 2772 B9R0.46 CCCCCNC(C)CC 2230a_100000209981_100000210326 [2,0,0,0,0,0|2,0,0]=4 2773 B9R0.46 CCCCCNC(C)CC 2230a_100000209983_100000758301 [2,0,0,0,0,0|2,0,0]=4 2774 B9R0.46 CCCCCOC(C)CC 34a_100000210253_100011215416 [2,0,0,0,0,0|2,0,0]=4 2775 B9R0.46 CCCCCOC(C)CC 7a_100000210228_100000210326 [2,0,0,0,0,0|2,0,0]=4 2776 B9R0.46 CCCCCOC(C)CC 7a_100000210253_100000758301 [2,0,0,0,0,0|2,0,0]=4 2777 B9R0.46 CCCCCSC(C)CC 62a_100000210326_100000758301 [2,0,0,0,0,0|2,0,0]=4 2778 B9R0.46 CCCCCSC(C)CC 62a_100000758301_100000210326 [2,0,0,0,0,0|2,0,0]=4 2779 B9R0.46 CCCCCSC(C)OC 62a_100000210326_100009879195 [2,0,0,0,0,0|1,0,0]=3 2780 B9R0.46 CCCCCSC(C)OC 62a_100009879195_100000210326 [2,0,0,0,0,0|1,0,0]=3 2781 B9R0.46 CCCCNCC(C)CC 2230a_100000102301_100000748023 [2,0,0,0,0,0|2,0,0]=4 2782 B9R0.46 CCCCNCC(C)CC 2230a_100020588543_100000210211 [2,0,0,0,0,0|2,0,0]=4 2783 B9R0.46 CCCCNCC(C)CC 270004a_100000102301_100000243153 [2,0,0,0,0,0|2,0,0]=4 2784 B9R0.46 CCCCNCC(C)CC 7a_106832991798_100000748023 [2,0,0,0,0,0|2,0,0]=4 2785 B9R0.46 CCCCNCC(O)CC 2230a_100000102301_100011218378 [2,0,0,0,0,0|2,0,0]=4 2786 B9R0.46 CCCCNCC(O)CC 2230a_100011218483_100000210211 [2,0,0,0,0,0|2,0,0]=4 2787 B9R0.46 CCCCNCC(O)CC 7a_106832991798_100011218378 [2,0,0,0,0,0|2,0,0]=4 2788 B9R0.46 CCCCNC[C@@H](C)CC 2230a_100000102301_100009816398 [2,0,0,0,0,0|2,0,0]=4 2789 B9R0.46 CCCCNC[C@@H](C)CC 7a_106832991798_100009816398 [2,0,0,0,0,0|2,0,0]=4 2790 B9R0.46 CCCCNC[C@@H](C)OC 2230a_100020591295_100000210211 [2,0,0,0,0,0|1,0,0]=3 2791 B9R0.46 CCCCOCC(C)CC 34a_100000210227_100000748023 [2,0,0,0,0,0|2,0,0]=4 2792 B9R0.46 CCCCOCC(C)CC 7a_100000210227_100000748023 [2,0,0,0,0,0|2,0,0]=4 2793 B9R0.46 CCCCOCC(C)OC 34a_100000690652_100000210210 [2,0,0,0,0,0|1,0,0]=3 2794 B9R0.46 CCCCOCC(C)OC 34a_100011217071_200000210301 [2,0,0,0,0,0|1,0,0]=3 2795 B9R0.46 CCCCOCC(C)OC 7a_100011217071_200000210301 [2,0,0,0,0,0|1,0,0]=3 2796 B9R0.46 CCCCOCC(C)O[13CH3] 34a_100011217071_200025704644 [2,0,0,0,0,0|1,0,0]=3 2797 B9R0.46 CCCCOCC(C)O[13CH3] 7a_100011217071_200025704644 [2,0,0,0,0,0|1,0,0]=3 2798 B9R0.46 CCCCOCC(O)CC 34a_100000210227_100011218378 [2,0,0,0,0,0|2,0,0]=4 2799 B9R0.46 CCCCOCC(O)CC 7a_100000210227_100011218378 [2,0,0,0,0,0|2,0,0]=4 2800 B9R0.46 CCCCOC[C@@H](C)CC 34a_100000210227_100009816398 [2,0,0,0,0,0|2,0,0]=4 2801 B9R0.46 CCCCOC[C@@H](C)CC 7a_100000210227_100009816398 [2,0,0,0,0,0|2,0,0]=4 2802 B9R0.46 CCCCOC[C@@H](C)CC 7a_100009816381_100000210211 [2,0,0,0,0,0|2,0,0]=4 2803 B9R0.46 CCCCSCC(C)CC 62a_100000210211_100000748023 [2,0,0,0,0,0|2,0,0]=4 2804 B9R0.46 CCCCSCC(C)CC 62a_100000748023_100000210210 [2,0,0,0,0,0|2,0,0]=4 2805 B9R0.46 CCCCSCC(O)CC 62a_100000210211_100011218378 [2,0,0,0,0,0|2,0,0]=4 2806 B9R0.46 CCCCSCC(O)CC 62a_100011218378_100000210210 [2,0,0,0,0,0|2,0,0]=4 2807 B9R0.46 CCCCSC[C@@H](C)CC 62a_100000210211_100009816398 [2,0,0,0,0,0|2,0,0]=4 2808 B9R0.46 CCCCSC[C@@H](C)CC 62a_100009816398_100000210210 [2,0,0,0,0,0|2,0,0]=4 2809 B9R0.46 CCCNCCC(C)CC 2230a_100020591266_100000210303 [2,0,0,0,0,0|2,0,0]=4 2810 B9R0.46 CCCOCCC(C)CC 7a_100011215188_100000210303 [2,0,0,0,0,0|2,0,0]=4 2811 B9R0.46 CCCOCCC(C)OC 7a_100000764861_100000210303 [2,0,0,0,0,0|1,0,0]=3 2812 B9R0.46 CCOCCCC(C)CC 7a_100011216074_100000210202 [2,0,0,0,0,0|2,0,0]=4 2813 B9R0.46 CCOCCSC(C)OC 62a_100000210147_100009879195 [2,0,0,0,0,0|2,0,0]=4 2814 B9R0.46 CCOCCSC(C)OC 62a_100009879195_100011215890 [2,0,0,0,0,0|2,0,0]=4 2815 B9R0.46 CCSCCSC(C)OC 62a_100000757381_100009879195 [2,0,0,0,0,0|2,0,0]=4 2816 B9R0.46 CCSCCSC(C)OC 62a_100009879195_100000757381 [2,0,0,0,0,0|2,0,0]=4 2817 B9R0.46 COC(C)CCOCCF 7a_100000764861_100011217306 [2,0,0,0,0,0|2,0,0]=4 2818 B9R0.46 COC(C)CCOCCO 7a_100000764861_100000211926 [2,0,0,0,0,0|2,0,0]=4 2819 B9R0.46 COC(C)COCCCF 34a_100000690652_100011934791 [2,0,0,0,0,0|2,0,0]=4 2820 B9R0.46 COC(C)COCCCO 34a_100000690652_100000230001 [2,0,0,0,0,0|2,0,0]=4 2821 B9R0.46 COC(C)COCCSC 34a_100000690652_100000212216 [2,0,0,0,0,0|2,0,0]=4 2822 B9R0.46 COC(C)SCCCCF 62a_100000729493_100009879195 [2,0,0,0,0,0|2,0,0]=4 2823 B9R0.46 COC(C)SCCCCF 62a_100009879195_100000729493 [2,0,0,0,0,0|2,0,0]=4 2824 B9R0.46 COC(C)SCCCCO 62a_100000210776_100009879195 [2,0,0,0,0,0|2,0,0]=4 2825 B9R0.46 COC(C)SCCCCO 62a_100009879195_100000210776 [2,0,0,0,0,0|2,0,0]=4 2826 B9R0.46 COCCCSC(C)OC 62a_100000709357_100009879195 [2,0,0,0,0,0|2,0,0]=4 2827 B9R0.46 COCCCSC(C)OC 62a_100009879195_100000709357 [2,0,0,0,0,0|2,0,0]=4 2828 B9R0.46 COCCNC[C@@H](C)OC 2230a_100020591295_100011201679 [2,0,0,0,0,0|2,0,0]=4 2829 B9R0.46 COCCOCC(C)OC 34a_100000690652_100011201679 [2,0,0,0,0,0|2,0,0]=4 2830 B9R0.46 CO[C@H](C)CNCCCF 2230a_100020591295_100011934791 [2,0,0,0,0,0|2,0,0]=4 2831 B9R0.46 CO[C@H](C)CNCCCO 2230a_100020591295_100000230001 [2,0,0,0,0,0|2,0,0]=4 2832 B9R0.46 CO[C@H](C)CNCCSC 2230a_100020591295_100000751147 [2,0,0,0,0,0|2,0,0]=4 2833 B9R0.50 C#CC(CCCCC)OC 34a_100011216489_200000210301 [2,0,0,0,0,0|1,0,1]=4 2834 B9R0.50 C#CC(CCCCC)OC 7a_100011216489_200000210301 [2,0,0,0,0,0|1,0,1]=4 2835 B9R0.50 C#CC(CCCCC)O[13CH3] 34a_100011216489_200025704644 [2,0,0,0,0,0|1,0,1]=4 2836 B9R0.50 C#CC(CCCCC)O[13CH3] 7a_100011216489_200025704644 [2,0,0,0,0,0|1,0,1]=4 2837 B9R0.50 C=CC(CCCCC)OC 34a_100011216863_200000210301 [2,0,0,0,0,0|1,0,1]=4 2838 B9R0.50 C=CC(CCCCC)OC 7a_100011216863_200000210301 [2,0,0,0,0,0|1,0,1]=4 2839 B9R0.50 C=CC(CCCCC)O[13CH3] 34a_100011216863_200025704644 [2,0,0,0,0,0|1,0,1]=4 2840 B9R0.50 C=CC(CCCCC)O[13CH3] 7a_100011216863_200025704644 [2,0,0,0,0,0|1,0,1]=4 2841 B9R0.50 CCCCCC(CC)NC 270004a_106832991635_100011215316 [2,0,0,0,0,0|2,0,0]=4 2842 B9R0.50 CCCCCC(CC)OC 34a_100011215405_200000210301 [2,0,0,0,0,0|1,0,0]=3 2843 B9R0.50 CCCCCC(CC)OC 7a_100011215405_200000210301 [2,0,0,0,0,0|1,0,0]=3 2844 B9R0.50 CCCCCC(CC)O[13CH3] 34a_100011215405_200025704644 [2,0,0,0,0,0|1,0,0]=3 2845 B9R0.50 CCCCCC(CC)O[13CH3] 7a_100011215405_200025704644 [2,0,0,0,0,0|1,0,0]=3 2846 B9R0.50 CCCNCC(OC)OC 270004a_100020643023_100000752162 [2,0,0,0,0,0|1,0,0]=3 2847 B9R0.50 CCCOCC(CC)OC 34a_100011934954_100000210303 [2,0,0,0,0,0|2,0,0]=4 2848 B9R0.50 CCCOCC(CC)OC 7a_100011934954_100000210303 [2,0,0,0,0,0|2,0,0]=4 2849 B9R0.50 CCCOCC(OC)OC 34a_100000210258_100000211822 [2,0,0,0,0,0|1,0,0]=3 2850 B9R0.50 CCCOCC(OC)OC 34a_100011216393_100000210303 [2,0,0,0,0,0|1,0,0]=3 2851 B9R0.50 CCCSCC(OC)OC 62a_100000210303_100000751394 [2,0,0,0,0,0|1,0,0]=3 2852 B9R0.50 CCCSCC(OC)OC 62a_100000751394_100000210303 [2,0,0,0,0,0|1,0,0]=3 2853 B9R0.50 CCNCCC(OC)OC 2230a_100015525214_100009813347 [2,0,0,0,0,0|1,0,0]=3 2854 B9R0.50 CCOCCC(OC)OC 34a_100121572206_100000139399 [2,0,0,0,0,0|1,0,0]=3 2855 B9R0.50 CCSCCC(OC)OC 62a_100000139399_100000210202 [2,0,0,0,0,0|1,0,0]=3 2856 B9R0.50 CCSCCC(OC)OC 62a_100000210202_100000139399 [2,0,0,0,0,0|1,0,0]=3 2857 B9R0.50 CNCCCC(OC)OC 2230a_106832991635_100000069011 [2,0,0,0,0,0|1,0,0]=3 2858 B9R0.50 CNCCCC(OC)OC 34a_100102657272_100000069011 [2,0,0,0,0,0|1,0,0]=3 2859 B9R0.50 CNCCCC(OC)OC 7a_106832991635_100000069011 [2,0,0,0,0,0|1,0,0]=3 2860 B9R0.50 COC(CCCSC)OC 62a_100000069011_200000210301 [2,0,0,0,0,0|1,0,0]=3 2861 B9R0.50 COC(CCCSC)OC 62a_200000210301_100000069011 [2,0,0,0,0,0|1,0,0]=3 2862 B9R0.50 COC(CCCS[13CH3])OC 62a_100000069011_200025704644 [2,0,0,0,0,0|1,0,0]=3 2863 B9R0.50 COC(CCCS[13CH3])OC 62a_200025704644_100000069011 [2,0,0,0,0,0|1,0,0]=3 2864 B9R0.50 COC(CCSCF)OC 62a_100000139399_100015361967 [2,0,0,0,0,0|2,0,0]=4 2865 B9R0.50 COC(CCSCF)OC 62a_100015361967_100000139399 [2,0,0,0,0,0|2,0,0]=4 2866 B9R0.50 COC(CNCCF)OC 34a_100000724931_100000211822 [2,0,0,0,0,0|2,0,0]=4 2867 B9R0.50 COC(CNCCO)OC 2230a_100016997473_100000751394 [2,0,0,0,0,0|2,0,0]=4 2868 B9R0.50 COC(CNCCO)OC 270004a_100000210304_100000752162 [2,0,0,0,0,0|2,0,0]=4 2869 B9R0.50 COC(CNCCO)OC 34a_100016990907_100000211822 [2,0,0,0,0,0|2,0,0]=4 2870 B9R0.50 COC(COCCBr)OC 34a_100000211926_100000211822 [2,0,0,0,0,0|2,0,0]=4 2871 B9R0.50 COC(COCCF)OC 34a_100011216393_100011217306 [2,0,0,0,0,0|2,0,0]=4 2872 B9R0.50 COC(COCCN)OC 34a_100000210304_100000211822 [2,0,0,0,0,0|2,0,0]=4 2873 B9R0.50 COC(COCCO)OC 34a_100011216393_100000211926 [2,0,0,0,0,0|2,0,0]=4 2874 B9R0.50 COC(COCSC)OC 34a_100011216393_100011218213 [2,0,0,0,0,0|2,0,0]=4 2875 B9R0.50 COC(CSCCF)OC 62a_100000751394_100011217306 [2,0,0,0,0,0|2,0,0]=4 2876 B9R0.50 COC(CSCCF)OC 62a_100011217306_100000751394 [2,0,0,0,0,0|2,0,0]=4 2877 B9R0.50 COC(CSCCO)OC 62a_100000211926_100000751394 [2,0,0,0,0,0|2,0,0]=4 2878 B9R0.50 COC(CSCCO)OC 62a_100000751394_100000211926 [2,0,0,0,0,0|2,0,0]=4 2879 B9R0.50 COC(CSCSC)OC 62a_100000751394_100011218213 [2,0,0,0,0,0|2,0,0]=4 2880 B9R0.50 COC(CSCSC)OC 62a_100011218213_100000751394 [2,0,0,0,0,0|2,0,0]=4 2881 B9R0.50 COCCCC(OC)OC 34a_100138415774_100000069011 [2,0,0,0,0,0|1,0,0]=3 2882 B9R0.50 COCSCC(OC)OC 62a_100000751394_100000766300 [2,0,0,0,0,0|2,0,0]=4 2883 B9R0.50 COCSCC(OC)OC 62a_100000766300_100000751394 [2,0,0,0,0,0|2,0,0]=4 2884 B9R0.2 CC(C)CCCCCN[13CH3] 2230a_100011290863_200025704644 [2,0,0,0,0,0|1,0,0]=3 2885 B9R0.2 CC(C)CCCCCN[13CH3] 34a_100011290863_200025704644 [2,0,0,0,0,0|1,0,0]=3 2886 B9R0.2 CC(C)CCCCCO[13CH3] 34a_100011995859_200025704644 [2,0,0,0,0,0|1,0,0]=3 2887 B9R0.2 CC(C)CCCCCO[13CH3] 7a_100011995859_200025704644 [2,0,0,0,0,0|1,0,0]=3 2888 B9R0.2 CC(C)CCCCCS[13CH3] 62a_100000210682_200025704644 [2,0,0,0,0,0|1,0,0]=3 2889 B9R0.2 CC(C)CCCCCS[13CH3] 62a_200025704644_100000210682 [2,0,0,0,0,0|1,0,0]=3 2890 B9R0.2 CC(C)CCCCOCF 34a_100011214890_100015361967 [2,0,0,0,0,0|2,0,0]=4 2891 B9R0.2 CC(C)CCCCOCF 7a_100011214890_100015361967 [2,0,0,0,0,0|2,0,0]=4 2892 B9R0.2 CC(C)CCCCSCF 62a_100011216152_100015361967 [2,0,0,0,0,0|2,0,0]=4 2893 B9R0.2 CC(C)CCCCSCF 62a_100015361967_100011216152 [2,0,0,0,0,0|2,0,0]=4 2894 B9R0.2 CC(C)CCCNCCF 2230a_200000737386_100011217306 [2,0,0,0,0,0|2,0,0]=4 2895 B9R0.2 CC(C)CCCNCCF 34a_100000724931_100011214892 [2,0,0,0,0,0|2,0,0]=4 2896 B9R0.2 CC(C)CCCNCCF 34a_200000737386_100011217306 [2,0,0,0,0,0|2,0,0]=4 2897 B9R0.2 CC(C)CCCNCCO 2230a_100016997473_100011214892 [2,0,0,0,0,0|2,0,0]=4 2898 B9R0.2 CC(C)CCCNCCO 2230a_200000737386_100000211926 [2,0,0,0,0,0|2,0,0]=4 2899 B9R0.2 CC(C)CCCNCCO 34a_100016990907_100011214892 [2,0,0,0,0,0|2,0,0]=4 2900 B9R0.2 CC(C)CCCNCCO 34a_200000737386_100000211926 [2,0,0,0,0,0|2,0,0]=4 2901 B9R0.2 CC(C)CCCOCCBr 34a_100000211926_100011214892 [2,0,0,0,0,0|2,0,0]=4 2902 B9R0.2 CC(C)CCCOCCF 34a_100000210774_100011217306 [2,0,0,0,0,0|2,0,0]=4 2903 B9R0.2 CC(C)CCCOCCF 7a_100000210774_100011217306 [2,0,0,0,0,0|2,0,0]=4 2904 B9R0.2 CC(C)CCCOCCN 34a_100000210304_100011214892 [2,0,0,0,0,0|2,0,0]=4 2905 B9R0.2 CC(C)CCCOCCO 34a_100000210774_100000211926 [2,0,0,0,0,0|2,0,0]=4 2906 B9R0.2 CC(C)CCCOCCO 7a_100000210774_100000211926 [2,0,0,0,0,0|2,0,0]=4 2907 B9R0.2 CC(C)CCCSCCF 62a_100011214892_100011217306 [2,0,0,0,0,0|2,0,0]=4 2908 B9R0.2 CC(C)CCCSCCF 62a_100011217306_100011214892 [2,0,0,0,0,0|2,0,0]=4 2909 B9R0.2 CC(C)CCCSCCO 62a_100000211926_100011214892 [2,0,0,0,0,0|2,0,0]=4 2910 B9R0.2 CC(C)CCCSCCO 62a_100011214892_100000211926 [2,0,0,0,0,0|2,0,0]=4 2911 B9R0.2 CC(C)CCNCCCF 2230a_100015189416_100000210312 [2,0,0,0,0,0|2,0,0]=4 2912 B9R0.2 CC(C)CCNCCCF 269862a_100015189416_100000185833 [2,0,0,0,0,0|2,0,0]=4 2913 B9R0.2 CC(C)CCNCCCF 34a_100015189416_100000210312 [2,0,0,0,0,0|2,0,0]=4 2914 B9R0.2 CC(C)CCNCCCO 269862a_100000182051_100000185833 [2,0,0,0,0,0|2,0,0]=4 2915 B9R0.2 CC(C)CCOCCCBr 34a_100011217188_100000210312 [2,0,0,0,0,0|2,0,0]=4 2916 B9R0.2 CC(C)CCOCCCCl 34a_100000230001_100000210312 [2,0,0,0,0,0|2,0,0]=4 2917 B9R0.2 CC(C)CCOCCCF 34a_100000210254_100011934791 [2,0,0,0,0,0|2,0,0]=4 2918 B9R0.2 CC(C)CCOCCCF 34a_100000759539_100000210312 [2,0,0,0,0,0|2,0,0]=4 2919 B9R0.2 CC(C)CCOCCCF 7a_100000210254_100011934791 [2,0,0,0,0,0|2,0,0]=4 2920 B9R0.2 CC(C)CCOCCCN 34a_100000182051_100000210312 [2,0,0,0,0,0|2,0,0]=4 2921 B9R0.2 CC(C)CCOCCCO 34a_100000210254_100000230001 [2,0,0,0,0,0|2,0,0]=4 2922 B9R0.2 CC(C)CCOCCCO 7a_100000210254_100011215043 [2,0,0,0,0,0|2,0,0]=4 2923 B9R0.2 CC(C)CCSCCCF 62a_100000210312_100011934791 [2,0,0,0,0,0|2,0,0]=4 2924 B9R0.2 CC(C)CCSCCCF 62a_100011934791_100000210312 [2,0,0,0,0,0|2,0,0]=4 2925 B9R0.2 CC(C)CCSCCCO 62a_100000210312_100011215043 [2,0,0,0,0,0|2,0,0]=4 2926 B9R0.2 CC(C)CCSCCCO 62a_100011215043_100000210312 [2,0,0,0,0,0|2,0,0]=4 2927 B9R0.2 CC(C)CNCCCCF 2230a_100000210953_100000729493 [2,0,0,0,0,0|2,0,0]=4 2928 B9R0.2 CC(C)CNCCCCF 34a_100000210953_100000729493 [2,0,0,0,0,0|2,0,0]=4 2929 B9R0.2 CC(C)CNCCCCO 2230a_100000210953_100000210776 [2,0,0,0,0,0|2,0,0]=4 2930 B9R0.2 CC(C)CNCCCCO 2230a_100000750430_100000210760 [2,0,0,0,0,0|2,0,0]=4 2931 B9R0.2 CC(C)CNCCCCO 270004a_100000750430_100000210432 [2,0,0,0,0,0|2,0,0]=4 2932 B9R0.2 CC(C)CNCCCCO 34a_100000210953_100011216708 [2,0,0,0,0,0|2,0,0]=4 2933 B9R0.2 CC(C)CNCCCCO 34a_100000750430_100000210624 [2,0,0,0,0,0|2,0,0]=4 2934 B9R0.2 CC(C)COCCCCBr 34a_100011216708_100000210624 [2,0,0,0,0,0|2,0,0]=4 2935 B9R0.2 CC(C)COCCCCCl 34a_100000210776_100000210624 [2,0,0,0,0,0|2,0,0]=4 2936 B9R0.2 CC(C)COCCCCCl 7a_100000210776_100000210760 [2,0,0,0,0,0|2,0,0]=4 2937 B9R0.2 CC(C)COCCCCF 34a_100000210257_100000729493 [2,0,0,0,0,0|2,0,0]=4 2938 B9R0.2 CC(C)COCCCCF 34a_100011995726_100000210624 [2,0,0,0,0,0|2,0,0]=4 2939 B9R0.2 CC(C)COCCCCF 7a_100011995726_100000210760 [2,0,0,0,0,0|2,0,0]=4 2940 B9R0.2 CC(C)COCCCCI 34a_200012148704_100000210624 [2,0,0,0,0,0|2,0,0]=4 2941 B9R0.2 CC(C)COCCCCN 34a_100000750430_100000210624 [2,0,0,0,0,0|2,0,0]=4 2942 B9R0.2 CC(C)COCCCCO 34a_100000210257_100011216708 [2,0,0,0,0,0|2,0,0]=4 2943 B9R0.2 CC(C)COCCCN[13CH3] 2230a_100000205972_200025704644 [2,0,0,0,0,0|2,0,0]=4 2944 B9R0.2 CC(C)COCCCN[13CH3] 34a_100000205972_200025704644 [2,0,0,0,0,0|2,0,0]=4 2945 B9R0.2 CC(C)CSCCCCF 62a_100000210624_100000729493 [2,0,0,0,0,0|2,0,0]=4 2946 B9R0.2 CC(C)CSCCCCF 62a_100000729493_100000210760 [2,0,0,0,0,0|2,0,0]=4 2947 B9R0.2 CC(C)CSCCCCO 62a_100000210624_100000210776 [2,0,0,0,0,0|2,0,0]=4 2948 B9R0.2 CC(C)CSCCCCO 62a_100000210776_100000210760 [2,0,0,0,0,0|2,0,0]=4 2949 B9R0.2 CC(C)NCCCCCF 2230a_100138425928_100000729378 [2,0,0,0,0,0|2,0,0]=4 2950 B9R0.2 CC(C)NCCCCCF 34a_100138425928_100000729378 [2,0,0,0,0,0|2,0,0]=4 2951 B9R0.2 CC(C)NCCCCCO 2230a_100000762737_100000210206 [2,0,0,0,0,0|2,0,0]=4 2952 B9R0.2 CC(C)NCCCCCO 2230a_100138425928_100000746330 [2,0,0,0,0,0|2,0,0]=4 2953 B9R0.2 CC(C)NCCCCCO 34a_100000762737_100000210206 [2,0,0,0,0,0|2,0,0]=4 2954 B9R0.2 CC(C)NCCCCCO 34a_100138425928_100000746330 [2,0,0,0,0,0|2,0,0]=4 2955 B9R0.2 CC(C)NCCCCO[13CH3] 34a_100011521146_200025704644 [2,0,0,0,0,0|2,0,0]=4 2956 B9R0.2 CC(C)OCCCCCBr 34a_100000746331_100000210206 [2,0,0,0,0,0|2,0,0]=4 2957 B9R0.2 CC(C)OCCCCCBr 7a_100000746331_100000210206 [2,0,0,0,0,0|2,0,0]=4 2958 B9R0.2 CC(C)OCCCCCCl 34a_100000746330_100000210206 [2,0,0,0,0,0|2,0,0]=4 2959 B9R0.2 CC(C)OCCCCCCl 7a_100000746330_100000210206 [2,0,0,0,0,0|2,0,0]=4 2960 B9R0.2 CC(C)OCCCCCF 34a_100000212225_100000729378 [2,0,0,0,0,0|2,0,0]=4 2961 B9R0.2 CC(C)OCCCCCI 34a_200012148887_100000210206 [2,0,0,0,0,0|2,0,0]=4 2962 B9R0.2 CC(C)OCCCCCI 7a_200012148887_100000210206 [2,0,0,0,0,0|2,0,0]=4 2963 B9R0.2 CC(C)OCCCCCN 34a_100000762737_100000210206 [2,0,0,0,0,0|2,0,0]=4 2964 B9R0.2 CC(C)OCCCCCO 34a_100000212225_100000746330 [2,0,0,0,0,0|2,0,0]=4 2965 B9R0.2 CC(C)SCCCCCF 62a_100000210206_100000729378 [2,0,0,0,0,0|2,0,0]=4 2966 B9R0.2 CC(C)SCCCCCF 62a_100000729378_100000210206 [2,0,0,0,0,0|2,0,0]=4 2967 B9R0.2 CC(C)SCCCCCO 62a_100000210206_100000746330 [2,0,0,0,0,0|2,0,0]=4 2968 B9R0.2 CC(C)SCCCCCO 62a_100000746330_100000210206 [2,0,0,0,0,0|2,0,0]=4 2969 B9R0.2 CC(O)CCCNCCF 34a_100000724931_200000718107 [2,0,0,0,0,0|2,0,0]=4 2970 B9R0.2 CC(O)CCCNCCO 2230a_100016997473_200000718107 [2,0,0,0,0,0|2,0,0]=4 2971 B9R0.2 CC(O)CCCNCCO 34a_100016990907_200000718107 [2,0,0,0,0,0|2,0,0]=4 2972 B9R0.2 CC(O)CCCOCCBr 34a_100000211926_200000718107 [2,0,0,0,0,0|2,0,0]=4 2973 B9R0.2 CC(O)CCCOCCN 34a_100000210304_200000718107 [2,0,0,0,0,0|2,0,0]=4 2974 B9R0.2 CC(O)CCCSCCF 62a_100011217306_200000718107 [2,0,0,0,0,0|2,0,0]=4 2975 B9R0.2 CC(O)CCCSCCF 62a_200000718107_100011217306 [2,0,0,0,0,0|2,0,0]=4 2976 B9R0.2 CC(O)CCCSCCO 62a_100000211926_200000718107 [2,0,0,0,0,0|2,0,0]=4 2977 B9R0.2 CC(O)CCCSCCO 62a_200000718107_100000211926 [2,0,0,0,0,0|2,0,0]=4 2978 B9R0.2 CC(O)CCNCCCF 2230a_100015189416_100012276601 [2,0,0,0,0,0|2,0,0]=4 2979 B9R0.2 CC(O)CCNCCCF 2230a_200000755665_100011934791 [2,0,0,0,0,0|2,0,0]=4 2980 B9R0.2 CC(O)CCNCCCF 34a_100015189416_100012276601 [2,0,0,0,0,0|2,0,0]=4 2981 B9R0.2 CC(O)CCNCCCO 2230a_200000755665_100000230001 [2,0,0,0,0,0|2,0,0]=4 2982 B9R0.2 CC(O)CCOCCCBr 34a_100011217188_100012276601 [2,0,0,0,0,0|2,0,0]=4 2983 B9R0.2 CC(O)CCOCCCCl 34a_100000230001_100012276601 [2,0,0,0,0,0|2,0,0]=4 2984 B9R0.2 CC(O)CCOCCCF 34a_100000759539_100012276601 [2,0,0,0,0,0|2,0,0]=4 2985 B9R0.2 CC(O)CCOCCCN 34a_100000182051_100012276601 [2,0,0,0,0,0|2,0,0]=4 2986 B9R0.2 CC(O)CCSCCCF 62a_100011934791_100012276601 [2,0,0,0,0,0|2,0,0]=4 2987 B9R0.2 CC(O)CCSCCCF 62a_100012276601_100011934791 [2,0,0,0,0,0|2,0,0]=4 2988 B9R0.2 CC(O)CCSCCCO 62a_100011215043_100012276601 [2,0,0,0,0,0|2,0,0]=4 2989 B9R0.2 CC(O)CCSCCCO 62a_100012276601_100011215043 [2,0,0,0,0,0|2,0,0]=4 2990 B9R0.2 CC(O)CNCCCCF 2230a_100000210904_100000729493 [2,0,0,0,0,0|2,0,0]=4 2991 B9R0.2 CC(O)CNCCCCF 34a_100000210904_100000729493 [2,0,0,0,0,0|2,0,0]=4 2992 B9R0.2 CC(O)CNCCCCO 2230a_100000210904_100000210776 [2,0,0,0,0,0|2,0,0]=4 2993 B9R0.2 CC(O)CNCCCCO 2230a_100000750430_100011218427 [2,0,0,0,0,0|2,0,0]=4 2994 B9R0.2 CC(O)CNCCCCO 34a_100000210904_100011216708 [2,0,0,0,0,0|2,0,0]=4 2995 B9R0.2 CC(O)CNCCCCO 34a_100000750430_100011218427 [2,0,0,0,0,0|2,0,0]=4 2996 B9R0.2 CC(O)COCCCCBr 34a_100011216708_100011218427 [2,0,0,0,0,0|2,0,0]=4 2997 B9R0.2 CC(O)COCCCCCl 34a_100000210776_100011218427 [2,0,0,0,0,0|2,0,0]=4 2998 B9R0.2 CC(O)COCCCCCl 7a_100000210776_100011218427 [2,0,0,0,0,0|2,0,0]=4 2999 B9R0.2 CC(O)COCCCCF 34a_100011995726_100011218427 [2,0,0,0,0,0|2,0,0]=4 3000 B9R0.2 CC(O)COCCCCF 7a_100011995726_100011218427 [2,0,0,0,0,0|2,0,0]=4 3001 B9R0.2 CC(O)COCCCCI 34a_200012148704_100011218427 [2,0,0,0,0,0|2,0,0]=4 3002 B9R0.2 CC(O)COCCCCN 34a_100000750430_100011218427 [2,0,0,0,0,0|2,0,0]=4 3003 B9R0.2 CC(O)CSCCCCF 62a_100000729493_100011218427 [2,0,0,0,0,0|2,0,0]=4 3004 B9R0.2 CC(O)CSCCCCF 62a_100011218427_100000729493 [2,0,0,0,0,0|2,0,0]=4 3005 B9R0.2 CC(O)CSCCCCO 62a_100000210776_100011218427 [2,0,0,0,0,0|2,0,0]=4 3006 B9R0.2 CC(O)CSCCCCO 62a_100011218427_100000210776 [2,0,0,0,0,0|2,0,0]=4 3007 B9R0.2 CCCCCCCC(=O)C 1458a_100000070787_100000210614 [2,0,0,0,0,0|0,0,2]=4 3008 B9R0.2 CCCCCCCC(=O)C 1458a_100000211969_200000210301 [2,0,0,0,0,0|0,0,2]=4 3009 B9R0.2 CCCCCCCC(=O)[13CH3] 1458a_100000211969_200025704644 [2,0,0,0,0,0|0,0,2]=4 3010 B9R0.2 CCCCCCCN(C)C 2230a_100000228206_200000210301 [2,0,0,0,0,0|1,0,0]=3 3011 B9R0.2 CCCCCCCN(C)C 2230a_100102631434_100000210681 [2,0,0,0,0,0|1,0,0]=3 3012 B9R0.2 CCCCCCCN(C)C 269982a_100000228206_200000210301 [2,0,0,0,0,0|1,0,0]=3 3013 B9R0.2 CCCCCCCN(C)C 269982a_100102631434_100000210681 [2,0,0,0,0,0|1,0,0]=3 3014 B9R0.2 CCCCCCCN(C)[13CH3] 2230a_100000228206_200025704644 [2,0,0,0,0,0|1,0,0]=3 3015 B9R0.2 CCCCCCCN(C)[13CH3] 269982a_100000228206_200025704644 [2,0,0,0,0,0|1,0,0]=3 3016 B9R0.2 CCCCCCNC(C)C 2230a_100000210581_100000210206 [2,0,0,0,0,0|1,0,0]=3 3017 B9R0.2 CCCCCCNC(C)C 2230a_100138425928_100000210314 [2,0,0,0,0,0|1,0,0]=3 3018 B9R0.2 CCCCCCNC(C)C 34a_100138425928_100000210314 [2,0,0,0,0,0|1,0,0]=3 3019 B9R0.2 CCCCCCOC(C)C 34a_100000210259_100000210206 [2,0,0,0,0,0|1,0,0]=3 3020 B9R0.2 CCCCCCOC(C)C 34a_100000212225_100000210314 [2,0,0,0,0,0|1,0,0]=3 3021 B9R0.2 CCCCCCOC(C)C 7a_100000210259_100000210206 [2,0,0,0,0,0|1,0,0]=3 3022 B9R0.2 CCCCCCSC(C)C 62a_100000210206_100000210757 [2,0,0,0,0,0|1,0,0]=3 3023 B9R0.2 CCCCCCSC(C)C 62a_100000210314_100000210206 [2,0,0,0,0,0|1,0,0]=3 3024 B9R0.2 CCCCCNCC(C)C 2230a_100000209983_100000210760 [2,0,0,0,0,0|1,0,0]=3 3025 B9R0.2 CCCCCNCC(C)C 2230a_100000210953_100000210326 [2,0,0,0,0,0|1,0,0]=3 3026 B9R0.2 CCCCCNCC(C)C 270004a_100000209983_100000210432 [2,0,0,0,0,0|1,0,0]=3 3027 B9R0.2 CCCCCNCC(C)C 34a_100000210953_100000718602 [2,0,0,0,0,0|1,0,0]=3 3028 B9R0.2 CCCCCNCC(C)O 2230a_100000209983_100011218427 [2,0,0,0,0,0|1,0,0]=3 3029 B9R0.2 CCCCCNCC(C)O 2230a_100000210904_100000210326 [2,0,0,0,0,0|1,0,0]=3 3030 B9R0.2 CCCCCNCC(C)O 34a_100000210904_100000718602 [2,0,0,0,0,0|1,0,0]=3 3031 B9R0.2 CCCCCNC[C@@H](C)O 2230a_100000209983_100009817552 [2,0,0,0,0,0|1,0,0]=3 3032 B9R0.2 CCCCCOCC(C)Br 34a_100012180447_100000718602 [2,0,0,0,0,0|2,0,0]=4 3033 B9R0.2 CCCCCOCC(C)C 34a_100000210253_100000210624 [2,0,0,0,0,0|1,0,0]=3 3034 B9R0.2 CCCCCOCC(C)C 34a_100000210257_100000718602 [2,0,0,0,0,0|1,0,0]=3 3035 B9R0.2 CCCCCOCC(C)C 7a_100000210253_100000210760 [2,0,0,0,0,0|1,0,0]=3 3036 B9R0.2 CCCCCOCC(C)F 34a_100015925927_100000718602 [2,0,0,0,0,0|2,0,0]=4 3037 B9R0.2 CCCCCOCC(C)O 34a_100000210253_100011218427 [2,0,0,0,0,0|1,0,0]=3 3038 B9R0.2 CCCCCOCC(C)O 7a_100000210253_100011218427 [2,0,0,0,0,0|1,0,0]=3 3039 B9R0.2 CCCCCOC[C@@H](C)Cl 34a_100016084084_100000718602 [2,0,0,0,0,0|2,0,0]=4 3040 B9R0.2 CCCCCOC[C@@H](C)N 34a_100000737577_100000718602 [2,0,0,0,0,0|2,0,0]=4 3041 B9R0.2 CCCCCOC[C@@H](C)O 34a_100000210253_100009817552 [2,0,0,0,0,0|1,0,0]=3 3042 B9R0.2 CCCCCOC[C@@H](C)O 7a_100000210253_100009817552 [2,0,0,0,0,0|1,0,0]=3 3043 B9R0.2 CCCCCSCC(C)C 62a_100000210326_100000210760 [2,0,0,0,0,0|1,0,0]=3 3044 B9R0.2 CCCCCSCC(C)C 62a_100000210624_100000210326 [2,0,0,0,0,0|1,0,0]=3 3045 B9R0.2 CCCCCSCC(C)O 62a_100000210326_100011218427 [2,0,0,0,0,0|1,0,0]=3 3046 B9R0.2 CCCCCSCC(C)O 62a_100011218427_100000210326 [2,0,0,0,0,0|1,0,0]=3 3047 B9R0.2 CCCCCSC[C@@H](C)O 62a_100000210326_100009817552 [2,0,0,0,0,0|1,0,0]=3 3048 B9R0.2 CCCCCSC[C@@H](C)O 62a_100009817552_100000210326 [2,0,0,0,0,0|1,0,0]=3 3049 B9R0.2 CCCCNCCC(C)C 2230a_100000102301_100000210312 [2,0,0,0,0,0|1,0,0]=3 3050 B9R0.2 CCCCNCCC(C)C 269862a_100000102301_100000185833 [2,0,0,0,0,0|1,0,0]=3 3051 B9R0.2 CCCCNCCC(C)C 7a_106832991798_100000210626 [2,0,0,0,0,0|1,0,0]=3 3052 B9R0.2 CCCCNCCC(C)O 2230a_100000102301_100012276601 [2,0,0,0,0,0|1,0,0]=3 3053 B9R0.2 CCCCNCCC(C)O 2230a_200000755665_100000210211 [2,0,0,0,0,0|1,0,0]=3 3054 B9R0.2 CCCCNCCC(C)O 7a_106832991798_100012276601 [2,0,0,0,0,0|1,0,0]=3 3055 B9R0.2 CCCCNCCN(C)C 7a_106832991798_100000755713 [2,0,0,0,0,0|2,0,0]=4 3056 B9R0.2 CCCCNCOC(C)C 2230a_100000102301_100000709892 [2,0,0,0,0,0|2,0,0]=4 3057 B9R0.2 CCCCOCCC(C)Br 34a_100009893172_100000210210 [2,0,0,0,0,0|2,0,0]=4 3058 B9R0.2 CCCCOCCC(C)C 34a_100000210227_100000210312 [2,0,0,0,0,0|1,0,0]=3 3059 B9R0.2 CCCCOCCC(C)C 34a_100000210254_100000210210 [2,0,0,0,0,0|1,0,0]=3 3060 B9R0.2 CCCCOCCC(C)C 7a_100000210227_100000210626 [2,0,0,0,0,0|1,0,0]=3 3061 B9R0.2 CCCCOCCC(C)C 7a_100000210254_100000210211 [2,0,0,0,0,0|1,0,0]=3 3062 B9R0.2 CCCCOCCC(C)O 34a_100000210227_100012276601 [2,0,0,0,0,0|1,0,0]=3 3063 B9R0.2 CCCCOCCC(C)O 7a_100000210227_100012276601 [2,0,0,0,0,0|1,0,0]=3 3064 B9R0.2 CCCCOCCN(C)C 2230a_100102631434_100000743108 [2,0,0,0,0,0|2,0,0]=4 3065 B9R0.2 CCCCOCCN(C)C 269982a_100102631434_100000743108 [2,0,0,0,0,0|2,0,0]=4 3066 B9R0.2 CCCCOCCN(C)C 7a_100000210227_100000755713 [2,0,0,0,0,0|2,0,0]=4 3067 B9R0.2 CCCCOCC[C@@H](C)N 34a_100000706166_100000210210 [2,0,0,0,0,0|2,0,0]=4 3068 B9R0.2 CCCCOCNC(C)C 2230a_100138425928_100011995733 [2,0,0,0,0,0|2,0,0]=4 3069 B9R0.2 CCCCOCNC(C)C 34a_100138425928_100011995733 [2,0,0,0,0,0|2,0,0]=4 3070 B9R0.2 CCCCOCOC(C)C 34a_100000210227_100000709892 [2,0,0,0,0,0|2,0,0]=4 3071 B9R0.2 CCCCOCOC(C)C 34a_100000212225_100011995733 [2,0,0,0,0,0|2,0,0]=4 3072 B9R0.2 CCCCOCSC(C)C 62a_100000210206_100011995733 [2,0,0,0,0,0|2,0,0]=4 3073 B9R0.2 CCCCOCSC(C)C 62a_100011995733_100000210206 [2,0,0,0,0,0|2,0,0]=4 3074 B9R0.2 CCCCSCCC(C)C 62a_100000210211_100000210312 [2,0,0,0,0,0|1,0,0]=3 3075 B9R0.2 CCCCSCCC(C)C 62a_100000210312_100000210210 [2,0,0,0,0,0|1,0,0]=3 3076 B9R0.2 CCCCSCCC(C)O 62a_100000210211_100012276601 [2,0,0,0,0,0|1,0,0]=3 3077 B9R0.2 CCCCSCCC(C)O 62a_100012276601_100000210210 [2,0,0,0,0,0|1,0,0]=3 3078 B9R0.2 CCCCSCCN(C)C 62a_100000210211_100000755713 [2,0,0,0,0,0|2,0,0]=4 3079 B9R0.2 CCCCSCOC(C)C 62a_100000210211_100000709892 [2,0,0,0,0,0|2,0,0]=4 3080 B9R0.2 CCCCSCOC(C)C 62a_100000709892_100000210210 [2,0,0,0,0,0|2,0,0]=4 3081 B9R0.2 CCCNCCCC(C)C 2230a_200000737386_100000210303 [2,0,0,0,0,0|1,0,0]=3 3082 B9R0.2 CCCNCCCC(C)C 34a_200000737386_100000210303 [2,0,0,0,0,0|1,0,0]=3 3083 B9R0.2 CCCNCCOC(C)C 2230a_100000701111_100000210303 [2,0,0,0,0,0|2,0,0]=4 3084 B9R0.2 CCCNCCOC(C)C 34a_100000701111_100000210303 [2,0,0,0,0,0|2,0,0]=4 3085 B9R0.2 CCCNCCSC(C)C 2230a_100000731138_100000210303 [2,0,0,0,0,0|2,0,0]=4 3086 B9R0.2 CCCNCCSC(C)C 34a_100000731138_100000210303 [2,0,0,0,0,0|2,0,0]=4 3087 B9R0.2 CCCOCCCC(C)C 34a_100000210258_100011214892 [2,0,0,0,0,0|1,0,0]=3 3088 B9R0.2 CCCOCCCC(C)C 34a_100000210774_100000210303 [2,0,0,0,0,0|1,0,0]=3 3089 B9R0.2 CCCOCCCC(C)C 7a_100000210774_100000210303 [2,0,0,0,0,0|1,0,0]=3 3090 B9R0.2 CCCOCCCC(C)O 34a_100000210258_200000718107 [2,0,0,0,0,0|1,0,0]=3 3091 B9R0.2 CCCOCCNC(C)C 2230a_100138425928_100011215938 [2,0,0,0,0,0|2,0,0]=4 3092 B9R0.2 CCCOCCNC(C)C 2230a_100161115042_100000210206 [2,0,0,0,0,0|2,0,0]=4 3093 B9R0.2 CCCOCCNC(C)C 34a_100000224655_100000210303 [2,0,0,0,0,0|2,0,0]=4 3094 B9R0.2 CCCOCCNC(C)C 34a_100138425928_100011215938 [2,0,0,0,0,0|2,0,0]=4 3095 B9R0.2 CCCOCCNC(C)C 34a_100161115042_100000210206 [2,0,0,0,0,0|2,0,0]=4 3096 B9R0.2 CCCOCCOC(C)C 34a_100000210258_100000211751 [2,0,0,0,0,0|2,0,0]=4 3097 B9R0.2 CCCOCCOC(C)C 34a_100000211219_100000210303 [2,0,0,0,0,0|2,0,0]=4 3098 B9R0.2 CCCOCCOC(C)C 34a_100000212225_100011215938 [2,0,0,0,0,0|2,0,0]=4 3099 B9R0.2 CCCOCCOC(C)C 34a_100000752267_100000210206 [2,0,0,0,0,0|2,0,0]=4 3100 B9R0.2 CCCOCCOC(C)C 7a_100000211219_100000210303 [2,0,0,0,0,0|2,0,0]=4 3101 B9R0.2 CCCOCCOC(C)C 7a_100000752267_100000210206 [2,0,0,0,0,0|2,0,0]=4 3102 B9R0.2 CCCOCCSC(C)C 34a_100000210258_100000730970 [2,0,0,0,0,0|2,0,0]=4 3103 B9R0.2 CCCOCCSC(C)C 34a_200011212901_100000210303 [2,0,0,0,0,0|2,0,0]=4 3104 B9R0.2 CCCOCCSC(C)C 62a_100000210206_100011215938 [2,0,0,0,0,0|2,0,0]=4 3105 B9R0.2 CCCOCCSC(C)C 62a_100011215938_100000210206 [2,0,0,0,0,0|2,0,0]=4 3106 B9R0.2 CCCOCCSC(C)C 7a_200011212901_100000210303 [2,0,0,0,0,0|2,0,0]=4 3107 B9R0.2 CCCSCCCC(C)C 62a_100000210303_100011214892 [2,0,0,0,0,0|1,0,0]=3 3108 B9R0.2 CCCSCCCC(C)C 62a_100011214892_100000210303 [2,0,0,0,0,0|1,0,0]=3 3109 B9R0.2 CCCSCCCC(C)O 62a_100000210303_200000718107 [2,0,0,0,0,0|1,0,0]=3 3110 B9R0.2 CCCSCCCC(C)O 62a_200000718107_100000210303 [2,0,0,0,0,0|1,0,0]=3 3111 B9R0.2 CCCSCCCN(C)C 62a_100000210303_100000757444 [2,0,0,0,0,0|2,0,0]=4 3112 B9R0.2 CCCSCCNC(C)C 2230a_100020603323_100000210206 [2,0,0,0,0,0|2,0,0]=4 3113 B9R0.2 CCCSCCOC(C)C 34a_200000230433_100000210206 [2,0,0,0,0,0|2,0,0]=4 3114 B9R0.2 CCCSCCOC(C)C 62a_100000210303_100000211751 [2,0,0,0,0,0|2,0,0]=4 3115 B9R0.2 CCCSCCOC(C)C 62a_100000211751_100000210303 [2,0,0,0,0,0|2,0,0]=4 3116 B9R0.2 CCCSCCOC(C)C 7a_200000230433_100000210206 [2,0,0,0,0,0|2,0,0]=4 3117 B9R0.2 CCCSCCSC(C)C 62a_100000210303_100000730970 [2,0,0,0,0,0|2,0,0]=4 3118 B9R0.2 CCCSCCSC(C)C 62a_100000730970_100000210303 [2,0,0,0,0,0|2,0,0]=4 3119 B9R0.2 CCNCCCCB(O)O 2230a_100015525214_200009817182 [2,0,0,0,0,0|2,0,0]=4 3120 B9R0.2 CCNCCCCC(C)C 2230a_100015525214_100011216152 [2,0,0,0,0,0|1,0,0]=3 3121 B9R0.2 CCNCCCOC(C)C 2230a_100000737246_100000210202 [2,0,0,0,0,0|2,0,0]=4 3122 B9R0.2 CCNCCCOC(C)C 34a_100000737246_100000210202 [2,0,0,0,0,0|2,0,0]=4 3123 B9R0.2 CCOCCCCB(O)O 34a_100121572206_200009817182 [2,0,0,0,0,0|2,0,0]=4 3124 B9R0.2 CCOCCCCC(C)C 34a_100011214890_100000210202 [2,0,0,0,0,0|1,0,0]=3 3125 B9R0.2 CCOCCCCC(C)C 34a_100121572206_100011216152 [2,0,0,0,0,0|1,0,0]=3 3126 B9R0.2 CCOCCCCC(C)C 7a_100011214890_100000210202 [2,0,0,0,0,0|1,0,0]=3 3127 B9R0.2 CCOCCCNC(C)C 2230a_100000210961_100000210206 [2,0,0,0,0,0|2,0,0]=4 3128 B9R0.2 CCOCCCNC(C)C 2230a_100138425928_100012232248 [2,0,0,0,0,0|2,0,0]=4 3129 B9R0.2 CCOCCCNC(C)C 34a_100000182298_100000210202 [2,0,0,0,0,0|2,0,0]=4 3130 B9R0.2 CCOCCCNC(C)C 34a_100000210961_100000210206 [2,0,0,0,0,0|2,0,0]=4 3131 B9R0.2 CCOCCCNC(C)C 34a_100138425928_100012232248 [2,0,0,0,0,0|2,0,0]=4 3132 B9R0.2 CCOCCCOC(C)C 34a_100000212225_100012232248 [2,0,0,0,0,0|2,0,0]=4 3133 B9R0.2 CCOCCCOC(C)C 34a_100000757476_100000210206 [2,0,0,0,0,0|2,0,0]=4 3134 B9R0.2 CCOCCCOC(C)C 7a_100000757476_100000210206 [2,0,0,0,0,0|2,0,0]=4 3135 B9R0.2 CCOCCCSC(C)C 62a_100000210206_100012232248 [2,0,0,0,0,0|2,0,0]=4 3136 B9R0.2 CCOCCCSC(C)C 62a_100012232248_100000210206 [2,0,0,0,0,0|2,0,0]=4 3137 B9R0.2 CCOCCNCC(C)C 2230a_100000210953_100011215890 [2,0,0,0,0,0|2,0,0]=4 3138 B9R0.2 CCOCCNCC(C)C 2230a_102516460346_100000210760 [2,0,0,0,0,0|2,0,0]=4 3139 B9R0.2 CCOCCNCC(C)C 270004a_102516460346_100000210432 [2,0,0,0,0,0|2,0,0]=4 3140 B9R0.2 CCOCCNCC(C)C 34a_100000210953_100000210147 [2,0,0,0,0,0|2,0,0]=4 3141 B9R0.2 CCOCCNCC(C)C 34a_100015185251_100000210202 [2,0,0,0,0,0|2,0,0]=4 3142 B9R0.2 CCOCCNCC(C)C 34a_102516460346_100000210624 [2,0,0,0,0,0|2,0,0]=4 3143 B9R0.2 CCOCCNCC(C)O 2230a_100000210904_100011215890 [2,0,0,0,0,0|2,0,0]=4 3144 B9R0.2 CCOCCNCC(C)O 2230a_102516460346_100011218427 [2,0,0,0,0,0|2,0,0]=4 3145 B9R0.2 CCOCCNCC(C)O 34a_100000210904_100000210147 [2,0,0,0,0,0|2,0,0]=4 3146 B9R0.2 CCOCCNCC(C)O 34a_102516460346_100011218427 [2,0,0,0,0,0|2,0,0]=4 3147 B9R0.2 CCOCCNC[C@@H](C)O 2230a_102516460346_100009817552 [2,0,0,0,0,0|2,0,0]=4 3148 B9R0.2 CCOCCNC[C@@H](C)O 34a_102516460346_100009817552 [2,0,0,0,0,0|2,0,0]=4 3149 B9R0.2 CCOCCOCC(C)C 34a_100000210136_100000210624 [2,0,0,0,0,0|2,0,0]=4 3150 B9R0.2 CCOCCOCC(C)C 34a_100000210257_100000210147 [2,0,0,0,0,0|2,0,0]=4 3151 B9R0.2 CCOCCOCC(C)C 34a_100000703358_100000210202 [2,0,0,0,0,0|2,0,0]=4 3152 B9R0.2 CCOCCOCC(C)C 7a_100000210136_100000210760 [2,0,0,0,0,0|2,0,0]=4 3153 B9R0.2 CCOCCOCC(C)C 7a_100000703358_100000210202 [2,0,0,0,0,0|2,0,0]=4 3154 B9R0.2 CCOCCOCC(C)O 34a_100000210136_100011218427 [2,0,0,0,0,0|2,0,0]=4 3155 B9R0.2 CCOCCOCC(C)O 7a_100000210136_100011218427 [2,0,0,0,0,0|2,0,0]=4 3156 B9R0.2 CCOCCOC[C@@H](C)O 34a_100000210136_100009817552 [2,0,0,0,0,0|2,0,0]=4 3157 B9R0.2 CCOCCOC[C@@H](C)O 7a_100000210136_100009817552 [2,0,0,0,0,0|2,0,0]=4 3158 B9R0.2 CCOCCSCC(C)C 34a_200000230437_100000210202 [2,0,0,0,0,0|2,0,0]=4 3159 B9R0.2 CCOCCSCC(C)C 62a_100000210147_100000210760 [2,0,0,0,0,0|2,0,0]=4 3160 B9R0.2 CCOCCSCC(C)C 62a_100000210624_100011215890 [2,0,0,0,0,0|2,0,0]=4 3161 B9R0.2 CCOCCSCC(C)C 7a_200000230437_100000210202 [2,0,0,0,0,0|2,0,0]=4 3162 B9R0.2 CCOCCSCC(C)O 62a_100000210147_100011218427 [2,0,0,0,0,0|2,0,0]=4 3163 B9R0.2 CCOCCSCC(C)O 62a_100011218427_100011215890 [2,0,0,0,0,0|2,0,0]=4 3164 B9R0.2 CCOCCSC[C@@H](C)O 62a_100000210147_100009817552 [2,0,0,0,0,0|2,0,0]=4 3165 B9R0.2 CCOCCSC[C@@H](C)O 62a_100009817552_100011215890 [2,0,0,0,0,0|2,0,0]=4 3166 B9R0.2 CCOCSCCC(C)C 62a_100000210312_100000739092 [2,0,0,0,0,0|2,0,0]=4 3167 B9R0.2 CCOCSCCC(C)C 62a_100000739092_100000210312 [2,0,0,0,0,0|2,0,0]=4 3168 B9R0.2 CCOCSCCC(C)O 62a_100000739092_100012276601 [2,0,0,0,0,0|2,0,0]=4 3169 B9R0.2 CCOCSCCC(C)O 62a_100012276601_100000739092 [2,0,0,0,0,0|2,0,0]=4 3170 B9R0.2 CCSCCCCB(O)O 62a_100000210202_200009817182 [2,0,0,0,0,0|2,0,0]=4 3171 B9R0.2 CCSCCCCB(O)O 62a_200009817182_100000210202 [2,0,0,0,0,0|2,0,0]=4 3172 B9R0.2 CCSCCCCC(C)C 62a_100000210202_100011216152 [2,0,0,0,0,0|1,0,0]=3 3173 B9R0.2 CCSCCCCC(C)C 62a_100011216152_100000210202 [2,0,0,0,0,0|1,0,0]=3 3174 B9R0.2 CCSCCCCN(C)C 62a_100000210202_100000690147 [2,0,0,0,0,0|2,0,0]=4 3175 B9R0.2 CCSCCCOC(C)C 34a_100011216438_100000210206 [2,0,0,0,0,0|2,0,0]=4 3176 B9R0.2 CCSCCCOC(C)C 7a_100011216438_100000210206 [2,0,0,0,0,0|2,0,0]=4 3177 B9R0.2 CCSCCNCC(C)C 2230a_100000106463_100000210760 [2,0,0,0,0,0|2,0,0]=4 3178 B9R0.2 CCSCCNCC(C)C 2230a_100000210953_100000757381 [2,0,0,0,0,0|2,0,0]=4 3179 B9R0.2 CCSCCNCC(C)C 270004a_100000106463_100000210432 [2,0,0,0,0,0|2,0,0]=4 3180 B9R0.2 CCSCCNCC(C)C 34a_100000210953_100000757381 [2,0,0,0,0,0|2,0,0]=4 3181 B9R0.2 CCSCCNCC(C)O 2230a_100000106463_100011218427 [2,0,0,0,0,0|2,0,0]=4 3182 B9R0.2 CCSCCNCC(C)O 2230a_100000210904_100000757381 [2,0,0,0,0,0|2,0,0]=4 3183 B9R0.2 CCSCCNCC(C)O 34a_100000210904_100000757381 [2,0,0,0,0,0|2,0,0]=4 3184 B9R0.2 CCSCCNC[C@@H](C)O 2230a_100000106463_100009817552 [2,0,0,0,0,0|2,0,0]=4 3185 B9R0.2 CCSCCOCC(C)C 34a_100000210257_100000757381 [2,0,0,0,0,0|2,0,0]=4 3186 B9R0.2 CCSCCOCC(C)C 34a_100000212035_100000210624 [2,0,0,0,0,0|2,0,0]=4 3187 B9R0.2 CCSCCOCC(C)C 7a_100000212035_100000210760 [2,0,0,0,0,0|2,0,0]=4 3188 B9R0.2 CCSCCOCC(C)O 34a_100000212035_100011218427 [2,0,0,0,0,0|2,0,0]=4 3189 B9R0.2 CCSCCOCC(C)O 7a_100000212035_100011218427 [2,0,0,0,0,0|2,0,0]=4 3190 B9R0.2 CCSCCOC[C@@H](C)O 34a_100000212035_100009817552 [2,0,0,0,0,0|2,0,0]=4 3191 B9R0.2 CCSCCOC[C@@H](C)O 7a_100000212035_100009817552 [2,0,0,0,0,0|2,0,0]=4 3192 B9R0.2 CCSCCSCC(C)C 62a_100000210624_100000757381 [2,0,0,0,0,0|2,0,0]=4 3193 B9R0.2 CCSCCSCC(C)C 62a_100000757381_100000210760 [2,0,0,0,0,0|2,0,0]=4 3194 B9R0.2 CCSCCSCC(C)O 62a_100000757381_100011218427 [2,0,0,0,0,0|2,0,0]=4 3195 B9R0.2 CCSCCSCC(C)O 62a_100011218427_100000757381 [2,0,0,0,0,0|2,0,0]=4 3196 B9R0.2 CCSCCSC[C@@H](C)O 62a_100000757381_100009817552 [2,0,0,0,0,0|2,0,0]=4 3197 B9R0.2 CCSCCSC[C@@H](C)O 62a_100009817552_100000757381 [2,0,0,0,0,0|2,0,0]=4 3198 B9R0.2 CN(C)CCCCCCF 2230a_100102631434_100015922095 [2,0,0,0,0,0|2,0,0]=4 3199 B9R0.2 CN(C)CCCCCCF 269982a_100102631434_100015922095 [2,0,0,0,0,0|2,0,0]=4 3200 B9R0.2 CN(C)CCCCCCO 2230a_100102631434_100000766143 [2,0,0,0,0,0|2,0,0]=4 3201 B9R0.2 CN(C)CCCCCCO 269982a_100102631434_100000766143 [2,0,0,0,0,0|2,0,0]=4 3202 B9R0.2 CNCCCCCB(O)O 2230a_106832991635_200009817188 [2,0,0,0,0,0|2,0,0]=4 3203 B9R0.2 CNCCCCCB(O)O 34a_100102657272_200009817188 [2,0,0,0,0,0|2,0,0]=4 3204 B9R0.2 CNCCCCCB(O)O 7a_106832991635_200009817188 [2,0,0,0,0,0|2,0,0]=4 3205 B9R0.2 CNCCCCCC(C)C 2230a_100011290863_200000210301 [2,0,0,0,0,0|1,0,0]=3 3206 B9R0.2 CNCCCCCC(C)C 2230a_106832991635_100000210682 [2,0,0,0,0,0|1,0,0]=3 3207 B9R0.2 CNCCCCCC(C)C 34a_100011290863_200000210301 [2,0,0,0,0,0|1,0,0]=3 3208 B9R0.2 CNCCCCCC(C)C 34a_100102657272_100000210682 [2,0,0,0,0,0|1,0,0]=3 3209 B9R0.2 CNCCCCCC(C)C 7a_106832991635_100000210682 [2,0,0,0,0,0|1,0,0]=3 3210 B9R0.2 CNCCCOCC(C)C 2230a_100000205972_200000210301 [2,0,0,0,0,0|2,0,0]=4 3211 B9R0.2 CNCCCOCC(C)C 34a_100000205972_200000210301 [2,0,0,0,0,0|2,0,0]=4 3212 B9R0.2 CNCCCOCC(C)C 34a_100000213112_100000210624 [2,0,0,0,0,0|2,0,0]=4 3213 B9R0.2 CNCCCOCC(C)O 34a_100000213112_100011218427 [2,0,0,0,0,0|2,0,0]=4 3214 B9R0.2 CNCCCOC[C@@H](C)O 34a_100000213112_100009817552 [2,0,0,0,0,0|2,0,0]=4 3215 B9R0.2 COCCCCCB(O)O 34a_100138415774_200009817188 [2,0,0,0,0,0|2,0,0]=4 3216 B9R0.2 COCCCCCC(C)C 34a_100011995859_200000210301 [2,0,0,0,0,0|1,0,0]=3 3217 B9R0.2 COCCCCCC(C)C 34a_100138415774_100000210682 [2,0,0,0,0,0|1,0,0]=3 3218 B9R0.2 COCCCCCC(C)C 7a_100011995859_200000210301 [2,0,0,0,0,0|1,0,0]=3 3219 B9R0.2 COCCCCNC(C)C 2230a_100138425928_100000730899 [2,0,0,0,0,0|2,0,0]=4 3220 B9R0.2 COCCCCNC(C)C 34a_100011521146_200000210301 [2,0,0,0,0,0|2,0,0]=4 3221 B9R0.2 COCCCCNC(C)C 34a_100138425928_100000755781 [2,0,0,0,0,0|2,0,0]=4 3222 B9R0.2 COCCCCOC(C)C 34a_100000212225_100000755781 [2,0,0,0,0,0|2,0,0]=4 3223 B9R0.2 COCCCCOC(C)C 34a_100000740925_100000210206 [2,0,0,0,0,0|2,0,0]=4 3224 B9R0.2 COCCCCSC(C)C 62a_100000210206_100000730899 [2,0,0,0,0,0|2,0,0]=4 3225 B9R0.2 COCCCCSC(C)C 62a_100000730899_100000210206 [2,0,0,0,0,0|2,0,0]=4 3226 B9R0.2 COCCCNCC(C)C 2230a_100000210953_100000740836 [2,0,0,0,0,0|2,0,0]=4 3227 B9R0.2 COCCCNCC(C)C 270004a_100150723488_100000210432 [2,0,0,0,0,0|2,0,0]=4 3228 B9R0.2 COCCCNCC(C)C 34a_100000210953_100000740836 [2,0,0,0,0,0|2,0,0]=4 3229 B9R0.2 COCCCNCC(C)C 34a_100150723488_100000210624 [2,0,0,0,0,0|2,0,0]=4 3230 B9R0.2 COCCCNCC(C)O 2230a_100000210904_100000740836 [2,0,0,0,0,0|2,0,0]=4 3231 B9R0.2 COCCCNCC(C)O 34a_100000210904_100000740836 [2,0,0,0,0,0|2,0,0]=4 3232 B9R0.2 COCCCNCC(C)O 34a_100150723488_100011218427 [2,0,0,0,0,0|2,0,0]=4 3233 B9R0.2 COCCCNC[C@@H](C)O 34a_100150723488_100009817552 [2,0,0,0,0,0|2,0,0]=4 3234 B9R0.2 COCCCOCC(C)C 34a_100000210257_100000740836 [2,0,0,0,0,0|2,0,0]=4 3235 B9R0.2 COCCCOCC(C)C 34a_100000740835_100000210624 [2,0,0,0,0,0|2,0,0]=4 3236 B9R0.2 COCCCOCC(C)O 34a_100000740835_100011218427 [2,0,0,0,0,0|2,0,0]=4 3237 B9R0.2 COCCCOC[C@@H](C)O 34a_100000740835_100009817552 [2,0,0,0,0,0|2,0,0]=4 3238 B9R0.2 COCCCSCC(C)C 62a_100000210624_100000709357 [2,0,0,0,0,0|2,0,0]=4 3239 B9R0.2 COCCCSCC(C)C 62a_100000709357_100000210760 [2,0,0,0,0,0|2,0,0]=4 3240 B9R0.2 COCCCSCC(C)O 62a_100000709357_100011218427 [2,0,0,0,0,0|2,0,0]=4 3241 B9R0.2 COCCCSCC(C)O 62a_100011218427_100000709357 [2,0,0,0,0,0|2,0,0]=4 3242 B9R0.2 COCCCSC[C@@H](C)O 62a_100000709357_100009817552 [2,0,0,0,0,0|2,0,0]=4 3243 B9R0.2 COCCCSC[C@@H](C)O 62a_100009817552_100000709357 [2,0,0,0,0,0|2,0,0]=4 3244 B9R0.2 COCCNCCC(C)C 2230a_100000209980_100000210312 [2,0,0,0,0,0|2,0,0]=4 3245 B9R0.2 COCCNCCC(C)C 269862a_100000209980_100000185833 [2,0,0,0,0,0|2,0,0]=4 3246 B9R0.2 COCCNCCC(C)O 2230a_100000209980_100012276601 [2,0,0,0,0,0|2,0,0]=4 3247 B9R0.2 COCCNCCC(C)O 2230a_200000755665_100011201679 [2,0,0,0,0,0|2,0,0]=4 3248 B9R0.2 COCCOCCC(C)C 34a_100000210237_100000210312 [2,0,0,0,0,0|2,0,0]=4 3249 B9R0.2 COCCOCCC(C)C 34a_100000210254_100011201679 [2,0,0,0,0,0|2,0,0]=4 3250 B9R0.2 COCCOCCC(C)C 7a_100000210254_100000233755 [2,0,0,0,0,0|2,0,0]=4 3251 B9R0.2 COCCOCCC(C)O 34a_100000210237_100012276601 [2,0,0,0,0,0|2,0,0]=4 3252 B9R0.2 COCCSCCC(C)C 62a_100000210312_100000233755 [2,0,0,0,0,0|2,0,0]=4 3253 B9R0.2 COCCSCCC(C)C 62a_100000233755_100000210312 [2,0,0,0,0,0|2,0,0]=4 3254 B9R0.2 COCCSCCC(C)O 62a_100000233755_100012276601 [2,0,0,0,0,0|2,0,0]=4 3255 B9R0.2 COCCSCCC(C)O 62a_100012276601_100000233755 [2,0,0,0,0,0|2,0,0]=4 3256 B9R0.2 COCNCCCC(C)C 2230a_200000737386_100000766300 [2,0,0,0,0,0|2,0,0]=4 3257 B9R0.2 COCSCCCC(C)C 62a_100000766300_100011214892 [2,0,0,0,0,0|2,0,0]=4 3258 B9R0.2 COCSCCCC(C)C 62a_100011214892_100000766300 [2,0,0,0,0,0|2,0,0]=4 3259 B9R0.2 COCSCCCC(C)O 62a_100000766300_200000718107 [2,0,0,0,0,0|2,0,0]=4 3260 B9R0.2 COCSCCCC(C)O 62a_200000718107_100000766300 [2,0,0,0,0,0|2,0,0]=4 3261 B9R0.2 CSCCCCCB(O)O 62a_200000210301_200009817188 [2,0,0,0,0,0|2,0,0]=4 3262 B9R0.2 CSCCCCCB(O)O 62a_200009817188_200000210301 [2,0,0,0,0,0|2,0,0]=4 3263 B9R0.2 CSCCCCCC(C)C 62a_100000210682_200000210301 [2,0,0,0,0,0|1,0,0]=3 3264 B9R0.2 CSCCCCCC(C)C 62a_200000210301_100000210682 [2,0,0,0,0,0|1,0,0]=3 3265 B9R0.2 CSCCCCOC(C)C 34a_100011217163_100000210206 [2,0,0,0,0,0|2,0,0]=4 3266 B9R0.2 CSCCCCOC(C)C 7a_100011217163_100000210206 [2,0,0,0,0,0|2,0,0]=4 3267 B9R0.2 CSCCCNCC(C)C 2230a_100000749238_100000210760 [2,0,0,0,0,0|2,0,0]=4 3268 B9R0.2 CSCCCNCC(C)C 270004a_100000749238_100000210432 [2,0,0,0,0,0|2,0,0]=4 3269 B9R0.2 CSCCCNCC(C)O 2230a_100000749238_100011218427 [2,0,0,0,0,0|2,0,0]=4 3270 B9R0.2 CSCCCNC[C@@H](C)O 2230a_100000749238_100009817552 [2,0,0,0,0,0|2,0,0]=4 3271 B9R0.2 CSCCCOCC(C)C 34a_100000690336_100000210624 [2,0,0,0,0,0|2,0,0]=4 3272 B9R0.2 CSCCCOCC(C)C 7a_100000690336_100000210760 [2,0,0,0,0,0|2,0,0]=4 3273 B9R0.2 CSCCCOCC(C)O 34a_100000690336_100011218427 [2,0,0,0,0,0|2,0,0]=4 3274 B9R0.2 CSCCCOCC(C)O 7a_100000690336_100011218427 [2,0,0,0,0,0|2,0,0]=4 3275 B9R0.2 CSCCCOC[C@@H](C)O 34a_100000690336_100009817552 [2,0,0,0,0,0|2,0,0]=4 3276 B9R0.2 CSCCCOC[C@@H](C)O 7a_100000690336_100009817552 [2,0,0,0,0,0|2,0,0]=4 3277 B9R0.2 CSCCNCCC(C)C 2230a_100020590264_100000210312 [2,0,0,0,0,0|2,0,0]=4 3278 B9R0.2 CSCCNCCC(C)C 269862a_100020590264_100000185833 [2,0,0,0,0,0|2,0,0]=4 3279 B9R0.2 CSCCNCCC(C)O 2230a_100020590264_100012276601 [2,0,0,0,0,0|2,0,0]=4 3280 B9R0.2 CSCCNCCC(C)O 2230a_200000755665_100000751147 [2,0,0,0,0,0|2,0,0]=4 3281 B9R0.2 CSCCOCCC(C)C 34a_100000210254_100000212216 [2,0,0,0,0,0|2,0,0]=4 3282 B9R0.2 CSCCOCCC(C)C 34a_100000230434_100000210312 [2,0,0,0,0,0|2,0,0]=4 3283 B9R0.2 CSCCOCCC(C)C 7a_100000210254_100000212216 [2,0,0,0,0,0|2,0,0]=4 3284 B9R0.2 CSCCOCCC(C)C 7a_100000230434_100000210626 [2,0,0,0,0,0|2,0,0]=4 3285 B9R0.2 CSCCOCCC(C)O 34a_100000230434_100012276601 [2,0,0,0,0,0|2,0,0]=4 3286 B9R0.2 CSCCOCCC(C)O 7a_100000230434_100012276601 [2,0,0,0,0,0|2,0,0]=4 3287 B9R0.2 CSCCSCCC(C)C 62a_100000210312_100000751147 [2,0,0,0,0,0|2,0,0]=4 3288 B9R0.2 CSCCSCCC(C)C 62a_100000212216_100000210312 [2,0,0,0,0,0|2,0,0]=4 3289 B9R0.2 CSCCSCCC(C)O 62a_100000212216_100012276601 [2,0,0,0,0,0|2,0,0]=4 3290 B9R0.2 CSCCSCCC(C)O 62a_100012276601_100000751147 [2,0,0,0,0,0|2,0,0]=4 3291 B9R0.2 CSCNCCCC(C)C 2230a_200000737386_100011218213 [2,0,0,0,0,0|2,0,0]=4 3292 B9R0.2 CSCNCCCC(C)C 34a_200000737386_100011218213 [2,0,0,0,0,0|2,0,0]=4 3293 B9R0.2 CSCOCCCC(C)C 34a_100000210774_100011218213 [2,0,0,0,0,0|2,0,0]=4 3294 B9R0.2 CSCSCCCC(C)C 62a_100011214892_100011218213 [2,0,0,0,0,0|2,0,0]=4 3295 B9R0.2 CSCSCCCC(C)C 62a_100011218213_100011214892 [2,0,0,0,0,0|2,0,0]=4 3296 B9R0.2 CSCSCCCC(C)O 62a_100011218213_200000718107 [2,0,0,0,0,0|2,0,0]=4 3297 B9R0.2 CSCSCCCC(C)O 62a_200000718107_100011218213 [2,0,0,0,0,0|2,0,0]=4 3298 B9R0.2 C[C@@H](O)CNCCCCO 2230a_100000750430_100009817552 [2,0,0,0,0,0|2,0,0]=4 3299 B9R0.2 C[C@@H](O)CNCCCCO 34a_100000750430_100009817552 [2,0,0,0,0,0|2,0,0]=4 3300 B9R0.2 C[C@@H](O)COCCCCBr 34a_100011216708_100009817552 [2,0,0,0,0,0|2,0,0]=4 3301 B9R0.2 C[C@@H](O)COCCCCCl 34a_100000210776_100009817552 [2,0,0,0,0,0|2,0,0]=4 3302 B9R0.2 C[C@@H](O)COCCCCCl 7a_100000210776_100009817552 [2,0,0,0,0,0|2,0,0]=4 3303 B9R0.2 C[C@@H](O)COCCCCF 34a_100011995726_100009817552 [2,0,0,0,0,0|2,0,0]=4 3304 B9R0.2 C[C@@H](O)COCCCCF 7a_100011995726_100009817552 [2,0,0,0,0,0|2,0,0]=4 3305 B9R0.2 C[C@@H](O)COCCCCI 34a_200012148704_100009817552 [2,0,0,0,0,0|2,0,0]=4 3306 B9R0.2 C[C@@H](O)COCCCCN 34a_100000750430_100009817552 [2,0,0,0,0,0|2,0,0]=4 3307 B9R0.2 C[C@@H](O)CSCCCCF 62a_100000729493_100009817552 [2,0,0,0,0,0|2,0,0]=4 3308 B9R0.2 C[C@@H](O)CSCCCCF 62a_100009817552_100000729493 [2,0,0,0,0,0|2,0,0]=4 3309 B9R0.2 C[C@@H](O)CSCCCCO 62a_100000210776_100009817552 [2,0,0,0,0,0|2,0,0]=4 3310 B9R0.2 C[C@@H](O)CSCCCCO 62a_100009817552_100000210776 [2,0,0,0,0,0|2,0,0]=4 3311 B9R0.2 [13CH3]SCCCCCB(O)O 62a_200009817188_200025704644 [2,0,0,0,0,0|2,0,0]=4 3312 B9R0.2 [13CH3]SCCCCCB(O)O 62a_200025704644_200009817188 [2,0,0,0,0,0|2,0,0]=4 3313 B9R0.45 C#CCCCCCCOC 34a_100011217361_200000210301 [2,0,0,0,0,0|0,0,2]=4 3314 B9R0.45 C#CCCCCCCOC 34a_100138415774_100012276617 [2,0,0,0,0,0|0,0,2]=4 3315 B9R0.45 C#CCCCCCCOC 7a_100011217361_200000210301 [2,0,0,0,0,0|0,0,2]=4 3316 B9R0.45 C#CCCCCCCO[13CH3] 34a_100011217361_200025704644 [2,0,0,0,0,0|0,0,2]=4 3317 B9R0.45 C#CCCCCCCO[13CH3] 7a_100011217361_200025704644 [2,0,0,0,0,0|0,0,2]=4 3318 B9R0.45 C=CCCCCCCOC 34a_100138415774_100011215473 [2,0,0,0,0,0|0,0,2]=4 3319 B9R0.45 C=CCCCCCCOC 34a_200011216477_200000210301 [2,0,0,0,0,0|0,0,2]=4 3320 B9R0.45 C=CCCCCCCOC 7a_200011216477_200000210301 [2,0,0,0,0,0|0,0,2]=4 3321 B9R0.45 C=CCCCCCCO[13CH3] 34a_200011216477_200025704644 [2,0,0,0,0,0|0,0,2]=4 3322 B9R0.45 C=CCCCCCCO[13CH3] 7a_200011216477_200025704644 [2,0,0,0,0,0|0,0,2]=4 3323 B9R0.45 CC/C=C\CCCCOC 34a_100016287862_200000210301 [2,0,0,0,0,0|0,0,2]=4 3324 B9R0.45 CC/C=C\CCCCOC 7a_100016287862_200000210301 [2,0,0,0,0,0|0,0,2]=4 3325 B9R0.45 CC/C=C\CCCCO[13CH3] 34a_100016287862_200025704644 [2,0,0,0,0,0|0,0,2]=4 3326 B9R0.45 CC/C=C\CCCCO[13CH3] 7a_100016287862_200025704644 [2,0,0,0,0,0|0,0,2]=4 3327 B9R0.45 CCCC/C=C\CCOC 34a_200016286491_200000210301 [2,0,0,0,0,0|0,0,2]=4 3328 B9R0.45 CCCC/C=C\CCOC 7a_200016286491_200000210301 [2,0,0,0,0,0|0,0,2]=4 3329 B9R0.45 CCCC/C=C\CCO[13CH3] 34a_200016286491_200025704644 [2,0,0,0,0,0|0,0,2]=4 3330 B9R0.45 CCCC/C=C\CCO[13CH3] 7a_200016286491_200025704644 [2,0,0,0,0,0|0,0,2]=4 3331 B9R0.45 CCCCC#CCCOC 34a_100000037610_200000210301 [2,0,0,0,0,0|0,0,2]=4 3332 B9R0.45 CCCCC#CCCOC 7a_100000037610_200000210301 [2,0,0,0,0,0|0,0,2]=4 3333 B9R0.45 CCCCC#CCCO[13CH3] 34a_100000037610_200025704644 [2,0,0,0,0,0|0,0,2]=4 3334 B9R0.45 CCCCC#CCCO[13CH3] 7a_100000037610_200025704644 [2,0,0,0,0,0|0,0,2]=4 3335 B9R0.45 CCCCC/C=C/COC 34a_100016258190_200000210301 [2,0,0,0,0,0|0,0,2]=4 3336 B9R0.45 CCCCC/C=C/COC 7a_100016258190_200000210301 [2,0,0,0,0,0|0,0,2]=4 3337 B9R0.45 CCCCC/C=C/CO[13CH3] 34a_100016258190_200025704644 [2,0,0,0,0,0|0,0,2]=4 3338 B9R0.45 CCCCC/C=C/CO[13CH3] 7a_100016258190_200025704644 [2,0,0,0,0,0|0,0,2]=4 3339 B9R0.45 CCCCCC#CCOC 34a_100138415774_100009816472 [2,0,0,0,0,0|0,0,2]=4 3340 B9R0.45 CCCCCC#CCOC 34a_200000033628_200000210301 [2,0,0,0,0,0|0,0,2]=4 3341 B9R0.45 CCCCCC#CCOC 7a_200000033628_200000210301 [2,0,0,0,0,0|0,0,2]=4 3342 B9R0.45 CCCCCC#CCO[13CH3] 34a_200000033628_200025704644 [2,0,0,0,0,0|0,0,2]=4 3343 B9R0.45 CCCCCC#CCO[13CH3] 7a_200000033628_200025704644 [2,0,0,0,0,0|0,0,2]=4 3344 B9R0.45 CCCCCCCCNC 2230a_100000229939_200000210301 [2,0,0,0,0,0|1,0,0]=3 3345 B9R0.45 CCCCCCCCNC 2230a_106832991635_100000210759 [2,0,0,0,0,0|1,0,0]=3 3346 B9R0.45 CCCCCCCCNC 34a_100000229939_200000210301 [2,0,0,0,0,0|1,0,0]=3 3347 B9R0.45 CCCCCCCCNC 34a_100102657272_100000210759 [2,0,0,0,0,0|1,0,0]=3 3348 B9R0.45 CCCCCCCCNC 7a_106832991635_100000210759 [2,0,0,0,0,0|1,0,0]=3 3349 B9R0.45 CCCCCCCCN[13CH3] 2230a_100000229939_200025704644 [2,0,0,0,0,0|1,0,0]=3 3350 B9R0.45 CCCCCCCCN[13CH3] 34a_100000229939_200025704644 [2,0,0,0,0,0|1,0,0]=3 3351 B9R0.45 CCCCCCCCOC 34a_100000210232_200000210301 [2,0,0,0,0,0|0,0,0]=2 3352 B9R0.45 CCCCCCCCOC 34a_100138415774_100000210759 [2,0,0,0,0,0|0,0,0]=2 3353 B9R0.45 CCCCCCCCOC 7a_100000210232_200000210301 [2,0,0,0,0,0|0,0,0]=2 3354 B9R0.45 CCCCCCCCO[13CH3] 34a_100000210232_200025704644 [2,0,0,0,0,0|0,0,0]=2 3355 B9R0.45 CCCCCCCCO[13CH3] 7a_100000210232_200025704644 [2,0,0,0,0,0|0,0,0]=2 3356 B9R0.45 CCCCCCCCSC 62a_100000210759_200000210301 [2,0,0,0,0,0|0,1,0]=3 3357 B9R0.45 CCCCCCCCSC 62a_200000210301_100000210317 [2,0,0,0,0,0|0,1,0]=3 3358 B9R0.45 CCCCCCCCS[13CH3] 62a_100000210759_200025704644 [2,0,0,0,0,0|0,1,0]=3 3359 B9R0.45 CCCCCCCCS[13CH3] 62a_200025704644_100000210317 [2,0,0,0,0,0|0,1,0]=3 3360 B9R0.45 CCCCCCCNCC 2230a_100000229938_100000210202 [2,0,0,0,0,0|2,0,0]=4 3361 B9R0.45 CCCCCCCNCC 2230a_100015525214_100000210681 [2,0,0,0,0,0|2,0,0]=4 3362 B9R0.45 CCCCCCCOCC 34a_100000210272_100000210202 [2,0,0,0,0,0|2,0,0]=4 3363 B9R0.45 CCCCCCCOCC 34a_100121572206_100000210614 [2,0,0,0,0,0|2,0,0]=4 3364 B9R0.45 CCCCCCCOCC 7a_100000210272_100000210202 [2,0,0,0,0,0|2,0,0]=4 3365 B9R0.45 CCCCCCCSCC 62a_100000210202_100000210316 [2,0,0,0,0,0|2,0,0]=4 3366 B9R0.45 CCCCCCCSCC 62a_100000210614_100000210202 [2,0,0,0,0,0|2,0,0]=4 3367 B9R0.45 CCCCCCNCCC 2230a_100000210581_100000210303 [2,0,0,0,0,0|2,0,0]=4 3368 B9R0.45 CCCCCCNCOC 2230a_100000210581_100000766300 [2,0,0,0,0,0|1,0,0]=3 3369 B9R0.45 CCCCCCNCSC 2230a_100000210581_100011218213 [2,0,0,0,0,0|1,1,0]=4 3370 B9R0.45 CCCCCCOCCC 34a_100000210258_100000210314 [2,0,0,0,0,0|2,0,0]=4 3371 B9R0.45 CCCCCCOCCC 34a_100000210259_100000210303 [2,0,0,0,0,0|2,0,0]=4 3372 B9R0.45 CCCCCCOCCC 7a_100000210259_100000210303 [2,0,0,0,0,0|2,0,0]=4 3373 B9R0.45 CCCCCCOCSC 34a_100000210259_100011218213 [2,0,0,0,0,0|1,1,0]=4 3374 B9R0.45 CCCCCCSCCC 62a_100000210303_100000210757 [2,0,0,0,0,0|2,0,0]=4 3375 B9R0.45 CCCCCCSCCC 62a_100000210314_100000210303 [2,0,0,0,0,0|2,0,0]=4 3376 B9R0.45 CCCCCCSCOC 62a_100000210314_100000766300 [2,0,0,0,0,0|1,0,0]=3 3377 B9R0.45 CCCCCCSCOC 62a_100000766300_100000210757 [2,0,0,0,0,0|1,0,0]=3 3378 B9R0.45 CCCCCCSCSC 62a_100000210314_100011218213 [2,0,0,0,0,0|1,1,0]=4 3379 B9R0.45 CCCCCCSCSC 62a_100011218213_100000210757 [2,0,0,0,0,0|1,1,0]=4 3380 B9R0.45 CCCCCNCCCC 2230a_100000102301_100000210326 [2,0,0,0,0,0|2,0,0]=4 3381 B9R0.45 CCCCCNCCCC 2230a_100000209983_100000210211 [2,0,0,0,0,0|2,0,0]=4 3382 B9R0.45 CCCCCNCCCC 7a_106832991798_100000210326 [2,0,0,0,0,0|2,0,0]=4 3383 B9R0.45 CCCCCNCCOC 2230a_100000209980_100000210326 [2,0,0,0,0,0|1,0,0]=3 3384 B9R0.45 CCCCCNCCOC 2230a_100000209983_100011201679 [2,0,0,0,0,0|1,0,0]=3 3385 B9R0.45 CCCCCNCCOC 34a_100000224656_200000210301 [2,0,0,0,0,0|1,0,0]=3 3386 B9R0.45 CCCCCNCCO[13CH3] 34a_100000224656_200025704644 [2,0,0,0,0,0|1,0,0]=3 3387 B9R0.45 CCCCCNCCSC 2230a_100000209983_100000751147 [2,0,0,0,0,0|1,1,0]=4 3388 B9R0.45 CCCCCNCCSC 2230a_100020590264_100000210326 [2,0,0,0,0,0|1,1,0]=4 3389 B9R0.45 CCCCCOCCCC 34a_100000210227_100000718602 [2,0,0,0,0,0|2,0,0]=4 3390 B9R0.45 CCCCCOCCCC 34a_100000210253_100000210210 [2,0,0,0,0,0|2,0,0]=4 3391 B9R0.45 CCCCCOCCCC 7a_100000210227_100000210326 [2,0,0,0,0,0|2,0,0]=4 3392 B9R0.45 CCCCCOCCCC 7a_100000210253_100000210211 [2,0,0,0,0,0|2,0,0]=4 3393 B9R0.45 CCCCCOCCOC 34a_100000210237_100000718602 [2,0,0,0,0,0|1,0,0]=3 3394 B9R0.45 CCCCCOCCOC 34a_100000210253_100011201679 [2,0,0,0,0,0|1,0,0]=3 3395 B9R0.45 CCCCCOCCOC 34a_100011215259_200000210301 [2,0,0,0,0,0|1,0,0]=3 3396 B9R0.45 CCCCCOCCOC 7a_100000210253_100000233755 [2,0,0,0,0,0|1,0,0]=3 3397 B9R0.45 CCCCCOCCOC 7a_100011215259_200000210301 [2,0,0,0,0,0|1,0,0]=3 3398 B9R0.45 CCCCCOCCON 34a_100000700252_100000718602 [2,0,0,0,0,0|2,0,0]=4 3399 B9R0.45 CCCCCOCCO[13CH3] 34a_100011215259_200025704644 [2,0,0,0,0,0|1,0,0]=3 3400 B9R0.45 CCCCCOCCO[13CH3] 7a_100011215259_200025704644 [2,0,0,0,0,0|1,0,0]=3 3401 B9R0.45 CCCCCOCCSC 34a_100000210253_100000212216 [2,0,0,0,0,0|1,1,0]=4 3402 B9R0.45 CCCCCOCCSC 34a_100000230434_100000718602 [2,0,0,0,0,0|1,1,0]=4 3403 B9R0.45 CCCCCOCCSC 7a_100000210253_100000212216 [2,0,0,0,0,0|1,1,0]=4 3404 B9R0.45 CCCCCOCCSC 7a_100000230434_100000210326 [2,0,0,0,0,0|1,1,0]=4 3405 B9R0.45 CCCCCSCCCC 62a_100000210211_100000210326 [2,0,0,0,0,0|2,0,0]=4 3406 B9R0.45 CCCCCSCCCC 62a_100000210326_100000210210 [2,0,0,0,0,0|2,0,0]=4 3407 B9R0.45 CCCCCSCCOC 62a_100000210326_100000233755 [2,0,0,0,0,0|1,0,0]=3 3408 B9R0.45 CCCCCSCCOC 62a_100000233755_100000210326 [2,0,0,0,0,0|1,0,0]=3 3409 B9R0.45 CCCCCSCCSC 62a_100000210326_100000751147 [2,0,0,0,0,0|1,1,0]=4 3410 B9R0.45 CCCCCSCCSC 62a_100000212216_100000210326 [2,0,0,0,0,0|1,1,0]=4 3411 B9R0.45 CCCCNCCCOC 2230a_100000102301_100000740836 [2,0,0,0,0,0|1,0,0]=3 3412 B9R0.45 CCCCNCCCOC 34a_100150723488_100000210210 [2,0,0,0,0,0|1,0,0]=3 3413 B9R0.45 CCCCNCCCOC 7a_106832991798_100000740836 [2,0,0,0,0,0|1,0,0]=3 3414 B9R0.45 CCCCNCCCSC 2230a_100000749238_100000210211 [2,0,0,0,0,0|1,1,0]=4 3415 B9R0.45 CCCCOCCCNC 2230a_200000211371_200000210301 [2,0,0,0,0,0|2,0,0]=4 3416 B9R0.45 CCCCOCCCNC 34a_100000213112_100000210210 [2,0,0,0,0,0|2,0,0]=4 3417 B9R0.45 CCCCOCCCNC 34a_200000211371_200000210301 [2,0,0,0,0,0|2,0,0]=4 3418 B9R0.45 CCCCOCCCN[13CH3] 2230a_200000211371_200025704644 [2,0,0,0,0,0|2,0,0]=4 3419 B9R0.45 CCCCOCCCN[13CH3] 34a_200000211371_200025704644 [2,0,0,0,0,0|2,0,0]=4 3420 B9R0.45 CCCCOCCCOC 34a_100000210227_100000740836 [2,0,0,0,0,0|1,0,0]=3 3421 B9R0.45 CCCCOCCCOC 34a_100000740835_100000210210 [2,0,0,0,0,0|1,0,0]=3 3422 B9R0.45 CCCCOCCCOC 34a_200011215613_200000210301 [2,0,0,0,0,0|1,0,0]=3 3423 B9R0.45 CCCCOCCCOC 7a_100000210227_100000740836 [2,0,0,0,0,0|1,0,0]=3 3424 B9R0.45 CCCCOCCCOC 7a_200011215613_200000210301 [2,0,0,0,0,0|1,0,0]=3 3425 B9R0.45 CCCCOCCCO[13CH3] 34a_200011215613_200025704644 [2,0,0,0,0,0|1,0,0]=3 3426 B9R0.45 CCCCOCCCO[13CH3] 7a_200011215613_200025704644 [2,0,0,0,0,0|1,0,0]=3 3427 B9R0.45 CCCCOCCCSC 34a_100000690336_100000210210 [2,0,0,0,0,0|1,1,0]=4 3428 B9R0.45 CCCCOCCCSC 7a_100000690336_100000210211 [2,0,0,0,0,0|1,1,0]=4 3429 B9R0.45 CCCCOCSCOC 62a_100000766300_100011995733 [2,0,0,0,0,0|2,0,0]=4 3430 B9R0.45 CCCCOCSCOC 62a_100011995733_100000766300 [2,0,0,0,0,0|2,0,0]=4 3431 B9R0.45 CCCCSCCCOC 62a_100000210211_100000709357 [2,0,0,0,0,0|1,0,0]=3 3432 B9R0.45 CCCCSCCCOC 62a_100000709357_100000210210 [2,0,0,0,0,0|1,0,0]=3 3433 B9R0.45 CCCOCCCCOC 34a_100000210258_100000755781 [2,0,0,0,0,0|1,0,0]=3 3434 B9R0.45 CCCOCCCCOC 34a_100000740925_100000210303 [2,0,0,0,0,0|1,0,0]=3 3435 B9R0.45 CCCOCCCCSC 34a_100011217163_100000210303 [2,0,0,0,0,0|1,1,0]=4 3436 B9R0.45 CCCOCCCCSC 7a_100011217163_100000210303 [2,0,0,0,0,0|1,1,0]=4 3437 B9R0.45 CCCOCCNCOC 2230a_100161115042_100000766300 [2,0,0,0,0,0|2,0,0]=4 3438 B9R0.45 CCCOCCSCOC 62a_100000766300_100011215938 [2,0,0,0,0,0|2,0,0]=4 3439 B9R0.45 CCCOCCSCOC 62a_100011215938_100000766300 [2,0,0,0,0,0|2,0,0]=4 3440 B9R0.45 CCCSCCCCOC 62a_100000210303_100000730899 [2,0,0,0,0,0|1,0,0]=3 3441 B9R0.45 CCCSCCCCOC 62a_100000730899_100000210303 [2,0,0,0,0,0|1,0,0]=3 3442 B9R0.45 CCCSCCNCOC 2230a_100020603323_100000766300 [2,0,0,0,0,0|2,0,0]=4 3443 B9R0.45 CCCSCOCCOC 62a_100000210303_100000231047 [2,0,0,0,0,0|2,0,0]=4 3444 B9R0.45 CCCSCOCCOC 62a_100000231047_100000210303 [2,0,0,0,0,0|2,0,0]=4 3445 B9R0.45 CCNCCCCCOC 2230a_100000747528_100000210202 [2,0,0,0,0,0|1,0,0]=3 3446 B9R0.45 CCNCCCCCOC 34a_100000747528_100000210202 [2,0,0,0,0,0|1,0,0]=3 3447 B9R0.45 CCNCCOCCOC 2230a_100000745349_100000210202 [2,0,0,0,0,0|2,0,0]=4 3448 B9R0.45 CCNCCOCCOC 2230a_100015525214_100000695917 [2,0,0,0,0,0|2,0,0]=4 3449 B9R0.45 CCNCCOCCOC 34a_100000745349_100000210202 [2,0,0,0,0,0|2,0,0]=4 3450 B9R0.45 CCOCCCCCNC 34a_100000722520_100000210202 [2,0,0,0,0,0|2,0,0]=4 3451 B9R0.45 CCOCCCNCOC 2230a_100000210961_100000766300 [2,0,0,0,0,0|2,0,0]=4 3452 B9R0.45 CCOCCCSCOC 62a_100000766300_100012232248 [2,0,0,0,0,0|2,0,0]=4 3453 B9R0.45 CCOCCCSCOC 62a_100012232248_100000766300 [2,0,0,0,0,0|2,0,0]=4 3454 B9R0.45 CCOCCNCCOC 2230a_100000209980_100011215890 [2,0,0,0,0,0|2,0,0]=4 3455 B9R0.45 CCOCCNCCOC 2230a_102516460346_100011201679 [2,0,0,0,0,0|2,0,0]=4 3456 B9R0.45 CCOCCNCCOC 34a_102516460346_100011201679 [2,0,0,0,0,0|2,0,0]=4 3457 B9R0.45 CCOCCOCCOC 34a_100000210136_100011201679 [2,0,0,0,0,0|2,0,0]=4 3458 B9R0.45 CCOCCOCCOC 34a_100000210237_100000210147 [2,0,0,0,0,0|2,0,0]=4 3459 B9R0.45 CCOCCOCCOC 34a_100000210240_200000210301 [2,0,0,0,0,0|2,0,0]=4 3460 B9R0.45 CCOCCOCCOC 34a_100011215163_100000210202 [2,0,0,0,0,0|2,0,0]=4 3461 B9R0.45 CCOCCOCCOC 34a_100121572206_100000695917 [2,0,0,0,0,0|2,0,0]=4 3462 B9R0.45 CCOCCOCCOC 34a_100138415774_100011211534 [2,0,0,0,0,0|2,0,0]=4 3463 B9R0.45 CCOCCOCCOC 7a_100000210136_100000233755 [2,0,0,0,0,0|2,0,0]=4 3464 B9R0.45 CCOCCOCCOC 7a_100000210240_200000210301 [2,0,0,0,0,0|2,0,0]=4 3465 B9R0.45 CCOCCOCCOC 7a_100011215163_100000210202 [2,0,0,0,0,0|2,0,0]=4 3466 B9R0.45 CCOCCOCCO[13CH3] 34a_100000210240_200025704644 [2,0,0,0,0,0|2,0,0]=4 3467 B9R0.45 CCOCCOCCO[13CH3] 7a_100000210240_200025704644 [2,0,0,0,0,0|2,0,0]=4 3468 B9R0.45 CCOCCSCCOC 62a_100000210147_100000233755 [2,0,0,0,0,0|2,0,0]=4 3469 B9R0.45 CCOCCSCCOC 62a_100000233755_100011215890 [2,0,0,0,0,0|2,0,0]=4 3470 B9R0.45 CCOCSCCCOC 62a_100000709357_100000739092 [2,0,0,0,0,0|2,0,0]=4 3471 B9R0.45 CCOCSCCCOC 62a_100000739092_100000709357 [2,0,0,0,0,0|2,0,0]=4 3472 B9R0.45 CCSCCNCCOC 2230a_100000106463_100011201679 [2,0,0,0,0,0|2,0,0]=4 3473 B9R0.45 CCSCCNCCOC 2230a_100000209980_100000757381 [2,0,0,0,0,0|2,0,0]=4 3474 B9R0.45 CCSCCOCCOC 34a_100000210237_100000757381 [2,0,0,0,0,0|2,0,0]=4 3475 B9R0.45 CCSCCOCCOC 34a_100000212035_100011201679 [2,0,0,0,0,0|2,0,0]=4 3476 B9R0.45 CCSCCOCCOC 62a_100000210202_100000695917 [2,0,0,0,0,0|2,0,0]=4 3477 B9R0.45 CCSCCOCCOC 62a_100000695917_100000210202 [2,0,0,0,0,0|2,0,0]=4 3478 B9R0.45 CCSCCOCCOC 7a_100000212035_100000233755 [2,0,0,0,0,0|2,0,0]=4 3479 B9R0.45 CCSCCSCCOC 62a_100000233755_100000757381 [2,0,0,0,0,0|2,0,0]=4 3480 B9R0.45 CCSCCSCCOC 62a_100000757381_100000233755 [2,0,0,0,0,0|2,0,0]=4 3481 B9R0.45 CNCCCCCCCO 2230a_100011996573_200000210301 [2,0,0,0,0,0|2,0,0]=4 3482 B9R0.45 CNCCCCCCCO 2230a_106832991635_100000760002 [2,0,0,0,0,0|2,0,0]=4 3483 B9R0.45 CNCCCCCCCO 34a_100011996573_200000210301 [2,0,0,0,0,0|2,0,0]=4 3484 B9R0.45 CNCCCCCCCO 34a_100102657272_100000760002 [2,0,0,0,0,0|2,0,0]=4 3485 B9R0.45 CNCCCCCCCO 7a_106832991635_100000760002 [2,0,0,0,0,0|2,0,0]=4 3486 B9R0.45 CNCCCCCCOC 2230a_106832991635_100011998445 [2,0,0,0,0,0|1,0,0]=3 3487 B9R0.45 CNCCCCCCOC 34a_100102657272_100011998445 [2,0,0,0,0,0|1,0,0]=3 3488 B9R0.45 CNCCCCCCOC 7a_106832991635_100011998445 [2,0,0,0,0,0|1,0,0]=3 3489 B9R0.45 CNCCCOCCOC 2230a_100000206027_200000210301 [2,0,0,0,0,0|2,0,0]=4 3490 B9R0.45 CNCCCOCCOC 2230a_106832991635_100011216529 [2,0,0,0,0,0|2,0,0]=4 3491 B9R0.45 CNCCCOCCOC 34a_100000206027_200000210301 [2,0,0,0,0,0|2,0,0]=4 3492 B9R0.45 CNCCCOCCOC 34a_100000213112_100011201679 [2,0,0,0,0,0|2,0,0]=4 3493 B9R0.45 CNCCCOCCOC 34a_100102657272_100011216529 [2,0,0,0,0,0|2,0,0]=4 3494 B9R0.45 CNCCCOCCOC 7a_106832991635_100011216529 [2,0,0,0,0,0|2,0,0]=4 3495 B9R0.45 COCCCCCCCBr 34a_100000760002_200000210301 [2,0,0,0,0,0|1,0,0]=3 3496 B9R0.45 COCCCCCCCBr 7a_100000760002_200000210301 [2,0,0,0,0,0|1,0,0]=3 3497 B9R0.45 COCCCCCCCN 34a_100011996573_200000210301 [2,0,0,0,0,0|1,0,0]=3 3498 B9R0.45 COCCCCCCCO 34a_100138415774_100000760002 [2,0,0,0,0,0|1,0,0]=3 3499 B9R0.45 COCCCCCCOC 34a_100138415774_100011998445 [2,0,0,0,0,0|1,0,0]=3 3500 B9R0.45 COCCCCCCOC 34a_200012092642_200000210301 [2,0,0,0,0,0|1,0,0]=3 3501 B9R0.45 COCCCCCCOC 7a_200012092642_200000210301 [2,0,0,0,0,0|1,0,0]=3 3502 B9R0.45 COCCCCCCO[13CH3] 34a_200012092642_200025704644 [2,0,0,0,0,0|1,0,0]=3 3503 B9R0.45 COCCCCCCO[13CH3] 7a_200012092642_200025704644 [2,0,0,0,0,0|1,0,0]=3 3504 B9R0.45 COCCCCCCSC 62a_100011998445_200000210301 [2,0,0,0,0,0|1,0,0]=3 3505 B9R0.45 COCCCCCCSC 62a_200000210301_100011998445 [2,0,0,0,0,0|1,0,0]=3 3506 B9R0.45 COCCCCCCS[13CH3] 62a_100011998445_200025704644 [2,0,0,0,0,0|1,0,0]=3 3507 B9R0.45 COCCCCCCS[13CH3] 62a_200025704644_100011998445 [2,0,0,0,0,0|1,0,0]=3 3508 B9R0.45 COCCCCCNCF 34a_100000747528_100015361967 [2,0,0,0,0,0|2,0,0]=4 3509 B9R0.45 COCCCCNCCF 34a_100000724931_100000755781 [2,0,0,0,0,0|2,0,0]=4 3510 B9R0.45 COCCCCNCCO 2230a_100016997473_100000730899 [2,0,0,0,0,0|2,0,0]=4 3511 B9R0.45 COCCCCNCCO 34a_100016990907_100000755781 [2,0,0,0,0,0|2,0,0]=4 3512 B9R0.45 COCCCCOCCBr 34a_100000211926_100000755781 [2,0,0,0,0,0|2,0,0]=4 3513 B9R0.45 COCCCCOCCF 34a_100000740925_100011217306 [2,0,0,0,0,0|2,0,0]=4 3514 B9R0.45 COCCCCOCCN 34a_100000210304_100000755781 [2,0,0,0,0,0|2,0,0]=4 3515 B9R0.45 COCCCCOCCO 34a_100000740925_100000211926 [2,0,0,0,0,0|2,0,0]=4 3516 B9R0.45 COCCCCOCSC 34a_100000740925_100011218213 [2,0,0,0,0,0|2,0,0]=4 3517 B9R0.45 COCCCCSCCF 62a_100000730899_100011217306 [2,0,0,0,0,0|2,0,0]=4 3518 B9R0.45 COCCCCSCCF 62a_100011217306_100000730899 [2,0,0,0,0,0|2,0,0]=4 3519 B9R0.45 COCCCCSCCO 62a_100000211926_100000730899 [2,0,0,0,0,0|2,0,0]=4 3520 B9R0.45 COCCCCSCCO 62a_100000730899_100000211926 [2,0,0,0,0,0|2,0,0]=4 3521 B9R0.45 COCCCCSCOC 62a_100000730899_100000766300 [2,0,0,0,0,0|2,0,0]=4 3522 B9R0.45 COCCCCSCOC 62a_100000766300_100000730899 [2,0,0,0,0,0|2,0,0]=4 3523 B9R0.45 COCCCCSCSC 62a_100000730899_100011218213 [2,0,0,0,0,0|2,0,0]=4 3524 B9R0.45 COCCCCSCSC 62a_100011218213_100000730899 [2,0,0,0,0,0|2,0,0]=4 3525 B9R0.45 COCCCNCCCF 2230a_100015189416_100000740836 [2,0,0,0,0,0|2,0,0]=4 3526 B9R0.45 COCCCNCCCF 34a_100015189416_100000740836 [2,0,0,0,0,0|2,0,0]=4 3527 B9R0.45 COCCCNCCCF 34a_100150723488_100011934791 [2,0,0,0,0,0|2,0,0]=4 3528 B9R0.45 COCCCNCCCO 34a_100150723488_100000230001 [2,0,0,0,0,0|2,0,0]=4 3529 B9R0.45 COCCCNCCOC 2230a_100000209980_100000740836 [2,0,0,0,0,0|2,0,0]=4 3530 B9R0.45 COCCCNCCOC 34a_100150723488_100011201679 [2,0,0,0,0,0|2,0,0]=4 3531 B9R0.45 COCCCNCCSC 2230a_100020590264_100000740836 [2,0,0,0,0,0|2,0,0]=4 3532 B9R0.45 COCCCNCCSC 34a_100150723488_100000212216 [2,0,0,0,0,0|2,0,0]=4 3533 B9R0.45 COCCCOCCCBr 34a_100011217188_100000740836 [2,0,0,0,0,0|2,0,0]=4 3534 B9R0.45 COCCCOCCCCl 34a_100000230001_100000740836 [2,0,0,0,0,0|2,0,0]=4 3535 B9R0.45 COCCCOCCCF 34a_100000740835_100011934791 [2,0,0,0,0,0|2,0,0]=4 3536 B9R0.45 COCCCOCCCF 34a_100000759539_100000740836 [2,0,0,0,0,0|2,0,0]=4 3537 B9R0.45 COCCCOCCCN 34a_100000182051_100000740836 [2,0,0,0,0,0|2,0,0]=4 3538 B9R0.45 COCCCOCCCN 34a_100011310245_200000210301 [2,0,0,0,0,0|2,0,0]=4 3539 B9R0.45 COCCCOCCCO 34a_100000740835_100000230001 [2,0,0,0,0,0|2,0,0]=4 3540 B9R0.45 COCCCOCCOC 34a_100000210237_100000740836 [2,0,0,0,0,0|2,0,0]=4 3541 B9R0.45 COCCCOCCOC 34a_100000740835_100011201679 [2,0,0,0,0,0|2,0,0]=4 3542 B9R0.45 COCCCOCCOC 34a_100138415774_100011216529 [2,0,0,0,0,0|2,0,0]=4 3543 B9R0.45 COCCCOCCSC 34a_100000230434_100000740836 [2,0,0,0,0,0|2,0,0]=4 3544 B9R0.45 COCCCOCCSC 34a_100000740835_100000212216 [2,0,0,0,0,0|2,0,0]=4 3545 B9R0.45 COCCCOCCSC 7a_100000230434_100000740836 [2,0,0,0,0,0|2,0,0]=4 3546 B9R0.45 COCCCSCCCF 62a_100000709357_100011934791 [2,0,0,0,0,0|2,0,0]=4 3547 B9R0.45 COCCCSCCCF 62a_100011934791_100000709357 [2,0,0,0,0,0|2,0,0]=4 3548 B9R0.45 COCCCSCCCO 62a_100000709357_100011215043 [2,0,0,0,0,0|2,0,0]=4 3549 B9R0.45 COCCCSCCCO 62a_100011215043_100000709357 [2,0,0,0,0,0|2,0,0]=4 3550 B9R0.45 COCCCSCCOC 62a_100000233755_100000709357 [2,0,0,0,0,0|2,0,0]=4 3551 B9R0.45 COCCCSCCOC 62a_100000709357_100000233755 [2,0,0,0,0,0|2,0,0]=4 3552 B9R0.45 COCCCSCCSC 62a_100000212216_100000709357 [2,0,0,0,0,0|2,0,0]=4 3553 B9R0.45 COCCCSCCSC 62a_100000709357_100000751147 [2,0,0,0,0,0|2,0,0]=4 3554 B9R0.45 COCCNCCCCF 2230a_100000209980_100000729493 [2,0,0,0,0,0|2,0,0]=4 3555 B9R0.45 COCCNCCCCO 2230a_100000209980_100000210776 [2,0,0,0,0,0|2,0,0]=4 3556 B9R0.45 COCCNCCCCO 2230a_100000750430_100011201679 [2,0,0,0,0,0|2,0,0]=4 3557 B9R0.45 COCCNCCCCO 34a_100000750430_100011201679 [2,0,0,0,0,0|2,0,0]=4 3558 B9R0.45 COCCNCCCSC 2230a_100000749238_100011201679 [2,0,0,0,0,0|2,0,0]=4 3559 B9R0.45 COCCOCCCCBr 34a_100011216708_100011201679 [2,0,0,0,0,0|2,0,0]=4 3560 B9R0.45 COCCOCCCCCl 34a_100000210776_100011201679 [2,0,0,0,0,0|2,0,0]=4 3561 B9R0.45 COCCOCCCCCl 7a_100000210776_100000233755 [2,0,0,0,0,0|2,0,0]=4 3562 B9R0.45 COCCOCCCCF 34a_100000210237_100000729493 [2,0,0,0,0,0|2,0,0]=4 3563 B9R0.45 COCCOCCCCF 34a_100011995726_100011201679 [2,0,0,0,0,0|2,0,0]=4 3564 B9R0.45 COCCOCCCCF 7a_100011995726_100000233755 [2,0,0,0,0,0|2,0,0]=4 3565 B9R0.45 COCCOCCCCI 34a_200012148704_100011201679 [2,0,0,0,0,0|2,0,0]=4 3566 B9R0.45 COCCOCCCCN 34a_100000750430_100011201679 [2,0,0,0,0,0|2,0,0]=4 3567 B9R0.45 COCCOCCCCO 34a_100000210237_100011216708 [2,0,0,0,0,0|2,0,0]=4 3568 B9R0.45 COCCOCCCN[13CH3] 2230a_100000206027_200025704644 [2,0,0,0,0,0|2,0,0]=4 3569 B9R0.45 COCCOCCCN[13CH3] 34a_100000206027_200025704644 [2,0,0,0,0,0|2,0,0]=4 3570 B9R0.45 COCCOCCCSC 34a_100000690336_100011201679 [2,0,0,0,0,0|2,0,0]=4 3571 B9R0.45 COCCOCCCSC 62a_100011216529_200000210301 [2,0,0,0,0,0|2,0,0]=4 3572 B9R0.45 COCCOCCCSC 62a_200000210301_100011216529 [2,0,0,0,0,0|2,0,0]=4 3573 B9R0.45 COCCOCCCSC 7a_100000690336_100000233755 [2,0,0,0,0,0|2,0,0]=4 3574 B9R0.45 COCCOCCCS[13CH3] 62a_100011216529_200025704644 [2,0,0,0,0,0|2,0,0]=4 3575 B9R0.45 COCCOCCCS[13CH3] 62a_200025704644_100011216529 [2,0,0,0,0,0|2,0,0]=4 3576 B9R0.45 COCCSCCCCF 62a_100000233755_100000729493 [2,0,0,0,0,0|2,0,0]=4 3577 B9R0.45 COCCSCCCCF 62a_100000729493_100000233755 [2,0,0,0,0,0|2,0,0]=4 3578 B9R0.45 COCCSCCCCO 62a_100000210776_100000233755 [2,0,0,0,0,0|2,0,0]=4 3579 B9R0.45 COCCSCCCCO 62a_100000233755_100000210776 [2,0,0,0,0,0|2,0,0]=4 3580 B9R0.45 COCNCCCCCO 2230a_100000762737_100000766300 [2,0,0,0,0,0|2,0,0]=4 3581 B9R0.45 COCSCCCCCF 62a_100000729378_100000766300 [2,0,0,0,0,0|2,0,0]=4 3582 B9R0.45 COCSCCCCCF 62a_100000766300_100000729378 [2,0,0,0,0,0|2,0,0]=4 3583 B9R0.45 COCSCCCCCO 62a_100000746330_100000766300 [2,0,0,0,0,0|2,0,0]=4 3584 B9R0.45 COCSCCCCCO 62a_100000766300_100000746330 [2,0,0,0,0,0|2,0,0]=4 3585 B9R0.45 CSCCCCCCCO 62a_100000760002_200000210301 [2,0,0,0,0,0|1,1,0]=4 3586 B9R0.45 CSCCCCCCCO 62a_200000210301_100000760002 [2,0,0,0,0,0|1,1,0]=4 3587 B9R0.45 [13CH3]NCCCCCCCO 2230a_100011996573_200025704644 [2,0,0,0,0,0|2,0,0]=4 3588 B9R0.45 [13CH3]NCCCCCCCO 34a_100011996573_200025704644 [2,0,0,0,0,0|2,0,0]=4 3589 B9R0.45 [13CH3]OCCCCCCCBr 34a_100000760002_200025704644 [2,0,0,0,0,0|1,0,0]=3 3590 B9R0.45 [13CH3]OCCCCCCCBr 7a_100000760002_200025704644 [2,0,0,0,0,0|1,0,0]=3 3591 B9R0.45 [13CH3]OCCCCCCCN 34a_100011996573_200025704644 [2,0,0,0,0,0|1,0,0]=3 3592 B9R0.45 [13CH3]OCCCOCCCN 34a_100011310245_200025704644 [2,0,0,0,0,0|2,0,0]=4 3593 B9R0.45 [13CH3]SCCCCCCCO 62a_100000760002_200025704644 [2,0,0,0,0,0|1,1,0]=4 3594 B9R0.45 [13CH3]SCCCCCCCO 62a_200025704644_100000760002 [2,0,0,0,0,0|1,1,0]=4 3595 B11R0.9 CCCC(=O)CCC(OC)OC 1458a_100000211992_100000139399 [1,1,0,0,0,0|0,0,1]=3 3596 B11R0.9 CCCC(=O)CCC(OC)OC 1458a_200000082759_100000210303 [1,1,0,0,0,0|0,0,1]=3 3597 B11R0.9 CCCC(=O)NCC(OC)OC 11a_100000210479_100000211992 [1,1,0,0,0,0|1,0,1]=4 3598 B11R0.9 CCCC(=O)NCC(OC)OC 1626a_100000210479_100000211992 [1,1,0,0,0,0|1,0,1]=4 3599 B11R0.9 CCCC(=O)NCC(OC)OC 240690a_100000210479_100000211992 [1,1,0,0,0,0|1,0,1]=4 3600 B11R0.9 CCCC(=O)NCC(OC)OC 527a_100000210479_100000211992 [1,1,0,0,0,0|1,0,1]=4 3601 B11R0.9 CCCC(C)NCC(CC)OC 270004a_100000731041_100000211909 [1,1,0,0,0,0|2,0,0]=4 3602 B11R0.9 CCCC(C)NCC(OC)OC 2230a_100000741246_100000751394 [1,1,0,0,0,0|1,0,0]=3 3603 B11R0.9 CCCC(C)NCC(OC)OC 270004a_100000210479_100000211909 [1,1,0,0,0,0|1,0,0]=3 3604 B11R0.9 CCCC(C)NCC(OC)OC 270004a_100000741246_100000752162 [1,1,0,0,0,0|1,0,0]=3 3605 B11R0.9 CCCC(C)OCC(CC)OC 34a_100011934954_100000766640 [1,1,0,0,0,0|2,0,0]=4 3606 B11R0.9 CCCC(C)OCC(CC)OC 7a_100011934954_100000766640 [1,1,0,0,0,0|2,0,0]=4 3607 B11R0.9 CCCC(C)OCC(OC)OC 34a_100000764384_100000211822 [1,1,0,0,0,0|1,0,0]=3 3608 B11R0.9 CCCC(C)OCC(OC)OC 34a_100011216393_100000766640 [1,1,0,0,0,0|1,0,0]=3 3609 B11R0.9 CCCC(C)OCC(OC)OC 7a_100000764384_100000751394 [1,1,0,0,0,0|1,0,0]=3 3610 B11R0.9 CCCC(C)SCC(OC)OC 62a_100000751394_100000766640 [1,1,0,0,0,0|1,0,0]=3 3611 B11R0.9 CCCC(C)SCC(OC)OC 62a_100000766640_100000751394 [1,1,0,0,0,0|1,0,0]=3 3612 B11R0.9 CCCN(C)CCC(OC)OC 2230a_100000747261_100009813347 [1,1,0,0,0,0|1,0,0]=3 3613 B11R0.9 CCCN(C)CCC(OC)OC 269982a_100000747261_100000139399 [1,1,0,0,0,0|1,0,0]=3 3614 B11R0.9 CCNC(=O)CCC(OC)OC 11a_100015525214_200000082759 [1,1,0,0,0,0|1,0,1]=4 3615 B11R0.9 CCNC(=O)CCC(OC)OC 240690a_100015525214_200000082759 [1,1,0,0,0,0|1,0,1]=4 3616 B11R0.9 CCNC(=O)CCC(OC)OC 527a_100015525214_200000082759 [1,1,0,0,0,0|1,0,1]=4 3617 B11R0.9 COC(CCC(=O)CCF)OC 1458a_200000082759_100011217306 [1,1,0,0,0,0|1,0,1]=4 3618 B11R0.9 COC(CCC(=O)CCO)OC 1458a_100011216618_100000139399 [1,1,0,0,0,0|1,0,1]=4 3619 B11R0.9 COC(CCC(=O)CCO)OC 1458a_200000082759_100000211926 [1,1,0,0,0,0|1,0,1]=4 3620 B11R0.9 COC(CCC(=O)CSC)OC 1458a_100000184570_100000139399 [1,1,0,0,0,0|1,0,1]=4 3621 B11R0.9 COC(CCN(C)CCO)OC 2230a_100000210263_100009813347 [1,1,0,0,0,0|2,0,0]=4 3622 B11R0.9 COC(CCN(C)CCO)OC 269982a_100000210263_100000139399 [1,1,0,0,0,0|2,0,0]=4 3623 B11R0.9 COC(CNC(C)CSC)OC 270004a_100000210479_100011216314 [1,1,0,0,0,0|2,0,0]=4 3624 B11R0.9 COC(CN[C@H](C)CCO)OC 2230a_100000706166_100000751394 [1,1,0,0,0,0|2,0,0]=4 3625 B11R0.9 COC(CN[C@H](C)CCO)OC 270004a_100000706166_100000752162 [1,1,0,0,0,0|2,0,0]=4 3626 B11R0.9 COC(CN[C@H](C)CCO)OC 34a_100000706166_100000211822 [1,1,0,0,0,0|2,0,0]=4 3627 B11R0.9 COC(COC(C)CCBr)OC 34a_100012276601_100000211822 [1,1,0,0,0,0|2,0,0]=4 3628 B11R0.9 COC(COC(C)CCO)OC 34a_100011216393_100009893172 [1,1,0,0,0,0|2,0,0]=4 3629 B11R0.9 COC(CSC(C)CCO)OC 62a_100000751394_100009893172 [1,1,0,0,0,0|2,0,0]=4 3630 B11R0.9 COC(CSC(C)CCO)OC 62a_100009893172_100000751394 [1,1,0,0,0,0|2,0,0]=4 3631 B11R0.9 COCC(=O)CCC(OC)OC 1458a_100000210968_100000139399 [1,1,0,0,0,0|1,0,1]=4 3632 B11R0.9 COCC(C)NCC(OC)OC 270004a_100000210479_100000749346 [1,1,0,0,0,0|2,0,0]=4 3633 B11R0.9 COCC(C)OCC(OC)OC 34a_100011216393_100000765312 [1,1,0,0,0,0|2,0,0]=4 3634 B11R0.9 COCC(C)SCC(OC)OC 62a_100000751394_100000765312 [1,1,0,0,0,0|2,0,0]=4 3635 B11R0.9 COCC(C)SCC(OC)OC 62a_100000765312_100000751394 [1,1,0,0,0,0|2,0,0]=4 3636 B11R0.9 COC[C@@H](C)NCC(OC)OC 2230a_100000764878_100000751394 [1,1,0,0,0,0|2,0,0]=4 3637 B11R0.9 COC[C@@H](C)NCC(OC)OC 270004a_100000764878_100000752162 [1,1,0,0,0,0|2,0,0]=4 3638 B11R0.9 COC[C@@H](C)OCC(OC)OC 34a_100011934205_100000211822 [1,1,0,0,0,0|2,0,0]=4 3639 B11R0.22 C=C(C)CCOCC(OC)OC 34a_100000764851_100000211822 [1,1,0,0,0,0|1,0,1]=4 3640 B11R0.22 C=C(C)CCOCC(OC)OC 34a_100011216393_100000730704 [1,1,0,0,0,0|1,0,1]=4 3641 B11R0.22 C=C(C)CCSCC(OC)OC 62a_100000730704_100000751394 [1,1,0,0,0,0|1,0,1]=4 3642 B11R0.22 C=C(C)CCSCC(OC)OC 62a_100000751394_100000730704 [1,1,0,0,0,0|1,0,1]=4 3643 B11R0.22 C=C(C)COCCC(OC)OC 34a_100000210245_100000139399 [1,1,0,0,0,0|1,0,1]=4 3644 B11R0.22 C=C(C)CSCCC(OC)OC 62a_100000139399_100000211660 [1,1,0,0,0,0|1,0,1]=4 3645 B11R0.22 C=C(C)CSCCC(OC)OC 62a_100000748629_100000139399 [1,1,0,0,0,0|1,0,1]=4 3646 B11R0.22 CCC(CNCCC(C)C)OC 269862a_100000731041_100000185833 [1,1,0,0,0,0|2,0,0]=4 3647 B11R0.22 CCC(COCCC(C)C)OC 34a_100011934954_100000210312 [1,1,0,0,0,0|2,0,0]=4 3648 B11R0.22 CCC(COCCC(C)C)OC 7a_100011934954_100000210626 [1,1,0,0,0,0|2,0,0]=4 3649 B11R0.22 CCC(COCCC(C)O)OC 34a_100011934954_100012276601 [1,1,0,0,0,0|2,0,0]=4 3650 B11R0.22 CCC(COCCC(C)O)OC 7a_100011934954_100012276601 [1,1,0,0,0,0|2,0,0]=4 3651 B11R0.22 COC(CCCNC(=O)C)OC 11a_100000034021_100015343762 [1,1,0,0,0,0|1,0,1]=4 3652 B11R0.22 COC(CCCNC(=O)C)OC 1626a_100000034021_100015343762 [1,1,0,0,0,0|1,0,1]=4 3653 B11R0.22 COC(CCCNC(=O)C)OC 240690a_100000034021_100015343762 [1,1,0,0,0,0|1,0,1]=4 3654 B11R0.22 COC(CCCNC(=O)C)OC 527a_100000034021_100103153847 [1,1,0,0,0,0|1,0,1]=4 3655 B11R0.22 COC(CCCNC(C)C)OC 2230a_100138425928_100000069011 [1,1,0,0,0,0|1,0,0]=3 3656 B11R0.22 COC(CCCNC(C)C)OC 34a_100138425928_100000069011 [1,1,0,0,0,0|1,0,0]=3 3657 B11R0.22 COC(CCCOC(C)C)OC 34a_100000212225_100000069011 [1,1,0,0,0,0|1,0,0]=3 3658 B11R0.22 COC(CCCSC(C)C)OC 62a_100000069011_100000210206 [1,1,0,0,0,0|1,0,0]=3 3659 B11R0.22 COC(CCCSC(C)C)OC 62a_100000210206_100000069011 [1,1,0,0,0,0|1,0,0]=3 3660 B11R0.22 COC(CCNCC(C)C)OC 2230a_100000210953_100009813347 [1,1,0,0,0,0|1,0,0]=3 3661 B11R0.22 COC(CCNCC(C)C)OC 34a_100000210953_100000139399 [1,1,0,0,0,0|1,0,0]=3 3662 B11R0.22 COC(CCNCC(C)O)OC 2230a_100000210904_100009813347 [1,1,0,0,0,0|1,0,0]=3 3663 B11R0.22 COC(CCNCC(C)O)OC 34a_100000210904_100000139399 [1,1,0,0,0,0|1,0,0]=3 3664 B11R0.22 COC(CCNCC(F)F)OC 34a_100000765723_100000139399 [1,1,0,0,0,0|2,0,0]=4 3665 B11R0.22 COC(CCOCC(=O)C)OC 34a_100000211253_100000139399 [1,1,0,0,0,0|1,0,1]=4 3666 B11R0.22 COC(CCOCC(C)Br)OC 34a_100012180447_100000139399 [1,1,0,0,0,0|1,0,0]=3 3667 B11R0.22 COC(CCOCC(C)C)OC 34a_100000210257_100000139399 [1,1,0,0,0,0|1,0,0]=3 3668 B11R0.22 COC(CCOCC(C)F)OC 34a_100015925927_100000139399 [1,1,0,0,0,0|1,0,0]=3 3669 B11R0.22 COC(CCOCC(F)F)OC 34a_100000743014_100000139399 [1,1,0,0,0,0|2,0,0]=4 3670 B11R0.22 COC(CCOC[C@@H](C)Cl)OC 34a_100016084084_100000139399 [1,1,0,0,0,0|1,0,0]=3 3671 B11R0.22 COC(CCOC[C@@H](C)N)OC 34a_100000737577_100000139399 [1,1,0,0,0,0|1,0,0]=3 3672 B11R0.22 COC(CCSCC(C)C)OC 62a_100000139399_100000210760 [1,1,0,0,0,0|1,0,0]=3 3673 B11R0.22 COC(CCSCC(C)C)OC 62a_100000210624_100000139399 [1,1,0,0,0,0|1,0,0]=3 3674 B11R0.22 COC(CCSCC(C)O)OC 62a_100000139399_100011218427 [1,1,0,0,0,0|1,0,0]=3 3675 B11R0.22 COC(CCSCC(C)O)OC 62a_100011218427_100000139399 [1,1,0,0,0,0|1,0,0]=3 3676 B11R0.22 COC(CCSCC(F)F)OC 62a_100000139399_100011934356 [1,1,0,0,0,0|2,0,0]=4 3677 B11R0.22 COC(CCSCC(F)F)OC 62a_100011934356_100000139399 [1,1,0,0,0,0|2,0,0]=4 3678 B11R0.22 COC(CCSC[C@@H](C)O)OC 62a_100000139399_100009817552 [1,1,0,0,0,0|1,0,0]=3 3679 B11R0.22 COC(CCSC[C@@H](C)O)OC 62a_100009817552_100000139399 [1,1,0,0,0,0|1,0,0]=3 3680 B11R0.22 COC(CNCCC(C)C)OC 270004a_100000210545_100000752162 [1,1,0,0,0,0|1,0,0]=3 3681 B11R0.22 COC(CNCCC(C)O)OC 2230a_200000755665_100000751394 [1,1,0,0,0,0|1,0,0]=3 3682 B11R0.22 COC(CNCCC(C)O)OC 270004a_200000755665_100000752162 [1,1,0,0,0,0|1,0,0]=3 3683 B11R0.22 COC(CNCCN(C)C)OC 270004a_100000210585_100000752162 [1,1,0,0,0,0|2,0,0]=4 3684 B11R0.22 COC(COCCC(=O)C)OC 34a_100000759926_100000211822 [1,1,0,0,0,0|1,0,1]=4 3685 B11R0.22 COC(COCCC(=O)C)OC 7a_100000759926_100000751394 [1,1,0,0,0,0|1,0,1]=4 3686 B11R0.22 COC(COCCC(C)Br)OC 34a_100009893172_100000211822 [1,1,0,0,0,0|1,0,0]=3 3687 B11R0.22 COC(COCCC(C)C)OC 34a_100000210254_100000211822 [1,1,0,0,0,0|1,0,0]=3 3688 B11R0.22 COC(COCCC(C)C)OC 34a_100011216393_100000210312 [1,1,0,0,0,0|1,0,0]=3 3689 B11R0.22 COC(COCCC(C)C)OC 7a_100000210254_100000751394 [1,1,0,0,0,0|1,0,0]=3 3690 B11R0.22 COC(COCCC(C)O)OC 34a_100011216393_100012276601 [1,1,0,0,0,0|1,0,0]=3 3691 B11R0.22 COC(COCCC(F)F)OC 34a_100103093639_100000211822 [1,1,0,0,0,0|2,0,0]=4 3692 B11R0.22 COC(COCC[C@@H](C)N)OC 34a_100000706166_100000211822 [1,1,0,0,0,0|1,0,0]=3 3693 B11R0.22 COC(COCOC(C)C)OC 34a_100011216393_100000709892 [1,1,0,0,0,0|2,0,0]=4 3694 B11R0.22 COC(CSCCC(=O)C)OC 62a_100000053229_100000751394 [1,1,0,0,0,0|1,0,1]=4 3695 B11R0.22 COC(CSCCC(=O)C)OC 62a_100000751394_100000053229 [1,1,0,0,0,0|1,0,1]=4 3696 B11R0.22 COC(CSCCC(C)C)OC 62a_100000210312_100000751394 [1,1,0,0,0,0|1,0,0]=3 3697 B11R0.22 COC(CSCCC(C)C)OC 62a_100000751394_100000210312 [1,1,0,0,0,0|1,0,0]=3 3698 B11R0.22 COC(CSCCC(C)O)OC 62a_100000751394_100012276601 [1,1,0,0,0,0|1,0,0]=3 3699 B11R0.22 COC(CSCCC(C)O)OC 62a_100012276601_100000751394 [1,1,0,0,0,0|1,0,0]=3 3700 B11R0.22 COC(CSCCN(C)C)OC 62a_100000751394_100000755713 [1,1,0,0,0,0|2,0,0]=4 3701 B11R0.22 COC(CSCOC(C)C)OC 62a_100000709892_100000751394 [1,1,0,0,0,0|2,0,0]=4 3702 B11R0.22 COC(CSCOC(C)C)OC 62a_100000751394_100000709892 [1,1,0,0,0,0|2,0,0]=4 3703 B11R0.72 CCCCC(=O)CC(OC)OC 1458a_100000082724_100000210211 [1,1,0,0,0,0|0,0,1]=3 3704 B11R0.72 CCCCC(=O)CC(OC)OC 1458a_100000210183_100000751394 [1,1,0,0,0,0|0,0,1]=3 3705 B11R0.72 CCCCN(C)CC(OC)OC 2230a_100000207549_100000751394 [1,1,0,0,0,0|1,0,0]=3 3706 B11R0.72 CCCCN(C)CC(OC)OC 269982a_100000225562_100000210211 [1,1,0,0,0,0|1,0,0]=3 3707 B11R0.72 CCCCN(C)CC(OC)OC 270004a_100000207549_100000752162 [1,1,0,0,0,0|1,0,0]=3 3708 B11R0.72 CCCNC(=O)CC(OC)OC 11a_100020643023_100000082724 [1,1,0,0,0,0|1,0,1]=4 3709 B11R0.72 CCCNC(=O)CC(OC)OC 1626a_100020643023_100000082724 [1,1,0,0,0,0|1,0,1]=4 3710 B11R0.72 CCCNC(=O)CC(OC)OC 240690a_100020643023_100000082724 [1,1,0,0,0,0|1,0,1]=4 3711 B11R0.72 CCCNC(=O)CC(OC)OC 527a_100020643023_100000082724 [1,1,0,0,0,0|1,0,1]=4 3712 B11R0.72 CCCNC(C)CC(OC)OC 270004a_100020643023_100000210484 [1,1,0,0,0,0|1,0,0]=3 3713 B11R0.72 CCCOC(C)CC(OC)OC 7a_100011018202_100000210303 [1,1,0,0,0,0|1,0,0]=3 3714 B11R0.72 CCOCC(=O)CC(OC)OC 1458a_100000211967_100000751394 [1,1,0,0,0,0|1,0,1]=4 3715 B11R0.72 CCOCN(C)CC(OC)OC 269982a_100000225562_100000739092 [1,1,0,0,0,0|2,0,0]=4 3716 B11R0.72 CCSCC(=O)CC(OC)OC 1458a_100000230394_100000751394 [1,1,0,0,0,0|1,0,1]=4 3717 B11R0.72 COC(CC(=O)CCCF)OC 1458a_100000082724_100011934791 [1,1,0,0,0,0|1,0,1]=4 3718 B11R0.72 COC(CC(=O)CCCO)OC 1458a_100000082724_100011215043 [1,1,0,0,0,0|1,0,1]=4 3719 B11R0.72 COC(CC(=O)CCSC)OC 1458a_100000082724_100000751147 [1,1,0,0,0,0|1,0,1]=4 3720 B11R0.72 COC(CC(=O)CCSC)OC 1458a_100000174002_100000751394 [1,1,0,0,0,0|1,0,1]=4 3721 B11R0.72 COC(CC(C)NCCO)OC 270004a_100000210304_100000210484 [1,1,0,0,0,0|2,0,0]=4 3722 B11R0.72 COC(CC(C)OCCF)OC 7a_100011018202_100011217306 [1,1,0,0,0,0|2,0,0]=4 3723 B11R0.72 COC(CC(C)OCCO)OC 7a_100011018202_100000211926 [1,1,0,0,0,0|2,0,0]=4 3724 B11R0.72 COC(CN(C)CCCF)OC 269982a_100000225562_100011934791 [1,1,0,0,0,0|2,0,0]=4 3725 B11R0.72 COC(CN(C)CCCO)OC 2230a_100000213112_100000751394 [1,1,0,0,0,0|2,0,0]=4 3726 B11R0.72 COC(CN(C)CCCO)OC 269982a_100000225562_100011215043 [1,1,0,0,0,0|2,0,0]=4 3727 B11R0.72 COC(CN(C)CCCO)OC 270004a_100000213112_100000752162 [1,1,0,0,0,0|2,0,0]=4 3728 B11R0.72 COC(CN(C)CCSC)OC 2230a_100000686725_100000751394 [1,1,0,0,0,0|2,0,0]=4 3729 B11R0.72 COC(CN(C)CCSC)OC 269982a_100000225562_100000212216 [1,1,0,0,0,0|2,0,0]=4 3730 B11R0.72 COC(CN(C)CCSC)OC 270004a_100000686725_100000752162 [1,1,0,0,0,0|2,0,0]=4 3731 B11R0.72 COCCC(=O)CC(OC)OC 1458a_100000082724_100000233755 [1,1,0,0,0,0|1,0,1]=4 3732 B11R0.72 COCCC(=O)CC(OC)OC 1458a_100000749529_100000751394 [1,1,0,0,0,0|1,0,1]=4 3733 B11R0.72 COCCN(C)CC(OC)OC 2230a_100000743101_100000751394 [1,1,0,0,0,0|2,0,0]=4 3734 B11R0.72 COCCN(C)CC(OC)OC 269982a_100000225562_100000233755 [1,1,0,0,0,0|2,0,0]=4 3735 B11R0.72 COCCN(C)CC(OC)OC 270004a_100000743101_100000752162 [1,1,0,0,0,0|2,0,0]=4 3736 B11R0.76 CCCCCCC(CC)N(C)C 270004a_100102631434_100011219640 [1,1,0,0,0,0|2,0,0]=4 3737 B11R0.157 CCCCCC(=O)C(CC)OC 1458a_100000747056_100000210326 [1,1,0,0,0,0|1,0,1]=4 3738 B11R0.157 CCCCCC(=O)C(OC)OC 1458a_100000046285_100000210326 [1,1,0,0,0,0|0,0,1]=3 3739 B11R0.157 CCCCNC(=O)C(OC)OC 11a_100000102301_100000046285 [1,1,0,0,0,0|1,0,1]=4 3740 B11R0.157 CCCCNC(=O)C(OC)OC 240690a_100000102301_100000046285 [1,1,0,0,0,0|1,0,1]=4 3741 B11R0.157 CCCCNC(=O)C(OC)OC 527a_100000102301_100000046285 [1,1,0,0,0,0|1,0,1]=4 3742 B11R0.157 CCCCNC(C)C(OC)OC 270004a_100000102301_100000211384 [1,1,0,0,0,0|1,0,0]=3 3743 B11R0.157 CCCCOC(C)C(OC)OC 34a_100000210227_100011222894 [1,1,0,0,0,0|1,0,0]=3 3744 B11R0.157 CCCCOC(C)C(OC)OC 34a_100000754440_100000210210 [1,1,0,0,0,0|1,0,0]=3 3745 B11R0.157 CCCCOC(C)C(OC)OC 7a_100000754440_100000210211 [1,1,0,0,0,0|1,0,0]=3 3746 B11R0.157 CCCCSC(C)C(OC)OC 62a_100000210211_100011222894 [1,1,0,0,0,0|1,0,0]=3 3747 B11R0.157 CCCCSC(C)C(OC)OC 62a_100011222894_100000210210 [1,1,0,0,0,0|1,0,0]=3 3748 B11R0.157 CCOCCC(=O)C(OC)OC 1458a_100000046285_100011215890 [1,1,0,0,0,0|1,0,1]=4 3749 B11R0.157 CCOCSC(C)C(OC)OC 62a_100000739092_100011222894 [1,1,0,0,0,0|2,0,0]=4 3750 B11R0.157 CCOCSC(C)C(OC)OC 62a_100011222894_100000739092 [1,1,0,0,0,0|2,0,0]=4 3751 B11R0.157 CCSCCC(=O)C(OC)OC 1458a_100000046285_100000757381 [1,1,0,0,0,0|1,0,1]=4 3752 B11R0.157 COC(OC)C(=O)CCCCF 1458a_100000046285_100000729493 [1,1,0,0,0,0|1,0,1]=4 3753 B11R0.157 COC(OC)C(=O)CCCCO 1458a_100000046285_100000210776 [1,1,0,0,0,0|1,0,1]=4 3754 B11R0.157 COC(OC)C(C)NCCCF 270004a_100015189416_100000211384 [1,1,0,0,0,0|2,0,0]=4 3755 B11R0.157 COC(OC)C(C)NCCCF 34a_100015189416_100011222894 [1,1,0,0,0,0|2,0,0]=4 3756 B11R0.157 COC(OC)C(C)NCCCO 270004a_100000182051_100000211384 [1,1,0,0,0,0|2,0,0]=4 3757 B11R0.157 COC(OC)C(C)NCCSC 270004a_100020590264_100000211384 [1,1,0,0,0,0|2,0,0]=4 3758 B11R0.157 COC(OC)C(C)OCCCBr 34a_100011217188_100011222894 [1,1,0,0,0,0|2,0,0]=4 3759 B11R0.157 COC(OC)C(C)OCCCCl 34a_100000230001_100011222894 [1,1,0,0,0,0|2,0,0]=4 3760 B11R0.157 COC(OC)C(C)OCCCF 34a_100000754440_100011934791 [1,1,0,0,0,0|2,0,0]=4 3761 B11R0.157 COC(OC)C(C)OCCCF 34a_100000759539_100011222894 [1,1,0,0,0,0|2,0,0]=4 3762 B11R0.157 COC(OC)C(C)OCCCF 7a_100000754440_100011934791 [1,1,0,0,0,0|2,0,0]=4 3763 B11R0.157 COC(OC)C(C)OCCCN 34a_100000182051_100011222894 [1,1,0,0,0,0|2,0,0]=4 3764 B11R0.157 COC(OC)C(C)OCCCO 34a_100000754440_100000230001 [1,1,0,0,0,0|2,0,0]=4 3765 B11R0.157 COC(OC)C(C)OCCCO 7a_100000754440_100011215043 [1,1,0,0,0,0|2,0,0]=4 3766 B11R0.157 COC(OC)C(C)OCCSC 34a_100000230434_100011222894 [1,1,0,0,0,0|2,0,0]=4 3767 B11R0.157 COC(OC)C(C)OCCSC 34a_100000754440_100000212216 [1,1,0,0,0,0|2,0,0]=4 3768 B11R0.157 COC(OC)C(C)OCCSC 7a_100000754440_100000212216 [1,1,0,0,0,0|2,0,0]=4 3769 B11R0.157 COC(OC)C(C)SCCCF 62a_100011222894_100011934791 [1,1,0,0,0,0|2,0,0]=4 3770 B11R0.157 COC(OC)C(C)SCCCF 62a_100011934791_100011222894 [1,1,0,0,0,0|2,0,0]=4 3771 B11R0.157 COC(OC)C(C)SCCCO 62a_100011215043_100011222894 [1,1,0,0,0,0|2,0,0]=4 3772 B11R0.157 COC(OC)C(C)SCCCO 62a_100011222894_100011215043 [1,1,0,0,0,0|2,0,0]=4 3773 B11R0.157 COC(OC)C(C)SCCSC 62a_100000212216_100011222894 [1,1,0,0,0,0|2,0,0]=4 3774 B11R0.157 COC(OC)C(C)SCCSC 62a_100011222894_100000751147 [1,1,0,0,0,0|2,0,0]=4 3775 B11R0.157 COCCCC(=O)C(OC)OC 1458a_100000046285_100000740836 [1,1,0,0,0,0|1,0,1]=4 3776 B11R0.157 COCCNC(C)C(OC)OC 270004a_100000209980_100000211384 [1,1,0,0,0,0|2,0,0]=4 3777 B11R0.157 COCCOC(C)C(OC)OC 34a_100000210237_100011222894 [1,1,0,0,0,0|2,0,0]=4 3778 B11R0.157 COCCOC(C)C(OC)OC 34a_100000754440_100011201679 [1,1,0,0,0,0|2,0,0]=4 3779 B11R0.157 COCCOC(C)C(OC)OC 7a_100000754440_100000233755 [1,1,0,0,0,0|2,0,0]=4 3780 B11R0.157 COCCSC(C)C(OC)OC 62a_100000233755_100011222894 [1,1,0,0,0,0|2,0,0]=4 3781 B11R0.157 COCCSC(C)C(OC)OC 62a_100011222894_100000233755 [1,1,0,0,0,0|2,0,0]=4 3782 B11R0.161 C=CC(CCCCCC)OCC 34a_200011215977_100000210202 [1,1,0,0,0,0|1,0,1]=4 3783 B11R0.161 C=CC(CCCCCC)OCC 7a_200011215977_100000210202 [1,1,0,0,0,0|1,0,1]=4 3784 B11R0.161 C=CC(CCCCCC)OCF 34a_200011215977_100015361967 [1,1,0,0,0,0|1,0,1]=4 3785 B11R0.161 C=CC(CCCCCC)OCF 7a_200011215977_100015361967 [1,1,0,0,0,0|1,0,1]=4 3786 B11R0.161 CCCCCCC(CC)NCC 270004a_100015525214_100011219640 [1,1,0,0,0,0|2,0,0]=4 3787 B11R0.161 CCCCCCC(CC)OCC 34a_100011215785_100000210202 [1,1,0,0,0,0|1,0,0]=3 3788 B11R0.161 CCCCCCC(CC)OCC 7a_100011215785_100000210202 [1,1,0,0,0,0|1,0,0]=3 3789 B11R0.161 CCCCCCC(CC)OCF 34a_100011215785_100015361967 [1,1,0,0,0,0|1,0,0]=3 3790 B11R0.161 CCCCCCC(CC)OCF 7a_100011215785_100015361967 [1,1,0,0,0,0|1,0,0]=3 3791 B11R0.161 CCCCCCC(CCC)NC 270004a_106832991635_200011215359 [1,1,0,0,0,0|2,0,0]=4 3792 B11R0.161 CCCCCCC(CCC)OC 34a_200011215193_200000210301 [1,1,0,0,0,0|1,0,0]=3 3793 B11R0.161 CCCCCCC(CCC)OC 7a_200011215193_200000210301 [1,1,0,0,0,0|1,0,0]=3 3794 B11R0.161 CCCCCCC(CCC)O[13CH3] 34a_200011215193_200025704644 [1,1,0,0,0,0|1,0,0]=3 3795 B11R0.161 CCCCCCC(CCC)O[13CH3] 7a_200011215193_200025704644 [1,1,0,0,0,0|1,0,0]=3 3796 B11R0.161 CCCCCNC(CC)COC 2230a_100000757820_100000210326 [1,1,0,0,0,0|2,0,0]=4 3797 B11R0.161 CCCCCNC(CC)COC 270004a_100000209983_100000757811 [1,1,0,0,0,0|2,0,0]=4 3798 B11R0.161 CCCCCOC(CC)COC 7a_200011214946_100000210326 [1,1,0,0,0,0|2,0,0]=4 3799 B11R0.161 CCCCNCC(CC)OCC 2230a_100015183923_100000210211 [1,1,0,0,0,0|2,0,0]=4 3800 B11R0.161 CCCCNCC(CC)OCC 34a_100015183923_100000210210 [1,1,0,0,0,0|2,0,0]=4 3801 B11R0.200 CCC(=O)CCCC(OC)OC 1458a_100000210414_100000069011 [1,1,0,0,0,0|0,0,1]=3 3802 B11R0.200 CCC(=O)COCC(OC)OC 34a_100000725409_100000211822 [1,1,0,0,0,0|1,0,1]=4 3803 B11R0.200 CCC(=O)CSCC(OC)OC 62a_100000747405_100000751394 [1,1,0,0,0,0|1,0,1]=4 3804 B11R0.200 CCC(=O)CSCC(OC)OC 62a_100000751394_100000747405 [1,1,0,0,0,0|1,0,1]=4 3805 B11R0.200 CCC(C)CNCC(CC)OC 270004a_100000731041_100000243153 [1,1,0,0,0,0|2,0,0]=4 3806 B11R0.200 CCC(C)CNCC(OC)OC 2230a_100020588543_100000751394 [1,1,0,0,0,0|1,0,0]=3 3807 B11R0.200 CCC(C)CNCC(OC)OC 270004a_100000210479_100000243153 [1,1,0,0,0,0|1,0,0]=3 3808 B11R0.200 CCC(C)CNCC(OC)OC 270004a_100020588543_100000752162 [1,1,0,0,0,0|1,0,0]=3 3809 B11R0.200 CCC(C)COCC(CC)OC 34a_100011934954_100000748023 [1,1,0,0,0,0|2,0,0]=4 3810 B11R0.200 CCC(C)COCC(CC)OC 7a_100011934954_100000748023 [1,1,0,0,0,0|2,0,0]=4 3811 B11R0.200 CCC(C)COCC(OC)OC 34a_100011216393_100000748023 [1,1,0,0,0,0|1,0,0]=3 3812 B11R0.200 CCC(C)CSCC(OC)OC 62a_100000748023_100000751394 [1,1,0,0,0,0|1,0,0]=3 3813 B11R0.200 CCC(C)CSCC(OC)OC 62a_100000751394_100000748023 [1,1,0,0,0,0|1,0,0]=3 3814 B11R0.200 CCC(C)NCCC(OC)OC 2230a_100000209981_100009813347 [1,1,0,0,0,0|1,0,0]=3 3815 B11R0.200 CCC(C)OCCC(OC)OC 7a_100000210228_100009813347 [1,1,0,0,0,0|1,0,0]=3 3816 B11R0.200 CCC(C)SCCC(OC)OC 62a_100000139399_100000758301 [1,1,0,0,0,0|1,0,0]=3 3817 B11R0.200 CCC(C)SCCC(OC)OC 62a_100000758301_100000139399 [1,1,0,0,0,0|1,0,0]=3 3818 B11R0.200 CCC(COC[C@@H](C)CC)OC 34a_100011934954_100009816398 [1,1,0,0,0,0|2,0,0]=4 3819 B11R0.200 CCC(COC[C@@H](C)CC)OC 7a_100011934954_100009816398 [1,1,0,0,0,0|2,0,0]=4 3820 B11R0.200 CCC(O)CNCC(OC)OC 2230a_100011218483_100000751394 [1,1,0,0,0,0|1,0,0]=3 3821 B11R0.200 CCC(O)CNCC(OC)OC 270004a_100011218483_100000752162 [1,1,0,0,0,0|1,0,0]=3 3822 B11R0.200 CCC(O)COCC(CC)OC 34a_100011934954_100011218378 [1,1,0,0,0,0|2,0,0]=4 3823 B11R0.200 CCC(O)COCC(CC)OC 7a_100011934954_100011218378 [1,1,0,0,0,0|2,0,0]=4 3824 B11R0.200 CCC(O)COCC(OC)OC 34a_100011216393_100011218378 [1,1,0,0,0,0|1,0,0]=3 3825 B11R0.200 CCC(O)CSCC(OC)OC 62a_100000751394_100011218378 [1,1,0,0,0,0|1,0,0]=3 3826 B11R0.200 CCC(O)CSCC(OC)OC 62a_100011218378_100000751394 [1,1,0,0,0,0|1,0,0]=3 3827 B11R0.200 CCN(C)CCCC(OC)OC 2230a_100000225621_100000069011 [1,1,0,0,0,0|1,0,0]=3 3828 B11R0.200 CCN(C)CCCC(OC)OC 269982a_100000225621_100000069011 [1,1,0,0,0,0|1,0,0]=3 3829 B11R0.200 CC[C@H](C)COCC(OC)OC 34a_100011216393_100009816398 [1,1,0,0,0,0|1,0,0]=3 3830 B11R0.200 CC[C@H](C)COCC(OC)OC 7a_100009816381_100000751394 [1,1,0,0,0,0|1,0,0]=3 3831 B11R0.200 CC[C@H](C)CSCC(OC)OC 62a_100000751394_100009816398 [1,1,0,0,0,0|1,0,0]=3 3832 B11R0.200 CC[C@H](C)CSCC(OC)OC 62a_100009816398_100000751394 [1,1,0,0,0,0|1,0,0]=3 3833 B11R0.200 COC(C)COCC(OC)OC 34a_100000690652_100000211822 [1,1,0,0,0,0|2,0,0]=4 3834 B11R0.200 COC(CCCC(=O)CO)OC 1458a_100000210174_100000069011 [1,1,0,0,0,0|1,0,1]=4 3835 B11R0.200 COC(CCN[C@H](C)CO)OC 2230a_100000737577_100009813347 [1,1,0,0,0,0|2,0,0]=4 3836 B11R0.200 COC(CCOC(C)CF)OC 34a_100016041109_100000139399 [1,1,0,0,0,0|2,0,0]=4 3837 B11R0.200 COC(CCOC(C)CF)OC 7a_100016041109_100009813347 [1,1,0,0,0,0|2,0,0]=4 3838 B11R0.200 COC(CCOC(C)CN)OC 34a_100000210904_100000139399 [1,1,0,0,0,0|2,0,0]=4 3839 B11R0.200 COC(CCSC(C)CO)OC 62a_100012180447_100000139399 [1,1,0,0,0,0|2,0,0]=4 3840 B11R0.200 COC(CCSC(C)OC)OC 62a_100000139399_100009879195 [1,1,0,0,0,0|2,0,0]=4 3841 B11R0.200 COC(CCSC(C)OC)OC 62a_100009879195_100000139399 [1,1,0,0,0,0|2,0,0]=4 3842 B11R0.200 COC(CCS[C@H](C)CO)OC 62a_100000139399_100016084084 [1,1,0,0,0,0|2,0,0]=4 3843 B11R0.200 COC(CCS[C@H](C)CO)OC 62a_100016084084_100000139399 [1,1,0,0,0,0|2,0,0]=4 3844 B11R0.200 COC(CNCC(C)CO)OC 34a_100000744482_100000211822 [1,1,0,0,0,0|2,0,0]=4 3845 B11R0.200 COC(CNC[C@@H](C)OC)OC 2230a_100020591295_100000751394 [1,1,0,0,0,0|2,0,0]=4 3846 B11R0.200 COC(CNC[C@@H](C)OC)OC 270004a_100020591295_100000752162 [1,1,0,0,0,0|2,0,0]=4 3847 B11R0.200 COC(CNC[C@@H](F)CO)OC 270004a_100015665980_100000752162 [1,1,0,0,0,0|2,0,0]=4 3848 B11R0.200 COC(CNC[C@@H](F)CO)OC 34a_100015665980_100000211822 [1,1,0,0,0,0|2,0,0]=4 3849 B11R0.200 COC(CNC[C@H](O)CO)OC 2230a_100020644852_100000751394 [1,1,0,0,0,0|2,0,0]=4 3850 B11R0.200 COC(COCC(C)CN)OC 34a_100000744482_100000211822 [1,1,0,0,0,0|2,0,0]=4 3851 B11R0.200 COC(COCC(Cl)CCl)OC 34a_100000033668_100000211822 [1,1,0,0,0,0|2,0,0]=4 3852 B11R0.200 COC(COCC(O)CO)OC 34a_100011216393_100011219619 [1,1,0,0,0,0|2,0,0]=4 3853 B11R0.200 COC(COC[C@@H](C)CO)OC 34a_100011216393_100000059175 [1,1,0,0,0,0|2,0,0]=4 3854 B11R0.200 COC(COC[C@@H](O)CF)OC 34a_100011216393_100015614560 [1,1,0,0,0,0|2,0,0]=4 3855 B11R0.200 COC(COC[C@@H](O)CO)OC 34a_100011216393_100009815848 [1,1,0,0,0,0|2,0,0]=4 3856 B11R0.200 COC(COC[C@H](F)CN)OC 34a_100015665980_100000211822 [1,1,0,0,0,0|2,0,0]=4 3857 B11R0.200 COC(CSCC(O)CO)OC 62a_100000751394_100011219619 [1,1,0,0,0,0|2,0,0]=4 3858 B11R0.200 COC(CSCC(O)CO)OC 62a_100011219619_100000751394 [1,1,0,0,0,0|2,0,0]=4 3859 B11R0.200 COC(CSC[C@@H](C)CO)OC 62a_100000059175_100000751394 [1,1,0,0,0,0|2,0,0]=4 3860 B11R0.200 COC(CSC[C@@H](C)CO)OC 62a_100000751394_100000059175 [1,1,0,0,0,0|2,0,0]=4 3861 B11R0.200 COC(CSC[C@@H](O)CF)OC 62a_100000751394_100015614560 [1,1,0,0,0,0|2,0,0]=4 3862 B11R0.200 COC(CSC[C@@H](O)CF)OC 62a_100015614560_100000751394 [1,1,0,0,0,0|2,0,0]=4 3863 B11R0.200 COC(CSC[C@@H](O)CO)OC 62a_100000751394_100009815848 [1,1,0,0,0,0|2,0,0]=4 3864 B11R0.200 COC(CSC[C@@H](O)CO)OC 62a_100009815848_100000751394 [1,1,0,0,0,0|2,0,0]=4 3865 B11R0.305 C#CC(C)(CCCCCC)OC 34a_200000042405_200000210301 [1,1,0,0,0,0|1,0,1]=4 3866 B11R0.305 C#CC(C)(CCCCCC)OC 7a_200000042405_200000210301 [1,1,0,0,0,0|1,0,1]=4 3867 B11R0.305 C#CC(C)(CCCCCC)O[13CH3] 34a_200000042405_200025704644 [1,1,0,0,0,0|1,0,1]=4 3868 B11R0.305 C#CC(C)(CCCCCC)O[13CH3] 7a_200000042405_200025704644 [1,1,0,0,0,0|1,0,1]=4 3869 B11R0.305 CCCCNCC(C)(OC)OC 2230a_100000102301_100000064154 [1,1,0,0,0,0|1,0,0]=3 3870 B11R0.305 CCCCNCC(C)(OC)OC 2230a_100000732740_100000210211 [1,1,0,0,0,0|1,0,0]=3 3871 B11R0.305 CCCCOCC(C)(OC)OC 34a_100000210227_100000766008 [1,1,0,0,0,0|1,0,0]=3 3872 B11R0.305 CCCCOCP(=O)(OC)OC 34a_100000101693_100000210210 [1,1,0,0,0,0|2,0,0]=4 3873 B11R0.305 CCCCSCC(C)(OC)OC 62a_100000210211_100000766008 [1,1,0,0,0,0|1,0,0]=3 3874 B11R0.305 CCCCSCC(C)(OC)OC 62a_100000766008_100000210210 [1,1,0,0,0,0|1,0,0]=3 3875 B11R0.305 CCCCSC[Si](C)(OC)OC 62a_100000067953_100000210210 [1,1,0,0,0,0|1,1,0]=4 3876 B11R0.305 CCCCSC[Si](C)(OC)OC 62a_100000210211_100000067953 [1,1,0,0,0,0|1,1,0]=4 3877 B11R0.305 CCCOCCP(=O)(OC)OC 34a_200000043213_100000210303 [1,1,0,0,0,0|2,0,0]=4 3878 B11R0.305 CCOCCC[Si](C)(OC)OC 34a_100121572206_100000031653 [1,1,0,0,0,0|1,1,0]=4 3879 B11R0.305 CCOCSCC(C)(OC)OC 62a_100000739092_100000766008 [1,1,0,0,0,0|2,0,0]=4 3880 B11R0.305 CCOCSCC(C)(OC)OC 62a_100000766008_100000739092 [1,1,0,0,0,0|2,0,0]=4 3881 B11R0.305 CCSCCC[Si](C)(OC)OC 62a_100000031653_100000210202 [1,1,0,0,0,0|1,1,0]=4 3882 B11R0.305 CCSCCC[Si](C)(OC)OC 62a_100000210202_100000031653 [1,1,0,0,0,0|1,1,0]=4 3883 B11R0.305 COC(C)(CNCCCF)OC 2230a_100000732740_100011934791 [1,1,0,0,0,0|2,0,0]=4 3884 B11R0.305 COC(C)(CNCCCF)OC 2230a_100015189416_100000064154 [1,1,0,0,0,0|2,0,0]=4 3885 B11R0.305 COC(C)(CNCCCF)OC 34a_100015189416_100000766008 [1,1,0,0,0,0|2,0,0]=4 3886 B11R0.305 COC(C)(CNCCCO)OC 2230a_100000732740_100000230001 [1,1,0,0,0,0|2,0,0]=4 3887 B11R0.305 COC(C)(CNCCSC)OC 2230a_100000732740_100000751147 [1,1,0,0,0,0|2,0,0]=4 3888 B11R0.305 COC(C)(CNCCSC)OC 2230a_100020590264_100000064154 [1,1,0,0,0,0|2,0,0]=4 3889 B11R0.305 COC(C)(COCCCBr)OC 34a_100011217188_100000766008 [1,1,0,0,0,0|2,0,0]=4 3890 B11R0.305 COC(C)(COCCCCl)OC 34a_100000230001_100000766008 [1,1,0,0,0,0|2,0,0]=4 3891 B11R0.305 COC(C)(COCCCF)OC 34a_100000759539_100000766008 [1,1,0,0,0,0|2,0,0]=4 3892 B11R0.305 COC(C)(COCCCN)OC 34a_100000182051_100000766008 [1,1,0,0,0,0|2,0,0]=4 3893 B11R0.305 COC(C)(COCCSC)OC 34a_100000230434_100000766008 [1,1,0,0,0,0|2,0,0]=4 3894 B11R0.305 COC(C)(CSCCCF)OC 62a_100000766008_100011934791 [1,1,0,0,0,0|2,0,0]=4 3895 B11R0.305 COC(C)(CSCCCF)OC 62a_100011934791_100000766008 [1,1,0,0,0,0|2,0,0]=4 3896 B11R0.305 COC(C)(CSCCCO)OC 62a_100000766008_100011215043 [1,1,0,0,0,0|2,0,0]=4 3897 B11R0.305 COC(C)(CSCCCO)OC 62a_100011215043_100000766008 [1,1,0,0,0,0|2,0,0]=4 3898 B11R0.305 COC(C)(CSCCSC)OC 62a_100000212216_100000766008 [1,1,0,0,0,0|2,0,0]=4 3899 B11R0.305 COC(C)(CSCCSC)OC 62a_100000766008_100000751147 [1,1,0,0,0,0|2,0,0]=4 3900 B11R0.305 COCCNCC(C)(OC)OC 2230a_100000209980_100000064154 [1,1,0,0,0,0|2,0,0]=4 3901 B11R0.305 COCCNCC(C)(OC)OC 2230a_100000732740_100011201679 [1,1,0,0,0,0|2,0,0]=4 3902 B11R0.305 COCCOCC(C)(OC)OC 34a_100000210237_100000766008 [1,1,0,0,0,0|2,0,0]=4 3903 B11R0.305 COCCSCC(C)(OC)OC 62a_100000233755_100000766008 [1,1,0,0,0,0|2,0,0]=4 3904 B11R0.305 COCCSCC(C)(OC)OC 62a_100000766008_100000233755 [1,1,0,0,0,0|2,0,0]=4 3905 B11R0.4 C/C=C/C(C)OCCCCCC 34a_200102604097_100000210314 [1,1,0,0,0,0|2,0,0]=4 3906 B11R0.4 CC#CC(C)OCCCCCC 34a_100011216543_100000210314 [1,1,0,0,0,0|2,0,0]=4 3907 B11R0.4 CCCCCCCC(=O)COC 1458a_100000210968_100000210614 [1,1,0,0,0,0|0,0,2]=4 3908 B11R0.4 CCCCCCCC(C)NCC 2230a_100015525214_200011218727 [1,1,0,0,0,0|1,0,0]=3 3909 B11R0.4 CCCCCCCC(C)NCC 270004a_100015525214_100000210596 [1,1,0,0,0,0|1,0,0]=3 3910 B11R0.4 CCCCCCCC(C)OCC 34a_100121572206_200011218727 [1,1,0,0,0,0|0,0,0]=2 3911 B11R0.4 CCCCCCCC(C)OCC 34a_200011215852_100000210202 [1,1,0,0,0,0|0,0,0]=2 3912 B11R0.4 CCCCCCCC(C)OCC 7a_200011215852_100000210202 [1,1,0,0,0,0|0,0,0]=2 3913 B11R0.4 CCCCCCCC(C)OCF 34a_200011215852_100015361967 [1,1,0,0,0,0|0,0,0]=2 3914 B11R0.4 CCCCCCCC(C)OCF 7a_200011215852_100015361967 [1,1,0,0,0,0|0,0,0]=2 3915 B11R0.4 CCCCCCCC(C)SCC 62a_100000210202_200011218727 [1,1,0,0,0,0|0,1,0]=3 3916 B11R0.4 CCCCCCCC(C)SCC 62a_200011218727_100000210202 [1,1,0,0,0,0|0,1,0]=3 3917 B11R0.4 CCCCCCCC(C)SCF 62a_100015361967_200011218727 [1,1,0,0,0,0|0,1,0]=3 3918 B11R0.4 CCCCCCCC(C)SCF 62a_200011218727_100015361967 [1,1,0,0,0,0|0,1,0]=3 3919 B11R0.4 CCCCCCCN(C)CCC 2230a_100000228206_100000210303 [1,1,0,0,0,0|2,0,0]=4 3920 B11R0.4 CCCCCCCN(C)CCC 2230a_100000747261_100000210681 [1,1,0,0,0,0|2,0,0]=4 3921 B11R0.4 CCCCCCCN(C)CCC 269982a_100000228206_100000210303 [1,1,0,0,0,0|2,0,0]=4 3922 B11R0.4 CCCCCCCN(C)CCC 269982a_100000747261_100000210681 [1,1,0,0,0,0|2,0,0]=4 3923 B11R0.4 CCCCCCCN(C)CCF 2230a_100000228206_100011217306 [1,1,0,0,0,0|2,0,0]=4 3924 B11R0.4 CCCCCCCN(C)CCF 269982a_100000228206_100011217306 [1,1,0,0,0,0|2,0,0]=4 3925 B11R0.4 CCCCCCCN(C)CCO 2230a_100000210263_100000210681 [1,1,0,0,0,0|2,0,0]=4 3926 B11R0.4 CCCCCCCN(C)CCO 2230a_100000228206_100000211926 [1,1,0,0,0,0|2,0,0]=4 3927 B11R0.4 CCCCCCCN(C)CCO 269982a_100000210263_100000210681 [1,1,0,0,0,0|2,0,0]=4 3928 B11R0.4 CCCCCCCN(C)CCO 269982a_100000228206_100000211926 [1,1,0,0,0,0|2,0,0]=4 3929 B11R0.4 CCCCCCCN(C)COC 2230a_100000228206_100000766300 [1,1,0,0,0,0|1,0,0]=3 3930 B11R0.4 CCCCCCCN(C)COC 269982a_100000228206_100000766300 [1,1,0,0,0,0|1,0,0]=3 3931 B11R0.4 CCCCCCCN(C)CSC 2230a_100000228206_100011218213 [1,1,0,0,0,0|1,1,0]=4 3932 B11R0.4 CCCCCCCN(C)CSC 269982a_100000228206_100011218213 [1,1,0,0,0,0|1,1,0]=4 3933 B11R0.4 CCCCCCNC(C)CCC 2230a_100000210581_100000766640 [1,1,0,0,0,0|2,0,0]=4 3934 B11R0.4 CCCCCCNC(C)CCC 2230a_100000741246_100000210314 [1,1,0,0,0,0|2,0,0]=4 3935 B11R0.4 CCCCCCNC(C)CCC 270004a_100000210581_100000211909 [1,1,0,0,0,0|2,0,0]=4 3936 B11R0.4 CCCCCCNC(C)CCO 2230a_100000210581_100009893172 [1,1,0,0,0,0|2,0,0]=4 3937 B11R0.4 CCCCCCNC(C)COC 2230a_100000210581_100000765312 [1,1,0,0,0,0|1,0,0]=3 3938 B11R0.4 CCCCCCNC(C)COC 270004a_100000210581_100000749346 [1,1,0,0,0,0|1,0,0]=3 3939 B11R0.4 CCCCCCNC(C)CSC 270004a_100000210581_100011216314 [1,1,0,0,0,0|1,1,0]=4 3940 B11R0.4 CCCCCCN[C@H](C)CCO 2230a_100000706166_100000210314 [1,1,0,0,0,0|2,0,0]=4 3941 B11R0.4 CCCCCCN[C@H](C)CCO 34a_100000706166_100000210314 [1,1,0,0,0,0|2,0,0]=4 3942 B11R0.4 CCCCCCN[C@H](C)COC 2230a_100000764878_100000210314 [1,1,0,0,0,0|1,0,0]=3 3943 B11R0.4 CCCCCCOC(C)CCBr 34a_100012276601_100000210314 [1,1,0,0,0,0|2,0,0]=4 3944 B11R0.4 CCCCCCOC(C)CCC 34a_100000210259_100000766640 [1,1,0,0,0,0|2,0,0]=4 3945 B11R0.4 CCCCCCOC(C)CCC 34a_100000764384_100000210314 [1,1,0,0,0,0|2,0,0]=4 3946 B11R0.4 CCCCCCOC(C)CCC 7a_100000210259_100000766640 [1,1,0,0,0,0|2,0,0]=4 3947 B11R0.4 CCCCCCOC(C)CCC 7a_100000764384_100000210314 [1,1,0,0,0,0|2,0,0]=4 3948 B11R0.4 CCCCCCOC(C)CCO 34a_100000210259_100009893172 [1,1,0,0,0,0|2,0,0]=4 3949 B11R0.4 CCCCCCOC(C)CCO 7a_100000210259_100009893172 [1,1,0,0,0,0|2,0,0]=4 3950 B11R0.4 CCCCCCOC(C)COC 34a_100000210259_100000765312 [1,1,0,0,0,0|1,0,0]=3 3951 B11R0.4 CCCCCCOC(C)COC 7a_100000210259_100000765312 [1,1,0,0,0,0|1,0,0]=3 3952 B11R0.4 CCCCCCO[C@H](C)COC 34a_100011934205_100000210314 [1,1,0,0,0,0|1,0,0]=3 3953 B11R0.4 CCCCCCSC(C)CCC 62a_100000210314_100000766640 [1,1,0,0,0,0|2,0,0]=4 3954 B11R0.4 CCCCCCSC(C)CCC 62a_100000766640_100000210757 [1,1,0,0,0,0|2,0,0]=4 3955 B11R0.4 CCCCCCSC(C)CCO 62a_100000210314_100009893172 [1,1,0,0,0,0|2,0,0]=4 3956 B11R0.4 CCCCCCSC(C)CCO 62a_100009893172_100000210757 [1,1,0,0,0,0|2,0,0]=4 3957 B11R0.4 CCCCCCSC(C)COC 62a_100000210314_100000765312 [1,1,0,0,0,0|1,0,0]=3 3958 B11R0.4 CCCCCCSC(C)COC 62a_100000765312_100000210757 [1,1,0,0,0,0|1,0,0]=3 3959 B11R0.4 CCCCCNCC(C)CCC 2230a_100000209983_100011216630 [1,1,0,0,0,0|2,0,0]=4 3960 B11R0.4 CCCCCNCC(C)CCC 270004a_100000209983_100000243154 [1,1,0,0,0,0|2,0,0]=4 3961 B11R0.4 CCCCCNCC(O)COC 2230a_100000756049_100000210326 [1,1,0,0,0,0|1,0,0]=3 3962 B11R0.4 CCCCCNCC(O)COC 34a_100000756049_100000718602 [1,1,0,0,0,0|1,0,0]=3 3963 B11R0.4 CCCCCOCC(C)CCC 34a_100000210253_100011216630 [1,1,0,0,0,0|2,0,0]=4 3964 B11R0.4 CCCCCOCC(C)CCC 34a_100000688023_100000718602 [1,1,0,0,0,0|2,0,0]=4 3965 B11R0.4 CCCCCOCC(C)CCC 7a_100000210253_100011216630 [1,1,0,0,0,0|2,0,0]=4 3966 B11R0.4 CCCCCOCC(C)CCC 7a_100000688023_100000210326 [1,1,0,0,0,0|2,0,0]=4 3967 B11R0.4 CCCCCOCC(C)CCN 34a_106354213184_100000718602 [1,1,0,0,0,0|2,0,0]=4 3968 B11R0.4 CCCCCOCC(N)COC 34a_100000724102_100000718602 [1,1,0,0,0,0|2,0,0]=4 3969 B11R0.4 CCCCCOCC(O)COC 34a_100000210253_100011215053 [1,1,0,0,0,0|1,0,0]=3 3970 B11R0.4 CCCCCOCC(O)COC 7a_100000210253_100011215053 [1,1,0,0,0,0|1,0,0]=3 3971 B11R0.4 CCCCCSCC(C)CCC 62a_100000210326_100011216630 [1,1,0,0,0,0|2,0,0]=4 3972 B11R0.4 CCCCCSCC(C)CCC 62a_100011216630_100000210326 [1,1,0,0,0,0|2,0,0]=4 3973 B11R0.4 CCCCCSCC(O)COC 62a_100000210326_100011215053 [1,1,0,0,0,0|1,0,0]=3 3974 B11R0.4 CCCCCSCC(O)COC 62a_100011215053_100000210326 [1,1,0,0,0,0|1,0,0]=3 3975 B11R0.4 CCCCOCCC(C)CCC 34a_100011217855_100000210210 [1,1,0,0,0,0|2,0,0]=4 3976 B11R0.4 CCCCOCCC(C)CCC 7a_100011217855_100000210211 [1,1,0,0,0,0|2,0,0]=4 3977 B11R0.4 CCCCOCN[C@H](C)COC 2230a_100000764878_100011995733 [1,1,0,0,0,0|2,0,0]=4 3978 B11R0.4 CCCCOCO[C@H](C)COC 34a_100011934205_100011995733 [1,1,0,0,0,0|2,0,0]=4 3979 B11R0.4 CCCCOCSC(C)COC 62a_100000765312_100011995733 [1,1,0,0,0,0|2,0,0]=4 3980 B11R0.4 CCCCOCSC(C)COC 62a_100011995733_100000765312 [1,1,0,0,0,0|2,0,0]=4 3981 B11R0.4 CCCOCCCC(C)CCC 34a_100011713154_100000210303 [1,1,0,0,0,0|2,0,0]=4 3982 B11R0.4 CCCOCCCC(C)CCC 7a_100011713154_100000210303 [1,1,0,0,0,0|2,0,0]=4 3983 B11R0.4 CCCOCCNC(C)COC 2230a_100161115042_100000765312 [1,1,0,0,0,0|2,0,0]=4 3984 B11R0.4 CCCOCCNC(C)COC 270004a_100161115042_100000749346 [1,1,0,0,0,0|2,0,0]=4 3985 B11R0.4 CCCOCCNC(C)COC 34a_100161115042_100000765312 [1,1,0,0,0,0|2,0,0]=4 3986 B11R0.4 CCCOCCN[C@H](C)COC 2230a_100000764878_100011215938 [1,1,0,0,0,0|2,0,0]=4 3987 B11R0.4 CCCOCCOC(C)COC 34a_100000752267_100000765312 [1,1,0,0,0,0|2,0,0]=4 3988 B11R0.4 CCCOCCOC(C)COC 7a_100000752267_100000765312 [1,1,0,0,0,0|2,0,0]=4 3989 B11R0.4 CCCOCCO[C@H](C)COC 34a_100011934205_100011215938 [1,1,0,0,0,0|2,0,0]=4 3990 B11R0.4 CCCOCCSC(C)COC 62a_100000765312_100011215938 [1,1,0,0,0,0|2,0,0]=4 3991 B11R0.4 CCCOCCSC(C)COC 62a_100011215938_100000765312 [1,1,0,0,0,0|2,0,0]=4 3992 B11R0.4 CCCSCCNC(C)COC 2230a_100020603323_100000765312 [1,1,0,0,0,0|2,0,0]=4 3993 B11R0.4 CCCSCCNC(C)COC 270004a_100020603323_100000749346 [1,1,0,0,0,0|2,0,0]=4 3994 B11R0.4 CCCSCCOC(C)COC 34a_200000230433_100000765312 [1,1,0,0,0,0|2,0,0]=4 3995 B11R0.4 CCCSCCOC(C)COC 7a_200000230433_100000765312 [1,1,0,0,0,0|2,0,0]=4 3996 B11R0.4 CCOCCCNC(C)COC 2230a_100000210961_100000765312 [1,1,0,0,0,0|2,0,0]=4 3997 B11R0.4 CCOCCCNC(C)COC 270004a_100000210961_100000749346 [1,1,0,0,0,0|2,0,0]=4 3998 B11R0.4 CCOCCCNC(C)COC 34a_100000210961_100000765312 [1,1,0,0,0,0|2,0,0]=4 3999 B11R0.4 CCOCCCN[C@H](C)COC 2230a_100000764878_100012232248 [1,1,0,0,0,0|2,0,0]=4 4000 B11R0.4 CCOCCCOC(C)COC 34a_100000757476_100000765312 [1,1,0,0,0,0|2,0,0]=4 4001 B11R0.4 CCOCCCOC(C)COC 7a_100000757476_100000765312 [1,1,0,0,0,0|2,0,0]=4 4002 B11R0.4 CCOCCCO[C@H](C)COC 34a_100011934205_100012232248 [1,1,0,0,0,0|2,0,0]=4 4003 B11R0.4 CCOCCCSC(C)COC 62a_100000765312_100012232248 [1,1,0,0,0,0|2,0,0]=4 4004 B11R0.4 CCOCCCSC(C)COC 62a_100012232248_100000765312 [1,1,0,0,0,0|2,0,0]=4 4005 B11R0.4 CCOCCNCC(O)COC 2230a_100000756049_100011215890 [1,1,0,0,0,0|2,0,0]=4 4006 B11R0.4 CCOCCNCC(O)COC 34a_100000756049_100000210147 [1,1,0,0,0,0|2,0,0]=4 4007 B11R0.4 CCOCCNCC(O)COC 34a_102516460346_100011215053 [1,1,0,0,0,0|2,0,0]=4 4008 B11R0.4 CCOCCOCC(O)COC 34a_100000210136_100011215053 [1,1,0,0,0,0|2,0,0]=4 4009 B11R0.4 CCOCCOCC(O)COC 7a_100000210136_100011215053 [1,1,0,0,0,0|2,0,0]=4 4010 B11R0.4 CCOCCSCC(O)COC 62a_100000210147_100011215053 [1,1,0,0,0,0|2,0,0]=4 4011 B11R0.4 CCOCCSCC(O)COC 62a_100011215053_100011215890 [1,1,0,0,0,0|2,0,0]=4 4012 B11R0.4 CCSCCCOC(C)COC 34a_100011216438_100000765312 [1,1,0,0,0,0|2,0,0]=4 4013 B11R0.4 CCSCCCOC(C)COC 7a_100011216438_100000765312 [1,1,0,0,0,0|2,0,0]=4 4014 B11R0.4 CCSCCNCC(O)COC 2230a_100000756049_100000757381 [1,1,0,0,0,0|2,0,0]=4 4015 B11R0.4 CCSCCNCC(O)COC 34a_100000756049_100000757381 [1,1,0,0,0,0|2,0,0]=4 4016 B11R0.4 CCSCCOCC(O)COC 34a_100000212035_100011215053 [1,1,0,0,0,0|2,0,0]=4 4017 B11R0.4 CCSCCOCC(O)COC 7a_100000212035_100011215053 [1,1,0,0,0,0|2,0,0]=4 4018 B11R0.4 CCSCCSCC(O)COC 62a_100000757381_100011215053 [1,1,0,0,0,0|2,0,0]=4 4019 B11R0.4 CCSCCSCC(O)COC 62a_100011215053_100000757381 [1,1,0,0,0,0|2,0,0]=4 4020 B11R0.4 CNCCCOCC(O)COC 34a_100000213112_100011215053 [1,1,0,0,0,0|2,0,0]=4 4021 B11R0.4 COCC(C)NCCCCCO 2230a_100000762737_100000765312 [1,1,0,0,0,0|2,0,0]=4 4022 B11R0.4 COCC(C)NCCCCCO 270004a_100000762737_100000749346 [1,1,0,0,0,0|2,0,0]=4 4023 B11R0.4 COCC(C)NCCCCCO 34a_100000762737_100000765312 [1,1,0,0,0,0|2,0,0]=4 4024 B11R0.4 COCC(C)OCCCCCBr 34a_100000746331_100000765312 [1,1,0,0,0,0|2,0,0]=4 4025 B11R0.4 COCC(C)OCCCCCBr 7a_100000746331_100000765312 [1,1,0,0,0,0|2,0,0]=4 4026 B11R0.4 COCC(C)OCCCCCCl 34a_100000746330_100000765312 [1,1,0,0,0,0|2,0,0]=4 4027 B11R0.4 COCC(C)OCCCCCCl 7a_100000746330_100000765312 [1,1,0,0,0,0|2,0,0]=4 4028 B11R0.4 COCC(C)OCCCCCI 34a_200012148887_100000765312 [1,1,0,0,0,0|2,0,0]=4 4029 B11R0.4 COCC(C)OCCCCCI 7a_200012148887_100000765312 [1,1,0,0,0,0|2,0,0]=4 4030 B11R0.4 COCC(C)OCCCCCN 34a_100000762737_100000765312 [1,1,0,0,0,0|2,0,0]=4 4031 B11R0.4 COCC(C)OCCCCSC 34a_100011217163_100000765312 [1,1,0,0,0,0|2,0,0]=4 4032 B11R0.4 COCC(C)OCCCCSC 7a_100011217163_100000765312 [1,1,0,0,0,0|2,0,0]=4 4033 B11R0.4 COCC(C)SCCCCCF 62a_100000729378_100000765312 [1,1,0,0,0,0|2,0,0]=4 4034 B11R0.4 COCC(C)SCCCCCF 62a_100000765312_100000729378 [1,1,0,0,0,0|2,0,0]=4 4035 B11R0.4 COCC(C)SCCCCCO 62a_100000746330_100000765312 [1,1,0,0,0,0|2,0,0]=4 4036 B11R0.4 COCC(C)SCCCCCO 62a_100000765312_100000746330 [1,1,0,0,0,0|2,0,0]=4 4037 B11R0.4 COCC(O)CNCCCCF 2230a_100000756049_100000729493 [1,1,0,0,0,0|2,0,0]=4 4038 B11R0.4 COCC(O)CNCCCCF 34a_100000756049_100000729493 [1,1,0,0,0,0|2,0,0]=4 4039 B11R0.4 COCC(O)CNCCCCO 2230a_100000756049_100000210776 [1,1,0,0,0,0|2,0,0]=4 4040 B11R0.4 COCC(O)CNCCCCO 34a_100000750430_100011215053 [1,1,0,0,0,0|2,0,0]=4 4041 B11R0.4 COCC(O)CNCCCCO 34a_100000756049_100011216708 [1,1,0,0,0,0|2,0,0]=4 4042 B11R0.4 COCC(O)COCCCCBr 34a_100011216708_100011215053 [1,1,0,0,0,0|2,0,0]=4 4043 B11R0.4 COCC(O)COCCCCCl 34a_100000210776_100011215053 [1,1,0,0,0,0|2,0,0]=4 4044 B11R0.4 COCC(O)COCCCCCl 7a_100000210776_100011215053 [1,1,0,0,0,0|2,0,0]=4 4045 B11R0.4 COCC(O)COCCCCF 34a_100011995726_100011215053 [1,1,0,0,0,0|2,0,0]=4 4046 B11R0.4 COCC(O)COCCCCF 7a_100011995726_100011215053 [1,1,0,0,0,0|2,0,0]=4 4047 B11R0.4 COCC(O)COCCCCI 34a_200012148704_100011215053 [1,1,0,0,0,0|2,0,0]=4 4048 B11R0.4 COCC(O)COCCCCN 34a_100000750430_100011215053 [1,1,0,0,0,0|2,0,0]=4 4049 B11R0.4 COCC(O)COCCCSC 34a_100000690336_100011215053 [1,1,0,0,0,0|2,0,0]=4 4050 B11R0.4 COCC(O)COCCCSC 7a_100000690336_100011215053 [1,1,0,0,0,0|2,0,0]=4 4051 B11R0.4 COCC(O)CSCCCCF 62a_100000729493_100011215053 [1,1,0,0,0,0|2,0,0]=4 4052 B11R0.4 COCC(O)CSCCCCF 62a_100011215053_100000729493 [1,1,0,0,0,0|2,0,0]=4 4053 B11R0.4 COCC(O)CSCCCCO 62a_100000210776_100011215053 [1,1,0,0,0,0|2,0,0]=4 4054 B11R0.4 COCC(O)CSCCCCO 62a_100011215053_100000210776 [1,1,0,0,0,0|2,0,0]=4 4055 B11R0.4 COCCCCN[C@H](C)COC 2230a_100000764878_100000730899 [1,1,0,0,0,0|2,0,0]=4 4056 B11R0.4 COCCCCOC(C)COC 34a_100000740925_100000765312 [1,1,0,0,0,0|2,0,0]=4 4057 B11R0.4 COCCCCO[C@H](C)COC 34a_100011934205_100000755781 [1,1,0,0,0,0|2,0,0]=4 4058 B11R0.4 COCCCCSC(C)COC 62a_100000730899_100000765312 [1,1,0,0,0,0|2,0,0]=4 4059 B11R0.4 COCCCCSC(C)COC 62a_100000765312_100000730899 [1,1,0,0,0,0|2,0,0]=4 4060 B11R0.4 COCCCNCC(O)COC 2230a_100000756049_100000740836 [1,1,0,0,0,0|2,0,0]=4 4061 B11R0.4 COCCCNCC(O)COC 34a_100000756049_100000740836 [1,1,0,0,0,0|2,0,0]=4 4062 B11R0.4 COCCCNCC(O)COC 34a_100150723488_100011215053 [1,1,0,0,0,0|2,0,0]=4 4063 B11R0.4 COCCCOCC(O)COC 34a_100000740835_100011215053 [1,1,0,0,0,0|2,0,0]=4 4064 B11R0.4 COCCCSCC(O)COC 62a_100000709357_100011215053 [1,1,0,0,0,0|2,0,0]=4 4065 B11R0.4 COCCCSCC(O)COC 62a_100011215053_100000709357 [1,1,0,0,0,0|2,0,0]=4 4066 B11R0.4 COC[C@@H](C)NCCCCCF 2230a_100000764878_100000729378 [1,1,0,0,0,0|2,0,0]=4 4067 B11R0.4 COC[C@@H](C)NCCCCCO 2230a_100000764878_100000746330 [1,1,0,0,0,0|2,0,0]=4 4068 B11R0.4 COC[C@@H](C)OCCCCCF 34a_100011934205_100000729378 [1,1,0,0,0,0|2,0,0]=4 4069 B11R0.4 COC[C@@H](C)OCCCCCO 34a_100011934205_100000746330 [1,1,0,0,0,0|2,0,0]=4 4070 B11R0.40 C#CC(C)NCCCCCCC 2230a_100000707721_100000210681 [1,1,0,0,0,0|1,0,1]=4 4071 B11R0.40 C#CC(C)NCCCCCCC 34a_100000707721_100000210614 [1,1,0,0,0,0|1,0,1]=4 4072 B11R0.40 C#CC(C)OCCCCCCC 34a_100000210272_200000035995 [1,1,0,0,0,0|1,0,1]=4 4073 B11R0.40 C#CC(C)SCCCCCCC 62a_200000035995_100000210316 [1,1,0,0,0,0|1,0,1]=4 4074 B11R0.40 C#CC(O)CCCCCNCC 2230a_100015525214_200010408556 [1,1,0,0,0,0|1,0,1]=4 4075 B11R0.40 C#CC(O)CCCCCOCC 34a_100121572206_200010408556 [1,1,0,0,0,0|1,0,1]=4 4076 B11R0.40 C#CC(O)CCCCCSCC 62a_100000210202_200010408556 [1,1,0,0,0,0|1,0,1]=4 4077 B11R0.40 C#CC(O)CCCCCSCC 62a_200010408556_100000210202 [1,1,0,0,0,0|1,0,1]=4 4078 B11R0.40 C#CCCCCCSC(C)OC 62a_100009879195_100012094781 [1,1,0,0,0,0|0,0,2]=4 4079 B11R0.40 C#CCCCCCSC(C)OC 62a_100012094781_100009879195 [1,1,0,0,0,0|0,0,2]=4 4080 B11R0.40 C#CCCCCNC[C@@H](C)OC 2230a_100020591295_100010269958 [1,1,0,0,0,0|0,0,2]=4 4081 B11R0.40 C#CCCCCOCC(C)OC 34a_100000690652_100010269958 [1,1,0,0,0,0|0,0,2]=4 4082 B11R0.40 C#CCCCOCCC(C)OC 7a_100000764861_100011215417 [1,1,0,0,0,0|0,0,2]=4 4083 B11R0.40 C#C[C@@H](C)OCCCCCCC 34a_100009815206_100000210614 [1,1,0,0,0,0|1,0,1]=4 4084 B11R0.40 C#C[C@@H](C)OCCCCCCC 7a_100009815206_100000210614 [1,1,0,0,0,0|1,0,1]=4 4085 B11R0.40 C=CC(C)COCCCCCC 34a_100011215527_100000210314 [1,1,0,0,0,0|1,0,1]=4 4086 B11R0.40 C=CC(C)COCCCCCC 7a_100011215527_100000210314 [1,1,0,0,0,0|1,0,1]=4 4087 B11R0.40 C=CC(C)OCCCCCCC 34a_100000695699_100000210614 [1,1,0,0,0,0|1,0,1]=4 4088 B11R0.40 C=CC(C)SCCCCCCC 62a_100011215867_100000210316 [1,1,0,0,0,0|1,0,1]=4 4089 B11R0.40 C=CC(O)CNCCCCCC 2230a_100000210581_100000730141 [1,1,0,0,0,0|1,0,1]=4 4090 B11R0.40 C=CC(O)COCCCCCC 34a_100000210259_100000730141 [1,1,0,0,0,0|1,0,1]=4 4091 B11R0.40 C=CC(O)COCCCCCC 7a_100000210259_100000730141 [1,1,0,0,0,0|1,0,1]=4 4092 B11R0.40 C=CC(O)CSCCCCCC 62a_100000210314_100000730141 [1,1,0,0,0,0|1,0,1]=4 4093 B11R0.40 C=CC(O)CSCCCCCC 62a_100000730141_100000210757 [1,1,0,0,0,0|1,0,1]=4 4094 B11R0.40 C=CCCCCCSC(C)OC 62a_100000700193_100009879195 [1,1,0,0,0,0|0,0,2]=4 4095 B11R0.40 C=CCCCCCSC(C)OC 62a_100009879195_100000700193 [1,1,0,0,0,0|0,0,2]=4 4096 B11R0.40 C=CCCCCNC[C@@H](C)OC 2230a_100020591295_100011215482 [1,1,0,0,0,0|0,0,2]=4 4097 B11R0.40 C=CCCCCOCC(C)OC 34a_100000690652_100011215482 [1,1,0,0,0,0|0,0,2]=4 4098 B11R0.40 C=CCCCOCCC(C)OC 7a_100000764861_100000757094 [1,1,0,0,0,0|0,0,2]=4 4099 B11R0.40 CC/C=C\CCNC[C@@H](C)OC 2230a_100020591295_100015370543 [1,1,0,0,0,0|0,0,2]=4 4100 B11R0.40 CC/C=C\CCOCC(C)OC 34a_100000690652_100015370543 [1,1,0,0,0,0|0,0,2]=4 4101 B11R0.40 CC/C=C\COCCC(C)OC 7a_100000764861_100103147603 [1,1,0,0,0,0|0,0,2]=4 4102 B11R0.40 CCC#CCOCCC(C)OC 7a_100000764861_100009813939 [1,1,0,0,0,0|0,0,2]=4 4103 B11R0.40 CCC(C)CCCCCOCF 7a_200000035636_100015361967 [1,1,0,0,0,0|2,0,0]=4 4104 B11R0.40 CCC(C)CCCOCCCF 7a_100011216074_100011934791 [1,1,0,0,0,0|2,0,0]=4 4105 B11R0.40 CCC(C)CCCOCCCO 7a_100011216074_100011215043 [1,1,0,0,0,0|2,0,0]=4 4106 B11R0.40 CCC(C)CCCOCCOC 7a_100011216074_100000233755 [1,1,0,0,0,0|2,0,0]=4 4107 B11R0.40 CCC(C)CCCOCCSC 7a_100011216074_100000212216 [1,1,0,0,0,0|2,0,0]=4 4108 B11R0.40 CCC(C)CCNCCCCF 2230a_100020591266_100000729493 [1,1,0,0,0,0|2,0,0]=4 4109 B11R0.40 CCC(C)CCNCCCCO 2230a_100020591266_100000210776 [1,1,0,0,0,0|2,0,0]=4 4110 B11R0.40 CCC(C)CCNCCCOC 2230a_100020591266_100000740836 [1,1,0,0,0,0|2,0,0]=4 4111 B11R0.40 CCC(C)CCOCCCCF 7a_100011215188_100000729493 [1,1,0,0,0,0|2,0,0]=4 4112 B11R0.40 CCC(C)CCOCCCCO 7a_100011215188_100000210776 [1,1,0,0,0,0|2,0,0]=4 4113 B11R0.40 CCC(C)CCOCCCOC 7a_100011215188_100000740836 [1,1,0,0,0,0|2,0,0]=4 4114 B11R0.40 CCC(C)CNCCCCCF 2230a_100020588543_100000729378 [1,1,0,0,0,0|2,0,0]=4 4115 B11R0.40 CCC(C)CNCCCCCO 2230a_100000762737_100000748023 [1,1,0,0,0,0|2,0,0]=4 4116 B11R0.40 CCC(C)CNCCCCCO 2230a_100020588543_100000746330 [1,1,0,0,0,0|2,0,0]=4 4117 B11R0.40 CCC(C)CNCCCCCO 270004a_100000762737_100000243153 [1,1,0,0,0,0|2,0,0]=4 4118 B11R0.40 CCC(C)CNCCCCCO 34a_100000762737_100000748023 [1,1,0,0,0,0|2,0,0]=4 4119 B11R0.40 CCC(C)CNCCCCOC 2230a_100020588543_100000730899 [1,1,0,0,0,0|2,0,0]=4 4120 B11R0.40 CCC(C)COCCCCCBr 34a_100000746331_100000748023 [1,1,0,0,0,0|2,0,0]=4 4121 B11R0.40 CCC(C)COCCCCCBr 7a_100000746331_100000748023 [1,1,0,0,0,0|2,0,0]=4 4122 B11R0.40 CCC(C)COCCCCCCl 34a_100000746330_100000748023 [1,1,0,0,0,0|2,0,0]=4 4123 B11R0.40 CCC(C)COCCCCCCl 7a_100000746330_100000748023 [1,1,0,0,0,0|2,0,0]=4 4124 B11R0.40 CCC(C)COCCCCCI 34a_200012148887_100000748023 [1,1,0,0,0,0|2,0,0]=4 4125 B11R0.40 CCC(C)COCCCCCI 7a_200012148887_100000748023 [1,1,0,0,0,0|2,0,0]=4 4126 B11R0.40 CCC(C)COCCCCCN 34a_100000762737_100000748023 [1,1,0,0,0,0|2,0,0]=4 4127 B11R0.40 CCC(C)COCCCCOC 34a_100000740925_100000748023 [1,1,0,0,0,0|2,0,0]=4 4128 B11R0.40 CCC(C)COCCCCSC 34a_100011217163_100000748023 [1,1,0,0,0,0|2,0,0]=4 4129 B11R0.40 CCC(C)COCCCCSC 7a_100011217163_100000748023 [1,1,0,0,0,0|2,0,0]=4 4130 B11R0.40 CCC(C)CSCCCCCF 62a_100000729378_100000748023 [1,1,0,0,0,0|2,0,0]=4 4131 B11R0.40 CCC(C)CSCCCCCF 62a_100000748023_100000729378 [1,1,0,0,0,0|2,0,0]=4 4132 B11R0.40 CCC(C)CSCCCCCO 62a_100000746330_100000748023 [1,1,0,0,0,0|2,0,0]=4 4133 B11R0.40 CCC(C)CSCCCCCO 62a_100000748023_100000746330 [1,1,0,0,0,0|2,0,0]=4 4134 B11R0.40 CCC(C)CSCCCCOC 62a_100000730899_100000748023 [1,1,0,0,0,0|2,0,0]=4 4135 B11R0.40 CCC(C)CSCCCCOC 62a_100000748023_100000730899 [1,1,0,0,0,0|2,0,0]=4 4136 B11R0.40 CCC(C)NCCCCCCF 2230a_100000209981_100015922095 [1,1,0,0,0,0|2,0,0]=4 4137 B11R0.40 CCC(C)NCCCCCCO 2230a_100000209981_100000766143 [1,1,0,0,0,0|2,0,0]=4 4138 B11R0.40 CCC(C)NCCCCCCO 2230a_100000686447_100000758301 [1,1,0,0,0,0|2,0,0]=4 4139 B11R0.40 CCC(C)NCCCCCCO 34a_100000686447_100011215416 [1,1,0,0,0,0|2,0,0]=4 4140 B11R0.40 CCC(C)NCCCCCOC 2230a_100000747528_100000758301 [1,1,0,0,0,0|2,0,0]=4 4141 B11R0.40 CCC(C)NCCCCCOC 34a_100000747528_100011215416 [1,1,0,0,0,0|2,0,0]=4 4142 B11R0.40 CCC(C)OCCCCCCBr 34a_100011215345_100011215416 [1,1,0,0,0,0|2,0,0]=4 4143 B11R0.40 CCC(C)OCCCCCCBr 7a_100011215345_100000758301 [1,1,0,0,0,0|2,0,0]=4 4144 B11R0.40 CCC(C)OCCCCCCCl 34a_100000766143_100011215416 [1,1,0,0,0,0|2,0,0]=4 4145 B11R0.40 CCC(C)OCCCCCCCl 7a_100000766143_100000758301 [1,1,0,0,0,0|2,0,0]=4 4146 B11R0.40 CCC(C)OCCCCCCF 34a_100000732779_100011215416 [1,1,0,0,0,0|2,0,0]=4 4147 B11R0.40 CCC(C)OCCCCCCF 7a_100000210228_100015922095 [1,1,0,0,0,0|2,0,0]=4 4148 B11R0.40 CCC(C)OCCCCCCF 7a_100000732779_100000758301 [1,1,0,0,0,0|2,0,0]=4 4149 B11R0.40 CCC(C)OCCCCCCN 34a_100000686447_100011215416 [1,1,0,0,0,0|2,0,0]=4 4150 B11R0.40 CCC(C)OCCCCCCO 7a_100000210228_100000766143 [1,1,0,0,0,0|2,0,0]=4 4151 B11R0.40 CCC(C)OCCCCCNC 34a_100000722520_100011215416 [1,1,0,0,0,0|2,0,0]=4 4152 B11R0.40 CCC(C)SCCCCCCF 62a_100000758301_100015922095 [1,1,0,0,0,0|2,0,0]=4 4153 B11R0.40 CCC(C)SCCCCCCF 62a_100015922095_100000758301 [1,1,0,0,0,0|2,0,0]=4 4154 B11R0.40 CCC(C)SCCCCCCO 62a_100000758301_100000766143 [1,1,0,0,0,0|2,0,0]=4 4155 B11R0.40 CCC(C)SCCCCCCO 62a_100000766143_100000758301 [1,1,0,0,0,0|2,0,0]=4 4156 B11R0.40 CCC(O)CNCCCCCF 2230a_100011218483_100000729378 [1,1,0,0,0,0|2,0,0]=4 4157 B11R0.40 CCC(O)CNCCCCCO 2230a_100000762737_100011218378 [1,1,0,0,0,0|2,0,0]=4 4158 B11R0.40 CCC(O)CNCCCCCO 2230a_100011218483_100000746330 [1,1,0,0,0,0|2,0,0]=4 4159 B11R0.40 CCC(O)CNCCCCCO 34a_100000762737_100011218378 [1,1,0,0,0,0|2,0,0]=4 4160 B11R0.40 CCC(O)CNCCCCOC 2230a_100011218483_100000730899 [1,1,0,0,0,0|2,0,0]=4 4161 B11R0.40 CCC(O)COCCCCCBr 34a_100000746331_100011218378 [1,1,0,0,0,0|2,0,0]=4 4162 B11R0.40 CCC(O)COCCCCCBr 7a_100000746331_100011218378 [1,1,0,0,0,0|2,0,0]=4 4163 B11R0.40 CCC(O)COCCCCCCl 34a_100000746330_100011218378 [1,1,0,0,0,0|2,0,0]=4 4164 B11R0.40 CCC(O)COCCCCCCl 7a_100000746330_100011218378 [1,1,0,0,0,0|2,0,0]=4 4165 B11R0.40 CCC(O)COCCCCCI 34a_200012148887_100011218378 [1,1,0,0,0,0|2,0,0]=4 4166 B11R0.40 CCC(O)COCCCCCI 7a_200012148887_100011218378 [1,1,0,0,0,0|2,0,0]=4 4167 B11R0.40 CCC(O)COCCCCCN 34a_100000762737_100011218378 [1,1,0,0,0,0|2,0,0]=4 4168 B11R0.40 CCC(O)COCCCCOC 34a_100000740925_100011218378 [1,1,0,0,0,0|2,0,0]=4 4169 B11R0.40 CCC(O)COCCCCSC 34a_100011217163_100011218378 [1,1,0,0,0,0|2,0,0]=4 4170 B11R0.40 CCC(O)COCCCCSC 7a_100011217163_100011218378 [1,1,0,0,0,0|2,0,0]=4 4171 B11R0.40 CCC(O)CSCCCCCF 62a_100000729378_100011218378 [1,1,0,0,0,0|2,0,0]=4 4172 B11R0.40 CCC(O)CSCCCCCF 62a_100011218378_100000729378 [1,1,0,0,0,0|2,0,0]=4 4173 B11R0.40 CCC(O)CSCCCCCO 62a_100000746330_100011218378 [1,1,0,0,0,0|2,0,0]=4 4174 B11R0.40 CCC(O)CSCCCCCO 62a_100011218378_100000746330 [1,1,0,0,0,0|2,0,0]=4 4175 B11R0.40 CCC(O)CSCCCCOC 62a_100000730899_100011218378 [1,1,0,0,0,0|2,0,0]=4 4176 B11R0.40 CCC(O)CSCCCCOC 62a_100011218378_100000730899 [1,1,0,0,0,0|2,0,0]=4 4177 B11R0.40 CCCCCCCCC(C)NC 270004a_106832991635_100011216694 [1,1,0,0,0,0|1,0,0]=3 4178 B11R0.40 CCCCCCCCC(C)OC 34a_100000210740_200000210301 [1,1,0,0,0,0|0,0,0]=2 4179 B11R0.40 CCCCCCCCC(C)OC 7a_100000210740_200000210301 [1,1,0,0,0,0|0,0,0]=2 4180 B11R0.40 CCCCCCCCC(C)O[13CH3] 34a_100000210740_200025704644 [1,1,0,0,0,0|0,0,0]=2 4181 B11R0.40 CCCCCCCCC(C)O[13CH3] 7a_100000210740_200025704644 [1,1,0,0,0,0|0,0,0]=2 4182 B11R0.40 CCCCCCCCN(C)CC 2230a_100000207567_100000210202 [1,1,0,0,0,0|2,0,0]=4 4183 B11R0.40 CCCCCCCCN(C)CC 2230a_100000225621_100000210759 [1,1,0,0,0,0|2,0,0]=4 4184 B11R0.40 CCCCCCCCN(C)CC 269982a_100000207567_100000204670 [1,1,0,0,0,0|2,0,0]=4 4185 B11R0.40 CCCCCCCCN(C)CC 269982a_100000225621_100000210759 [1,1,0,0,0,0|2,0,0]=4 4186 B11R0.40 CCCCCCCNC(C)C#N 2230a_100000229938_100000184139 [1,1,0,0,0,0|2,0,0]=4 4187 B11R0.40 CCCCCCCNC(C)C#N 2230a_100000737613_100000210681 [1,1,0,0,0,0|2,0,0]=4 4188 B11R0.40 CCCCCCCNC(C)CC 2230a_100000209981_100000210681 [1,1,0,0,0,0|1,0,0]=3 4189 B11R0.40 CCCCCCCNC(C)CC 2230a_100000229938_100000758301 [1,1,0,0,0,0|1,0,0]=3 4190 B11R0.40 CCCCCCCNC(C)CO 2230a_100000229938_100012180447 [1,1,0,0,0,0|2,0,0]=4 4191 B11R0.40 CCCCCCCN[C@H](C)CO 2230a_100000737577_100000210681 [1,1,0,0,0,0|2,0,0]=4 4192 B11R0.40 CCCCCCCOC(C)C#N 34a_100011218135_100000210614 [1,1,0,0,0,0|2,0,0]=4 4193 B11R0.40 CCCCCCCOC(C)C#N 7a_100000210272_100000703298 [1,1,0,0,0,0|2,0,0]=4 4194 B11R0.40 CCCCCCCOC(C)CC 34a_100000210272_100011215416 [1,1,0,0,0,0|1,0,0]=3 4195 B11R0.40 CCCCCCCOC(C)CC 7a_100000210228_100000210614 [1,1,0,0,0,0|1,0,0]=3 4196 B11R0.40 CCCCCCCOC(C)CC 7a_100000210272_100000758301 [1,1,0,0,0,0|1,0,0]=3 4197 B11R0.40 CCCCCCCOC(C)CF 34a_100016041109_100000210614 [1,1,0,0,0,0|2,0,0]=4 4198 B11R0.40 CCCCCCCOC(C)CF 7a_100016041109_100000210614 [1,1,0,0,0,0|2,0,0]=4 4199 B11R0.40 CCCCCCCOC(C)CN 34a_100000210904_100000210614 [1,1,0,0,0,0|2,0,0]=4 4200 B11R0.40 CCCCCCCOC(C)CO 34a_100000210272_100012180447 [1,1,0,0,0,0|2,0,0]=4 4201 B11R0.40 CCCCCCCOC(C)CO 7a_100000210272_100012180447 [1,1,0,0,0,0|2,0,0]=4 4202 B11R0.40 CCCCCCCSC(C)C#N 62a_100000210614_100000703298 [1,1,0,0,0,0|2,0,0]=4 4203 B11R0.40 CCCCCCCSC(C)C#N 62a_100000703298_100000210316 [1,1,0,0,0,0|2,0,0]=4 4204 B11R0.40 CCCCCCCSC(C)CC 62a_100000210614_100000758301 [1,1,0,0,0,0|1,0,0]=3 4205 B11R0.40 CCCCCCCSC(C)CC 62a_100000758301_100000210316 [1,1,0,0,0,0|1,0,0]=3 4206 B11R0.40 CCCCCCCSC(C)CO 62a_100012180447_100000210316 [1,1,0,0,0,0|2,0,0]=4 4207 B11R0.40 CCCCCCCSC(C)OC 62a_100000210614_100009879195 [1,1,0,0,0,0|0,0,0]=2 4208 B11R0.40 CCCCCCCSC(C)OC 62a_100009879195_100000210316 [1,1,0,0,0,0|0,0,0]=2 4209 B11R0.40 CCCCCCCS[C@H](C)CO 62a_100000210614_100016084084 [1,1,0,0,0,0|2,0,0]=4 4210 B11R0.40 CCCCCCCS[C@H](C)CO 62a_100016084084_100000210316 [1,1,0,0,0,0|2,0,0]=4 4211 B11R0.40 CCCCCCNCC(=O)OC 2230a_100000210581_100000747449 [1,1,0,0,0,0|0,0,2]=4 4212 B11R0.40 CCCCCCNCC(C)CC 2230a_100000210581_100000748023 [1,1,0,0,0,0|1,0,0]=3 4213 B11R0.40 CCCCCCNCC(C)CC 2230a_100020588543_100000210314 [1,1,0,0,0,0|1,0,0]=3 4214 B11R0.40 CCCCCCNCC(C)CC 270004a_100000210581_100000243153 [1,1,0,0,0,0|1,0,0]=3 4215 B11R0.40 CCCCCCNCC(C)CO 34a_100000744482_100000210314 [1,1,0,0,0,0|2,0,0]=4 4216 B11R0.40 CCCCCCNCC(O)CC 2230a_100000210581_100011218378 [1,1,0,0,0,0|1,0,0]=3 4217 B11R0.40 CCCCCCNCC(O)CC 2230a_100011218483_100000210314 [1,1,0,0,0,0|1,0,0]=3 4218 B11R0.40 CCCCCCNCC(O)CO 2230a_100000210581_100011219619 [1,1,0,0,0,0|2,0,0]=4 4219 B11R0.40 CCCCCCNC[C@@H](C)CC 2230a_100000210581_100009816398 [1,1,0,0,0,0|1,0,0]=3 4220 B11R0.40 CCCCCCNC[C@@H](C)CO 2230a_100000210581_100000059175 [1,1,0,0,0,0|2,0,0]=4 4221 B11R0.40 CCCCCCNC[C@@H](C)OC 2230a_100020591295_100000210314 [1,1,0,0,0,0|0,0,0]=2 4222 B11R0.40 CCCCCCNC[C@@H](O)CF 2230a_100000210581_100015614560 [1,1,0,0,0,0|2,0,0]=4 4223 B11R0.40 CCCCCCNC[C@@H](O)CO 2230a_100000210581_100009815848 [1,1,0,0,0,0|2,0,0]=4 4224 B11R0.40 CCCCCCNC[C@H](O)CO 2230a_100020644852_100000210314 [1,1,0,0,0,0|2,0,0]=4 4225 B11R0.40 CCCCCCOCC(=O)OC 34a_100000210259_100000747449 [1,1,0,0,0,0|0,0,2]=4 4226 B11R0.40 CCCCCCOCC(=O)OC 7a_100000210259_100000747449 [1,1,0,0,0,0|0,0,2]=4 4227 B11R0.40 CCCCCCOCC(C)CC 34a_100000210259_100000748023 [1,1,0,0,0,0|1,0,0]=3 4228 B11R0.40 CCCCCCOCC(C)CC 7a_100000210259_100000748023 [1,1,0,0,0,0|1,0,0]=3 4229 B11R0.40 CCCCCCOCC(C)CN 34a_100000744482_100000210314 [1,1,0,0,0,0|2,0,0]=4 4230 B11R0.40 CCCCCCOCC(C)OC 34a_100000690652_100000210314 [1,1,0,0,0,0|0,0,0]=2 4231 B11R0.40 CCCCCCOCC(O)CC 34a_100000210259_100011218378 [1,1,0,0,0,0|1,0,0]=3 4232 B11R0.40 CCCCCCOCC(O)CC 7a_100000210259_100011218378 [1,1,0,0,0,0|1,0,0]=3 4233 B11R0.40 CCCCCCOCC(O)CO 34a_100000210259_100011219619 [1,1,0,0,0,0|2,0,0]=4 4234 B11R0.40 CCCCCCOCC(O)CO 7a_100000210259_100011219619 [1,1,0,0,0,0|2,0,0]=4 4235 B11R0.40 CCCCCCOC[C@@H](C)CC 34a_100000210259_100009816398 [1,1,0,0,0,0|1,0,0]=3 4236 B11R0.40 CCCCCCOC[C@@H](C)CC 7a_100000210259_100009816398 [1,1,0,0,0,0|1,0,0]=3 4237 B11R0.40 CCCCCCOC[C@@H](C)CC 7a_100009816381_100000210314 [1,1,0,0,0,0|1,0,0]=3 4238 B11R0.40 CCCCCCOC[C@@H](C)CO 34a_100000210259_100000059175 [1,1,0,0,0,0|2,0,0]=4 4239 B11R0.40 CCCCCCOC[C@@H](C)CO 7a_100000210259_100000059175 [1,1,0,0,0,0|2,0,0]=4 4240 B11R0.40 CCCCCCOC[C@@H](O)CF 34a_100000210259_100015614560 [1,1,0,0,0,0|2,0,0]=4 4241 B11R0.40 CCCCCCOC[C@@H](O)CF 7a_100000210259_100015614560 [1,1,0,0,0,0|2,0,0]=4 4242 B11R0.40 CCCCCCOC[C@@H](O)CO 34a_100000210259_100009815848 [1,1,0,0,0,0|2,0,0]=4 4243 B11R0.40 CCCCCCOC[C@@H](O)CO 7a_100000210259_100009815848 [1,1,0,0,0,0|2,0,0]=4 4244 B11R0.40 CCCCCCSCC(=O)OC 62a_100000210314_100000747449 [1,1,0,0,0,0|0,0,2]=4 4245 B11R0.40 CCCCCCSCC(=O)OC 62a_100000747449_100000210757 [1,1,0,0,0,0|0,0,2]=4 4246 B11R0.40 CCCCCCSCC(C)CC 62a_100000210314_100000748023 [1,1,0,0,0,0|1,0,0]=3 4247 B11R0.40 CCCCCCSCC(C)CC 62a_100000748023_100000210757 [1,1,0,0,0,0|1,0,0]=3 4248 B11R0.40 CCCCCCSCC(O)CC 62a_100000210314_100011218378 [1,1,0,0,0,0|1,0,0]=3 4249 B11R0.40 CCCCCCSCC(O)CC 62a_100011218378_100000210757 [1,1,0,0,0,0|1,0,0]=3 4250 B11R0.40 CCCCCCSCC(O)CO 62a_100000210314_100011219619 [1,1,0,0,0,0|2,0,0]=4 4251 B11R0.40 CCCCCCSCC(O)CO 62a_100011219619_100000210757 [1,1,0,0,0,0|2,0,0]=4 4252 B11R0.40 CCCCCCSC[C@@H](C)CC 62a_100000210314_100009816398 [1,1,0,0,0,0|1,0,0]=3 4253 B11R0.40 CCCCCCSC[C@@H](C)CC 62a_100009816398_100000210757 [1,1,0,0,0,0|1,0,0]=3 4254 B11R0.40 CCCCCCSC[C@@H](C)CO 62a_100000059175_100000210757 [1,1,0,0,0,0|2,0,0]=4 4255 B11R0.40 CCCCCCSC[C@@H](C)CO 62a_100000210314_100000059175 [1,1,0,0,0,0|2,0,0]=4 4256 B11R0.40 CCCCCCSC[C@@H](O)CF 62a_100000210314_100015614560 [1,1,0,0,0,0|2,0,0]=4 4257 B11R0.40 CCCCCCSC[C@@H](O)CF 62a_100015614560_100000210757 [1,1,0,0,0,0|2,0,0]=4 4258 B11R0.40 CCCCCCSC[C@@H](O)CO 62a_100000210314_100009815848 [1,1,0,0,0,0|2,0,0]=4 4259 B11R0.40 CCCCCCSC[C@@H](O)CO 62a_100009815848_100000210757 [1,1,0,0,0,0|2,0,0]=4 4260 B11R0.40 CCCCCNCCC(=O)OC 2230a_100000209983_100000204255 [1,1,0,0,0,0|0,0,2]=4 4261 B11R0.40 CCCCCNCCC(C)CC 2230a_100020591266_100000210326 [1,1,0,0,0,0|1,0,0]=3 4262 B11R0.40 CCCCCNCCC(C)CO 2230a_106354213184_100000210326 [1,1,0,0,0,0|2,0,0]=4 4263 B11R0.40 CCCCCNCCC(C)CO 34a_106354213184_100000718602 [1,1,0,0,0,0|2,0,0]=4 4264 B11R0.40 CCCCCOCCC(=O)OC 34a_100000210253_100000742370 [1,1,0,0,0,0|0,0,2]=4 4265 B11R0.40 CCCCCOCCC(=O)OC 7a_100000210253_100000204255 [1,1,0,0,0,0|0,0,2]=4 4266 B11R0.40 CCCCCOCCC(C)CC 7a_100011215188_100000210326 [1,1,0,0,0,0|1,0,0]=3 4267 B11R0.40 CCCCCOCCC(C)OC 7a_100000764861_100000210326 [1,1,0,0,0,0|0,0,0]=2 4268 B11R0.40 CCCCCSCCC(=O)OC 62a_100000204255_100000210326 [1,1,0,0,0,0|0,0,2]=4 4269 B11R0.40 CCCCCSCCC(=O)OC 62a_100000210326_100000204255 [1,1,0,0,0,0|0,0,2]=4 4270 B11R0.40 CCCCNCCCC(=O)OC 2230a_100000102301_100011218270 [1,1,0,0,0,0|0,0,2]=4 4271 B11R0.40 CCCCNCCCC(=O)OC 7a_106832991798_100011218270 [1,1,0,0,0,0|0,0,2]=4 4272 B11R0.40 CCCCNCCCN(C)CC 2230a_100000102301_100015186262 [1,1,0,0,0,0|2,0,0]=4 4273 B11R0.40 CCCCNCCCN(C)CC 7a_106832991798_100015186262 [1,1,0,0,0,0|2,0,0]=4 4274 B11R0.40 CCCCOCCCC(=O)OC 34a_100000210227_100000742333 [1,1,0,0,0,0|0,0,2]=4 4275 B11R0.40 CCCCOCCCC(=O)OC 7a_100000210227_100011218270 [1,1,0,0,0,0|0,0,2]=4 4276 B11R0.40 CCCCOCCCC(C)CC 7a_100011216074_100000210211 [1,1,0,0,0,0|1,0,0]=3 4277 B11R0.40 CCCCOCCCN(C)CC 7a_100000210227_100015186262 [1,1,0,0,0,0|2,0,0]=4 4278 B11R0.40 CCCCOCCC[C@@H](C)CN 34a_100160569302_100000210210 [1,1,0,0,0,0|2,0,0]=4 4279 B11R0.40 CCCCOCCNC(C)CC 2230a_100000209981_100000743108 [1,1,0,0,0,0|2,0,0]=4 4280 B11R0.40 CCCCOCCOC(C)CC 34a_100000210238_100011215416 [1,1,0,0,0,0|2,0,0]=4 4281 B11R0.40 CCCCOCCOC(C)CC 7a_100000210228_100000743108 [1,1,0,0,0,0|2,0,0]=4 4282 B11R0.40 CCCCOCCOC(C)CC 7a_100000210238_100000758301 [1,1,0,0,0,0|2,0,0]=4 4283 B11R0.40 CCCCOCCSC(C)CC 62a_100000743108_100000758301 [1,1,0,0,0,0|2,0,0]=4 4284 B11R0.40 CCCCOCCSC(C)CC 62a_100000758301_100000743108 [1,1,0,0,0,0|2,0,0]=4 4285 B11R0.40 CCCCOCCSC(C)OC 62a_100000743108_100009879195 [1,1,0,0,0,0|1,0,0]=3 4286 B11R0.40 CCCCOCCSC(C)OC 62a_100009879195_100000743108 [1,1,0,0,0,0|1,0,0]=3 4287 B11R0.40 CCCCOCNCC(C)CC 2230a_100020588543_100011995733 [1,1,0,0,0,0|2,0,0]=4 4288 B11R0.40 CCCCOCNCC(O)CC 2230a_100011218483_100011995733 [1,1,0,0,0,0|2,0,0]=4 4289 B11R0.40 CCCCOCNC[C@@H](C)OC 2230a_100020591295_100011995733 [1,1,0,0,0,0|1,0,0]=3 4290 B11R0.40 CCCCOCOCC(C)OC 34a_100000690652_100011995733 [1,1,0,0,0,0|1,0,0]=3 4291 B11R0.40 CCCCOCSCC(C)CC 62a_100000748023_100011995733 [1,1,0,0,0,0|2,0,0]=4 4292 B11R0.40 CCCCOCSCC(C)CC 62a_100011995733_100000748023 [1,1,0,0,0,0|2,0,0]=4 4293 B11R0.40 CCCCOCSCC(O)CC 62a_100011218378_100011995733 [1,1,0,0,0,0|2,0,0]=4 4294 B11R0.40 CCCCOCSCC(O)CC 62a_100011995733_100011218378 [1,1,0,0,0,0|2,0,0]=4 4295 B11R0.40 CCCCOCSC[C@@H](C)CC 62a_100009816398_100011995733 [1,1,0,0,0,0|2,0,0]=4 4296 B11R0.40 CCCCOCSC[C@@H](C)CC 62a_100011995733_100009816398 [1,1,0,0,0,0|2,0,0]=4 4297 B11R0.40 CCCCSCCCC(=O)OC 62a_100000210211_100011218270 [1,1,0,0,0,0|0,0,2]=4 4298 B11R0.40 CCCCSCCCC(=O)OC 62a_100011218270_100000210210 [1,1,0,0,0,0|0,0,2]=4 4299 B11R0.40 CCCCSCCCN(C)CC 62a_100000210211_100015186262 [1,1,0,0,0,0|2,0,0]=4 4300 B11R0.40 CCCCSCCNC(C)CC 2230a_100025743550_100000758301 [1,1,0,0,0,0|2,0,0]=4 4301 B11R0.40 CCCCSCCOC(C)CC 34a_200000230436_100011215416 [1,1,0,0,0,0|2,0,0]=4 4302 B11R0.40 CCCCSCCOC(C)CC 7a_200000230436_100000758301 [1,1,0,0,0,0|2,0,0]=4 4303 B11R0.40 CCCOCCCCC(=O)OC 34a_100000059025_100000210303 [1,1,0,0,0,0|0,0,2]=4 4304 B11R0.40 CCCOCCCCC(=O)OC 34a_100000210258_100000204269 [1,1,0,0,0,0|0,0,2]=4 4305 B11R0.40 CCCOCCCCC(=O)OC 7a_100000059025_100000210303 [1,1,0,0,0,0|0,0,2]=4 4306 B11R0.40 CCCOCCCNC(C)CC 2230a_100011217757_100000758301 [1,1,0,0,0,0|2,0,0]=4 4307 B11R0.40 CCCOCCCNC(C)CC 34a_100011217757_100011215416 [1,1,0,0,0,0|2,0,0]=4 4308 B11R0.40 CCCOCCNCC(C)CC 2230a_100020588543_100011215938 [1,1,0,0,0,0|2,0,0]=4 4309 B11R0.40 CCCOCCNCC(C)CC 2230a_100161115042_100000748023 [1,1,0,0,0,0|2,0,0]=4 4310 B11R0.40 CCCOCCNCC(C)CC 270004a_100161115042_100000243153 [1,1,0,0,0,0|2,0,0]=4 4311 B11R0.40 CCCOCCNCC(C)CC 34a_100161115042_100000748023 [1,1,0,0,0,0|2,0,0]=4 4312 B11R0.40 CCCOCCNCC(O)CC 2230a_100011218483_100011215938 [1,1,0,0,0,0|2,0,0]=4 4313 B11R0.40 CCCOCCNCC(O)CC 2230a_100161115042_100011218378 [1,1,0,0,0,0|2,0,0]=4 4314 B11R0.40 CCCOCCNCC(O)CC 34a_100161115042_100011218378 [1,1,0,0,0,0|2,0,0]=4 4315 B11R0.40 CCCOCCNC[C@@H](C)CC 2230a_100161115042_100009816398 [1,1,0,0,0,0|2,0,0]=4 4316 B11R0.40 CCCOCCNC[C@@H](C)CC 34a_100161115042_100009816398 [1,1,0,0,0,0|2,0,0]=4 4317 B11R0.40 CCCOCCNC[C@@H](C)OC 2230a_100020591295_100011215938 [1,1,0,0,0,0|1,0,0]=3 4318 B11R0.40 CCCOCCOCC(C)CC 34a_100000752267_100000748023 [1,1,0,0,0,0|2,0,0]=4 4319 B11R0.40 CCCOCCOCC(C)CC 7a_100000752267_100000748023 [1,1,0,0,0,0|2,0,0]=4 4320 B11R0.40 CCCOCCOCC(C)OC 34a_100000690652_100011215938 [1,1,0,0,0,0|1,0,0]=3 4321 B11R0.40 CCCOCCOCC(O)CC 34a_100000752267_100011218378 [1,1,0,0,0,0|2,0,0]=4 4322 B11R0.40 CCCOCCOCC(O)CC 7a_100000752267_100011218378 [1,1,0,0,0,0|2,0,0]=4 4323 B11R0.40 CCCOCCOC[C@@H](C)CC 34a_100000752267_100009816398 [1,1,0,0,0,0|2,0,0]=4 4324 B11R0.40 CCCOCCOC[C@@H](C)CC 7a_100000752267_100009816398 [1,1,0,0,0,0|2,0,0]=4 4325 B11R0.40 CCCOCCOC[C@@H](C)CC 7a_100009816381_100011215938 [1,1,0,0,0,0|2,0,0]=4 4326 B11R0.40 CCCOCCSCC(C)CC 62a_100000748023_100011215938 [1,1,0,0,0,0|2,0,0]=4 4327 B11R0.40 CCCOCCSCC(C)CC 62a_100011215938_100000748023 [1,1,0,0,0,0|2,0,0]=4 4328 B11R0.40 CCCOCCSCC(O)CC 62a_100011215938_100011218378 [1,1,0,0,0,0|2,0,0]=4 4329 B11R0.40 CCCOCCSCC(O)CC 62a_100011218378_100011215938 [1,1,0,0,0,0|2,0,0]=4 4330 B11R0.40 CCCOCCSC[C@@H](C)CC 62a_100009816398_100011215938 [1,1,0,0,0,0|2,0,0]=4 4331 B11R0.40 CCCOCCSC[C@@H](C)CC 62a_100011215938_100009816398 [1,1,0,0,0,0|2,0,0]=4 4332 B11R0.40 CCCSCCCCC(=O)OC 62a_100000204269_100000210303 [1,1,0,0,0,0|0,0,2]=4 4333 B11R0.40 CCCSCCCCC(=O)OC 62a_100000210303_100000204269 [1,1,0,0,0,0|0,0,2]=4 4334 B11R0.40 CCCSCCNCC(C)CC 2230a_100020603323_100000748023 [1,1,0,0,0,0|2,0,0]=4 4335 B11R0.40 CCCSCCNCC(C)CC 270004a_100020603323_100000243153 [1,1,0,0,0,0|2,0,0]=4 4336 B11R0.40 CCCSCCNCC(O)CC 2230a_100020603323_100011218378 [1,1,0,0,0,0|2,0,0]=4 4337 B11R0.40 CCCSCCNC[C@@H](C)CC 2230a_100020603323_100009816398 [1,1,0,0,0,0|2,0,0]=4 4338 B11R0.40 CCCSCCOCC(C)CC 34a_200000230433_100000748023 [1,1,0,0,0,0|2,0,0]=4 4339 B11R0.40 CCCSCCOCC(C)CC 7a_200000230433_100000748023 [1,1,0,0,0,0|2,0,0]=4 4340 B11R0.40 CCCSCCOCC(O)CC 34a_200000230433_100011218378 [1,1,0,0,0,0|2,0,0]=4 4341 B11R0.40 CCCSCCOCC(O)CC 7a_200000230433_100011218378 [1,1,0,0,0,0|2,0,0]=4 4342 B11R0.40 CCCSCCOC[C@@H](C)CC 34a_200000230433_100009816398 [1,1,0,0,0,0|2,0,0]=4 4343 B11R0.40 CCCSCCOC[C@@H](C)CC 7a_200000230433_100009816398 [1,1,0,0,0,0|2,0,0]=4 4344 B11R0.40 CCN(C)CCCCCCCO 2230a_100000225621_100000760002 [1,1,0,0,0,0|2,0,0]=4 4345 B11R0.40 CCN(C)CCCCCCCO 269982a_100000225621_100000760002 [1,1,0,0,0,0|2,0,0]=4 4346 B11R0.40 CCN(C)CCCCCCOC 2230a_100000225621_100011998445 [1,1,0,0,0,0|2,0,0]=4 4347 B11R0.40 CCN(C)CCCCCCOC 269982a_100000225621_100011998445 [1,1,0,0,0,0|2,0,0]=4 4348 B11R0.40 CCNCCCCCC(=O)OC 2230a_100015525214_100009816466 [1,1,0,0,0,0|0,0,2]=4 4349 B11R0.40 CCOCCCCCC(=O)OC 34a_100000074720_100000210202 [1,1,0,0,0,0|0,0,2]=4 4350 B11R0.40 CCOCCCCCC(=O)OC 34a_100121572206_100009816466 [1,1,0,0,0,0|0,0,2]=4 4351 B11R0.40 CCOCCCCCC(=O)OC 7a_100000074720_100000210202 [1,1,0,0,0,0|0,0,2]=4 4352 B11R0.40 CCOCCCCCC(C)CC 7a_200000035636_100000210202 [1,1,0,0,0,0|1,0,0]=3 4353 B11R0.40 CCOCCCNCC(C)CC 2230a_100000210961_100000748023 [1,1,0,0,0,0|2,0,0]=4 4354 B11R0.40 CCOCCCNCC(C)CC 2230a_100020588543_100012232248 [1,1,0,0,0,0|2,0,0]=4 4355 B11R0.40 CCOCCCNCC(C)CC 270004a_100000210961_100000243153 [1,1,0,0,0,0|2,0,0]=4 4356 B11R0.40 CCOCCCNCC(C)CC 34a_100000210961_100000748023 [1,1,0,0,0,0|2,0,0]=4 4357 B11R0.40 CCOCCCNCC(O)CC 2230a_100000210961_100011218378 [1,1,0,0,0,0|2,0,0]=4 4358 B11R0.40 CCOCCCNCC(O)CC 2230a_100011218483_100012232248 [1,1,0,0,0,0|2,0,0]=4 4359 B11R0.40 CCOCCCNCC(O)CC 34a_100000210961_100011218378 [1,1,0,0,0,0|2,0,0]=4 4360 B11R0.40 CCOCCCNC[C@@H](C)CC 2230a_100000210961_100009816398 [1,1,0,0,0,0|2,0,0]=4 4361 B11R0.40 CCOCCCNC[C@@H](C)CC 34a_100000210961_100009816398 [1,1,0,0,0,0|2,0,0]=4 4362 B11R0.40 CCOCCCNC[C@@H](C)OC 2230a_100020591295_100012232248 [1,1,0,0,0,0|1,0,0]=3 4363 B11R0.40 CCOCCCOCC(C)CC 34a_100000757476_100000748023 [1,1,0,0,0,0|2,0,0]=4 4364 B11R0.40 CCOCCCOCC(C)CC 7a_100000757476_100000748023 [1,1,0,0,0,0|2,0,0]=4 4365 B11R0.40 CCOCCCOCC(C)OC 34a_100000690652_100012232248 [1,1,0,0,0,0|1,0,0]=3 4366 B11R0.40 CCOCCCOCC(O)CC 34a_100000757476_100011218378 [1,1,0,0,0,0|2,0,0]=4 4367 B11R0.40 CCOCCCOCC(O)CC 7a_100000757476_100011218378 [1,1,0,0,0,0|2,0,0]=4 4368 B11R0.40 CCOCCCOC[C@@H](C)CC 34a_100000757476_100009816398 [1,1,0,0,0,0|2,0,0]=4 4369 B11R0.40 CCOCCCOC[C@@H](C)CC 7a_100000757476_100009816398 [1,1,0,0,0,0|2,0,0]=4 4370 B11R0.40 CCOCCCOC[C@@H](C)CC 7a_100009816381_100012232248 [1,1,0,0,0,0|2,0,0]=4 4371 B11R0.40 CCOCCCSCC(C)CC 62a_100000748023_100012232248 [1,1,0,0,0,0|2,0,0]=4 4372 B11R0.40 CCOCCCSCC(C)CC 62a_100012232248_100000748023 [1,1,0,0,0,0|2,0,0]=4 4373 B11R0.40 CCOCCCSCC(O)CC 62a_100011218378_100012232248 [1,1,0,0,0,0|2,0,0]=4 4374 B11R0.40 CCOCCCSCC(O)CC 62a_100012232248_100011218378 [1,1,0,0,0,0|2,0,0]=4 4375 B11R0.40 CCOCCCSC[C@@H](C)CC 62a_100009816398_100012232248 [1,1,0,0,0,0|2,0,0]=4 4376 B11R0.40 CCOCCCSC[C@@H](C)CC 62a_100012232248_100009816398 [1,1,0,0,0,0|2,0,0]=4 4377 B11R0.40 CCOCCNCCC(C)CC 2230a_100020591266_100011215890 [1,1,0,0,0,0|2,0,0]=4 4378 B11R0.40 CCOCCOCCC(C)CC 7a_100011215188_100011215890 [1,1,0,0,0,0|2,0,0]=4 4379 B11R0.40 CCOCCOCCC(C)OC 7a_100000764861_100011215890 [1,1,0,0,0,0|1,0,0]=3 4380 B11R0.40 CCSCCCCCC(=O)OC 62a_100000210202_100009816466 [1,1,0,0,0,0|0,0,2]=4 4381 B11R0.40 CCSCCCCCC(=O)OC 62a_100009816466_100000210202 [1,1,0,0,0,0|0,0,2]=4 4382 B11R0.40 CCSCCCOCC(C)CC 34a_100011216438_100000748023 [1,1,0,0,0,0|2,0,0]=4 4383 B11R0.40 CCSCCCOCC(C)CC 7a_100011216438_100000748023 [1,1,0,0,0,0|2,0,0]=4 4384 B11R0.40 CCSCCCOCC(O)CC 34a_100011216438_100011218378 [1,1,0,0,0,0|2,0,0]=4 4385 B11R0.40 CCSCCCOCC(O)CC 7a_100011216438_100011218378 [1,1,0,0,0,0|2,0,0]=4 4386 B11R0.40 CCSCCCOC[C@@H](C)CC 34a_100011216438_100009816398 [1,1,0,0,0,0|2,0,0]=4 4387 B11R0.40 CCSCCCOC[C@@H](C)CC 7a_100011216438_100009816398 [1,1,0,0,0,0|2,0,0]=4 4388 B11R0.40 CCSCCNCCC(C)CC 2230a_100020591266_100000757381 [1,1,0,0,0,0|2,0,0]=4 4389 B11R0.40 CCSCCOCCC(C)CC 7a_100011215188_100000757381 [1,1,0,0,0,0|2,0,0]=4 4390 B11R0.40 CCSCCOCCC(C)OC 7a_100000764861_100000757381 [1,1,0,0,0,0|1,0,0]=3 4391 B11R0.40 CC[C@H](C)CNCCCCCO 2230a_100000762737_100009816398 [1,1,0,0,0,0|2,0,0]=4 4392 B11R0.40 CC[C@H](C)CNCCCCCO 34a_100000762737_100009816398 [1,1,0,0,0,0|2,0,0]=4 4393 B11R0.40 CC[C@H](C)COCCCCCBr 34a_100000746331_100009816398 [1,1,0,0,0,0|2,0,0]=4 4394 B11R0.40 CC[C@H](C)COCCCCCBr 7a_100000746331_100009816398 [1,1,0,0,0,0|2,0,0]=4 4395 B11R0.40 CC[C@H](C)COCCCCCCl 34a_100000746330_100009816398 [1,1,0,0,0,0|2,0,0]=4 4396 B11R0.40 CC[C@H](C)COCCCCCCl 7a_100000746330_100009816398 [1,1,0,0,0,0|2,0,0]=4 4397 B11R0.40 CC[C@H](C)COCCCCCF 7a_100009816381_100000729378 [1,1,0,0,0,0|2,0,0]=4 4398 B11R0.40 CC[C@H](C)COCCCCCI 34a_200012148887_100009816398 [1,1,0,0,0,0|2,0,0]=4 4399 B11R0.40 CC[C@H](C)COCCCCCI 7a_200012148887_100009816398 [1,1,0,0,0,0|2,0,0]=4 4400 B11R0.40 CC[C@H](C)COCCCCCN 34a_100000762737_100009816398 [1,1,0,0,0,0|2,0,0]=4 4401 B11R0.40 CC[C@H](C)COCCCCCO 7a_100009816381_100000746330 [1,1,0,0,0,0|2,0,0]=4 4402 B11R0.40 CC[C@H](C)COCCCCOC 34a_100000740925_100009816398 [1,1,0,0,0,0|2,0,0]=4 4403 B11R0.40 CC[C@H](C)COCCCCOC 7a_100009816381_100000730899 [1,1,0,0,0,0|2,0,0]=4 4404 B11R0.40 CC[C@H](C)COCCCCSC 34a_100011217163_100009816398 [1,1,0,0,0,0|2,0,0]=4 4405 B11R0.40 CC[C@H](C)COCCCCSC 7a_100011217163_100009816398 [1,1,0,0,0,0|2,0,0]=4 4406 B11R0.40 CC[C@H](C)CSCCCCCF 62a_100000729378_100009816398 [1,1,0,0,0,0|2,0,0]=4 4407 B11R0.40 CC[C@H](C)CSCCCCCF 62a_100009816398_100000729378 [1,1,0,0,0,0|2,0,0]=4 4408 B11R0.40 CC[C@H](C)CSCCCCCO 62a_100000746330_100009816398 [1,1,0,0,0,0|2,0,0]=4 4409 B11R0.40 CC[C@H](C)CSCCCCCO 62a_100009816398_100000746330 [1,1,0,0,0,0|2,0,0]=4 4410 B11R0.40 CC[C@H](C)CSCCCCOC 62a_100000730899_100009816398 [1,1,0,0,0,0|2,0,0]=4 4411 B11R0.40 CC[C@H](C)CSCCCCOC 62a_100009816398_100000730899 [1,1,0,0,0,0|2,0,0]=4 4412 B11R0.40 CNCCCCCCC(=O)OC 2230a_106832991635_100009815986 [1,1,0,0,0,0|0,0,2]=4 4413 B11R0.40 CNCCCCCCC(=O)OC 34a_100102657272_100009815986 [1,1,0,0,0,0|0,0,2]=4 4414 B11R0.40 CNCCCCCCC(=O)OC 7a_106832991635_100009815986 [1,1,0,0,0,0|0,0,2]=4 4415 B11R0.40 COC(=O)CCCCCCO[13CH3] 34a_100009863599_200025704644 [1,1,0,0,0,0|0,0,2]=4 4416 B11R0.40 COC(=O)CCCCCCO[13CH3] 7a_100009863599_200025704644 [1,1,0,0,0,0|0,0,2]=4 4417 B11R0.40 COC(=O)CCCCCCSC 62a_100009815986_200000210301 [1,1,0,0,0,0|0,0,2]=4 4418 B11R0.40 COC(=O)CCCCCCSC 62a_200000210301_100009815986 [1,1,0,0,0,0|0,0,2]=4 4419 B11R0.40 COC(=O)CCCCCCS[13CH3] 62a_100009815986_200025704644 [1,1,0,0,0,0|0,0,2]=4 4420 B11R0.40 COC(=O)CCCCCCS[13CH3] 62a_200025704644_100009815986 [1,1,0,0,0,0|0,0,2]=4 4421 B11R0.40 COC(C)CCOCCCC#N 7a_100000764861_100000687738 [1,1,0,0,0,0|1,0,1]=4 4422 B11R0.40 COC(C)CCOCCCC=O 7a_100000764861_200011292268 [1,1,0,0,0,0|1,0,1]=4 4423 B11R0.40 COC(C)CCOCCCCF 7a_100000764861_100000729493 [1,1,0,0,0,0|1,0,0]=3 4424 B11R0.40 COC(C)CCOCCCCO 7a_100000764861_100000210776 [1,1,0,0,0,0|1,0,0]=3 4425 B11R0.40 COC(C)COCCCCCF 34a_100000690652_100000729378 [1,1,0,0,0,0|1,0,0]=3 4426 B11R0.40 COC(C)COCCCCCO 34a_100000690652_100000746330 [1,1,0,0,0,0|1,0,0]=3 4427 B11R0.40 COC(C)COCCOCCO 34a_100000690652_100000692535 [1,1,0,0,0,0|2,0,0]=4 4428 B11R0.40 COC(C)SCCCCCC#N 62a_100009813376_100009879195 [1,1,0,0,0,0|1,0,1]=4 4429 B11R0.40 COC(C)SCCCCCC#N 62a_100009879195_100009813376 [1,1,0,0,0,0|1,0,1]=4 4430 B11R0.40 COC(C)SCCCCCC=O 62a_100000139337_100009879195 [1,1,0,0,0,0|1,0,1]=4 4431 B11R0.40 COC(C)SCCCCCC=O 62a_100009879195_100000139337 [1,1,0,0,0,0|1,0,1]=4 4432 B11R0.40 COC(C)SCCCCCCF 62a_100009879195_100015922095 [1,1,0,0,0,0|1,0,0]=3 4433 B11R0.40 COC(C)SCCCCCCF 62a_100015922095_100009879195 [1,1,0,0,0,0|1,0,0]=3 4434 B11R0.40 COC(C)SCCCCCCO 62a_100000766143_100009879195 [1,1,0,0,0,0|1,0,0]=3 4435 B11R0.40 COC(C)SCCCCCCO 62a_100009879195_100000766143 [1,1,0,0,0,0|1,0,0]=3 4436 B11R0.40 COCCCCCCC(=O)OC 34a_100009863599_200000210301 [1,1,0,0,0,0|0,0,2]=4 4437 B11R0.40 COCCCCCCC(=O)OC 34a_100138415774_100009815986 [1,1,0,0,0,0|0,0,2]=4 4438 B11R0.40 COCCCCCCC(=O)OC 7a_100009863599_200000210301 [1,1,0,0,0,0|0,0,2]=4 4439 B11R0.40 COCCCCNC[C@@H](C)OC 2230a_100020591295_100000730899 [1,1,0,0,0,0|1,0,0]=3 4440 B11R0.40 COCCCCOCC(C)OC 34a_100000690652_100000755781 [1,1,0,0,0,0|1,0,0]=3 4441 B11R0.40 COCCCOCCC(C)OC 7a_100000764861_100000740836 [1,1,0,0,0,0|1,0,0]=3 4442 B11R0.40 COCCOCCSC(C)OC 62a_100000695917_100009879195 [1,1,0,0,0,0|2,0,0]=4 4443 B11R0.40 COCCOCCSC(C)OC 62a_100009879195_100000695917 [1,1,0,0,0,0|2,0,0]=4 4444 B11R0.40 COCCOCNC[C@@H](C)OC 2230a_100020591295_100000231047 [1,1,0,0,0,0|2,0,0]=4 4445 B11R0.40 CO[C@H](C)CNCCCCC#N 2230a_100020591295_100000211819 [1,1,0,0,0,0|1,0,1]=4 4446 B11R0.40 CO[C@H](C)CNCCCCC=O 2230a_100020591295_100000139335 [1,1,0,0,0,0|1,0,1]=4 4447 B11R0.40 CO[C@H](C)CNCCCCCF 2230a_100020591295_100000729378 [1,1,0,0,0,0|1,0,0]=3 4448 B11R0.40 CO[C@H](C)CNCCCCCO 2230a_100020591295_100000746330 [1,1,0,0,0,0|1,0,0]=3 4449 B11R0.40 CO[C@H](C)CNCCOCCO 2230a_100020591295_100011215305 [1,1,0,0,0,0|2,0,0]=4 4450 B11R0.42 C=C(C)C(C)NCCCCCC 269862a_100000210581_100011216138 [1,1,0,0,0,0|2,0,0]=4 4451 B11R0.42 CCCCCCCC(C)C(=O)C 1458a_100000070787_200011218727 [1,1,0,0,0,0|1,0,0]=3 4452 B11R0.42 CCCCCCCC(C)N(C)C 2230a_100102631434_200011218727 [1,1,0,0,0,0|1,0,0]=3 4453 B11R0.42 CCCCCCCC(C)N(C)C 269982a_100102631434_200011218727 [1,1,0,0,0,0|1,0,0]=3 4454 B11R0.42 CCCCCCCC(C)N(C)C 270004a_100102631434_100000210596 [1,1,0,0,0,0|1,0,0]=3 4455 B11R0.42 CCCCCCCN(C)C(=O)C 11a_100000228206_100015343762 [1,1,0,0,0,0|2,0,0]=4 4456 B11R0.42 CCCCCCCN(C)C(=O)C 1626a_100000228206_100015343762 [1,1,0,0,0,0|2,0,0]=4 4457 B11R0.42 CCCCCCCN(C)C(=O)C 240690a_100000228206_100015343762 [1,1,0,0,0,0|2,0,0]=4 4458 B11R0.42 CCCCCCCN(C)C(=O)C 527a_100000228206_100103153847 [1,1,0,0,0,0|2,0,0]=4 4459 B11R0.42 CCCCCCCN(C)C(C)C 2230a_100000228206_100000210206 [1,1,0,0,0,0|2,0,0]=4 4460 B11R0.42 CCCCCCCN(C)C(C)C 269982a_100000228206_100000210206 [1,1,0,0,0,0|2,0,0]=4 4461 B11R0.42 CCCCCCCN(C)C(C)C 269982a_200000211004_100000210681 [1,1,0,0,0,0|2,0,0]=4 4462 B11R0.42 CCCCCCNC(C)C(=O)C 2230a_100000210581_100009814033 [1,1,0,0,0,0|2,0,0]=4 4463 B11R0.42 CCCCCCNC(C)C(C)C 2230a_100000211541_100000210314 [1,1,0,0,0,0|2,0,0]=4 4464 B11R0.42 CCCCCCOC(C)C(=O)C 34a_100000212229_100000210314 [1,1,0,0,0,0|2,0,0]=4 4465 B11R0.42 CCCCCCOC(C)C(=O)C 7a_100000210259_100000179758 [1,1,0,0,0,0|2,0,0]=4 4466 B11R0.42 CCCCCCOC(C)C(C)C 7a_100000748068_100000210314 [1,1,0,0,0,0|2,0,0]=4 4467 B11R0.42 CCCCCCSC(C)C(=O)C 62a_100000210314_100009814033 [1,1,0,0,0,0|2,0,0]=4 4468 B11R0.42 CCCCCCSC(C)C(=O)C 62a_100009814033_100000210757 [1,1,0,0,0,0|2,0,0]=4 4469 B11R0.42 CCCCCNCC(O)C(C)C 2230a_100000759067_100000210326 [1,1,0,0,0,0|2,0,0]=4 4470 B11R0.42 CCCCCNCC(O)C(C)C 34a_100000759067_100000718602 [1,1,0,0,0,0|2,0,0]=4 4471 B11R0.42 CCCCCOCC(C)C(=O)C 34a_100000032740_100000718602 [1,1,0,0,0,0|2,0,0]=4 4472 B11R0.42 CCCCCOCC(C)C(=O)C 7a_100000032740_100000210326 [1,1,0,0,0,0|2,0,0]=4 4473 B11R0.49 CCCCCCCC(C)(C)NC 34a_100102657272_200000046972 [1,1,0,0,0,0|1,0,0]=3 4474 B11R0.49 CCCCCCCC(C)(C)NC 7a_106832991635_200000046972 [1,1,0,0,0,0|1,0,0]=3 4475 B11R0.49 CCCCCCCC(C)(C)OC 34a_100138415774_200000046972 [1,1,0,0,0,0|0,0,0]=2 4476 B11R0.49 CCCCCCCC(C)(C)SC 62a_200000046972_200000210301 [1,1,0,0,0,0|0,1,0]=3 4477 B11R0.49 CCCCCCCC(C)(C)SC 62a_200000210301_200000046972 [1,1,0,0,0,0|0,1,0]=3 4478 B11R0.49 CCCCCCCC(C)(C)S[13CH3] 62a_200000046972_200025704644 [1,1,0,0,0,0|0,1,0]=3 4479 B11R0.49 CCCCCCCC(C)(C)S[13CH3] 62a_200025704644_200000046972 [1,1,0,0,0,0|0,1,0]=3 4480 B11R0.49 CCCCCCNC(C)(C)CC 2230a_100000211385_100000210314 [1,1,0,0,0,0|2,0,0]=4 4481 B11R0.49 CCCCCCOC(C)(C)CC 7a_100000210230_100000210314 [1,1,0,0,0,0|2,0,0]=4 4482 B11R0.49 CCCCCCOC(C)(C)CC 7a_100000210259_100000210677 [1,1,0,0,0,0|2,0,0]=4 4483 B11R0.49 CCCCCCSC(C)(C)CC 62a_100000032637_100000210757 [1,1,0,0,0,0|2,0,0]=4 4484 B11R0.49 CCCCCCSC(C)(C)CC 62a_100000210314_100000032637 [1,1,0,0,0,0|2,0,0]=4 4485 B11R0.49 CCCCCNCC(C)(C)OC 2230a_100000763424_100000210326 [1,1,0,0,0,0|1,0,0]=3 4486 B11R0.49 CCCCCNCC(C)(C)SC 270004a_100000209983_100009845794 [1,1,0,0,0,0|1,1,0]=4 4487 B11R0.49 CCCCCOCC(C)(C)CC 7a_100000765029_100000210326 [1,1,0,0,0,0|2,0,0]=4 4488 B11R0.49 CCCCCOCC(C)(C)OC 34a_100000210253_100000701081 [1,1,0,0,0,0|1,0,0]=3 4489 B11R0.49 CCCCCSCC(C)(C)OC 62a_100000210326_100000701081 [1,1,0,0,0,0|1,0,0]=3 4490 B11R0.49 CCCCCSCC(C)(C)OC 62a_100000701081_100000210326 [1,1,0,0,0,0|1,0,0]=3 4491 B11R0.49 CCCCOCCC(C)(C)OC 7a_100000699976_100000210211 [1,1,0,0,0,0|1,0,0]=3 4492 B11R0.49 CCOCCNCC(C)(C)OC 2230a_100000763424_100011215890 [1,1,0,0,0,0|2,0,0]=4 4493 B11R0.49 CCOCCNCC(C)(C)OC 34a_102516460346_100000701081 [1,1,0,0,0,0|2,0,0]=4 4494 B11R0.49 CCOCCOCC(C)(C)OC 34a_100000210136_100000701081 [1,1,0,0,0,0|2,0,0]=4 4495 B11R0.49 CCOCCSCC(C)(C)OC 62a_100000210147_100000701081 [1,1,0,0,0,0|2,0,0]=4 4496 B11R0.49 CCOCCSCC(C)(C)OC 62a_100000701081_100011215890 [1,1,0,0,0,0|2,0,0]=4 4497 B11R0.49 CCSCCNCC(C)(C)OC 2230a_100000763424_100000757381 [1,1,0,0,0,0|2,0,0]=4 4498 B11R0.49 CCSCCOCC(C)(C)OC 34a_100000212035_100000701081 [1,1,0,0,0,0|2,0,0]=4 4499 B11R0.49 CCSCCSCC(C)(C)OC 62a_100000701081_100000757381 [1,1,0,0,0,0|2,0,0]=4 4500 B11R0.49 CCSCCSCC(C)(C)OC 62a_100000757381_100000701081 [1,1,0,0,0,0|2,0,0]=4 4501 B11R0.49 CNCCCOCC(C)(C)OC 34a_100000213112_100000701081 [1,1,0,0,0,0|2,0,0]=4 4502 B11R0.49 COC(C)(C)CCOCCCF 7a_100000699976_100011934791 [1,1,0,0,0,0|2,0,0]=4 4503 B11R0.49 COC(C)(C)CCOCCCO 7a_100000699976_100011215043 [1,1,0,0,0,0|2,0,0]=4 4504 B11R0.49 COC(C)(C)CCOCCSC 7a_100000699976_100000212216 [1,1,0,0,0,0|2,0,0]=4 4505 B11R0.49 COC(C)(C)CNCCCCF 2230a_100000763424_100000729493 [1,1,0,0,0,0|2,0,0]=4 4506 B11R0.49 COC(C)(C)CNCCCCO 2230a_100000763424_100000210776 [1,1,0,0,0,0|2,0,0]=4 4507 B11R0.49 COC(C)(C)CNCCCCO 34a_100000750430_100000701081 [1,1,0,0,0,0|2,0,0]=4 4508 B11R0.49 COC(C)(C)COCCCCBr 34a_100011216708_100000701081 [1,1,0,0,0,0|2,0,0]=4 4509 B11R0.49 COC(C)(C)COCCCCCl 34a_100000210776_100000701081 [1,1,0,0,0,0|2,0,0]=4 4510 B11R0.49 COC(C)(C)COCCCCF 34a_100011995726_100000701081 [1,1,0,0,0,0|2,0,0]=4 4511 B11R0.49 COC(C)(C)COCCCCI 34a_200012148704_100000701081 [1,1,0,0,0,0|2,0,0]=4 4512 B11R0.49 COC(C)(C)COCCCCN 34a_100000750430_100000701081 [1,1,0,0,0,0|2,0,0]=4 4513 B11R0.49 COC(C)(C)COCCCSC 34a_100000690336_100000701081 [1,1,0,0,0,0|2,0,0]=4 4514 B11R0.49 COC(C)(C)CSCCCCF 62a_100000701081_100000729493 [1,1,0,0,0,0|2,0,0]=4 4515 B11R0.49 COC(C)(C)CSCCCCF 62a_100000729493_100000701081 [1,1,0,0,0,0|2,0,0]=4 4516 B11R0.49 COC(C)(C)CSCCCCO 62a_100000210776_100000701081 [1,1,0,0,0,0|2,0,0]=4 4517 B11R0.49 COC(C)(C)CSCCCCO 62a_100000701081_100000210776 [1,1,0,0,0,0|2,0,0]=4 4518 B11R0.49 COCCCNCC(C)(C)OC 2230a_100000763424_100000740836 [1,1,0,0,0,0|2,0,0]=4 4519 B11R0.49 COCCCNCC(C)(C)OC 34a_100150723488_100000701081 [1,1,0,0,0,0|2,0,0]=4 4520 B11R0.49 COCCCOCC(C)(C)OC 34a_100000740835_100000701081 [1,1,0,0,0,0|2,0,0]=4 4521 B11R0.49 COCCCSCC(C)(C)OC 62a_100000701081_100000709357 [1,1,0,0,0,0|2,0,0]=4 4522 B11R0.49 COCCCSCC(C)(C)OC 62a_100000709357_100000701081 [1,1,0,0,0,0|2,0,0]=4 4523 B11R0.49 COCCOCCC(C)(C)OC 7a_100000699976_100000233755 [1,1,0,0,0,0|2,0,0]=4 4524 B11R0.70 CCCCC(=O)CCC(C)CC 1458a_100000701222_100000210211 [1,1,0,0,0,0|1,0,1]=4 4525 B11R0.70 CCCCC(=O)NC[C@@H](C)OC 11a_100020591295_100000210183 [1,1,0,0,0,0|1,0,1]=4 4526 B11R0.70 CCCCC(=O)NC[C@@H](C)OC 1626a_100020591295_100000210183 [1,1,0,0,0,0|1,0,1]=4 4527 B11R0.70 CCCCC(=O)NC[C@@H](C)OC 240690a_100020591295_100000210183 [1,1,0,0,0,0|1,0,1]=4 4528 B11R0.70 CCCCC(=O)NC[C@@H](C)OC 527a_100020591295_100000210183 [1,1,0,0,0,0|1,0,1]=4 4529 B11R0.70 CCCCC(C)COC(C)CC 34a_100011995851_100011215416 [1,1,0,0,0,0|2,0,0]=4 4530 B11R0.70 CCCCC(C)COC(C)CC 7a_100011995851_100000758301 [1,1,0,0,0,0|2,0,0]=4 4531 B11R0.70 CCCCC(C)NCC(C)CC 2230a_100000126638_100000748023 [1,1,0,0,0,0|2,0,0]=4 4532 B11R0.70 CCCCC(C)NCC(C)CC 2230a_100020588543_200011215066 [1,1,0,0,0,0|2,0,0]=4 4533 B11R0.70 CCCCC(C)NCC(C)CC 270004a_100000126638_100000243153 [1,1,0,0,0,0|2,0,0]=4 4534 B11R0.70 CCCCC(C)NCC(C)CC 270004a_100020588543_100000210087 [1,1,0,0,0,0|2,0,0]=4 4535 B11R0.70 CCCCC(C)NCC(O)CC 2230a_100000126638_100011218378 [1,1,0,0,0,0|2,0,0]=4 4536 B11R0.70 CCCCC(C)NCC(O)CC 2230a_100011218483_200011215066 [1,1,0,0,0,0|2,0,0]=4 4537 B11R0.70 CCCCC(C)NCC(O)CC 270004a_100011218483_100000210087 [1,1,0,0,0,0|2,0,0]=4 4538 B11R0.70 CCCCC(C)NC[C@@H](C)CC 2230a_100000126638_100009816398 [1,1,0,0,0,0|2,0,0]=4 4539 B11R0.70 CCCCC(C)NC[C@@H](C)OC 2230a_100020591295_200011215066 [1,1,0,0,0,0|1,0,0]=3 4540 B11R0.70 CCCCC(C)NC[C@@H](C)OC 270004a_100020591295_100000210087 [1,1,0,0,0,0|1,0,0]=3 4541 B11R0.70 CCCCC(C)OCC(C)CC 34a_100000687866_100000748023 [1,1,0,0,0,0|2,0,0]=4 4542 B11R0.70 CCCCC(C)OCC(C)CC 7a_100000687866_100000748023 [1,1,0,0,0,0|2,0,0]=4 4543 B11R0.70 CCCCC(C)OCC(C)OC 34a_100000690652_200011215066 [1,1,0,0,0,0|1,0,0]=3 4544 B11R0.70 CCCCC(C)OCC(O)CC 34a_100000687866_100011218378 [1,1,0,0,0,0|2,0,0]=4 4545 B11R0.70 CCCCC(C)OCC(O)CC 7a_100000687866_100011218378 [1,1,0,0,0,0|2,0,0]=4 4546 B11R0.70 CCCCC(C)OC[C@@H](C)CC 34a_100000687866_100009816398 [1,1,0,0,0,0|2,0,0]=4 4547 B11R0.70 CCCCC(C)OC[C@@H](C)CC 7a_100000687866_100009816398 [1,1,0,0,0,0|2,0,0]=4 4548 B11R0.70 CCCCC(C)OC[C@@H](C)CC 7a_100009816381_200011215066 [1,1,0,0,0,0|2,0,0]=4 4549 B11R0.70 CCCCC(C)SCC(C)CC 62a_100000748023_200011215066 [1,1,0,0,0,0|2,0,0]=4 4550 B11R0.70 CCCCC(C)SCC(C)CC 62a_200011215066_100000748023 [1,1,0,0,0,0|2,0,0]=4 4551 B11R0.70 CCCCC(C)SCC(O)CC 62a_100011218378_200011215066 [1,1,0,0,0,0|2,0,0]=4 4552 B11R0.70 CCCCC(C)SCC(O)CC 62a_200011215066_100011218378 [1,1,0,0,0,0|2,0,0]=4 4553 B11R0.70 CCCCC(C)SC[C@@H](C)CC 62a_100009816398_200011215066 [1,1,0,0,0,0|2,0,0]=4 4554 B11R0.70 CCCCC(C)SC[C@@H](C)CC 62a_200011215066_100009816398 [1,1,0,0,0,0|2,0,0]=4 4555 B11R0.70 CCCC[C@H](N)COC(C)CC 34a_100011934283_100011215416 [1,1,0,0,0,0|2,0,0]=4 4556 B11R0.70 CCCOC(C)CCC(C)CC 7a_200011216552_100000210303 [1,1,0,0,0,0|2,0,0]=4 4557 B11R0.70 CCSCC(C)NC[C@@H](C)OC 270004a_100020591295_200011216171 [1,1,0,0,0,0|2,0,0]=4 4558 B11R0.70 COCCC(C)NC[C@@H](C)OC 270004a_100020591295_100000742357 [1,1,0,0,0,0|2,0,0]=4 4559 B11R0.70 CO[C@H](C)CNC(C)CCSC 270004a_100020591295_100011217047 [1,1,0,0,0,0|2,0,0]=4 4560 B11R0.106 CCC(=O)COCCC(C)OC 7a_100000764861_100000747405 [1,1,0,0,0,0|1,0,1]=4 4561 B11R0.106 CCC(C)CCCOC(C)CC 7a_100011216074_100000758301 [1,1,0,0,0,0|2,0,0]=4 4562 B11R0.106 CCC(C)CCNCC(C)CC 2230a_100020591266_100000748023 [1,1,0,0,0,0|2,0,0]=4 4563 B11R0.106 CCC(C)CCNCC(C)CC 270004a_100020591266_100000243153 [1,1,0,0,0,0|2,0,0]=4 4564 B11R0.106 CCC(C)CCNCC(O)CC 2230a_100020591266_100011218378 [1,1,0,0,0,0|2,0,0]=4 4565 B11R0.106 CCC(C)CCNC[C@@H](C)CC 2230a_100020591266_100009816398 [1,1,0,0,0,0|2,0,0]=4 4566 B11R0.106 CCC(C)CCOCC(C)CC 7a_100011215188_100000748023 [1,1,0,0,0,0|2,0,0]=4 4567 B11R0.106 CCC(C)CCOCC(O)CC 7a_100011215188_100011218378 [1,1,0,0,0,0|2,0,0]=4 4568 B11R0.106 CCC(C)CCOC[C@@H](C)CC 7a_100011215188_100009816398 [1,1,0,0,0,0|2,0,0]=4 4569 B11R0.106 CCC(C)COCCC(C)OC 7a_100000764861_100000748023 [1,1,0,0,0,0|1,0,0]=3 4570 B11R0.106 CCC(O)COCCC(C)OC 7a_100000764861_100011218378 [1,1,0,0,0,0|1,0,0]=3 4571 B11R0.106 CCN(C)CCCSC(C)OC 62a_100009879195_100015186262 [1,1,0,0,0,0|2,0,0]=4 4572 B11R0.106 CC[C@H](C)COCCC(C)OC 7a_100000764861_100009816398 [1,1,0,0,0,0|1,0,0]=3 4573 B11R0.106 COC(C)CCOCC(O)CO 7a_100000764861_100011219619 [1,1,0,0,0,0|2,0,0]=4 4574 B11R0.106 COC(C)CCOC[C@@H](C)CO 7a_100000764861_100000059175 [1,1,0,0,0,0|2,0,0]=4 4575 B11R0.106 COC(C)CCOC[C@@H](O)CF 7a_100000764861_100015614560 [1,1,0,0,0,0|2,0,0]=4 4576 B11R0.106 COC(C)CCOC[C@@H](O)CO 7a_100000764861_100009815848 [1,1,0,0,0,0|2,0,0]=4 4577 B11R0.111 C=C(C)CCOCCC(C)OC 7a_100000764861_100000730704 [1,1,0,0,0,0|1,0,1]=4 4578 B11R0.111 CCC(C)CCCOCC(C)C 7a_100011216074_100000210760 [1,1,0,0,0,0|2,0,0]=4 4579 B11R0.111 CCC(C)CCCOCC(C)O 7a_100011216074_100011218427 [1,1,0,0,0,0|2,0,0]=4 4580 B11R0.111 CCC(C)CCCOC[C@@H](C)O 7a_100011216074_100009817552 [1,1,0,0,0,0|2,0,0]=4 4581 B11R0.111 CCC(C)CCNCCC(C)C 2230a_100020591266_100000210312 [1,1,0,0,0,0|2,0,0]=4 4582 B11R0.111 CCC(C)CCNCCC(C)C 269862a_100020591266_100000185833 [1,1,0,0,0,0|2,0,0]=4 4583 B11R0.111 CCC(C)CCNCCC(C)O 2230a_100020591266_100012276601 [1,1,0,0,0,0|2,0,0]=4 4584 B11R0.111 CCC(C)CCOCCC(C)C 7a_100011215188_100000210626 [1,1,0,0,0,0|2,0,0]=4 4585 B11R0.111 CCC(C)CCOCCC(C)O 7a_100011215188_100012276601 [1,1,0,0,0,0|2,0,0]=4 4586 B11R0.111 CCC(C)CNCCCC(C)C 2230a_100020588543_100011214892 [1,1,0,0,0,0|2,0,0]=4 4587 B11R0.111 CCC(C)CNCCCC(C)C 2230a_200000737386_100000748023 [1,1,0,0,0,0|2,0,0]=4 4588 B11R0.111 CCC(C)CNCCCC(C)C 270004a_200000737386_100000243153 [1,1,0,0,0,0|2,0,0]=4 4589 B11R0.111 CCC(C)CNCCCC(C)C 34a_200000737386_100000748023 [1,1,0,0,0,0|2,0,0]=4 4590 B11R0.111 CCC(C)CNCCCC(C)O 2230a_100020588543_200000718107 [1,1,0,0,0,0|2,0,0]=4 4591 B11R0.111 CCC(C)COCCCC(C)C 34a_100000210774_100000748023 [1,1,0,0,0,0|2,0,0]=4 4592 B11R0.111 CCC(C)COCCCC(C)C 7a_100000210774_100000748023 [1,1,0,0,0,0|2,0,0]=4 4593 B11R0.111 CCC(C)CSCCCC(C)C 62a_100000748023_100011214892 [1,1,0,0,0,0|2,0,0]=4 4594 B11R0.111 CCC(C)CSCCCC(C)C 62a_100011214892_100000748023 [1,1,0,0,0,0|2,0,0]=4 4595 B11R0.111 CCC(C)CSCCCC(C)O 62a_100000748023_200000718107 [1,1,0,0,0,0|2,0,0]=4 4596 B11R0.111 CCC(C)CSCCCC(C)O 62a_200000718107_100000748023 [1,1,0,0,0,0|2,0,0]=4 4597 B11R0.111 CCC(C)NCCCCC(C)C 2230a_100000209981_100011216152 [1,1,0,0,0,0|2,0,0]=4 4598 B11R0.111 CCC(C)OCCCCC(C)C 34a_100011214890_100011215416 [1,1,0,0,0,0|2,0,0]=4 4599 B11R0.111 CCC(C)OCCCCC(C)C 7a_100000210228_100011216152 [1,1,0,0,0,0|2,0,0]=4 4600 B11R0.111 CCC(C)OCCCCC(C)C 7a_100011214890_100000758301 [1,1,0,0,0,0|2,0,0]=4 4601 B11R0.111 CCC(C)SCCCCC(C)C 62a_100000758301_100011216152 [1,1,0,0,0,0|2,0,0]=4 4602 B11R0.111 CCC(C)SCCCCC(C)C 62a_100011216152_100000758301 [1,1,0,0,0,0|2,0,0]=4 4603 B11R0.111 CCC(O)CNCCCC(C)C 2230a_100011218483_100011214892 [1,1,0,0,0,0|2,0,0]=4 4604 B11R0.111 CCC(O)CNCCCC(C)C 2230a_200000737386_100011218378 [1,1,0,0,0,0|2,0,0]=4 4605 B11R0.111 CCC(O)CNCCCC(C)C 34a_200000737386_100011218378 [1,1,0,0,0,0|2,0,0]=4 4606 B11R0.111 CCC(O)CNCCCC(C)O 2230a_100011218483_200000718107 [1,1,0,0,0,0|2,0,0]=4 4607 B11R0.111 CCC(O)COCCCC(C)C 34a_100000210774_100011218378 [1,1,0,0,0,0|2,0,0]=4 4608 B11R0.111 CCC(O)COCCCC(C)C 7a_100000210774_100011218378 [1,1,0,0,0,0|2,0,0]=4 4609 B11R0.111 CCC(O)CSCCCC(C)C 62a_100011214892_100011218378 [1,1,0,0,0,0|2,0,0]=4 4610 B11R0.111 CCC(O)CSCCCC(C)C 62a_100011218378_100011214892 [1,1,0,0,0,0|2,0,0]=4 4611 B11R0.111 CCC(O)CSCCCC(C)O 62a_100011218378_200000718107 [1,1,0,0,0,0|2,0,0]=4 4612 B11R0.111 CCC(O)CSCCCC(C)O 62a_200000718107_100011218378 [1,1,0,0,0,0|2,0,0]=4 4613 B11R0.111 CCN(C)CCCCCC(C)C 2230a_100000225621_100000210682 [1,1,0,0,0,0|2,0,0]=4 4614 B11R0.111 CCN(C)CCCCCC(C)C 269982a_100000225621_100000210682 [1,1,0,0,0,0|2,0,0]=4 4615 B11R0.111 CC[C@H](C)CNCCCC(C)C 2230a_200000737386_100009816398 [1,1,0,0,0,0|2,0,0]=4 4616 B11R0.111 CC[C@H](C)CNCCCC(C)C 34a_200000737386_100009816398 [1,1,0,0,0,0|2,0,0]=4 4617 B11R0.111 CC[C@H](C)COCCCC(C)C 34a_100000210774_100009816398 [1,1,0,0,0,0|2,0,0]=4 4618 B11R0.111 CC[C@H](C)COCCCC(C)C 7a_100000210774_100009816398 [1,1,0,0,0,0|2,0,0]=4 4619 B11R0.111 CC[C@H](C)COCCCC(C)C 7a_100009816381_100011214892 [1,1,0,0,0,0|2,0,0]=4 4620 B11R0.111 CC[C@H](C)COCCCC(C)O 7a_100009816381_200000718107 [1,1,0,0,0,0|2,0,0]=4 4621 B11R0.111 CC[C@H](C)CSCCCC(C)C 62a_100009816398_100011214892 [1,1,0,0,0,0|2,0,0]=4 4622 B11R0.111 CC[C@H](C)CSCCCC(C)C 62a_100011214892_100009816398 [1,1,0,0,0,0|2,0,0]=4 4623 B11R0.111 CC[C@H](C)CSCCCC(C)O 62a_100009816398_200000718107 [1,1,0,0,0,0|2,0,0]=4 4624 B11R0.111 CC[C@H](C)CSCCCC(C)O 62a_200000718107_100009816398 [1,1,0,0,0,0|2,0,0]=4 4625 B11R0.111 COC(C)CCOCCC(=O)C 7a_100000764861_100000053229 [1,1,0,0,0,0|1,0,1]=4 4626 B11R0.111 COC(C)CCOCCC(C)C 7a_100000764861_100000210626 [1,1,0,0,0,0|1,0,0]=3 4627 B11R0.111 COC(C)CCOCCC(C)O 7a_100000764861_100012276601 [1,1,0,0,0,0|1,0,0]=3 4628 B11R0.111 COC(C)CCOCCN(C)C 7a_100000764861_100000755713 [1,1,0,0,0,0|2,0,0]=4 4629 B11R0.111 COC(C)COCCCC(=O)C 34a_100000690652_100000685027 [1,1,0,0,0,0|1,0,1]=4 4630 B11R0.111 COC(C)COCCCC(C)C 34a_100000690652_100011214892 [1,1,0,0,0,0|1,0,0]=3 4631 B11R0.111 COC(C)COCCCC(C)O 34a_100000690652_200000718107 [1,1,0,0,0,0|1,0,0]=3 4632 B11R0.111 COC(C)COCCOC(C)C 34a_100000690652_100000211751 [1,1,0,0,0,0|2,0,0]=4 4633 B11R0.111 COC(C)COCCSC(C)C 34a_100000690652_100000730970 [1,1,0,0,0,0|2,0,0]=4 4634 B11R0.111 COC(C)SCCCCC(=O)C 62a_100000735457_100009879195 [1,1,0,0,0,0|1,0,1]=4 4635 B11R0.111 COC(C)SCCCCC(=O)C 62a_100009879195_100000735457 [1,1,0,0,0,0|1,0,1]=4 4636 B11R0.111 COC(C)SCCCCC(C)C 62a_100009879195_100011216152 [1,1,0,0,0,0|1,0,0]=3 4637 B11R0.111 COC(C)SCCCCC(C)C 62a_100011216152_100009879195 [1,1,0,0,0,0|1,0,0]=3 4638 B11R0.111 COC(C)SCCCCN(C)C 62a_100009879195_100000690147 [1,1,0,0,0,0|2,0,0]=4 4639 B11R0.111 CO[C@H](C)CNCCCC(C)C 2230a_100020591295_100011214892 [1,1,0,0,0,0|1,0,0]=3 4640 B11R0.111 CO[C@H](C)CNCCCC(C)O 2230a_100020591295_200000718107 [1,1,0,0,0,0|1,0,0]=3 4641 B11R0.111 CO[C@H](C)CNCCOC(C)C 2230a_100020591295_100000211751 [1,1,0,0,0,0|2,0,0]=4 4642 B11R0.111 CO[C@H](C)CNCCSC(C)C 2230a_100020591295_100000730970 [1,1,0,0,0,0|2,0,0]=4 4643 B11R0.142 CCCCCCC(=O)C(C)CC 1458a_100011192722_100000210757 [1,1,0,0,0,0|1,0,1]=4 4644 B11R0.142 CCCCCCC(=O)C(C)CC 1458a_100102632555_100000758301 [1,1,0,0,0,0|1,0,1]=4 4645 B11R0.142 CCCCCCC(=O)C(C)OC 1458a_100000743197_100000210757 [1,1,0,0,0,0|0,0,1]=3 4646 B11R0.142 CCCCCCC(=O)C(C)SC 1458a_100000149566_100000210757 [1,1,0,0,0,0|0,1,1]=4 4647 B11R0.142 CCCCCCC(=O)C(O)CC 1458a_100011196387_100000210757 [1,1,0,0,0,0|1,0,1]=4 4648 B11R0.142 CCCCCCC(C)N(C)CC 2230a_100000225621_100011215978 [1,1,0,0,0,0|2,0,0]=4 4649 B11R0.142 CCCCCCC(C)N(C)CC 269982a_100000225621_100011215978 [1,1,0,0,0,0|2,0,0]=4 4650 B11R0.142 CCCCCCN(C)C(C)CC 2230a_100000741768_100000210314 [1,1,0,0,0,0|2,0,0]=4 4651 B11R0.142 CCCCCCN(C)C(C)CC 2230a_106256046315_100000758301 [1,1,0,0,0,0|2,0,0]=4 4652 B11R0.142 CCCCCCN(C)C(C)CC 269982a_100000741768_100000210757 [1,1,0,0,0,0|2,0,0]=4 4653 B11R0.142 CCCCCCN(C)C(C)CC 269982a_106256046315_100000758301 [1,1,0,0,0,0|2,0,0]=4 4654 B11R0.142 CCCCCCN(C)C(C)OC 269982a_106256046315_100009879195 [1,1,0,0,0,0|1,0,0]=3 4655 B11R0.142 CCCCCNC(=O)C(C)OC 11a_100000209983_100000743197 [1,1,0,0,0,0|1,0,1]=4 4656 B11R0.142 CCCCCNC(=O)C(C)OC 1626a_100000209983_100000743197 [1,1,0,0,0,0|1,0,1]=4 4657 B11R0.142 CCCCCNC(=O)C(C)OC 240690a_100000209983_100000743197 [1,1,0,0,0,0|1,0,1]=4 4658 B11R0.142 CCCCCNC(=O)C(C)OC 527a_100000209983_100000743197 [1,1,0,0,0,0|1,0,1]=4 4659 B11R0.142 CCCCCNC(C)C(C)CC 269862a_100000209983_100000210599 [1,1,0,0,0,0|2,0,0]=4 4660 B11R0.142 CCCCCNC(C)C(C)CC 270004a_100000209983_100000210599 [1,1,0,0,0,0|2,0,0]=4 4661 B11R0.142 CCCCCOC(C)C(C)CC 7a_100011215189_100000210326 [1,1,0,0,0,0|2,0,0]=4 4662 B11R0.142 CCCCOCC(=O)C(C)OC 1458a_100000743197_100011995733 [1,1,0,0,0,0|1,0,1]=4 4663 B11R0.142 CCCOCCC(=O)C(C)OC 1458a_100000743197_100011215938 [1,1,0,0,0,0|1,0,1]=4 4664 B11R0.142 CCOCCCC(=O)C(C)OC 1458a_100000743197_100012232248 [1,1,0,0,0,0|1,0,1]=4 4665 B11R0.142 COC(C)C(=O)CCCCCF 1458a_100000743197_100000729378 [1,1,0,0,0,0|1,0,1]=4 4666 B11R0.142 COC(C)C(=O)CCCCCO 1458a_100000743197_100000746330 [1,1,0,0,0,0|1,0,1]=4 4667 B11R0.142 COC(C)N(C)CCCCCO 269982a_100000722520_100009879195 [1,1,0,0,0,0|2,0,0]=4 4668 B11R0.142 COCCCCC(=O)C(C)OC 1458a_100000743197_100000755781 [1,1,0,0,0,0|1,0,1]=4 4669 B11R0.154 CCCCCC(=O)CC(C)CC 1458a_100000212188_100000748023 [1,1,0,0,0,0|1,0,1]=4 4670 B11R0.154 CCCCCC(=O)CC(C)CC 1458a_100000708755_100000210326 [1,1,0,0,0,0|1,0,1]=4 4671 B11R0.154 CCCCCC(=O)CC(O)CC 1458a_100000212188_100011218378 [1,1,0,0,0,0|1,0,1]=4 4672 B11R0.154 CCCCCC(=O)CC(O)CC 1458a_100011667805_100000210326 [1,1,0,0,0,0|1,0,1]=4 4673 B11R0.154 CCCCCC(=O)C[C@@H](C)CC 1458a_100000212188_100009816398 [1,1,0,0,0,0|1,0,1]=4 4674 B11R0.154 CCCCCC(C)NC(C)CC 2230a_100000209981_200011218191 [1,1,0,0,0,0|2,0,0]=4 4675 B11R0.154 CCCCCC(C)NC(C)CC 2230a_100000211957_100000758301 [1,1,0,0,0,0|2,0,0]=4 4676 B11R0.154 CCCCCC(C)NC(C)CC 270004a_100000209981_100000211708 [1,1,0,0,0,0|2,0,0]=4 4677 B11R0.154 CCCCCC(C)OC(C)CC 34a_100011215632_100011215416 [1,1,0,0,0,0|2,0,0]=4 4678 B11R0.154 CCCCCC(C)OC(C)CC 7a_100000210228_200011218191 [1,1,0,0,0,0|2,0,0]=4 4679 B11R0.154 CCCCCC(C)OC(C)CC 7a_100011215632_100000758301 [1,1,0,0,0,0|2,0,0]=4 4680 B11R0.154 CCCCCC(C)SC(C)CC 62a_100000758301_200011218191 [1,1,0,0,0,0|2,0,0]=4 4681 B11R0.154 CCCCCC(C)SC(C)CC 62a_200011218191_100000758301 [1,1,0,0,0,0|2,0,0]=4 4682 B11R0.154 CCCCCC(C)SC(C)OC 62a_100009879195_200011218191 [1,1,0,0,0,0|1,0,0]=3 4683 B11R0.154 CCCCCC(C)SC(C)OC 62a_200011218191_100009879195 [1,1,0,0,0,0|1,0,0]=3 4684 B11R0.154 CCCCCN(C)CC(C)CC 2230a_100000223495_100000748023 [1,1,0,0,0,0|2,0,0]=4 4685 B11R0.154 CCCCCN(C)CC(C)CC 2230a_100000753921_100000210326 [1,1,0,0,0,0|2,0,0]=4 4686 B11R0.154 CCCCCN(C)CC(C)CC 269982a_100000223495_100000748023 [1,1,0,0,0,0|2,0,0]=4 4687 B11R0.154 CCCCCN(C)CC(C)CC 269982a_100000753921_100000210215 [1,1,0,0,0,0|2,0,0]=4 4688 B11R0.154 CCCCCN(C)CC(C)CC 270004a_100000223495_100000243153 [1,1,0,0,0,0|2,0,0]=4 4689 B11R0.154 CCCCCN(C)CC(O)CC 2230a_100000223495_100011218378 [1,1,0,0,0,0|2,0,0]=4 4690 B11R0.154 CCCCCN(C)CC(O)CC 269982a_100000223495_100011218378 [1,1,0,0,0,0|2,0,0]=4 4691 B11R0.154 CCCCCN(C)C[C@@H](C)CC 2230a_100000223495_100009816398 [1,1,0,0,0,0|2,0,0]=4 4692 B11R0.154 CCCCCN(C)C[C@@H](C)CC 269982a_100000223495_100009816398 [1,1,0,0,0,0|2,0,0]=4 4693 B11R0.154 CCCCNC(C)CC(C)CC 2230a_100000763565_100000210211 [1,1,0,0,0,0|2,0,0]=4 4694 B11R0.154 CCCCNC(C)CC(C)CC 270004a_100000102301_100011710205 [1,1,0,0,0,0|2,0,0]=4 4695 B11R0.174 CCCC(=O)CNC[C@@H](C)OC 2230a_100020591295_100000747444 [1,1,0,0,0,0|1,0,1]=4 4696 B11R0.174 CCCC(C)CCOC(C)CC 34a_100011217855_100011215416 [1,1,0,0,0,0|2,0,0]=4 4697 B11R0.174 CCCC(C)CCOC(C)CC 7a_100011217855_100000758301 [1,1,0,0,0,0|2,0,0]=4 4698 B11R0.174 CCCC(C)CNCC(C)CC 2230a_100020588543_100011216630 [1,1,0,0,0,0|2,0,0]=4 4699 B11R0.174 CCCC(C)CNCC(C)CC 270004a_100020588543_100000243154 [1,1,0,0,0,0|2,0,0]=4 4700 B11R0.174 CCCC(C)CNCC(O)CC 2230a_100011218483_100011216630 [1,1,0,0,0,0|2,0,0]=4 4701 B11R0.174 CCCC(C)CNCC(O)CC 270004a_100011218483_100000243154 [1,1,0,0,0,0|2,0,0]=4 4702 B11R0.174 CCCC(C)CNC[C@@H](C)OC 2230a_100020591295_100011216630 [1,1,0,0,0,0|1,0,0]=3 4703 B11R0.174 CCCC(C)CNC[C@@H](C)OC 270004a_100020591295_100000243154 [1,1,0,0,0,0|1,0,0]=3 4704 B11R0.174 CCCC(C)COCC(C)CC 34a_100000688023_100000748023 [1,1,0,0,0,0|2,0,0]=4 4705 B11R0.174 CCCC(C)COCC(C)CC 7a_100000688023_100000748023 [1,1,0,0,0,0|2,0,0]=4 4706 B11R0.174 CCCC(C)COCC(C)OC 34a_100000690652_100011216630 [1,1,0,0,0,0|1,0,0]=3 4707 B11R0.174 CCCC(C)COCC(O)CC 34a_100000688023_100011218378 [1,1,0,0,0,0|2,0,0]=4 4708 B11R0.174 CCCC(C)COCC(O)CC 7a_100000688023_100011218378 [1,1,0,0,0,0|2,0,0]=4 4709 B11R0.174 CCCC(C)COC[C@@H](C)CC 34a_100000688023_100009816398 [1,1,0,0,0,0|2,0,0]=4 4710 B11R0.174 CCCC(C)COC[C@@H](C)CC 7a_100000688023_100009816398 [1,1,0,0,0,0|2,0,0]=4 4711 B11R0.174 CCCC(C)COC[C@@H](C)CC 7a_100009816381_100011216630 [1,1,0,0,0,0|2,0,0]=4 4712 B11R0.174 CCCC(C)CSCC(C)CC 62a_100000748023_100011216630 [1,1,0,0,0,0|2,0,0]=4 4713 B11R0.174 CCCC(C)CSCC(C)CC 62a_100011216630_100000748023 [1,1,0,0,0,0|2,0,0]=4 4714 B11R0.174 CCCC(C)CSCC(O)CC 62a_100011216630_100011218378 [1,1,0,0,0,0|2,0,0]=4 4715 B11R0.174 CCCC(C)CSCC(O)CC 62a_100011218378_100011216630 [1,1,0,0,0,0|2,0,0]=4 4716 B11R0.174 CCCC(C)CSC[C@@H](C)CC 62a_100009816398_100011216630 [1,1,0,0,0,0|2,0,0]=4 4717 B11R0.174 CCCC(C)CSC[C@@H](C)CC 62a_100011216630_100009816398 [1,1,0,0,0,0|2,0,0]=4 4718 B11R0.174 CCCC(C)NCCC(C)CC 2230a_100020591266_100000766640 [1,1,0,0,0,0|2,0,0]=4 4719 B11R0.174 CCCC(C)NCCC(C)CC 270004a_100020591266_100000211909 [1,1,0,0,0,0|2,0,0]=4 4720 B11R0.174 CCCC(C)OCCC(C)CC 7a_100011215188_100000766640 [1,1,0,0,0,0|2,0,0]=4 4721 B11R0.174 CCCC(C)OCCC(C)OC 7a_100000764861_100000766640 [1,1,0,0,0,0|1,0,0]=3 4722 B11R0.174 CCC[C@H](N)CCOC(C)CC 34a_100015193777_100011215416 [1,1,0,0,0,0|2,0,0]=4 4723 B11R0.174 CCC[C@H](N)COCC(C)CC 34a_100000732646_100000748023 [1,1,0,0,0,0|2,0,0]=4 4724 B11R0.174 CCC[C@H](N)COCC(O)CC 34a_100000732646_100011218378 [1,1,0,0,0,0|2,0,0]=4 4725 B11R0.174 CCC[C@H](N)COC[C@@H](C)CC 34a_100000732646_100009816398 [1,1,0,0,0,0|2,0,0]=4 4726 B11R0.174 COC(C)CCOC(C)CCO 7a_100000764861_100009893172 [1,1,0,0,0,0|2,0,0]=4 4727 B11R0.174 COCC(C)OCCC(C)OC 7a_100000764861_100000765312 [1,1,0,0,0,0|2,0,0]=4 4728 B11R0.174 COCC(O)COCC(C)OC 34a_100000690652_100011215053 [1,1,0,0,0,0|2,0,0]=4 4729 B13R0.163 C=CC(C)COCCCC(OC)OC 34a_100011215527_100000069011 [0,2,0,0,0,0|1,0,0]=3 4730 B13R0.163 C=CC(C)COCCCC(OC)OC 7a_100011215527_100000069011 [0,2,0,0,0,0|1,0,0]=3 4731 B13R0.163 C=CC(O)CSCCCC(OC)OC 62a_100000069011_100000730141 [0,2,0,0,0,0|0,0,2]=4 4732 B13R0.163 C=CC(O)CSCCCC(OC)OC 62a_100000730141_100000069011 [0,2,0,0,0,0|0,0,2]=4 4733 B13R0.163 C=C[C@H](N)COCCCC(OC)OC 34a_100016989147_100000069011 [0,2,0,0,0,0|0,0,2]=4 4734 B13R0.163 CCC(=O)COCCCC(OC)OC 34a_100000725409_100000069011 [0,2,0,0,0,0|0,0,1]=3 4735 B13R0.163 CCC(=O)CSCCCC(OC)OC 62a_100000069011_100000747405 [0,2,0,0,0,0|0,0,1]=3 4736 B13R0.163 CCC(=O)CSCCCC(OC)OC 62a_100000747405_100000069011 [0,2,0,0,0,0|0,0,1]=3 4737 B13R0.163 CCC(=O)NCCNCC(OC)OC 270004a_100132302217_100000752162 [0,2,0,0,0,0|1,0,1]=4 4738 B13R0.163 CCC(=O)NCCNCC(OC)OC 34a_100132302217_100000211822 [0,2,0,0,0,0|1,0,1]=4 4739 B13R0.163 CCC(=O)NCCOCC(OC)OC 11a_100000692409_100000210414 [0,2,0,0,0,0|1,0,1]=4 4740 B13R0.163 CCC(=O)NCCOCC(OC)OC 1626a_100000692409_100000210414 [0,2,0,0,0,0|1,0,1]=4 4741 B13R0.163 CCC(=O)NCCOCC(OC)OC 240690a_100000692409_100000210414 [0,2,0,0,0,0|1,0,1]=4 4742 B13R0.163 CCC(=O)NCCOCC(OC)OC 34a_200000158885_100000211822 [0,2,0,0,0,0|1,0,1]=4 4743 B13R0.163 CCC(=O)NCCOCC(OC)OC 527a_100000692409_100000210414 [0,2,0,0,0,0|1,0,1]=4 4744 B13R0.163 CCC(=O)NCCOCC(OC)OC 7a_200000158885_100000751394 [0,2,0,0,0,0|1,0,1]=4 4745 B13R0.163 CCC(=O)OCCOCC(OC)OC 7a_200000031056_100000751394 [0,2,0,0,0,0|1,0,1]=4 4746 B13R0.163 CCC(C)CCCOCC(CC)CC 7a_100011216074_100011215472 [0,2,0,0,0,0|2,0,0]=4 4747 B13R0.163 CCC(C)CCCOCC(OC)OC 7a_100011216074_100000751394 [0,2,0,0,0,0|0,0,0]=2 4748 B13R0.163 CCC(C)CCNCCC(OC)OC 2230a_100020591266_100009813347 [0,2,0,0,0,0|0,0,0]=2 4749 B13R0.163 CCC(C)CCOCCC(OC)OC 7a_100011215188_100009813347 [0,2,0,0,0,0|0,0,0]=2 4750 B13R0.163 CCC(C)CNCCCC(OC)OC 2230a_100020588543_100000069011 [0,2,0,0,0,0|0,0,0]=2 4751 B13R0.163 CCC(C)CNCCCC(OC)OC 270004a_100000034021_100000243153 [0,2,0,0,0,0|0,0,0]=2 4752 B13R0.163 CCC(C)CSCCCC(OC)OC 62a_100000069011_100000748023 [0,2,0,0,0,0|0,0,0]=2 4753 B13R0.163 CCC(C)CSCCCC(OC)OC 62a_100000748023_100000069011 [0,2,0,0,0,0|0,0,0]=2 4754 B13R0.163 CCC(COCCCN(C)CC)OC 7a_100011934954_100015186262 [0,2,0,0,0,0|2,0,0]=4 4755 B13R0.163 CCC(O)CNCCCC(OC)OC 2230a_100011218483_100000069011 [0,2,0,0,0,0|0,0,0]=2 4756 B13R0.163 CCC(O)CSCCCC(OC)OC 62a_100000069011_100011218378 [0,2,0,0,0,0|0,0,0]=2 4757 B13R0.163 CCC(O)CSCCCC(OC)OC 62a_100011218378_100000069011 [0,2,0,0,0,0|0,0,0]=2 4758 B13R0.163 CCN(C)CCCSCC(OC)OC 62a_100000751394_100015186262 [0,2,0,0,0,0|1,0,0]=3 4759 B13R0.163 CC[C@H](C)COCCCC(OC)OC 7a_100009816381_100000069011 [0,2,0,0,0,0|0,0,0]=2 4760 B13R0.163 CC[C@H](C)CSCCCC(OC)OC 62a_100000069011_100009816398 [0,2,0,0,0,0|0,0,0]=2 4761 B13R0.163 CC[C@H](C)CSCCCC(OC)OC 62a_100009816398_100000069011 [0,2,0,0,0,0|0,0,0]=2 4762 B13R0.163 CNC(=O)CCCNCC(OC)OC 2230a_100000740002_100000751394 [0,2,0,0,0,0|1,0,1]=4 4763 B13R0.163 CNC(=O)CCCNCC(OC)OC 270004a_100000740002_100000752162 [0,2,0,0,0,0|1,0,1]=4 4764 B13R0.163 CNC(=O)CCCNCC(OC)OC 34a_100000740002_100000211822 [0,2,0,0,0,0|1,0,1]=4 4765 B13R0.163 CNC(=O)CCCOCC(OC)OC 34a_100011216393_100000741757 [0,2,0,0,0,0|1,0,1]=4 4766 B13R0.163 CNC(=O)CCCSCC(OC)OC 62a_100000741757_100000751394 [0,2,0,0,0,0|1,0,1]=4 4767 B13R0.163 CNC(=O)CCCSCC(OC)OC 62a_100000751394_100000741757 [0,2,0,0,0,0|1,0,1]=4 4768 B13R0.163 CNC(=O)CCNCCC(OC)OC 2230a_100000738227_100009813347 [0,2,0,0,0,0|1,0,1]=4 4769 B13R0.163 CNC(=O)CCNCCC(OC)OC 34a_100000738227_100000139399 [0,2,0,0,0,0|1,0,1]=4 4770 B13R0.163 CNC(=O)CCOCCC(OC)OC 34a_100000754576_100000139399 [0,2,0,0,0,0|1,0,1]=4 4771 B13R0.163 CNC(=O)CCSCCC(OC)OC 62a_100000139399_100000737683 [0,2,0,0,0,0|1,0,1]=4 4772 B13R0.163 CNC(=O)CCSCCC(OC)OC 62a_100000737683_100000139399 [0,2,0,0,0,0|1,0,1]=4 4773 B13R0.163 CNC(=O)CNCCCC(OC)OC 2230a_100000693194_100000069011 [0,2,0,0,0,0|1,0,1]=4 4774 B13R0.163 CNC(=O)COCCCC(OC)OC 34a_100000750040_100000069011 [0,2,0,0,0,0|1,0,1]=4 4775 B13R0.163 CNC(=O)CSCCCC(OC)OC 62a_100000069011_100000183359 [0,2,0,0,0,0|1,0,1]=4 4776 B13R0.163 CNC(=O)CSCCCC(OC)OC 62a_100000183359_100000069011 [0,2,0,0,0,0|1,0,1]=4 4777 B13R0.163 COC(=O)CCCOCC(OC)OC 34a_100011216393_100000742333 [0,2,0,0,0,0|1,0,1]=4 4778 B13R0.163 COC(=O)CCCSCC(OC)OC 62a_100000751394_100011218270 [0,2,0,0,0,0|1,0,1]=4 4779 B13R0.163 COC(=O)CCCSCC(OC)OC 62a_100011218270_100000751394 [0,2,0,0,0,0|1,0,1]=4 4780 B13R0.163 COC(=O)CCSCCC(OC)OC 62a_100000139399_100000204255 [0,2,0,0,0,0|1,0,1]=4 4781 B13R0.163 COC(=O)CCSCCC(OC)OC 62a_100000204255_100000139399 [0,2,0,0,0,0|1,0,1]=4 4782 B13R0.163 COC(=O)CSCCCC(OC)OC 62a_100000069011_100000747449 [0,2,0,0,0,0|1,0,1]=4 4783 B13R0.163 COC(=O)CSCCCC(OC)OC 62a_100000747449_100000069011 [0,2,0,0,0,0|1,0,1]=4 4784 B13R0.163 COC(C)CCOCCC(OC)OC 7a_100000764861_100009813347 [0,2,0,0,0,0|1,0,0]=3 4785 B13R0.163 COC(C)COCCCC(OC)OC 34a_100000690652_100000069011 [0,2,0,0,0,0|1,0,0]=3 4786 B13R0.163 COC(CCCNCC(C)CO)OC 34a_100000744482_100000069011 [0,2,0,0,0,0|1,0,0]=3 4787 B13R0.163 COC(CCCNC[C@@H](C)OC)OC 2230a_100020591295_100000069011 [0,2,0,0,0,0|1,0,0]=3 4788 B13R0.163 COC(CCCNC[C@@H](F)CO)OC 34a_100015665980_100000069011 [0,2,0,0,0,0|1,0,0]=3 4789 B13R0.163 COC(CCCNC[C@H](O)CO)OC 2230a_100020644852_100000069011 [0,2,0,0,0,0|1,0,0]=3 4790 B13R0.163 COC(CCCOCC(C)CN)OC 34a_100000744482_100000069011 [0,2,0,0,0,0|1,0,0]=3 4791 B13R0.163 COC(CCCOCC(Cl)CCl)OC 34a_100000033668_100000069011 [0,2,0,0,0,0|1,0,0]=3 4792 B13R0.163 COC(CCCOC[C@H](F)CN)OC 34a_100015665980_100000069011 [0,2,0,0,0,0|1,0,0]=3 4793 B13R0.163 COC(CCCSCC(O)CO)OC 62a_100000069011_100011219619 [0,2,0,0,0,0|1,0,0]=3 4794 B13R0.163 COC(CCCSCC(O)CO)OC 62a_100011219619_100000069011 [0,2,0,0,0,0|1,0,0]=3 4795 B13R0.163 COC(CCCSC[C@@H](C)CO)OC 62a_100000059175_100000069011 [0,2,0,0,0,0|1,0,0]=3 4796 B13R0.163 COC(CCCSC[C@@H](C)CO)OC 62a_100000069011_100000059175 [0,2,0,0,0,0|1,0,0]=3 4797 B13R0.163 COC(CCCSC[C@@H](O)CF)OC 62a_100000069011_100015614560 [0,2,0,0,0,0|1,0,0]=3 4798 B13R0.163 COC(CCCSC[C@@H](O)CF)OC 62a_100015614560_100000069011 [0,2,0,0,0,0|1,0,0]=3 4799 B13R0.163 COC(CCCSC[C@@H](O)CO)OC 62a_100000069011_100009815848 [0,2,0,0,0,0|1,0,0]=3 4800 B13R0.163 COC(CCCSC[C@@H](O)CO)OC 62a_100009815848_100000069011 [0,2,0,0,0,0|1,0,0]=3 4801 B13R0.163 COC(CCNCCC(C)CO)OC 2230a_106354213184_100009813347 [0,2,0,0,0,0|1,0,0]=3 4802 B13R0.163 COC(CCNCCC(C)CO)OC 34a_106354213184_100000139399 [0,2,0,0,0,0|1,0,0]=3 4803 B13R0.163 COC(COCCC[C@@H](C)CN)OC 34a_100160569302_100000211822 [0,2,0,0,0,0|1,0,0]=3 4804 B13R0.313 CCC(COC)NCCCCC(C)C 2230a_100000757820_100011216152 [0,2,0,0,0,0|2,0,0]=4 4805 B13R0.313 CCC(COC)OCCCCC(C)C 7a_200011214946_100011216152 [0,2,0,0,0,0|2,0,0]=4 4806 B13R0.313 CCOC(CC)CNCCCC(C)C 2230a_100015183923_100011214892 [0,2,0,0,0,0|2,0,0]=4 4807 B13R0.313 CCOC(CC)CNCCCC(C)C 34a_100015183923_100011214892 [0,2,0,0,0,0|2,0,0]=4 4808 B13R0.313 CCOC(CC)CNCCCC(C)O 2230a_100015183923_200000718107 [0,2,0,0,0,0|2,0,0]=4 4809 B13R0.313 CCOC(CC)CNCCCC(C)O 34a_100015183923_200000718107 [0,2,0,0,0,0|2,0,0]=4 4810 B13R0.605 C=C(C)CCOC(C)CC(OC)OC 7a_100011018202_100000730704 [0,2,0,0,0,0|1,0,1]=4 4811 B13R0.605 COC(CC(=O)CCCC(=O)C)OC 1458a_100000082724_100011215641 [0,2,0,0,0,0|0,0,2]=4 4812 B13R0.605 COC(CC(=O)CCCC(C)C)OC 1458a_100000082724_100011214892 [0,2,0,0,0,0|0,0,1]=3 4813 B13R0.605 COC(CC(=O)CCCC(C)C)OC 1458a_100011216857_100000751394 [0,2,0,0,0,0|0,0,1]=3 4814 B13R0.605 COC(CC(=O)CCCC(C)O)OC 1458a_100000082724_200000718107 [0,2,0,0,0,0|0,0,1]=3 4815 B13R0.605 COC(CC(=O)CCCN(C)C)OC 1458a_100000082724_100000695564 [0,2,0,0,0,0|1,0,1]=4 4816 B13R0.605 COC(CC(=O)CCOC(C)C)OC 1458a_100000082724_100000211751 [0,2,0,0,0,0|1,0,1]=4 4817 B13R0.605 COC(CC(=O)CCSC(C)C)OC 1458a_100000082724_100000730970 [0,2,0,0,0,0|1,0,1]=4 4818 B13R0.605 COC(CC(=O)COCC(C)C)OC 1458a_100011223364_100000751394 [0,2,0,0,0,0|1,0,1]=4 4819 B13R0.605 COC(CC(=O)NCCC(C)C)OC 11a_100000210545_100000082724 [0,2,0,0,0,0|1,0,1]=4 4820 B13R0.605 COC(CC(=O)NCCC(C)C)OC 1626a_100000210545_100000082724 [0,2,0,0,0,0|1,0,1]=4 4821 B13R0.605 COC(CC(=O)NCCC(C)C)OC 240690a_100000210545_100000082724 [0,2,0,0,0,0|1,0,1]=4 4822 B13R0.605 COC(CC(=O)NCCC(C)C)OC 527a_100000210545_100000082724 [0,2,0,0,0,0|1,0,1]=4 4823 B13R0.605 COC(CC(=O)NCCC(C)O)OC 240690a_200000755665_100000082724 [0,2,0,0,0,0|1,0,1]=4 4824 B13R0.605 COC(CC(=O)NCCC(C)O)OC 527a_200000755665_100000082724 [0,2,0,0,0,0|1,0,1]=4 4825 B13R0.605 COC(CC(C)NCCC(C)C)OC 270004a_100000210545_100000210484 [0,2,0,0,0,0|1,0,0]=3 4826 B13R0.605 COC(CC(C)NCCC(C)O)OC 270004a_200000755665_100000210484 [0,2,0,0,0,0|1,0,0]=3 4827 B13R0.605 COC(CC(C)NCCN(C)C)OC 270004a_100000210585_100000210484 [0,2,0,0,0,0|2,0,0]=4 4828 B13R0.605 COC(CC(C)OCCC(=O)C)OC 7a_100011018202_100000053229 [0,2,0,0,0,0|1,0,1]=4 4829 B13R0.605 COC(CC(C)OCCC(C)C)OC 7a_100011018202_100000210626 [0,2,0,0,0,0|1,0,0]=3 4830 B13R0.605 COC(CC(C)OCCC(C)O)OC 7a_100011018202_100012276601 [0,2,0,0,0,0|1,0,0]=3 4831 B13R0.605 COC(CC(C)OCCN(C)C)OC 7a_100011018202_100000755713 [0,2,0,0,0,0|2,0,0]=4 4832 B13R0.605 COC(CN(C)CCCC(=O)C)OC 269982a_100000225562_100011215641 [0,2,0,0,0,0|1,0,1]=4 4833 B13R0.605 COC(CN(C)CCCC(C)C)OC 269982a_100000225562_100011214892 [0,2,0,0,0,0|1,0,0]=3 4834 B13R0.605 COC(CN(C)CCCC(C)O)OC 269982a_100000225562_200000718107 [0,2,0,0,0,0|1,0,0]=3 4835 B13R0.605 COC(CN(C)CCCN(C)C)OC 269982a_100000225562_100000757444 [0,2,0,0,0,0|2,0,0]=4 4836 B13R0.605 COC(CN(C)CCCN(C)C)OC 270004a_100000225831_100000752162 [0,2,0,0,0,0|2,0,0]=4 4837 B13R0.605 COC(CN(C)CCOC(C)C)OC 269982a_100000225562_100000211751 [0,2,0,0,0,0|2,0,0]=4 4838 B13R0.605 COC(CN(C)CCSC(C)C)OC 269982a_100000225562_100000730970 [0,2,0,0,0,0|2,0,0]=4 4839 B13R0.1118 C=C(C)CN(C)CCCC(OC)OC 2230a_100000225649_100000069011 [0,2,0,0,0,0|1,0,1]=4 4840 B13R0.1118 C=C(C)CN(C)CCCC(OC)OC 269982a_100000225649_100000069011 [0,2,0,0,0,0|1,0,1]=4 4841 B13R0.1118 COC(CCCC(=O)CC(C)C)OC 1458a_100000210554_100000069011 [0,2,0,0,0,0|0,0,1]=3 4842 B13R0.1118 COC(CCCC(=O)CN(C)C)OC 1458a_100000750896_100000069011 [0,2,0,0,0,0|1,0,1]=4 4843 B13R0.1118 COC(CCCC(=O)C[C@@H](C)O)OC 1458a_100011933948_100000069011 [0,2,0,0,0,0|0,0,1]=3 4844 B13R0.1118 COC(CCCC(=O)C[S+](C)C)OC 1458a_200159257847_100000069011 [0,2,0,0,0,0|1,0,1]=4 4845 B13R0.1118 COC(CCCN(C)CC(C)C)OC 2230a_100000747067_100000069011 [0,2,0,0,0,0|1,0,0]=3 4846 B13R0.1118 COC(CCCN(C)CC(C)C)OC 269982a_100000747067_100000069011 [0,2,0,0,0,0|1,0,0]=3 4847 B13R0.1118 COC(CCCN(C)CC(C)O)OC 2230a_100000227577_100000069011 [0,2,0,0,0,0|1,0,0]=3 4848 B13R0.1118 COC(CCCN(C)CC(C)O)OC 269982a_100000227577_100000069011 [0,2,0,0,0,0|1,0,0]=3 4849 B13R0.1118 COC(CCNC(C)CC(C)C)OC 2230a_100000692259_100009813347 [0,2,0,0,0,0|1,0,0]=3 4850 B13R0.1118 COC(CCOC(C)CC(C)C)OC 34a_100000211805_100000139399 [0,2,0,0,0,0|1,0,0]=3 4851 B13R0.1118 COC(CCOC(C)CC(C)C)OC 7a_100000211805_100009813347 [0,2,0,0,0,0|1,0,0]=3 4852 B13R0.1118 COC(CCSC(C)CC(C)C)OC 62a_100000139399_100000731052 [0,2,0,0,0,0|1,0,0]=3 4853 B13R0.1118 COC(CCSC(C)CC(C)C)OC 62a_100000731052_100000139399 [0,2,0,0,0,0|1,0,0]=3 4854 B13R0.1118 COC(CCSC(C)CN(C)C)OC 62a_100000139399_100020606517 [0,2,0,0,0,0|2,0,0]=4 4855 B13R0.1118 COC(CCSC(C)CN(C)C)OC 62a_100020606517_100000139399 [0,2,0,0,0,0|2,0,0]=4 4856 B13R0.1118 COC(COC[C@@H](N)CC(C)C)OC 34a_100011830311_100000211822 [0,2,0,0,0,0|1,0,0]=3 4857 B13R0.1118 COC(CSCC(C)CN(C)C)OC 62a_100000751394_100015348159 [0,2,0,0,0,0|2,0,0]=4 4858 B13R0.1118 COC(CSCC(C)CN(C)C)OC 62a_100015348159_100000751394 [0,2,0,0,0,0|2,0,0]=4 4859 B13R0.1121 COC(CCCNC(=O)C(C)C)OC 11a_100000034021_100000210198 [0,2,0,0,0,0|1,0,1]=4 4860 B13R0.1121 COC(CCCNC(=O)C(C)C)OC 1626a_100000034021_100000210198 [0,2,0,0,0,0|1,0,1]=4 4861 B13R0.1121 COC(CCCNC(=O)C(C)C)OC 240690a_100000034021_100000210198 [0,2,0,0,0,0|1,0,1]=4 4862 B13R0.1121 COC(CCCNC(=O)C(C)C)OC 527a_100000034021_100000210198 [0,2,0,0,0,0|1,0,1]=4 4863 B13R0.1121 COC(CCCNC(=O)C(C)F)OC 11a_100000034021_100000062450 [0,2,0,0,0,0|1,0,1]=4 4864 B13R0.1121 COC(CCCNC(=O)C(C)F)OC 1626a_100000034021_100000062450 [0,2,0,0,0,0|1,0,1]=4 4865 B13R0.1121 COC(CCCNC(=O)C(C)F)OC 240690a_100000034021_100000062450 [0,2,0,0,0,0|1,0,1]=4 4866 B13R0.1121 COC(CCCNC(=O)C(C)F)OC 527a_100000034021_100000062450 [0,2,0,0,0,0|1,0,1]=4 4867 B13R0.1121 COC(CCCNC(=O)[C@@H](C)O)OC 240690a_100000034021_100000717761 [0,2,0,0,0,0|1,0,1]=4 4868 B13R0.1121 COC(CCCNC(=O)[C@H](C)O)OC 1626a_100000034021_217856618621 [0,2,0,0,0,0|1,0,1]=4 4869 B13R0.1121 COC(CCCNC(=O)[C@H](C)O)OC 240690a_100000034021_217856618621 [0,2,0,0,0,0|1,0,1]=4 4870 B13R0.1121 COC(CCCNC(C)C(C)C)OC 2230a_100000211541_100000069011 [0,2,0,0,0,0|1,0,0]=3 4871 B13R0.1121 COC(CCCOC(C)C(=O)C)OC 34a_100000212229_100000069011 [0,2,0,0,0,0|1,0,1]=4 4872 B13R0.1121 COC(CCCOC(C)C(C)C)OC 7a_100000748068_100000069011 [0,2,0,0,0,0|1,0,0]=3 4873 B13R0.1121 COC(CCCSC(C)C(=O)C)OC 62a_100000069011_100009814033 [0,2,0,0,0,0|1,0,1]=4 4874 B13R0.1121 COC(CCCSC(C)C(=O)C)OC 62a_100009814033_100000069011 [0,2,0,0,0,0|1,0,1]=4 4875 B13R0.1121 COC(CCNCC(O)C(C)C)OC 2230a_100000759067_100009813347 [0,2,0,0,0,0|1,0,0]=3 4876 B13R0.1121 COC(CCNCC(O)C(C)C)OC 34a_100000759067_100000139399 [0,2,0,0,0,0|1,0,0]=3 4877 B13R0.1121 COC(CCOCC(C)C(=O)C)OC 34a_100000032740_100000139399 [0,2,0,0,0,0|1,0,1]=4 4878 B13R0.1121 COC(CCOCC(C)C(=O)C)OC 7a_100000032740_100009813347 [0,2,0,0,0,0|1,0,1]=4 4879 B13R0.1121 COC(CCOC[C@H](N)C(C)C)OC 34a_100011830312_100000139399 [0,2,0,0,0,0|1,0,0]=3 4880 B13R0.1121 COC(CCSCC(=O)C(C)C)OC 62a_100000139399_100000753385 [0,2,0,0,0,0|1,0,1]=4 4881 B13R0.1121 COC(CCSCC(=O)C(C)C)OC 62a_100000753385_100000139399 [0,2,0,0,0,0|1,0,1]=4 4882 B13R0.1121 COC(CNCCN(C)C(C)C)OC 270004a_100000749581_100000752162 [0,2,0,0,0,0|2,0,0]=4 4883 B13R0.1121 COC(COCCC(N)C(C)C)OC 34a_100161115045_100000211822 [0,2,0,0,0,0|1,0,0]=3 4884 B13R0.1124 C=C(C)CCC(=O)CCC(OC)OC 1458a_200000082759_100000730704 [0,2,0,0,0,0|0,0,2]=4 4885 B13R0.1124 C=C(C)CCC(=O)CCC(OC)OC 1458a_200000688413_100000139399 [0,2,0,0,0,0|0,0,2]=4 4886 B13R0.1124 C=C(C)CCC(C)NCC(OC)OC 270004a_100000210479_100011215600 [0,2,0,0,0,0|1,0,1]=4 4887 B13R0.1124 CCC(CNC(C)CCC(C)C)OC 270004a_100000731041_100000210476 [0,2,0,0,0,0|2,0,0]=4 4888 B13R0.1124 CCC(COC(C)CCC(C)C)OC 34a_100011934954_100011261404 [0,2,0,0,0,0|2,0,0]=4 4889 B13R0.1124 COC(CCC(=O)CCC(C)C)OC 1458a_100000181311_100000139399 [0,2,0,0,0,0|0,0,1]=3 4890 B13R0.1124 COC(CCC(=O)CCC(C)C)OC 1458a_200000082759_100000210312 [0,2,0,0,0,0|0,0,1]=3 4891 B13R0.1124 COC(CCC(=O)CCC(C)O)OC 1458a_200000082759_100012276601 [0,2,0,0,0,0|0,0,1]=3 4892 B13R0.1124 COC(CCC(=O)CC[S+](C)C)OC 1458a_100009452791_100000139399 [0,2,0,0,0,0|1,0,1]=4 4893 B13R0.1124 COC(CCC(=O)COC(C)C)OC 1458a_100000745533_100000139399 [0,2,0,0,0,0|1,0,1]=4 4894 B13R0.1124 COC(CCC(=O)CSC(C)C)OC 1458a_100000241585_100000139399 [0,2,0,0,0,0|1,0,1]=4 4895 B13R0.1124 COC(CCC(=O)NCC(C)C)OC 11a_100000210953_200000082759 [0,2,0,0,0,0|1,0,1]=4 4896 B13R0.1124 COC(CCC(=O)NCC(C)C)OC 1626a_100000210953_200000082759 [0,2,0,0,0,0|1,0,1]=4 4897 B13R0.1124 COC(CCC(=O)NCC(C)C)OC 240690a_100000210953_200000082759 [0,2,0,0,0,0|1,0,1]=4 4898 B13R0.1124 COC(CCC(=O)NCC(C)C)OC 527a_100000210953_200000082759 [0,2,0,0,0,0|1,0,1]=4 4899 B13R0.1124 COC(CCC(=O)NCC(C)O)OC 11a_100000210904_200000082759 [0,2,0,0,0,0|1,0,1]=4 4900 B13R0.1124 COC(CCC(=O)NCC(C)O)OC 240690a_100000210904_200000082759 [0,2,0,0,0,0|1,0,1]=4 4901 B13R0.1124 COC(CCC(=O)NCC(C)O)OC 527a_100000210904_200000082759 [0,2,0,0,0,0|1,0,1]=4 4902 B13R0.1124 COC(CCN(C)CCC(C)C)OC 2230a_100000742789_100009813347 [0,2,0,0,0,0|1,0,0]=3 4903 B13R0.1124 COC(CCN(C)CCC(C)C)OC 269982a_100000742789_100000139399 [0,2,0,0,0,0|1,0,0]=3 4904 B13R0.1124 COC(CCN(C)CCN(C)C)OC 269982a_100000225618_100000139399 [0,2,0,0,0,0|2,0,0]=4 4905 B13R0.1124 COC(CNC(=O)CCC(C)C)OC 11a_100000210479_100000181311 [0,2,0,0,0,0|1,0,1]=4 4906 B13R0.1124 COC(CNC(=O)CCC(C)C)OC 1626a_100000210479_100000181311 [0,2,0,0,0,0|1,0,1]=4 4907 B13R0.1124 COC(CNC(=O)CCC(C)C)OC 240690a_100000210479_100000181311 [0,2,0,0,0,0|1,0,1]=4 4908 B13R0.1124 COC(CNC(=O)CCC(C)C)OC 527a_100000210479_100000181311 [0,2,0,0,0,0|1,0,1]=4 4909 B13R0.1124 COC(CNC(=O)CCC(C)O)OC 1626a_100000210479_100000718519 [0,2,0,0,0,0|1,0,1]=4 4910 B13R0.1124 COC(CNC(C)CCC(C)C)OC 2230a_100138410893_100000751394 [0,2,0,0,0,0|1,0,0]=3 4911 B13R0.1124 COC(CNC(C)CCC(C)C)OC 270004a_100000210479_100000210476 [0,2,0,0,0,0|1,0,0]=3 4912 B13R0.1124 COC(CNC(C)CCC(C)C)OC 270004a_100138410893_100000752162 [0,2,0,0,0,0|1,0,0]=3 4913 B13R0.1124 COC(COC(C)CCC(C)C)OC 34a_100011215350_100000211822 [0,2,0,0,0,0|1,0,0]=3 4914 B13R0.1124 COC(COC(C)CCC(C)C)OC 34a_100011216393_100011261404 [0,2,0,0,0,0|1,0,0]=3 4915 B13R0.1124 COC(COC(C)CCC(C)C)OC 7a_100011215350_100000751394 [0,2,0,0,0,0|1,0,0]=3 4916 B13R0.1124 COC(CSC(C)CCC(C)C)OC 62a_100000751394_100011261404 [0,2,0,0,0,0|1,0,0]=3 4917 B13R0.1124 COC(CSC(C)CCC(C)C)OC 62a_100011261404_100000751394 [0,2,0,0,0,0|1,0,0]=3 4918 B13R0.1226 CCC(COCCCC(C)(C)O)OC 34a_100011934954_100009888830 [0,2,0,0,0,0|2,0,0]=4 4919 B13R0.1226 CCC(COCCCC(C)(C)O)OC 7a_100011934954_100009888830 [0,2,0,0,0,0|2,0,0]=4 4920 B13R0.1226 COC(CCCNCC(C)(C)C)OC 2230a_100000743828_100000069011 [0,2,0,0,0,0|1,0,0]=3 4921 B13R0.1226 COC(CCCNCC(C)(C)C)OC 270004a_100000034021_100011204126 [0,2,0,0,0,0|1,0,0]=3 4922 B13R0.1226 COC(CCCNCC(C)(C)F)OC 2230a_100020643315_100000069011 [0,2,0,0,0,0|1,0,0]=3 4923 B13R0.1226 COC(CCCNCC(C)(C)O)OC 2230a_100000751335_100000069011 [0,2,0,0,0,0|1,0,0]=3 4924 B13R0.1226 COC(CCCNCC(F)(F)F)OC 34a_100000717047_100000069011 [0,2,0,0,0,0|2,0,0]=4 4925 B13R0.1226 COC(CCCOCC(C)(C)F)OC 34a_100000716592_100000069011 [0,2,0,0,0,0|1,0,0]=3 4926 B13R0.1226 COC(CCCOCC(C)(F)F)OC 34a_100000068830_100000069011 [0,2,0,0,0,0|1,0,0]=3 4927 B13R0.1226 COC(CCCOCC(F)(F)Br)OC 34a_100011217949_100000069011 [0,2,0,0,0,0|2,0,0]=4 4928 B13R0.1226 COC(CCCOCC(F)(F)Cl)OC 34a_100000734434_100000069011 [0,2,0,0,0,0|2,0,0]=4 4929 B13R0.1226 COC(CCCOCC(F)(F)F)OC 34a_100000210435_100000069011 [0,2,0,0,0,0|2,0,0]=4 4930 B13R0.1226 COC(CCCSCC(C)(C)C)OC 62a_100000069011_100011219605 [0,2,0,0,0,0|1,0,0]=3 4931 B13R0.1226 COC(CCCSCC(C)(C)C)OC 62a_100011219605_100000069011 [0,2,0,0,0,0|1,0,0]=3 4932 B13R0.1226 COC(CCCSCC(C)(C)F)OC 62a_100000069011_100011997219 [0,2,0,0,0,0|1,0,0]=3 4933 B13R0.1226 COC(CCCSCC(C)(C)F)OC 62a_100011997219_100000069011 [0,2,0,0,0,0|1,0,0]=3 4934 B13R0.1226 COC(CCCSCC(C)(C)O)OC 62a_100000069011_100000764493 [0,2,0,0,0,0|1,0,0]=3 4935 B13R0.1226 COC(CCCSCC(C)(C)O)OC 62a_100000764493_100000069011 [0,2,0,0,0,0|1,0,0]=3 4936 B13R0.1226 COC(CCCSCC(F)(F)F)OC 62a_100000069011_100000763148 [0,2,0,0,0,0|2,0,0]=4 4937 B13R0.1226 COC(CCCSCC(F)(F)F)OC 62a_100000763148_100000069011 [0,2,0,0,0,0|2,0,0]=4 4938 B13R0.1226 COC(CCCSC[N+](C)(C)C)OC 62a_100000069011_200000036245 [0,2,0,0,0,0|2,0,0]=4 4939 B13R0.1226 COC(CCCSC[N+](C)(C)C)OC 62a_200000036245_100000069011 [0,2,0,0,0,0|2,0,0]=4 4940 B13R0.1226 COC(CCCSC[Si](C)(C)C)OC 62a_100000037933_100000069011 [0,2,0,0,0,0|1,1,0]=4 4941 B13R0.1226 COC(CCCSC[Si](C)(C)C)OC 62a_100000069011_100000037933 [0,2,0,0,0,0|1,1,0]=4 4942 B13R0.1226 COC(CCNCCC(C)(C)C)OC 2230a_100000738805_100009813347 [0,2,0,0,0,0|1,0,0]=3 4943 B13R0.1226 COC(CCNCCC(C)(C)F)OC 2230a_100016253952_100009813347 [0,2,0,0,0,0|1,0,0]=3 4944 B13R0.1226 COC(CCNCCC(F)(F)F)OC 2230a_100000740434_100009813347 [0,2,0,0,0,0|2,0,0]=4 4945 B13R0.1226 COC(CCNCCC(F)(F)F)OC 34a_100000740434_100000139399 [0,2,0,0,0,0|2,0,0]=4 4946 B13R0.1226 COC(CCNCCS(=O)(=O)C)OC 2230a_100000740961_100009813347 [0,2,0,0,0,0|2,0,0]=4 4947 B13R0.1226 COC(CCNCCS(=O)(=O)C)OC 34a_100000740961_100000139399 [0,2,0,0,0,0|2,0,0]=4 4948 B13R0.1226 COC(CCOCCC(C)(C)C)OC 7a_100000765024_100009813347 [0,2,0,0,0,0|1,0,0]=3 4949 B13R0.1226 COC(CCOCCC(F)(F)F)OC 34a_100000752437_100000139399 [0,2,0,0,0,0|2,0,0]=4 4950 B13R0.1226 COC(CCOCCS(=O)(=O)C)OC 34a_100000211924_100000139399 [0,2,0,0,0,0|2,0,0]=4 4951 B13R0.1226 COC(CCOCCS(=O)(=O)C)OC 7a_100000211924_100009813347 [0,2,0,0,0,0|2,0,0]=4 4952 B13R0.1226 COC(CCOCC[N+](C)(C)C)OC 7a_200020618287_100009813347 [0,2,0,0,0,0|2,0,0]=4 4953 B13R0.1226 COC(CCOCC[Si](C)(C)C)OC 7a_100000039746_100009813347 [0,2,0,0,0,0|1,1,0]=4 4954 B13R0.1226 COC(CCSCCC(C)(C)C)OC 62a_100000139399_100000755188 [0,2,0,0,0,0|1,0,0]=3 4955 B13R0.1226 COC(CCSCCC(C)(C)C)OC 62a_100000755188_100000139399 [0,2,0,0,0,0|1,0,0]=3 4956 B13R0.1226 COC(CCSCCC(C)(C)O)OC 62a_100000139399_100000702414 [0,2,0,0,0,0|1,0,0]=3 4957 B13R0.1226 COC(CCSCCC(C)(C)O)OC 62a_100000702414_100000139399 [0,2,0,0,0,0|1,0,0]=3 4958 B13R0.1226 COC(CCSCCC(F)(F)F)OC 62a_100000139399_100011219754 [0,2,0,0,0,0|2,0,0]=4 4959 B13R0.1226 COC(CCSCCC(F)(F)F)OC 62a_100011219754_100000139399 [0,2,0,0,0,0|2,0,0]=4 4960 B13R0.1226 COC(CCSCCS(=O)(=O)C)OC 62a_100000139399_100000230027 [0,2,0,0,0,0|2,0,0]=4 4961 B13R0.1226 COC(CCSCCS(=O)(=O)C)OC 62a_100000731031_100000139399 [0,2,0,0,0,0|2,0,0]=4 4962 B13R0.1226 COC(CCSCC[N+](C)(C)C)OC 62a_100000085578_100000139399 [0,2,0,0,0,0|2,0,0]=4 4963 B13R0.1226 COC(CCSCC[N+](C)(C)C)OC 62a_100000139399_100000085578 [0,2,0,0,0,0|2,0,0]=4 4964 B13R0.1226 COC(CCSCC[Si](C)(C)C)OC 62a_100000139399_200000733723 [0,2,0,0,0,0|1,1,0]=4 4965 B13R0.1226 COC(CCSCC[Si](C)(C)C)OC 62a_200000733723_100000139399 [0,2,0,0,0,0|1,1,0]=4 4966 B13R0.1226 COC(CNCCCC(F)(F)F)OC 2230a_100000727188_100000751394 [0,2,0,0,0,0|2,0,0]=4 4967 B13R0.1226 COC(CNCCCC(F)(F)F)OC 270004a_100000727188_100000752162 [0,2,0,0,0,0|2,0,0]=4 4968 B13R0.1226 COC(CNCCCC(F)(F)F)OC 34a_100000727188_100000211822 [0,2,0,0,0,0|2,0,0]=4 4969 B13R0.1226 COC(CNCCCS(=O)(=O)C)OC 2230a_100000742409_100000751394 [0,2,0,0,0,0|2,0,0]=4 4970 B13R0.1226 COC(CNCCCS(=O)(=O)C)OC 270004a_100000742409_100000752162 [0,2,0,0,0,0|2,0,0]=4 4971 B13R0.1226 COC(CNCCCS(=O)(=O)C)OC 34a_100000742409_100000211822 [0,2,0,0,0,0|2,0,0]=4 4972 B13R0.1226 COC(CNCCOC(C)(C)C)OC 2230a_100000747557_100000751394 [0,2,0,0,0,0|2,0,0]=4 4973 B13R0.1226 COC(CNCCOC(C)(C)C)OC 270004a_100000747557_100000752162 [0,2,0,0,0,0|2,0,0]=4 4974 B13R0.1226 COC(CNCCSC(C)(C)C)OC 2230a_100000689375_100000751394 [0,2,0,0,0,0|2,0,0]=4 4975 B13R0.1226 COC(CNCCSC(C)(C)C)OC 270004a_100000689375_100000752162 [0,2,0,0,0,0|2,0,0]=4 4976 B13R0.1226 COC(COCCCC(C)(C)O)OC 34a_100011216393_100009888830 [0,2,0,0,0,0|1,0,0]=3 4977 B13R0.1226 COC(COCCCC(F)(F)F)OC 34a_100000749235_100000211822 [0,2,0,0,0,0|2,0,0]=4 4978 B13R0.1226 COC(COCCCC(F)(F)F)OC 34a_100011216393_100011215983 [0,2,0,0,0,0|2,0,0]=4 4979 B13R0.1226 COC(COCCCS(=O)(=O)C)OC 34a_100000689940_100000211822 [0,2,0,0,0,0|2,0,0]=4 4980 B13R0.1226 COC(COCCCS(=O)(=O)C)OC 34a_100011216393_100000754308 [0,2,0,0,0,0|2,0,0]=4 4981 B13R0.1226 COC(COCCCS(=O)(=O)C)OC 7a_100000689940_100000751394 [0,2,0,0,0,0|2,0,0]=4 4982 B13R0.1226 COC(COCCC[N+](C)(C)C)OC 34a_100011216393_100016990835 [0,2,0,0,0,0|2,0,0]=4 4983 B13R0.1226 COC(COCCC[Si](C)(C)C)OC 34a_100011216393_100011219597 [0,2,0,0,0,0|1,1,0]=4 4984 B13R0.1226 COC(COCCC[Si](C)(C)C)OC 7a_200011215415_100000751394 [0,2,0,0,0,0|1,1,0]=4 4985 B13R0.1226 COC(COCCOC(C)(C)C)OC 34a_100000693234_100000211822 [0,2,0,0,0,0|2,0,0]=4 4986 B13R0.1226 COC(COCCOC(C)(C)C)OC 7a_100000693234_100000751394 [0,2,0,0,0,0|2,0,0]=4 4987 B13R0.1226 COC(CSCCCC(C)(C)O)OC 62a_100000751394_100009888830 [0,2,0,0,0,0|1,0,0]=3 4988 B13R0.1226 COC(CSCCCC(C)(C)O)OC 62a_100009888830_100000751394 [0,2,0,0,0,0|1,0,0]=3 4989 B13R0.1226 COC(CSCCCC(F)(F)F)OC 62a_100000751394_100011216173 [0,2,0,0,0,0|2,0,0]=4 4990 B13R0.1226 COC(CSCCCC(F)(F)F)OC 62a_100011216173_100000751394 [0,2,0,0,0,0|2,0,0]=4 4991 B13R0.1226 COC(CSCCCS(=O)(=O)C)OC 62a_100000751394_100000754308 [0,2,0,0,0,0|2,0,0]=4 4992 B13R0.1226 COC(CSCCCS(=O)(=O)C)OC 62a_100000754308_100000751394 [0,2,0,0,0,0|2,0,0]=4 4993 B13R0.1226 COC(CSCCC[N+](C)(C)C)OC 62a_100000751394_100016990835 [0,2,0,0,0,0|2,0,0]=4 4994 B13R0.1226 COC(CSCCC[N+](C)(C)C)OC 62a_100016990835_100000751394 [0,2,0,0,0,0|2,0,0]=4 4995 B13R0.1226 COC(CSCCC[Si](C)(C)C)OC 62a_100000751394_100011219597 [0,2,0,0,0,0|1,1,0]=4 4996 B13R0.1226 COC(CSCCC[Si](C)(C)C)OC 62a_100011219597_100000751394 [0,2,0,0,0,0|1,1,0]=4 4997 B13R0.1381 CCC(OC)C(=O)CCCCC(C)C 1458a_100000747056_100011216152 [0,2,0,0,0,0|1,0,1]=4 4998 B13R0.1381 COC(OC)C(=O)CCCCC(=O)C 1458a_100000046285_100000735457 [0,2,0,0,0,0|0,0,2]=4 4999 B13R0.1381 COC(OC)C(=O)CCCCC(C)C 1458a_100000046285_100011216152 [0,2,0,0,0,0|0,0,1]=3 5000 B13R0.1381 COC(OC)C(=O)NCCCC(C)C 11a_200000737386_100000046285 [0,2,0,0,0,0|1,0,1]=4 5001 B13R0.1381 COC(OC)C(=O)NCCCC(C)C 240690a_200000737386_100000046285 [0,2,0,0,0,0|1,0,1]=4 5002 B13R0.1381 COC(OC)C(=O)NCCCC(C)C 527a_200000737386_100000046285 [0,2,0,0,0,0|1,0,1]=4 5003 B13R0.1381 COC(OC)C(C)NCCCC(C)C 270004a_200000737386_100000211384 [0,2,0,0,0,0|1,0,0]=3 5004 B13R0.1381 COC(OC)C(C)NCCCC(C)C 34a_200000737386_100011222894 [0,2,0,0,0,0|1,0,0]=3 5005 B13R0.1381 COC(OC)C(C)NCCCN(C)C 270004a_102531767803_100000211384 [0,2,0,0,0,0|2,0,0]=4 5006 B13R0.1381 COC(OC)C(C)NCCCS(=O)C 270004a_200000753449_100000211384 [0,2,0,0,0,0|2,0,0]=4 5007 B13R0.1381 COC(OC)C(C)NCCOC(C)C 270004a_100000701111_100000211384 [0,2,0,0,0,0|2,0,0]=4 5008 B13R0.1381 COC(OC)C(C)NCCOC(C)C 34a_100000701111_100011222894 [0,2,0,0,0,0|2,0,0]=4 5009 B13R0.1381 COC(OC)C(C)NCCSC(C)C 270004a_100000731138_100000211384 [0,2,0,0,0,0|2,0,0]=4 5010 B13R0.1381 COC(OC)C(C)NCCSC(C)C 34a_100000731138_100011222894 [0,2,0,0,0,0|2,0,0]=4 5011 B13R0.1381 COC(OC)C(C)OCCCC(=O)C 34a_100000754440_100000685027 [0,2,0,0,0,0|1,0,1]=4 5012 B13R0.1381 COC(OC)C(C)OCCCC(=O)C 34a_100000759063_100011222894 [0,2,0,0,0,0|1,0,1]=4 5013 B13R0.1381 COC(OC)C(C)OCCCC(=O)C 7a_100000754440_100011215641 [0,2,0,0,0,0|1,0,1]=4 5014 B13R0.1381 COC(OC)C(C)OCCCC(C)C 34a_100000210774_100011222894 [0,2,0,0,0,0|1,0,0]=3 5015 B13R0.1381 COC(OC)C(C)OCCCC(C)C 34a_100000754440_100011214892 [0,2,0,0,0,0|1,0,0]=3 5016 B13R0.1381 COC(OC)C(C)OCCCC(C)C 7a_100000754440_100011214892 [0,2,0,0,0,0|1,0,0]=3 5017 B13R0.1381 COC(OC)C(C)OCCCC(C)O 34a_100000754440_200000718107 [0,2,0,0,0,0|1,0,0]=3 5018 B13R0.1381 COC(OC)C(C)OCCCC(C)O 7a_100000754440_200000718107 [0,2,0,0,0,0|1,0,0]=3 5019 B13R0.1381 COC(OC)C(C)OCCCN(C)C 7a_100000754440_100000757444 [0,2,0,0,0,0|2,0,0]=4 5020 B13R0.1381 COC(OC)C(C)OCCNC(C)C 34a_100000224655_100011222894 [0,2,0,0,0,0|2,0,0]=4 5021 B13R0.1381 COC(OC)C(C)OCCOC(C)C 34a_100000211219_100011222894 [0,2,0,0,0,0|2,0,0]=4 5022 B13R0.1381 COC(OC)C(C)OCCOC(C)C 34a_100000754440_100000211751 [0,2,0,0,0,0|2,0,0]=4 5023 B13R0.1381 COC(OC)C(C)OCCOC(C)C 7a_100000754440_100000211751 [0,2,0,0,0,0|2,0,0]=4 5024 B13R0.1381 COC(OC)C(C)OCCSC(C)C 34a_100000754440_100000730970 [0,2,0,0,0,0|2,0,0]=4 5025 B13R0.1381 COC(OC)C(C)OCCSC(C)C 34a_200011212901_100011222894 [0,2,0,0,0,0|2,0,0]=4 5026 B13R0.1381 COC(OC)C(C)OCCSC(C)C 7a_100000754440_100000730970 [0,2,0,0,0,0|2,0,0]=4 5027 B13R0.1381 COC(OC)C(C)SCCCC(=O)C 62a_100011215641_100011222894 [0,2,0,0,0,0|1,0,1]=4 5028 B13R0.1381 COC(OC)C(C)SCCCC(=O)C 62a_100011222894_100011215641 [0,2,0,0,0,0|1,0,1]=4 5029 B13R0.1381 COC(OC)C(C)SCCCC(C)C 62a_100011214892_100011222894 [0,2,0,0,0,0|1,0,0]=3 5030 B13R0.1381 COC(OC)C(C)SCCCC(C)C 62a_100011222894_100011214892 [0,2,0,0,0,0|1,0,0]=3 5031 B13R0.1381 COC(OC)C(C)SCCCC(C)O 62a_100011222894_200000718107 [0,2,0,0,0,0|1,0,0]=3 5032 B13R0.1381 COC(OC)C(C)SCCCC(C)O 62a_200000718107_100011222894 [0,2,0,0,0,0|1,0,0]=3 5033 B13R0.1381 COC(OC)C(C)SCCCN(C)C 62a_100011222894_100000757444 [0,2,0,0,0,0|2,0,0]=4 5034 B13R0.1381 COC(OC)C(C)SCCOC(C)C 62a_100000211751_100011222894 [0,2,0,0,0,0|2,0,0]=4 5035 B13R0.1381 COC(OC)C(C)SCCOC(C)C 62a_100011222894_100000211751 [0,2,0,0,0,0|2,0,0]=4 5036 B13R0.1381 COC(OC)C(C)SCCSC(C)C 62a_100000730970_100011222894 [0,2,0,0,0,0|2,0,0]=4 5037 B13R0.1381 COC(OC)C(C)SCCSC(C)C 62a_100011222894_100000730970 [0,2,0,0,0,0|2,0,0]=4 5038 B13R0.1614 COC(C)(CNCCCC(C)C)OC 2230a_100000732740_100011214892 [0,2,0,0,0,0|1,0,0]=3 5039 B13R0.1614 COC(C)(CNCCCC(C)C)OC 2230a_200000737386_100000064154 [0,2,0,0,0,0|1,0,0]=3 5040 B13R0.1614 COC(C)(CNCCCC(C)C)OC 34a_200000737386_100000766008 [0,2,0,0,0,0|1,0,0]=3 5041 B13R0.1614 COC(C)(CNCCCC(C)O)OC 2230a_100000732740_200000718107 [0,2,0,0,0,0|1,0,0]=3 5042 B13R0.1614 COC(C)(CNCCCS(=O)C)OC 2230a_200000753449_100000064154 [0,2,0,0,0,0|2,0,0]=4 5043 B13R0.1614 COC(C)(CNCCOC(C)C)OC 2230a_100000701111_100000064154 [0,2,0,0,0,0|2,0,0]=4 5044 B13R0.1614 COC(C)(CNCCOC(C)C)OC 2230a_100000732740_100000211751 [0,2,0,0,0,0|2,0,0]=4 5045 B13R0.1614 COC(C)(CNCCOC(C)C)OC 34a_100000701111_100000766008 [0,2,0,0,0,0|2,0,0]=4 5046 B13R0.1614 COC(C)(CNCCSC(C)C)OC 2230a_100000731138_100000064154 [0,2,0,0,0,0|2,0,0]=4 5047 B13R0.1614 COC(C)(CNCCSC(C)C)OC 2230a_100000732740_100000730970 [0,2,0,0,0,0|2,0,0]=4 5048 B13R0.1614 COC(C)(CNCCSC(C)C)OC 34a_100000731138_100000766008 [0,2,0,0,0,0|2,0,0]=4 5049 B13R0.1614 COC(C)(COCCCC(=O)C)OC 34a_100000759063_100000766008 [0,2,0,0,0,0|1,0,1]=4 5050 B13R0.1614 COC(C)(COCCCC(C)C)OC 34a_100000210774_100000766008 [0,2,0,0,0,0|1,0,0]=3 5051 B13R0.1614 COC(C)(COCCNC(C)C)OC 34a_100000224655_100000766008 [0,2,0,0,0,0|2,0,0]=4 5052 B13R0.1614 COC(C)(COCCOC(C)C)OC 34a_100000211219_100000766008 [0,2,0,0,0,0|2,0,0]=4 5053 B13R0.1614 COC(C)(COCCSC(C)C)OC 34a_200011212901_100000766008 [0,2,0,0,0,0|2,0,0]=4 5054 B13R0.1614 COC(C)(CSCCCC(=O)C)OC 62a_100000766008_100011215641 [0,2,0,0,0,0|1,0,1]=4 5055 B13R0.1614 COC(C)(CSCCCC(=O)C)OC 62a_100011215641_100000766008 [0,2,0,0,0,0|1,0,1]=4 5056 B13R0.1614 COC(C)(CSCCCC(C)C)OC 62a_100000766008_100011214892 [0,2,0,0,0,0|1,0,0]=3 5057 B13R0.1614 COC(C)(CSCCCC(C)C)OC 62a_100011214892_100000766008 [0,2,0,0,0,0|1,0,0]=3 5058 B13R0.1614 COC(C)(CSCCCC(C)O)OC 62a_100000766008_200000718107 [0,2,0,0,0,0|1,0,0]=3 5059 B13R0.1614 COC(C)(CSCCCC(C)O)OC 62a_200000718107_100000766008 [0,2,0,0,0,0|1,0,0]=3 5060 B13R0.1614 COC(C)(CSCCCN(C)C)OC 62a_100000766008_100000757444 [0,2,0,0,0,0|2,0,0]=4 5061 B13R0.1614 COC(C)(CSCCOC(C)C)OC 62a_100000211751_100000766008 [0,2,0,0,0,0|2,0,0]=4 5062 B13R0.1614 COC(C)(CSCCOC(C)C)OC 62a_100000766008_100000211751 [0,2,0,0,0,0|2,0,0]=4 5063 B13R0.1614 COC(C)(CSCCSC(C)C)OC 62a_100000730970_100000766008 [0,2,0,0,0,0|2,0,0]=4 5064 B13R0.1614 COC(C)(CSCCSC(C)C)OC 62a_100000766008_100000730970 [0,2,0,0,0,0|2,0,0]=4 5065 B13R0.1614 COP(=O)(CCOCCC(C)C)OC 34a_200000043213_100000210312 [0,2,0,0,0,0|2,0,0]=4 5066 B13R0.1614 COP(=O)(CCOCCC(C)O)OC 34a_200000043213_100012276601 [0,2,0,0,0,0|2,0,0]=4 5067 B13R0.1614 COP(=O)(COCCCC(C)C)OC 34a_100000101693_100011214892 [0,2,0,0,0,0|2,0,0]=4 5068 B13R0.1614 COP(=O)(COCCCC(C)O)OC 34a_100000101693_200000718107 [0,2,0,0,0,0|2,0,0]=4 5069 B13R0.1614 CO[Si](C)(CCCNCC(C)C)OC 34a_100000210953_100000031653 [0,2,0,0,0,0|1,1,0]=4 5070 B13R0.1614 CO[Si](C)(CCCNCC(C)O)OC 34a_100000210904_100000031653 [0,2,0,0,0,0|1,1,0]=4 5071 B13R0.1614 CO[Si](C)(CCCOCC(C)Br)OC 34a_100012180447_100000031653 [0,2,0,0,0,0|1,1,0]=4 5072 B13R0.1614 CO[Si](C)(CCCOCC(C)C)OC 34a_100000210257_100000031653 [0,2,0,0,0,0|1,1,0]=4 5073 B13R0.1614 CO[Si](C)(CCCOCC(C)F)OC 34a_100015925927_100000031653 [0,2,0,0,0,0|1,1,0]=4 5074 B13R0.1614 CO[Si](C)(CCCOC[C@@H](C)Cl)OC 34a_100016084084_100000031653 [0,2,0,0,0,0|1,1,0]=4 5075 B13R0.1614 CO[Si](C)(CCCOC[C@@H](C)N)OC 34a_100000737577_100000031653 [0,2,0,0,0,0|1,1,0]=4 5076 B13R0.1614 CO[Si](C)(CCCSCC(C)C)OC 62a_100000031653_100000210760 [0,2,0,0,0,0|1,1,0]=4 5077 B13R0.1614 CO[Si](C)(CCCSCC(C)C)OC 62a_100000210624_100000031653 [0,2,0,0,0,0|1,1,0]=4 5078 B13R0.1614 CO[Si](C)(CCCSCC(C)O)OC 62a_100000031653_100011218427 [0,2,0,0,0,0|1,1,0]=4 5079 B13R0.1614 CO[Si](C)(CCCSCC(C)O)OC 62a_100011218427_100000031653 [0,2,0,0,0,0|1,1,0]=4 5080 B13R0.1614 CO[Si](C)(CCCSC[C@@H](C)O)OC 62a_100000031653_100009817552 [0,2,0,0,0,0|1,1,0]=4 5081 B13R0.1614 CO[Si](C)(CCCSC[C@@H](C)O)OC 62a_100009817552_100000031653 [0,2,0,0,0,0|1,1,0]=4 5082 B13R0.1614 CO[Si](C)(CSCCCC(C)C)OC 62a_100000067953_100011214892 [0,2,0,0,0,0|1,1,0]=4 5083 B13R0.1614 CO[Si](C)(CSCCCC(C)C)OC 62a_100011214892_100000067953 [0,2,0,0,0,0|1,1,0]=4 5084 B13R0.1614 CO[Si](C)(CSCCCC(C)O)OC 62a_100000067953_200000718107 [0,2,0,0,0,0|1,1,0]=4 5085 B13R0.1614 CO[Si](C)(CSCCCC(C)O)OC 62a_200000718107_100000067953 [0,2,0,0,0,0|1,1,0]=4 5086 B13R0.3 C#CCCC(=O)CCCC(OC)OC 1458a_100000692101_100000069011 [0,2,0,0,0,0|0,0,2]=4 5087 B13R0.3 C=CCCC(=O)CCCC(OC)OC 1458a_100000749702_100000069011 [0,2,0,0,0,0|0,0,2]=4 5088 B13R0.3 C=CCCC(C)OCCC(OC)OC 34a_100000765329_100000139399 [0,2,0,0,0,0|0,0,2]=4 5089 B13R0.3 C=CCCC(C)OCCC(OC)OC 7a_100000765329_100009813347 [0,2,0,0,0,0|0,0,2]=4 5090 B13R0.3 C=CCCN(C)CCCC(OC)OC 2230a_100020639649_100000069011 [0,2,0,0,0,0|0,0,2]=4 5091 B13R0.3 C=CCCN(C)CCCC(OC)OC 269982a_100020639649_100000069011 [0,2,0,0,0,0|0,0,2]=4 5092 B13R0.3 CC=CCC(=O)CCCC(OC)OC 1458a_100121576822_100000069011 [0,2,0,0,0,0|0,0,2]=4 5093 B13R0.3 CCC#CC(=O)CCCC(OC)OC 1458a_100011827653_100000069011 [0,2,0,0,0,0|0,0,2]=4 5094 B13R0.3 CCC#CC(C)OCCC(OC)OC 34a_100000033903_100000139399 [0,2,0,0,0,0|0,0,2]=4 5095 B13R0.3 CCC#CC(C)OCCC(OC)OC 7a_100000033903_100009813347 [0,2,0,0,0,0|0,0,2]=4 5096 B13R0.3 CCC=CC(=O)CCCC(OC)OC 1458a_100000212282_100000069011 [0,2,0,0,0,0|0,0,2]=4 5097 B13R0.3 CCCCC(=O)CCCC(OC)OC 1458a_100000210183_100000069011 [0,2,0,0,0,0|0,0,0]=2 5098 B13R0.3 CCCCC(C)COCC(CC)CC 34a_100011995851_100011215472 [0,2,0,0,0,0|2,0,0]=4 5099 B13R0.3 CCCCC(C)COCC(CC)CC 7a_100011995851_100011215472 [0,2,0,0,0,0|2,0,0]=4 5100 B13R0.3 CCCCC(C)COCC(OC)OC 34a_100011995851_100000211822 [0,2,0,0,0,0|0,0,0]=2 5101 B13R0.3 CCCCC(C)COCC(OC)OC 7a_100011995851_100000751394 [0,2,0,0,0,0|0,0,0]=2 5102 B13R0.3 CCCCC(C)NCCC(OC)OC 2230a_100000126638_100009813347 [0,2,0,0,0,0|0,0,0]=2 5103 B13R0.3 CCCCC(C)OCCC(OC)OC 34a_100000687866_100000139399 [0,2,0,0,0,0|0,0,0]=2 5104 B13R0.3 CCCCC(C)OCCC(OC)OC 7a_100000687866_100009813347 [0,2,0,0,0,0|0,0,0]=2 5105 B13R0.3 CCCCC(C)SCCC(OC)OC 62a_100000139399_200011215066 [0,2,0,0,0,0|0,0,0]=2 5106 B13R0.3 CCCCC(C)SCCC(OC)OC 62a_200011215066_100000139399 [0,2,0,0,0,0|0,0,0]=2 5107 B13R0.3 CCCCN(C)CCCC(OC)OC 2230a_100000207549_100000069011 [0,2,0,0,0,0|0,0,0]=2 5108 B13R0.3 CCCCN(C)CCCC(OC)OC 269982a_100000207549_100000069011 [0,2,0,0,0,0|0,0,0]=2 5109 B13R0.3 CCCC[C@H](N)COCC(CC)CC 34a_100011934283_100011215472 [0,2,0,0,0,0|2,0,0]=4 5110 B13R0.3 CCCC[C@H](N)COCC(OC)OC 34a_100011934283_100000211822 [0,2,0,0,0,0|0,0,0]=2 5111 B13R0.3 CCCNC(=O)CNCC(OC)OC 2230a_100000174927_100000751394 [0,2,0,0,0,0|1,0,1]=4 5112 B13R0.3 CCCNC(=O)CNCC(OC)OC 270004a_100000174927_100000752162 [0,2,0,0,0,0|1,0,1]=4 5113 B13R0.3 CCCNC(=O)COCC(OC)OC 34a_100011216393_100000183358 [0,2,0,0,0,0|1,0,1]=4 5114 B13R0.3 CCCNC(=O)CSCC(OC)OC 62a_100000183358_100000751394 [0,2,0,0,0,0|1,0,1]=4 5115 B13R0.3 CCCNC(=O)CSCC(OC)OC 62a_100000751394_100000183358 [0,2,0,0,0,0|1,0,1]=4 5116 B13R0.3 CCCOC(=O)COCC(OC)OC 34a_100011216393_200011215008 [0,2,0,0,0,0|1,0,1]=4 5117 B13R0.3 CCCOC(=O)CSCC(OC)OC 62a_100000751394_200011215008 [0,2,0,0,0,0|1,0,1]=4 5118 B13R0.3 CCCOC(=O)CSCC(OC)OC 62a_200011215008_100000751394 [0,2,0,0,0,0|1,0,1]=4 5119 B13R0.3 CCCOC(C)CNCC(OC)OC 2230a_100015185124_100000751394 [0,2,0,0,0,0|1,0,0]=3 5120 B13R0.3 CCCOC(C)CNCC(OC)OC 270004a_100015185124_100000752162 [0,2,0,0,0,0|1,0,0]=3 5121 B13R0.3 CCCOC(C)CNCC(OC)OC 34a_100015185124_100000211822 [0,2,0,0,0,0|1,0,0]=3 5122 B13R0.3 CCOCC(=O)CCCC(OC)OC 1458a_100000211967_100000069011 [0,2,0,0,0,0|0,0,1]=3 5123 B13R0.3 CCOCC(C)OCCC(OC)OC 34a_100000718985_100000139399 [0,2,0,0,0,0|1,0,0]=3 5124 B13R0.3 CCOCC(C)OCCC(OC)OC 7a_100000718985_100009813347 [0,2,0,0,0,0|1,0,0]=3 5125 B13R0.3 CCOCC(O)CNCC(OC)OC 2230a_102515437182_100000751394 [0,2,0,0,0,0|1,0,0]=3 5126 B13R0.3 CCOCC(O)CNCC(OC)OC 270004a_102515437182_100000752162 [0,2,0,0,0,0|1,0,0]=3 5127 B13R0.3 CCOCC(O)CNCC(OC)OC 34a_102515437182_100000211822 [0,2,0,0,0,0|1,0,0]=3 5128 B13R0.3 CCSCC(=O)CCCC(OC)OC 1458a_100000230394_100000069011 [0,2,0,0,0,0|0,0,1]=3 5129 B13R0.3 COC(CCCC(=O)CCC#N)OC 1458a_100011934036_100000069011 [0,2,0,0,0,0|0,0,2]=4 5130 B13R0.3 COC(CCCC(=O)CCSC)OC 1458a_100000174002_100000069011 [0,2,0,0,0,0|0,0,1]=3 5131 B13R0.3 COC(CCCN(C)CCC#N)OC 2230a_100000184479_100000069011 [0,2,0,0,0,0|1,0,1]=4 5132 B13R0.3 COC(CCCN(C)CCCO)OC 2230a_100000213112_100000069011 [0,2,0,0,0,0|1,0,0]=3 5133 B13R0.3 COC(CCCN(C)CCCO)OC 269982a_100000213112_100000069011 [0,2,0,0,0,0|1,0,0]=3 5134 B13R0.3 COC(CCCN(C)CCSC)OC 2230a_100000686725_100000069011 [0,2,0,0,0,0|1,0,0]=3 5135 B13R0.3 COC(CCCN(C)CCSC)OC 269982a_100000686725_100000069011 [0,2,0,0,0,0|1,0,0]=3 5136 B13R0.3 COC(CCOC(C)CCCCl)OC 34a_200000718107_100000139399 [0,2,0,0,0,0|1,0,0]=3 5137 B13R0.3 COC(CCOC(C)CCCCl)OC 7a_200000718107_100009813347 [0,2,0,0,0,0|1,0,0]=3 5138 B13R0.3 COC(CNC[C@H](C)CCCO)OC 2230a_100160569302_100000751394 [0,2,0,0,0,0|1,0,0]=3 5139 B13R0.3 COC(CNC[C@H](C)CCCO)OC 270004a_100160569302_100000752162 [0,2,0,0,0,0|1,0,0]=3 5140 B13R0.3 COC(CNC[C@H](C)CCCO)OC 34a_100160569302_100000211822 [0,2,0,0,0,0|1,0,0]=3 5141 B13R0.3 COC(COC[C@@H](N)CCSC)OC 34a_100011827619_100000211822 [0,2,0,0,0,0|1,0,0]=3 5142 B13R0.3 COCCC(=O)CCCC(OC)OC 1458a_100000749529_100000069011 [0,2,0,0,0,0|0,0,1]=3 5143 B13R0.3 COCCN(C)CCCC(OC)OC 2230a_100000743101_100000069011 [0,2,0,0,0,0|1,0,0]=3 5144 B13R0.3 COCCN(C)CCCC(OC)OC 269982a_100000743101_100000069011 [0,2,0,0,0,0|1,0,0]=3 5145 B13R0.3 COCO[C@H](C)COCC(OC)OC 34a_100016172286_100000211822 [0,2,0,0,0,0|2,0,0]=4 5146 B13R0.3 COCO[C@H](C)COCC(OC)OC 7a_100016172286_100000751394 [0,2,0,0,0,0|2,0,0]=4 5147 B13R0.61 CCCCCCCCC(CC)N(C)C 270004a_100102631434_200011217995 [0,2,0,0,0,0|2,0,0]=4 5148 B13R0.61 CCCCCCCNC(CC)C(C)C 270004a_100000229938_100000210600 [0,2,0,0,0,0|2,0,0]=4 5149 B13R0.61 CCCCCCCN[C@@H](CC)[C@@H](C)O 2230a_100161114882_100000210681 [0,2,0,0,0,0|2,0,0]=4 5150 B13R0.61 CCCCCCCN[C@@H](CC)[C@@H](C)O 34a_100161114882_100000210614 [0,2,0,0,0,0|2,0,0]=4 5151 B13R0.61 CCCCCCCOC(CC)C(C)C 34a_100011218073_100000210614 [0,2,0,0,0,0|2,0,0]=4 5152 B13R0.61 CCCCCCCOC(CC)C(C)C 7a_100011218073_100000210614 [0,2,0,0,0,0|2,0,0]=4 5153 B13R0.61 CCCCCCNCC(CC)C(C)C 269862a_100000210581_100011214906 [0,2,0,0,0,0|2,0,0]=4 5154 B13R0.61 CCCCCCOCC(CC)C(C)C 34a_100011995916_100000210314 [0,2,0,0,0,0|2,0,0]=4 5155 B13R0.61 CCCCCCOCC(CC)C(C)C 7a_100011995916_100000210314 [0,2,0,0,0,0|2,0,0]=4 5156 B13R0.277 C#CCCCCCC(=O)C(OC)OC 1458a_100000046285_100012094781 [0,2,0,0,0,0|0,0,2]=4 5157 B13R0.277 C#CCCCCNC(C)C(OC)OC 34a_100000706060_100011222894 [0,2,0,0,0,0|0,0,2]=4 5158 B13R0.277 C#CCCCCOC(C)C(OC)OC 34a_100000754440_100010269958 [0,2,0,0,0,0|0,0,2]=4 5159 B13R0.277 C#CCCCCOC(C)C(OC)OC 34a_100000766709_100011222894 [0,2,0,0,0,0|0,0,2]=4 5160 B13R0.277 C#CCCCCOC(C)C(OC)OC 7a_100000754440_100010269958 [0,2,0,0,0,0|0,0,2]=4 5161 B13R0.277 C#CCCCCSC(C)C(OC)OC 62a_100010269958_100011222894 [0,2,0,0,0,0|0,0,2]=4 5162 B13R0.277 C#CCCCCSC(C)C(OC)OC 62a_100011222894_100010269958 [0,2,0,0,0,0|0,0,2]=4 5163 B13R0.277 C=CCCCCCC(=O)C(OC)OC 1458a_100000046285_100000700193 [0,2,0,0,0,0|0,0,2]=4 5164 B13R0.277 C=CCCCCNC(C)C(OC)OC 270004a_100000703577_100000211384 [0,2,0,0,0,0|0,0,2]=4 5165 B13R0.277 C=CCCCCNC(C)C(OC)OC 34a_100000703577_100011222894 [0,2,0,0,0,0|0,0,2]=4 5166 B13R0.277 C=CCCCCOC(C)C(OC)OC 34a_100000754440_100011215482 [0,2,0,0,0,0|0,0,2]=4 5167 B13R0.277 C=CCCCCOC(C)C(OC)OC 34a_100000766645_100011222894 [0,2,0,0,0,0|0,0,2]=4 5168 B13R0.277 C=CCCCCOC(C)C(OC)OC 7a_100000754440_100011215482 [0,2,0,0,0,0|0,0,2]=4 5169 B13R0.277 C=CCCCCSC(C)C(OC)OC 62a_100011215482_100011222894 [0,2,0,0,0,0|0,0,2]=4 5170 B13R0.277 C=CCCCCSC(C)C(OC)OC 62a_100011222894_100011215482 [0,2,0,0,0,0|0,0,2]=4 5171 B13R0.277 CC/C=C\CCOC(C)C(OC)OC 34a_100000754440_100015370543 [0,2,0,0,0,0|0,0,2]=4 5172 B13R0.277 CC/C=C\CCOC(C)C(OC)OC 34a_100016288707_100011222894 [0,2,0,0,0,0|0,0,2]=4 5173 B13R0.277 CC/C=C\CCOC(C)C(OC)OC 7a_100000754440_100015370543 [0,2,0,0,0,0|0,0,2]=4 5174 B13R0.277 CC/C=C\CCSC(C)C(OC)OC 62a_100011222894_100015370543 [0,2,0,0,0,0|0,0,2]=4 5175 B13R0.277 CC/C=C\CCSC(C)C(OC)OC 62a_100015370543_100011222894 [0,2,0,0,0,0|0,0,2]=4 5176 B13R0.277 CC=CCCCOC(C)C(OC)OC 34a_100020645299_100011222894 [0,2,0,0,0,0|0,0,2]=4 5177 B13R0.277 CCC#CCCOC(C)C(OC)OC 34a_100000036655_100011222894 [0,2,0,0,0,0|0,0,2]=4 5178 B13R0.277 CCC(OC)C(=O)CCCCCCF 1458a_100000747056_100015922095 [0,2,0,0,0,0|1,0,1]=4 5179 B13R0.277 CCC(OC)C(=O)CCCCCCO 1458a_100000747056_100000766143 [0,2,0,0,0,0|1,0,1]=4 5180 B13R0.277 CCC/C=C/COC(C)C(OC)OC 34a_100016278788_100011222894 [0,2,0,0,0,0|0,0,2]=4 5181 B13R0.277 CCCC#CCOC(C)C(OC)OC 34a_100000034806_100011222894 [0,2,0,0,0,0|0,0,2]=4 5182 B13R0.277 CCCCCCCC(=O)C(CC)CC 1458a_100000211163_100000210614 [0,2,0,0,0,0|2,0,0]=4 5183 B13R0.277 CCCCCCCC(=O)C(CC)CC 1458a_100000211969_100000210505 [0,2,0,0,0,0|2,0,0]=4 5184 B13R0.277 CCCCCCCC(=O)C(CC)OC 1458a_100000747056_100000210614 [0,2,0,0,0,0|1,0,0]=3 5185 B13R0.277 CCCCCCCC(=O)C(OC)OC 1458a_100000046285_100000210614 [0,2,0,0,0,0|0,0,0]=2 5186 B13R0.277 CCCCCCCN(C)C(CC)CC 2230a_100000737045_100000210681 [0,2,0,0,0,0|2,0,0]=4 5187 B13R0.277 CCCCCCCN(C)C(CC)CC 269982a_100000228206_100000210505 [0,2,0,0,0,0|2,0,0]=4 5188 B13R0.277 CCCCCCCN(C)C(CC)CC 269982a_100000737045_100000210681 [0,2,0,0,0,0|2,0,0]=4 5189 B13R0.277 CCCCCCCN(C)C(CC)CC 270004a_100000228206_100000210860 [0,2,0,0,0,0|2,0,0]=4 5190 B13R0.277 CCCCCCNC(=O)C(CC)OC 11a_100000210581_100000747056 [0,2,0,0,0,0|1,0,1]=4 5191 B13R0.277 CCCCCCNC(=O)C(CC)OC 1626a_100000210581_100000747056 [0,2,0,0,0,0|1,0,1]=4 5192 B13R0.277 CCCCCCNC(=O)C(CC)OC 240690a_100000210581_100000747056 [0,2,0,0,0,0|1,0,1]=4 5193 B13R0.277 CCCCCCNC(=O)C(CC)OC 527a_100000210581_100000747056 [0,2,0,0,0,0|1,0,1]=4 5194 B13R0.277 CCCCCCNC(=O)C(OC)OC 11a_100000210581_100000046285 [0,2,0,0,0,0|0,0,1]=3 5195 B13R0.277 CCCCCCNC(=O)C(OC)OC 240690a_100000210581_100000046285 [0,2,0,0,0,0|0,0,1]=3 5196 B13R0.277 CCCCCCNC(=O)C(OC)OC 527a_100000210581_100000046285 [0,2,0,0,0,0|0,0,1]=3 5197 B13R0.277 CCCCCCNC(C)C(CC)CC 269862a_100000210581_100011393642 [0,2,0,0,0,0|2,0,0]=4 5198 B13R0.277 CCCCCCNC(C)C(CC)CC 270004a_100000210581_100011393642 [0,2,0,0,0,0|2,0,0]=4 5199 B13R0.277 CCCCCCNC(C)C(OC)OC 270004a_100000210581_100000211384 [0,2,0,0,0,0|0,0,0]=2 5200 B13R0.277 CCCCCCOC(C)C(OC)OC 34a_100000210259_100011222894 [0,2,0,0,0,0|0,0,0]=2 5201 B13R0.277 CCCCCCOC(C)C(OC)OC 34a_100000754440_100000210314 [0,2,0,0,0,0|0,0,0]=2 5202 B13R0.277 CCCCCCOC(C)C(OC)OC 7a_100000754440_100000210314 [0,2,0,0,0,0|0,0,0]=2 5203 B13R0.277 CCCCCCSC(C)C(OC)OC 62a_100000210314_100011222894 [0,2,0,0,0,0|0,0,0]=2 5204 B13R0.277 CCCCCCSC(C)C(OC)OC 62a_100011222894_100000210757 [0,2,0,0,0,0|0,0,0]=2 5205 B13R0.277 CCCCCNN=C(C)C(OC)OC 4a_100000694160_100000211384 [0,2,0,0,0,0|1,0,1]=4 5206 B13R0.277 CCCCCNNC(=O)C(OC)OC 22a_100000694160_100000046285 [0,2,0,0,0,0|1,0,1]=4 5207 B13R0.277 CCCCOCCC(=O)C(CC)OC 1458a_100000747056_100000743108 [0,2,0,0,0,0|1,0,1]=4 5208 B13R0.277 CCCCOCCC(=O)C(OC)OC 1458a_100000046285_100000743108 [0,2,0,0,0,0|0,0,1]=3 5209 B13R0.277 CCCCOCOC(C)C(OC)OC 34a_100000754440_100011995733 [0,2,0,0,0,0|1,0,0]=3 5210 B13R0.277 CCCCOCSC(C)C(OC)OC 62a_100011222894_100011995733 [0,2,0,0,0,0|1,0,0]=3 5211 B13R0.277 CCCCOCSC(C)C(OC)OC 62a_100011995733_100011222894 [0,2,0,0,0,0|1,0,0]=3 5212 B13R0.277 CCCOCCNC(=O)C(OC)OC 240690a_100161115042_100000046285 [0,2,0,0,0,0|1,0,1]=4 5213 B13R0.277 CCCOCCNC(=O)C(OC)OC 527a_100161115042_100000046285 [0,2,0,0,0,0|1,0,1]=4 5214 B13R0.277 CCCOCCNC(C)C(OC)OC 270004a_100161115042_100000211384 [0,2,0,0,0,0|1,0,0]=3 5215 B13R0.277 CCCOCCNC(C)C(OC)OC 34a_100161115042_100011222894 [0,2,0,0,0,0|1,0,0]=3 5216 B13R0.277 CCCOCCOC(C)C(OC)OC 34a_100000752267_100011222894 [0,2,0,0,0,0|1,0,0]=3 5217 B13R0.277 CCCOCCOC(C)C(OC)OC 34a_100000754440_100011215938 [0,2,0,0,0,0|1,0,0]=3 5218 B13R0.277 CCCOCCOC(C)C(OC)OC 7a_100000754440_100011215938 [0,2,0,0,0,0|1,0,0]=3 5219 B13R0.277 CCCOCCSC(C)C(OC)OC 62a_100011215938_100011222894 [0,2,0,0,0,0|1,0,0]=3 5220 B13R0.277 CCCOCCSC(C)C(OC)OC 62a_100011222894_100011215938 [0,2,0,0,0,0|1,0,0]=3 5221 B13R0.277 CCCSCCNC(=O)C(OC)OC 11a_100020603323_100000046285 [0,2,0,0,0,0|1,0,1]=4 5222 B13R0.277 CCCSCCNC(=O)C(OC)OC 240690a_100020603323_100000046285 [0,2,0,0,0,0|1,0,1]=4 5223 B13R0.277 CCCSCCNC(=O)C(OC)OC 527a_100020603323_100000046285 [0,2,0,0,0,0|1,0,1]=4 5224 B13R0.277 CCCSCCNC(C)C(OC)OC 270004a_100020603323_100000211384 [0,2,0,0,0,0|1,0,0]=3 5225 B13R0.277 CCCSCCOC(C)C(OC)OC 34a_200000230433_100011222894 [0,2,0,0,0,0|1,0,0]=3 5226 B13R0.277 CCOCCCNC(=O)C(OC)OC 11a_100000210961_100000046285 [0,2,0,0,0,0|1,0,1]=4 5227 B13R0.277 CCOCCCNC(=O)C(OC)OC 240690a_100000210961_100000046285 [0,2,0,0,0,0|1,0,1]=4 5228 B13R0.277 CCOCCCNC(=O)C(OC)OC 527a_100000210961_100000046285 [0,2,0,0,0,0|1,0,1]=4 5229 B13R0.277 CCOCCCNC(C)C(OC)OC 270004a_100000210961_100000211384 [0,2,0,0,0,0|1,0,0]=3 5230 B13R0.277 CCOCCCNC(C)C(OC)OC 34a_100000210961_100011222894 [0,2,0,0,0,0|1,0,0]=3 5231 B13R0.277 CCOCCCOC(C)C(OC)OC 34a_100000754440_100012232248 [0,2,0,0,0,0|1,0,0]=3 5232 B13R0.277 CCOCCCOC(C)C(OC)OC 34a_100000757476_100011222894 [0,2,0,0,0,0|1,0,0]=3 5233 B13R0.277 CCOCCCOC(C)C(OC)OC 7a_100000754440_100012232248 [0,2,0,0,0,0|1,0,0]=3 5234 B13R0.277 CCOCCCSC(C)C(OC)OC 62a_100011222894_100012232248 [0,2,0,0,0,0|1,0,0]=3 5235 B13R0.277 CCOCCCSC(C)C(OC)OC 62a_100012232248_100011222894 [0,2,0,0,0,0|1,0,0]=3 5236 B13R0.277 CCSCCCOC(C)C(OC)OC 34a_100011216438_100011222894 [0,2,0,0,0,0|1,0,0]=3 5237 B13R0.277 COC(OC)C(=O)CCCCCC#N 1458a_100000046285_100009813376 [0,2,0,0,0,0|0,0,2]=4 5238 B13R0.277 COC(OC)C(=O)CCCCCCF 1458a_100000046285_100015922095 [0,2,0,0,0,0|0,0,1]=3 5239 B13R0.277 COC(OC)C(=O)CCCCCCO 1458a_100000046285_100000766143 [0,2,0,0,0,0|0,0,1]=3 5240 B13R0.277 COC(OC)C(=O)NCCCCCO 240690a_100000762737_100000046285 [0,2,0,0,0,0|1,0,1]=4 5241 B13R0.277 COC(OC)C(C)NCCCCC#N 270004a_100000751965_100000211384 [0,2,0,0,0,0|1,0,1]=4 5242 B13R0.277 COC(OC)C(C)NCCCCCO 270004a_100000762737_100000211384 [0,2,0,0,0,0|1,0,0]=3 5243 B13R0.277 COC(OC)C(C)NCCCCCO 34a_100000762737_100011222894 [0,2,0,0,0,0|1,0,0]=3 5244 B13R0.277 COC(OC)C(C)NCCOCCO 270004a_100000211614_100000211384 [0,2,0,0,0,0|2,0,0]=4 5245 B13R0.277 COC(OC)C(C)NCCOCCO 34a_100000211614_100011222894 [0,2,0,0,0,0|2,0,0]=4 5246 B13R0.277 COC(OC)C(C)NCCSCCO 270004a_100011219999_100000211384 [0,2,0,0,0,0|2,0,0]=4 5247 B13R0.277 COC(OC)C(C)OCCCCC#N 7a_100000754440_100000211819 [0,2,0,0,0,0|1,0,1]=4 5248 B13R0.277 COC(OC)C(C)OCCCCC=O 7a_100000754440_100000139335 [0,2,0,0,0,0|1,0,1]=4 5249 B13R0.277 COC(OC)C(C)OCCCCCBr 34a_100000746331_100011222894 [0,2,0,0,0,0|1,0,0]=3 5250 B13R0.277 COC(OC)C(C)OCCCCCCl 34a_100000746330_100011222894 [0,2,0,0,0,0|1,0,0]=3 5251 B13R0.277 COC(OC)C(C)OCCCCCF 34a_100000754440_100000729378 [0,2,0,0,0,0|1,0,0]=3 5252 B13R0.277 COC(OC)C(C)OCCCCCF 7a_100000754440_100000729378 [0,2,0,0,0,0|1,0,0]=3 5253 B13R0.277 COC(OC)C(C)OCCCCCI 34a_200012148887_100011222894 [0,2,0,0,0,0|1,0,0]=3 5254 B13R0.277 COC(OC)C(C)OCCCCCN 34a_100000762737_100011222894 [0,2,0,0,0,0|1,0,0]=3 5255 B13R0.277 COC(OC)C(C)OCCCCCO 34a_100000754440_100000746330 [0,2,0,0,0,0|1,0,0]=3 5256 B13R0.277 COC(OC)C(C)OCCCCCO 7a_100000754440_100000746330 [0,2,0,0,0,0|1,0,0]=3 5257 B13R0.277 COC(OC)C(C)OCCCCSC 34a_100011217163_100011222894 [0,2,0,0,0,0|1,0,0]=3 5258 B13R0.277 COC(OC)C(C)OCCOCCBr 34a_100000692535_100011222894 [0,2,0,0,0,0|2,0,0]=4 5259 B13R0.277 COC(OC)C(C)OCCOCCCl 34a_100011215305_100011222894 [0,2,0,0,0,0|2,0,0]=4 5260 B13R0.277 COC(OC)C(C)OCCOCCF 34a_200015357709_100011222894 [0,2,0,0,0,0|2,0,0]=4 5261 B13R0.277 COC(OC)C(C)OCCOCCI 34a_100012149058_100011222894 [0,2,0,0,0,0|2,0,0]=4 5262 B13R0.277 COC(OC)C(C)OCCOCCN 34a_100000211614_100011222894 [0,2,0,0,0,0|2,0,0]=4 5263 B13R0.277 COC(OC)C(C)OCCOCCO 34a_100000754440_100000692535 [0,2,0,0,0,0|2,0,0]=4 5264 B13R0.277 COC(OC)C(C)OCCOCCO 7a_100000754440_100011215305 [0,2,0,0,0,0|2,0,0]=4 5265 B13R0.277 COC(OC)C(C)SCCCCC#N 62a_100011219923_100011222894 [0,2,0,0,0,0|1,0,1]=4 5266 B13R0.277 COC(OC)C(C)SCCCCC#N 62a_100011222894_100000211819 [0,2,0,0,0,0|1,0,1]=4 5267 B13R0.277 COC(OC)C(C)SCCCCC=O 62a_100000139335_100011222894 [0,2,0,0,0,0|1,0,1]=4 5268 B13R0.277 COC(OC)C(C)SCCCCC=O 62a_100011222894_100000139335 [0,2,0,0,0,0|1,0,1]=4 5269 B13R0.277 COC(OC)C(C)SCCCCCF 62a_100000729378_100011222894 [0,2,0,0,0,0|1,0,0]=3 5270 B13R0.277 COC(OC)C(C)SCCCCCF 62a_100011222894_100000729378 [0,2,0,0,0,0|1,0,0]=3 5271 B13R0.277 COC(OC)C(C)SCCCCCO 62a_100000746330_100011222894 [0,2,0,0,0,0|1,0,0]=3 5272 B13R0.277 COC(OC)C(C)SCCCCCO 62a_100011222894_100000746330 [0,2,0,0,0,0|1,0,0]=3 5273 B13R0.277 COC(OC)C(C)SCCOCCO 62a_100011215305_100011222894 [0,2,0,0,0,0|2,0,0]=4 5274 B13R0.277 COC(OC)C(C)SCCOCCO 62a_100011222894_100011215305 [0,2,0,0,0,0|2,0,0]=4 5275 B13R0.277 COCCCCOC(C)C(OC)OC 34a_100000740925_100011222894 [0,2,0,0,0,0|1,0,0]=3 5276 B13R0.277 COCCCCOC(C)C(OC)OC 34a_100000754440_100000755781 [0,2,0,0,0,0|1,0,0]=3 5277 B13R0.277 COCCCCOC(C)C(OC)OC 7a_100000754440_100000730899 [0,2,0,0,0,0|1,0,0]=3 5278 B13R0.277 COCCCCSC(C)C(OC)OC 62a_100000730899_100011222894 [0,2,0,0,0,0|1,0,0]=3 5279 B13R0.277 COCCCCSC(C)C(OC)OC 62a_100011222894_100000730899 [0,2,0,0,0,0|1,0,0]=3 5280 B13R0.277 COCCOCCC(=O)C(OC)OC 1458a_100000046285_100000695917 [0,2,0,0,0,0|1,0,1]=4 5281 B13R0.277 COCCOCSC(C)C(OC)OC 62a_100000231047_100011222894 [0,2,0,0,0,0|2,0,0]=4 5282 B13R0.277 COCCOCSC(C)C(OC)OC 62a_100011222894_100000231047 [0,2,0,0,0,0|2,0,0]=4 5283 B13R0.282 CC#CC(CC)OCCCCCCC 34a_200011219922_100000210614 [0,2,0,0,0,0|2,0,0]=4 5284 B13R0.282 CC#CC(CC)OCCCCCCC 7a_200011219922_100000210614 [0,2,0,0,0,0|2,0,0]=4 5285 B13R0.282 CCC(COC)NCCCCCCF 2230a_100000757820_100015922095 [0,2,0,0,0,0|2,0,0]=4 5286 B13R0.282 CCC(COC)NCCCCCCO 2230a_100000757820_100000766143 [0,2,0,0,0,0|2,0,0]=4 5287 B13R0.282 CCC(COC)NCCCCCCO 270004a_100000686447_100000757811 [0,2,0,0,0,0|2,0,0]=4 5288 B13R0.282 CCC(COC)NCCCCCOC 270004a_100000747528_100000757811 [0,2,0,0,0,0|2,0,0]=4 5289 B13R0.282 CCC(COC)OCCCCCCF 7a_200011214946_100015922095 [0,2,0,0,0,0|2,0,0]=4 5290 B13R0.282 CCC(COC)OCCCCCCO 7a_200011214946_100000766143 [0,2,0,0,0,0|2,0,0]=4 5291 B13R0.282 CCCCCCCCC(CC)NCC 270004a_100015525214_200011217995 [0,2,0,0,0,0|2,0,0]=4 5292 B13R0.282 CCCCCCCCC(CC)OCC 34a_200011216270_100000210202 [0,2,0,0,0,0|1,0,0]=3 5293 B13R0.282 CCCCCCCCC(CC)OCC 7a_200011216270_100000210202 [0,2,0,0,0,0|1,0,0]=3 5294 B13R0.282 CCCCCCCCC(CC)OCF 34a_200011216270_100015361967 [0,2,0,0,0,0|1,0,0]=3 5295 B13R0.282 CCCCCCCCC(CC)OCF 7a_200011216270_100015361967 [0,2,0,0,0,0|1,0,0]=3 5296 B13R0.282 CCCCCCCCC(CCC)NC 270004a_106832991635_200011216056 [0,2,0,0,0,0|2,0,0]=4 5297 B13R0.282 CCCCCCCCC(CCC)OC 34a_200011218034_200000210301 [0,2,0,0,0,0|1,0,0]=3 5298 B13R0.282 CCCCCCCCC(CCC)OC 7a_200011218034_200000210301 [0,2,0,0,0,0|1,0,0]=3 5299 B13R0.282 CCCCCCCCC(CCC)O[13CH3] 34a_200011218034_200025704644 [0,2,0,0,0,0|1,0,0]=3 5300 B13R0.282 CCCCCCCCC(CCC)O[13CH3] 7a_200011218034_200025704644 [0,2,0,0,0,0|1,0,0]=3 5301 B13R0.282 CCCCCCCNC(CC)CCC 2230a_100000747048_100000210681 [0,2,0,0,0,0|2,0,0]=4 5302 B13R0.282 CCCCCCCNC(CC)CCC 270004a_100000229938_100000687865 [0,2,0,0,0,0|2,0,0]=4 5303 B13R0.282 CCCCCCCNC(CC)COC 2230a_100000757820_100000210681 [0,2,0,0,0,0|1,0,0]=3 5304 B13R0.282 CCCCCCCNC(CC)COC 270004a_100000229938_100000757811 [0,2,0,0,0,0|1,0,0]=3 5305 B13R0.282 CCCCCCCNC(CO)COC 2230a_100000724102_100000210681 [0,2,0,0,0,0|2,0,0]=4 5306 B13R0.282 CCCCCCCNC(CO)COC 34a_100000724102_100000210614 [0,2,0,0,0,0|2,0,0]=4 5307 B13R0.282 CCCCCCCOC(CC)CCC 34a_100000687864_100000210614 [0,2,0,0,0,0|2,0,0]=4 5308 B13R0.282 CCCCCCCOC(CC)CCC 7a_100000210272_100011219200 [0,2,0,0,0,0|2,0,0]=4 5309 B13R0.282 CCCCCCCOC(CC)CCC 7a_100000687864_100000210614 [0,2,0,0,0,0|2,0,0]=4 5310 B13R0.282 CCCCCCCOC(CC)COC 7a_200011214946_100000210614 [0,2,0,0,0,0|1,0,0]=3 5311 B13R0.282 CCCCCCCOC(CCl)COC 34a_100011215053_100000210614 [0,2,0,0,0,0|2,0,0]=4 5312 B13R0.282 CCCCCCCOC(CN)COC 34a_100000756049_100000210614 [0,2,0,0,0,0|2,0,0]=4 5313 B13R0.282 CCCCCCCSC(CC)CCC 62a_100000210614_100011219200 [0,2,0,0,0,0|2,0,0]=4 5314 B13R0.282 CCCCCCCSC(CC)CCC 62a_100011219200_100000210316 [0,2,0,0,0,0|2,0,0]=4 5315 B13R0.282 CCCCCCNCC(CC)OCC 2230a_100015183923_100000210314 [0,2,0,0,0,0|1,0,0]=3 5316 B13R0.282 CCCCCCNCC(CC)OCC 34a_100015183923_100000210314 [0,2,0,0,0,0|1,0,0]=3 5317 B13R0.282 CCCCCOCCC(CCC)SC 34a_100000032865_100000718602 [0,2,0,0,0,0|1,1,0]=4 5318 B13R0.282 CCCCCOCCC(CCC)SC 7a_100000032865_100000210326 [0,2,0,0,0,0|1,1,0]=4 5319 B13R0.282 CCCCOCCNC(CC)COC 2230a_100000757820_100000743108 [0,2,0,0,0,0|2,0,0]=4 5320 B13R0.282 CCCCOCCOC(CC)COC 7a_200011214946_100000743108 [0,2,0,0,0,0|2,0,0]=4 5321 B13R0.282 CCCCOCNCC(CC)OCC 2230a_100015183923_100011995733 [0,2,0,0,0,0|2,0,0]=4 5322 B13R0.282 CCCCOCNCC(CC)OCC 34a_100015183923_100011995733 [0,2,0,0,0,0|2,0,0]=4 5323 B13R0.282 CCCCSCCNC(CC)COC 270004a_100025743550_100000757811 [0,2,0,0,0,0|2,0,0]=4 5324 B13R0.282 CCCOCCCNC(CC)COC 270004a_100011217757_100000757811 [0,2,0,0,0,0|2,0,0]=4 5325 B13R0.282 CCCOCCNCC(CC)OCC 2230a_100015183923_100011215938 [0,2,0,0,0,0|2,0,0]=4 5326 B13R0.282 CCCOCCNCC(CC)OCC 34a_100015183923_100011215938 [0,2,0,0,0,0|2,0,0]=4 5327 B13R0.282 CCOC(CC)CNCCCCCF 2230a_100015183923_100000729378 [0,2,0,0,0,0|2,0,0]=4 5328 B13R0.282 CCOC(CC)CNCCCCCF 34a_100015183923_100000729378 [0,2,0,0,0,0|2,0,0]=4 5329 B13R0.282 CCOC(CC)CNCCCCCO 2230a_100015183923_100000746330 [0,2,0,0,0,0|2,0,0]=4 5330 B13R0.282 CCOC(CC)CNCCCCCO 34a_100015183923_100000746330 [0,2,0,0,0,0|2,0,0]=4 5331 B13R0.282 CCOC(CC)CNCCCCOC 2230a_100015183923_100000730899 [0,2,0,0,0,0|2,0,0]=4 5332 B13R0.282 CCOC(CC)CNCCCCOC 34a_100015183923_100000755781 [0,2,0,0,0,0|2,0,0]=4 5333 B13R0.282 CCOCCCNCC(CC)OCC 2230a_100015183923_100012232248 [0,2,0,0,0,0|2,0,0]=4 5334 B13R0.282 CCOCCCNCC(CC)OCC 34a_100015183923_100012232248 [0,2,0,0,0,0|2,0,0]=4 5335 B13R0.412 C#CCCCCCOCC(CC)OC 34a_100011934954_100012094781 [0,2,0,0,0,0|1,0,1]=4 5336 B13R0.412 C#CCCCCCOCC(CC)OC 7a_100011934954_100012094781 [0,2,0,0,0,0|1,0,1]=4 5337 B13R0.412 C#CCCCCCOCC(OC)OC 34a_100000766912_100000211822 [0,2,0,0,0,0|0,0,1]=3 5338 B13R0.412 C#CCCCCCOCC(OC)OC 34a_100011216393_100012094781 [0,2,0,0,0,0|0,0,1]=3 5339 B13R0.412 C#CCCCCCOCC(OC)OC 7a_100000766912_100000751394 [0,2,0,0,0,0|0,0,1]=3 5340 B13R0.412 C#CCCCCCSCC(OC)OC 62a_100000751394_100012094781 [0,2,0,0,0,0|0,0,1]=3 5341 B13R0.412 C#CCCCCCSCC(OC)OC 62a_100012094781_100000751394 [0,2,0,0,0,0|0,0,1]=3 5342 B13R0.412 C#CCCCCNCCC(OC)OC 2230a_100000706060_100009813347 [0,2,0,0,0,0|0,0,1]=3 5343 B13R0.412 C#CCCCCNCCC(OC)OC 34a_100000706060_100000139399 [0,2,0,0,0,0|0,0,1]=3 5344 B13R0.412 C#CCCCCOCCC(OC)OC 34a_100000766709_100000139399 [0,2,0,0,0,0|0,0,1]=3 5345 B13R0.412 C#CCCCCOCCC(OC)OC 7a_100000766709_100009813347 [0,2,0,0,0,0|0,0,1]=3 5346 B13R0.412 C#CCCCCSCCC(OC)OC 62a_100000139399_100010269958 [0,2,0,0,0,0|0,0,1]=3 5347 B13R0.412 C#CCCCCSCCC(OC)OC 62a_100010269958_100000139399 [0,2,0,0,0,0|0,0,1]=3 5348 B13R0.412 C#CCCCNCCCC(OC)OC 34a_100000718082_100000069011 [0,2,0,0,0,0|0,0,1]=3 5349 B13R0.412 C#CCCCOCCCC(OC)OC 34a_100000215630_100000069011 [0,2,0,0,0,0|0,0,1]=3 5350 B13R0.412 C#CCCCOCCCC(OC)OC 7a_100000215630_100000069011 [0,2,0,0,0,0|0,0,1]=3 5351 B13R0.412 C#CCCCSCCCC(OC)OC 62a_100000069011_100011215417 [0,2,0,0,0,0|0,0,1]=3 5352 B13R0.412 C#CCCCSCCCC(OC)OC 62a_100011215417_100000069011 [0,2,0,0,0,0|0,0,1]=3 5353 B13R0.412 C#CCOCCNCCC(OC)OC 2230a_100000700922_100009813347 [0,2,0,0,0,0|0,0,2]=4 5354 B13R0.412 C#CCOCCNCCC(OC)OC 34a_100000700922_100000139399 [0,2,0,0,0,0|0,0,2]=4 5355 B13R0.412 C#CCOCCOCCC(OC)OC 34a_100000054580_100000139399 [0,2,0,0,0,0|0,0,2]=4 5356 B13R0.412 C#CCOCCOCCC(OC)OC 7a_100000054580_100009813347 [0,2,0,0,0,0|0,0,2]=4 5357 B13R0.412 C#CCOCCSCCC(OC)OC 62a_100000139399_100010402529 [0,2,0,0,0,0|0,0,2]=4 5358 B13R0.412 C#CCOCCSCCC(OC)OC 62a_100010402529_100000139399 [0,2,0,0,0,0|0,0,2]=4 5359 B13R0.412 C/C=C/CCOCCCC(OC)OC 34a_100016278192_100000069011 [0,2,0,0,0,0|0,0,1]=3 5360 B13R0.412 C=CCCCCCOCC(CC)OC 34a_100011934954_100000700193 [0,2,0,0,0,0|1,0,1]=4 5361 B13R0.412 C=CCCCCCOCC(CC)OC 7a_100011934954_100000700193 [0,2,0,0,0,0|1,0,1]=4 5362 B13R0.412 C=CCCCCCOCC(OC)OC 34a_100011216393_100000700193 [0,2,0,0,0,0|0,0,1]=3 5363 B13R0.412 C=CCCCCCOCC(OC)OC 34a_100011216702_100000211822 [0,2,0,0,0,0|0,0,1]=3 5364 B13R0.412 C=CCCCCCOCC(OC)OC 7a_100011216702_100000751394 [0,2,0,0,0,0|0,0,1]=3 5365 B13R0.412 C=CCCCCCSCC(OC)OC 62a_100000700193_100000751394 [0,2,0,0,0,0|0,0,1]=3 5366 B13R0.412 C=CCCCCCSCC(OC)OC 62a_100000751394_100000700193 [0,2,0,0,0,0|0,0,1]=3 5367 B13R0.412 C=CCCCCNCCC(OC)OC 2230a_100000703577_100009813347 [0,2,0,0,0,0|0,0,1]=3 5368 B13R0.412 C=CCCCCNCCC(OC)OC 34a_100000703577_100000139399 [0,2,0,0,0,0|0,0,1]=3 5369 B13R0.412 C=CCCCCOCCC(OC)OC 34a_100000766645_100000139399 [0,2,0,0,0,0|0,0,1]=3 5370 B13R0.412 C=CCCCCOCCC(OC)OC 7a_100000766645_100009813347 [0,2,0,0,0,0|0,0,1]=3 5371 B13R0.412 C=CCCCCSCCC(OC)OC 62a_100000139399_100011215482 [0,2,0,0,0,0|0,0,1]=3 5372 B13R0.412 C=CCCCCSCCC(OC)OC 62a_100011215482_100000139399 [0,2,0,0,0,0|0,0,1]=3 5373 B13R0.412 C=CCCCNCCCC(OC)OC 2230a_100000700776_100000069011 [0,2,0,0,0,0|0,0,1]=3 5374 B13R0.412 C=CCCCNCCCC(OC)OC 34a_100000700776_100000069011 [0,2,0,0,0,0|0,0,1]=3 5375 B13R0.412 C=CCCCOCCCC(OC)OC 34a_100000758997_100000069011 [0,2,0,0,0,0|0,0,1]=3 5376 B13R0.412 C=CCCCOCCCC(OC)OC 7a_100000758997_100000069011 [0,2,0,0,0,0|0,0,1]=3 5377 B13R0.412 C=CCCCSCCCC(OC)OC 62a_100000069011_100000757094 [0,2,0,0,0,0|0,0,1]=3 5378 B13R0.412 C=CCCCSCCCC(OC)OC 62a_100011713584_100000069011 [0,2,0,0,0,0|0,0,1]=3 5379 B13R0.412 C=CCOCCOCCC(OC)OC 34a_100000037705_100000139399 [0,2,0,0,0,0|0,0,2]=4 5380 B13R0.412 C=CCOCCOCCC(OC)OC 7a_100000037705_100009813347 [0,2,0,0,0,0|0,0,2]=4 5381 B13R0.412 C=COCCCCOCC(OC)OC 34a_100000031558_100000211822 [0,2,0,0,0,0|0,0,2]=4 5382 B13R0.412 C=COCCCCOCC(OC)OC 7a_100000031558_100000751394 [0,2,0,0,0,0|0,0,2]=4 5383 B13R0.412 C=COCCCNCCC(OC)OC 2230a_100000210767_100009813347 [0,2,0,0,0,0|0,0,2]=4 5384 B13R0.412 C=COCCCNCCC(OC)OC 34a_100000210767_100000139399 [0,2,0,0,0,0|0,0,2]=4 5385 B13R0.412 C=COCCOCCCC(OC)OC 34a_100000033082_100000069011 [0,2,0,0,0,0|0,0,2]=4 5386 B13R0.412 C=COCCSCCCC(OC)OC 62a_100000039644_100000069011 [0,2,0,0,0,0|0,0,2]=4 5387 B13R0.412 C=COCCSCCCC(OC)OC 62a_100000069011_100000039644 [0,2,0,0,0,0|0,0,2]=4 5388 B13R0.412 CC#CCCOCCCC(OC)OC 34a_100000750427_100000069011 [0,2,0,0,0,0|0,0,1]=3 5389 B13R0.412 CC/C=C/CCCOCC(OC)OC 34a_100016287902_100000211822 [0,2,0,0,0,0|0,0,1]=3 5390 B13R0.412 CC/C=C/CCCOCC(OC)OC 7a_100016287902_100000751394 [0,2,0,0,0,0|0,0,1]=3 5391 B13R0.412 CC/C=C\CCOCCC(OC)OC 34a_100016288707_100000139399 [0,2,0,0,0,0|0,0,1]=3 5392 B13R0.412 CC/C=C\CCOCCC(OC)OC 7a_100016288707_100009813347 [0,2,0,0,0,0|0,0,1]=3 5393 B13R0.412 CC/C=C\CCSCCC(OC)OC 62a_100000139399_100015370543 [0,2,0,0,0,0|0,0,1]=3 5394 B13R0.412 CC/C=C\CCSCCC(OC)OC 62a_100015370543_100000139399 [0,2,0,0,0,0|0,0,1]=3 5395 B13R0.412 CC/C=C\COCCCC(OC)OC 34a_100016268518_100000069011 [0,2,0,0,0,0|0,0,1]=3 5396 B13R0.412 CC/C=C\CSCCCC(OC)OC 62a_100000069011_100103147603 [0,2,0,0,0,0|0,0,1]=3 5397 B13R0.412 CC/C=C\CSCCCC(OC)OC 62a_100103147603_100000069011 [0,2,0,0,0,0|0,0,1]=3 5398 B13R0.412 CC=C=CCCOCCC(OC)OC 34a_100011020354_100000139399 [0,2,0,0,0,0|0,0,2]=4 5399 B13R0.412 CC=CCCCOCCC(OC)OC 34a_100020645299_100000139399 [0,2,0,0,0,0|0,0,1]=3 5400 B13R0.412 CCC#CCCOCCC(OC)OC 34a_100000036655_100000139399 [0,2,0,0,0,0|0,0,1]=3 5401 B13R0.412 CCC#CCCOCCC(OC)OC 7a_100000036655_100009813347 [0,2,0,0,0,0|0,0,1]=3 5402 B13R0.412 CCC#CCOCCCC(OC)OC 34a_100000032950_100000069011 [0,2,0,0,0,0|0,0,1]=3 5403 B13R0.412 CCC#CCSCCCC(OC)OC 62a_100000069011_100009813939 [0,2,0,0,0,0|0,0,1]=3 5404 B13R0.412 CCC#CCSCCCC(OC)OC 62a_100009813939_100000069011 [0,2,0,0,0,0|0,0,1]=3 5405 B13R0.412 CCC(CC)CNCCCCCCF 2230a_100102946423_100015922095 [0,2,0,0,0,0|2,0,0]=4 5406 B13R0.412 CCC(CC)CNCCCCCCO 2230a_100000686447_100011215472 [0,2,0,0,0,0|2,0,0]=4 5407 B13R0.412 CCC(CC)CNCCCCCCO 2230a_100102946423_100000766143 [0,2,0,0,0,0|2,0,0]=4 5408 B13R0.412 CCC(CC)CNCCCCCCO 269862a_100000686447_100000211137 [0,2,0,0,0,0|2,0,0]=4 5409 B13R0.412 CCC(CC)CNCCCCCCO 270004a_100000686447_100000211137 [0,2,0,0,0,0|2,0,0]=4 5410 B13R0.412 CCC(CC)CNCCCCCCO 34a_100000686447_100011215472 [0,2,0,0,0,0|2,0,0]=4 5411 B13R0.412 CCC(CC)CNCCCCCOC 2230a_100000747528_100011215472 [0,2,0,0,0,0|2,0,0]=4 5412 B13R0.412 CCC(CC)CNCCCCCOC 269862a_100000747528_100000211137 [0,2,0,0,0,0|2,0,0]=4 5413 B13R0.412 CCC(CC)CNCCCCCOC 270004a_100000747528_100000211137 [0,2,0,0,0,0|2,0,0]=4 5414 B13R0.412 CCC(CC)CNCCCCCOC 34a_100000747528_100011215472 [0,2,0,0,0,0|2,0,0]=4 5415 B13R0.412 CCC(CC)COCCCCCCBr 34a_100011215345_100011215472 [0,2,0,0,0,0|2,0,0]=4 5416 B13R0.412 CCC(CC)COCCCCCCBr 7a_100011215345_100011215472 [0,2,0,0,0,0|2,0,0]=4 5417 B13R0.412 CCC(CC)COCCCCCCCl 34a_100000766143_100011215472 [0,2,0,0,0,0|2,0,0]=4 5418 B13R0.412 CCC(CC)COCCCCCCCl 7a_100000766143_100011215472 [0,2,0,0,0,0|2,0,0]=4 5419 B13R0.412 CCC(CC)COCCCCCCF 34a_100000732779_100011215472 [0,2,0,0,0,0|2,0,0]=4 5420 B13R0.412 CCC(CC)COCCCCCCF 7a_100000703878_100015922095 [0,2,0,0,0,0|2,0,0]=4 5421 B13R0.412 CCC(CC)COCCCCCCF 7a_100000732779_100011215472 [0,2,0,0,0,0|2,0,0]=4 5422 B13R0.412 CCC(CC)COCCCCCCN 34a_100000686447_100011215472 [0,2,0,0,0,0|2,0,0]=4 5423 B13R0.412 CCC(CC)COCCCCCCO 7a_100000703878_100000766143 [0,2,0,0,0,0|2,0,0]=4 5424 B13R0.412 CCC(CC)COCCCCCNC 34a_100000722520_100011215472 [0,2,0,0,0,0|2,0,0]=4 5425 B13R0.412 CCC(CC)CSCCCCCCF 62a_100011215472_100015922095 [0,2,0,0,0,0|2,0,0]=4 5426 B13R0.412 CCC(CC)CSCCCCCCF 62a_100015922095_100011215472 [0,2,0,0,0,0|2,0,0]=4 5427 B13R0.412 CCC(CC)CSCCCCCCO 62a_100000766143_100011215472 [0,2,0,0,0,0|2,0,0]=4 5428 B13R0.412 CCC(CC)CSCCCCCCO 62a_100011215472_100000766143 [0,2,0,0,0,0|2,0,0]=4 5429 B13R0.412 CCC(CC)NCCCCCCCO 2230a_100000199018_100000760002 [0,2,0,0,0,0|2,0,0]=4 5430 B13R0.412 CCC(CC)NCCCCCCCO 270004a_100011996573_100000210860 [0,2,0,0,0,0|2,0,0]=4 5431 B13R0.412 CCC(CC)NCCCCCCOC 2230a_100000199018_100011998445 [0,2,0,0,0,0|2,0,0]=4 5432 B13R0.412 CCC(CC)OCCCCCCCBr 7a_100000760002_100000210505 [0,2,0,0,0,0|2,0,0]=4 5433 B13R0.412 CCC(CC)OCCCCCCCO 7a_100000688536_100000760002 [0,2,0,0,0,0|2,0,0]=4 5434 B13R0.412 CCC(CC)OCCCCCCOC 7a_100000688536_100011998445 [0,2,0,0,0,0|2,0,0]=4 5435 B13R0.412 CCC(CC)OCCCCCCOC 7a_200012092642_100000210505 [0,2,0,0,0,0|2,0,0]=4 5436 B13R0.412 CCC(CC)SCCCCCCCO 62a_100000210505_100000760002 [0,2,0,0,0,0|2,0,0]=4 5437 B13R0.412 CCC(CC)SCCCCCCCO 62a_100000760002_100000210505 [0,2,0,0,0,0|2,0,0]=4 5438 B13R0.412 CCC(CC)SCCCCCCOC 62a_100000210505_100011998445 [0,2,0,0,0,0|2,0,0]=4 5439 B13R0.412 CCC(CC)SCCCCCCOC 62a_100011998445_100000210505 [0,2,0,0,0,0|2,0,0]=4 5440 B13R0.412 CCC(COCCCCCC#N)OC 7a_100011934954_100009813376 [0,2,0,0,0,0|1,0,1]=4 5441 B13R0.412 CCC(COCCCCCC=O)OC 7a_100011934954_100000139337 [0,2,0,0,0,0|1,0,1]=4 5442 B13R0.412 CCC(COCCCCCCF)OC 34a_100011934954_100015922095 [0,2,0,0,0,0|1,0,0]=3 5443 B13R0.412 CCC(COCCCCCCF)OC 7a_100011934954_100015922095 [0,2,0,0,0,0|1,0,0]=3 5444 B13R0.412 CCC(COCCCCCCO)OC 34a_100011934954_100000766143 [0,2,0,0,0,0|1,0,0]=3 5445 B13R0.412 CCC(COCCCCCCO)OC 7a_100011934954_100000766143 [0,2,0,0,0,0|1,0,0]=3 5446 B13R0.412 CCC(COCCOCCOC)OC 34a_100011934954_100000695917 [0,2,0,0,0,0|2,0,0]=4 5447 B13R0.412 CCC(COCCOCCOC)OC 7a_100011934954_100000695917 [0,2,0,0,0,0|2,0,0]=4 5448 B13R0.412 CCC/C=C/COCCC(OC)OC 34a_100016278788_100000139399 [0,2,0,0,0,0|0,0,1]=3 5449 B13R0.412 CCC/C=C/COCCC(OC)OC 7a_100016278788_100009813347 [0,2,0,0,0,0|0,0,1]=3 5450 B13R0.412 CCCC#CCCOCC(OC)OC 34a_100000042726_100000211822 [0,2,0,0,0,0|0,0,1]=3 5451 B13R0.412 CCCC#CCCOCC(OC)OC 7a_100000042726_100000751394 [0,2,0,0,0,0|0,0,1]=3 5452 B13R0.412 CCCC#CCOCCC(OC)OC 34a_100000034806_100000139399 [0,2,0,0,0,0|0,0,1]=3 5453 B13R0.412 CCCC#CCOCCC(OC)OC 7a_100000034806_100009813347 [0,2,0,0,0,0|0,0,1]=3 5454 B13R0.412 CCCC/C=C/COCC(OC)OC 34a_200016272032_100000211822 [0,2,0,0,0,0|0,0,1]=3 5455 B13R0.412 CCCC/C=C/COCC(OC)OC 7a_200016272032_100000751394 [0,2,0,0,0,0|0,0,1]=3 5456 B13R0.412 CCCCC#CCOCC(OC)OC 34a_200000034558_100000211822 [0,2,0,0,0,0|0,0,1]=3 5457 B13R0.412 CCCCC#CCOCC(OC)OC 7a_200000034558_100000751394 [0,2,0,0,0,0|0,0,1]=3 5458 B13R0.412 CCCCCCCCNC(CC)CC 2230a_100000199018_100000210759 [0,2,0,0,0,0|2,0,0]=4 5459 B13R0.412 CCCCCCCCNC(CC)CC 270004a_100000229939_100000210860 [0,2,0,0,0,0|2,0,0]=4 5460 B13R0.412 CCCCCCCCOC(CC)CC 7a_100000210232_100000210505 [0,2,0,0,0,0|2,0,0]=4 5461 B13R0.412 CCCCCCCCOC(CC)CC 7a_100000688536_100000210759 [0,2,0,0,0,0|2,0,0]=4 5462 B13R0.412 CCCCCCCCSC(CC)CC 62a_100000210505_100000210317 [0,2,0,0,0,0|2,0,0]=4 5463 B13R0.412 CCCCCCCCSC(CC)CC 62a_100000210759_100000210505 [0,2,0,0,0,0|2,0,0]=4 5464 B13R0.412 CCCCCCCNCC(CC)CC 2230a_100000229938_100011215472 [0,2,0,0,0,0|2,0,0]=4 5465 B13R0.412 CCCCCCCNCC(CC)CC 2230a_100102946423_100000210681 [0,2,0,0,0,0|2,0,0]=4 5466 B13R0.412 CCCCCCCNCC(CC)CC 269862a_100000229938_100000211137 [0,2,0,0,0,0|2,0,0]=4 5467 B13R0.412 CCCCCCCNCC(CC)CC 270004a_100000229938_100000211137 [0,2,0,0,0,0|2,0,0]=4 5468 B13R0.412 CCCCCCCNCC(OC)OC 2230a_100000229938_100000751394 [0,2,0,0,0,0|0,0,0]=2 5469 B13R0.412 CCCCCCCNCC(OC)OC 270004a_100000229938_100000752162 [0,2,0,0,0,0|0,0,0]=2 5470 B13R0.412 CCCCCCCOCC(CC)CC 34a_100000210272_100011215472 [0,2,0,0,0,0|2,0,0]=4 5471 B13R0.412 CCCCCCCOCC(CC)CC 7a_100000210272_100011215472 [0,2,0,0,0,0|2,0,0]=4 5472 B13R0.412 CCCCCCCOCC(CC)CC 7a_100000703878_100000210614 [0,2,0,0,0,0|2,0,0]=4 5473 B13R0.412 CCCCCCCOCC(CC)OC 34a_100011934954_100000210614 [0,2,0,0,0,0|1,0,0]=3 5474 B13R0.412 CCCCCCCOCC(CC)OC 7a_100011934954_100000210614 [0,2,0,0,0,0|1,0,0]=3 5475 B13R0.412 CCCCCCCOCC(OC)OC 34a_100000210272_100000211822 [0,2,0,0,0,0|0,0,0]=2 5476 B13R0.412 CCCCCCCOCC(OC)OC 34a_100011216393_100000210614 [0,2,0,0,0,0|0,0,0]=2 5477 B13R0.412 CCCCCCCOCC(OC)OC 7a_100000210272_100000751394 [0,2,0,0,0,0|0,0,0]=2 5478 B13R0.412 CCCCCCCSCC(CC)CC 62a_100000210614_100011215472 [0,2,0,0,0,0|2,0,0]=4 5479 B13R0.412 CCCCCCCSCC(CC)CC 62a_100011215472_100000210316 [0,2,0,0,0,0|2,0,0]=4 5480 B13R0.412 CCCCCCCSCC(OC)OC 62a_100000210614_100000751394 [0,2,0,0,0,0|0,0,0]=2 5481 B13R0.412 CCCCCCCSCC(OC)OC 62a_100000751394_100000210316 [0,2,0,0,0,0|0,0,0]=2 5482 B13R0.412 CCCCCCNCCC(OC)OC 2230a_100000210581_100009813347 [0,2,0,0,0,0|0,0,0]=2 5483 B13R0.412 CCCCCCOCCC(OC)OC 34a_100000210259_100000139399 [0,2,0,0,0,0|0,0,0]=2 5484 B13R0.412 CCCCCCOCCC(OC)OC 7a_100000210259_100009813347 [0,2,0,0,0,0|0,0,0]=2 5485 B13R0.412 CCCCCCSCCC(OC)OC 62a_100000139399_100000210757 [0,2,0,0,0,0|0,0,0]=2 5486 B13R0.412 CCCCCCSCCC(OC)OC 62a_100000210314_100000139399 [0,2,0,0,0,0|0,0,0]=2 5487 B13R0.412 CCCCCNCCCC(OC)OC 2230a_100000209983_100000069011 [0,2,0,0,0,0|0,0,0]=2 5488 B13R0.412 CCCCCOCCCC(OC)OC 34a_100000210253_100000069011 [0,2,0,0,0,0|0,0,0]=2 5489 B13R0.412 CCCCCOCCCC(OC)OC 7a_100000210253_100000069011 [0,2,0,0,0,0|0,0,0]=2 5490 B13R0.412 CCCCCOCCOC(CC)CC 7a_100011215259_100000210505 [0,2,0,0,0,0|2,0,0]=4 5491 B13R0.412 CCCCCSCCCC(OC)OC 62a_100000069011_100000210326 [0,2,0,0,0,0|0,0,0]=2 5492 B13R0.412 CCCCCSCCCC(OC)OC 62a_100000210326_100000069011 [0,2,0,0,0,0|0,0,0]=2 5493 B13R0.412 CCCCOCCCNC(CC)CC 270004a_200000211371_100000210860 [0,2,0,0,0,0|2,0,0]=4 5494 B13R0.412 CCCCOCCCOC(CC)CC 7a_200011215613_100000210505 [0,2,0,0,0,0|2,0,0]=4 5495 B13R0.412 CCCCOCCNCC(CC)CC 2230a_100102946423_100000743108 [0,2,0,0,0,0|2,0,0]=4 5496 B13R0.412 CCCCOCCOCC(CC)CC 34a_100000210238_100011215472 [0,2,0,0,0,0|2,0,0]=4 5497 B13R0.412 CCCCOCCOCC(CC)CC 7a_100000210238_100011215472 [0,2,0,0,0,0|2,0,0]=4 5498 B13R0.412 CCCCOCCOCC(CC)CC 7a_100000703878_100000743108 [0,2,0,0,0,0|2,0,0]=4 5499 B13R0.412 CCCCOCCOCC(CC)OC 34a_100011934954_100000743108 [0,2,0,0,0,0|1,0,0]=3 5500 B13R0.412 CCCCOCCOCC(CC)OC 7a_100011934954_100000743108 [0,2,0,0,0,0|1,0,0]=3 5501 B13R0.412 CCCCOCCOCC(OC)OC 34a_100000210238_100000211822 [0,2,0,0,0,0|0,0,0]=2 5502 B13R0.412 CCCCOCCOCC(OC)OC 34a_100011216393_100000743108 [0,2,0,0,0,0|0,0,0]=2 5503 B13R0.412 CCCCOCCOCC(OC)OC 7a_100000210238_100000751394 [0,2,0,0,0,0|0,0,0]=2 5504 B13R0.412 CCCCOCCSCC(CC)CC 62a_100000743108_100011215472 [0,2,0,0,0,0|2,0,0]=4 5505 B13R0.412 CCCCOCCSCC(CC)CC 62a_100011215472_100000743108 [0,2,0,0,0,0|2,0,0]=4 5506 B13R0.412 CCCCOCCSCC(OC)OC 62a_100000743108_100000751394 [0,2,0,0,0,0|0,0,0]=2 5507 B13R0.412 CCCCOCCSCC(OC)OC 62a_100000751394_100000743108 [0,2,0,0,0,0|0,0,0]=2 5508 B13R0.412 CCCCOCSCCC(OC)OC 62a_100000139399_100011995733 [0,2,0,0,0,0|0,0,0]=2 5509 B13R0.412 CCCCOCSCCC(OC)OC 62a_100011995733_100000139399 [0,2,0,0,0,0|0,0,0]=2 5510 B13R0.412 CCCCSCCNCC(CC)CC 2230a_100025743550_100011215472 [0,2,0,0,0,0|2,0,0]=4 5511 B13R0.412 CCCCSCCNCC(CC)CC 269862a_100025743550_100000211137 [0,2,0,0,0,0|2,0,0]=4 5512 B13R0.412 CCCCSCCNCC(CC)CC 270004a_100025743550_100000211137 [0,2,0,0,0,0|2,0,0]=4 5513 B13R0.412 CCCCSCCNCC(OC)OC 2230a_100025743550_100000751394 [0,2,0,0,0,0|0,0,0]=2 5514 B13R0.412 CCCCSCCNCC(OC)OC 270004a_100025743550_100000752162 [0,2,0,0,0,0|0,0,0]=2 5515 B13R0.412 CCCCSCCOCC(CC)CC 34a_200000230436_100011215472 [0,2,0,0,0,0|2,0,0]=4 5516 B13R0.412 CCCCSCCOCC(CC)CC 7a_200000230436_100011215472 [0,2,0,0,0,0|2,0,0]=4 5517 B13R0.412 CCCCSCCOCC(OC)OC 34a_200000230436_100000211822 [0,2,0,0,0,0|0,0,0]=2 5518 B13R0.412 CCCCSCCOCC(OC)OC 7a_200000230436_100000751394 [0,2,0,0,0,0|0,0,0]=2 5519 B13R0.412 CCCOCCCNCC(CC)CC 2230a_100011217757_100011215472 [0,2,0,0,0,0|2,0,0]=4 5520 B13R0.412 CCCOCCCNCC(CC)CC 269862a_100011217757_100000211137 [0,2,0,0,0,0|2,0,0]=4 5521 B13R0.412 CCCOCCCNCC(CC)CC 270004a_100011217757_100000211137 [0,2,0,0,0,0|2,0,0]=4 5522 B13R0.412 CCCOCCCNCC(CC)CC 34a_100011217757_100011215472 [0,2,0,0,0,0|2,0,0]=4 5523 B13R0.412 CCCOCCCNCC(OC)OC 2230a_100011217757_100000751394 [0,2,0,0,0,0|0,0,0]=2 5524 B13R0.412 CCCOCCCNCC(OC)OC 270004a_100011217757_100000752162 [0,2,0,0,0,0|0,0,0]=2 5525 B13R0.412 CCCOCCCNCC(OC)OC 34a_100011217757_100000211822 [0,2,0,0,0,0|0,0,0]=2 5526 B13R0.412 CCCOCCNCCC(OC)OC 2230a_100161115042_100009813347 [0,2,0,0,0,0|0,0,0]=2 5527 B13R0.412 CCCOCCNCCC(OC)OC 34a_100161115042_100000139399 [0,2,0,0,0,0|0,0,0]=2 5528 B13R0.412 CCCOCCOCCC(OC)OC 34a_100000752267_100000139399 [0,2,0,0,0,0|0,0,0]=2 5529 B13R0.412 CCCOCCOCCC(OC)OC 7a_100000752267_100009813347 [0,2,0,0,0,0|0,0,0]=2 5530 B13R0.412 CCCOCCSCCC(OC)OC 62a_100000139399_100011215938 [0,2,0,0,0,0|0,0,0]=2 5531 B13R0.412 CCCOCCSCCC(OC)OC 62a_100011215938_100000139399 [0,2,0,0,0,0|0,0,0]=2 5532 B13R0.412 CCCSCCNCCC(OC)OC 2230a_100020603323_100009813347 [0,2,0,0,0,0|0,0,0]=2 5533 B13R0.412 CCCSCCOCCC(OC)OC 34a_200000230433_100000139399 [0,2,0,0,0,0|0,0,0]=2 5534 B13R0.412 CCCSCCOCCC(OC)OC 7a_200000230433_100009813347 [0,2,0,0,0,0|0,0,0]=2 5535 B13R0.412 CCOCCCNCCC(OC)OC 2230a_100000210961_100009813347 [0,2,0,0,0,0|0,0,0]=2 5536 B13R0.412 CCOCCCNCCC(OC)OC 34a_100000210961_100000139399 [0,2,0,0,0,0|0,0,0]=2 5537 B13R0.412 CCOCCCOCCC(OC)OC 34a_100000757476_100000139399 [0,2,0,0,0,0|0,0,0]=2 5538 B13R0.412 CCOCCCOCCC(OC)OC 7a_100000757476_100009813347 [0,2,0,0,0,0|0,0,0]=2 5539 B13R0.412 CCOCCCSCCC(OC)OC 62a_100000139399_100012232248 [0,2,0,0,0,0|0,0,0]=2 5540 B13R0.412 CCOCCCSCCC(OC)OC 62a_100012232248_100000139399 [0,2,0,0,0,0|0,0,0]=2 5541 B13R0.412 CCOCCNCCCC(OC)OC 2230a_102516460346_100000069011 [0,2,0,0,0,0|0,0,0]=2 5542 B13R0.412 CCOCCNCCCC(OC)OC 34a_102516460346_100000069011 [0,2,0,0,0,0|0,0,0]=2 5543 B13R0.412 CCOCCOCCCC(OC)OC 34a_100000210136_100000069011 [0,2,0,0,0,0|0,0,0]=2 5544 B13R0.412 CCOCCOCCCC(OC)OC 7a_100000210136_100000069011 [0,2,0,0,0,0|0,0,0]=2 5545 B13R0.412 CCOCCSCCCC(OC)OC 62a_100000069011_100011215890 [0,2,0,0,0,0|0,0,0]=2 5546 B13R0.412 CCOCCSCCCC(OC)OC 62a_100000210147_100000069011 [0,2,0,0,0,0|0,0,0]=2 5547 B13R0.412 CCSCCCOCCC(OC)OC 34a_100011216438_100000139399 [0,2,0,0,0,0|0,0,0]=2 5548 B13R0.412 CCSCCCOCCC(OC)OC 7a_100011216438_100009813347 [0,2,0,0,0,0|0,0,0]=2 5549 B13R0.412 CCSCCNCCCC(OC)OC 2230a_100000106463_100000069011 [0,2,0,0,0,0|0,0,0]=2 5550 B13R0.412 CCSCCOCCCC(OC)OC 34a_100000212035_100000069011 [0,2,0,0,0,0|0,0,0]=2 5551 B13R0.412 CCSCCOCCCC(OC)OC 7a_100000212035_100000069011 [0,2,0,0,0,0|0,0,0]=2 5552 B13R0.412 CCSCCSCCCC(OC)OC 62a_100000069011_100000757381 [0,2,0,0,0,0|0,0,0]=2 5553 B13R0.412 CCSCCSCCCC(OC)OC 62a_100000757381_100000069011 [0,2,0,0,0,0|0,0,0]=2 5554 B13R0.412 CNCCCCCOCC(OC)OC 34a_100000722520_100000211822 [0,2,0,0,0,0|0,0,0]=2 5555 B13R0.412 CNCCCOCCCC(OC)OC 34a_100000213112_100000069011 [0,2,0,0,0,0|0,0,0]=2 5556 B13R0.412 CNCCOCCOCC(OC)OC 34a_100000228057_100000211822 [0,2,0,0,0,0|1,0,0]=3 5557 B13R0.412 COC(CCCNCCCCO)OC 2230a_100000750430_100000069011 [0,2,0,0,0,0|0,0,0]=2 5558 B13R0.412 COC(CCCNCCCCO)OC 34a_100000750430_100000069011 [0,2,0,0,0,0|0,0,0]=2 5559 B13R0.412 COC(CCCNCCCSC)OC 2230a_100000749238_100000069011 [0,2,0,0,0,0|0,0,0]=2 5560 B13R0.412 COC(CCCOCC#CCCl)OC 34a_200000047223_100000069011 [0,2,0,0,0,0|0,0,2]=4 5561 B13R0.412 COC(CCCOCCCCBr)OC 34a_100011216708_100000069011 [0,2,0,0,0,0|0,0,0]=2 5562 B13R0.412 COC(CCCOCCCCCl)OC 34a_100000210776_100000069011 [0,2,0,0,0,0|0,0,0]=2 5563 B13R0.412 COC(CCCOCCCCCl)OC 7a_100000210776_100000069011 [0,2,0,0,0,0|0,0,0]=2 5564 B13R0.412 COC(CCCOCCCCF)OC 34a_100011995726_100000069011 [0,2,0,0,0,0|0,0,0]=2 5565 B13R0.412 COC(CCCOCCCCF)OC 7a_100011995726_100000069011 [0,2,0,0,0,0|0,0,0]=2 5566 B13R0.412 COC(CCCOCCCCI)OC 34a_200012148704_100000069011 [0,2,0,0,0,0|0,0,0]=2 5567 B13R0.412 COC(CCCOCCCCN)OC 34a_100000750430_100000069011 [0,2,0,0,0,0|0,0,0]=2 5568 B13R0.412 COC(CCCOCCCSC)OC 34a_100000690336_100000069011 [0,2,0,0,0,0|0,0,0]=2 5569 B13R0.412 COC(CCCOCCCSC)OC 7a_100000690336_100000069011 [0,2,0,0,0,0|0,0,0]=2 5570 B13R0.412 COC(CCCSCC#CCO)OC 62a_100000069011_200000047223 [0,2,0,0,0,0|0,0,2]=4 5571 B13R0.412 COC(CCCSCC#CCO)OC 62a_200000047223_100000069011 [0,2,0,0,0,0|0,0,2]=4 5572 B13R0.412 COC(CCCSCCCC#N)OC 62a_100000069011_100000687738 [0,2,0,0,0,0|0,0,1]=3 5573 B13R0.412 COC(CCCSCCCC#N)OC 62a_100000687738_100000069011 [0,2,0,0,0,0|0,0,1]=3 5574 B13R0.412 COC(CCCSCCCC=O)OC 62a_100000069011_200011292268 [0,2,0,0,0,0|0,0,1]=3 5575 B13R0.412 COC(CCCSCCCC=O)OC 62a_200011292268_100000069011 [0,2,0,0,0,0|0,0,1]=3 5576 B13R0.412 COC(CCCSCCCCF)OC 62a_100000069011_100000729493 [0,2,0,0,0,0|0,0,0]=2 5577 B13R0.412 COC(CCCSCCCCF)OC 62a_100000729493_100000069011 [0,2,0,0,0,0|0,0,0]=2 5578 B13R0.412 COC(CCCSCCCCO)OC 62a_100000069011_100000210776 [0,2,0,0,0,0|0,0,0]=2 5579 B13R0.412 COC(CCCSCCCCO)OC 62a_100000210776_100000069011 [0,2,0,0,0,0|0,0,0]=2 5580 B13R0.412 COC(CCCSCCSC#N)OC 62a_100000034367_100000069011 [0,2,0,0,0,0|1,0,1]=4 5581 B13R0.412 COC(CCCSCCSC#N)OC 62a_100000069011_100000034367 [0,2,0,0,0,0|1,0,1]=4 5582 B13R0.412 COC(CCNCCCCCO)OC 2230a_100000762737_100009813347 [0,2,0,0,0,0|0,0,0]=2 5583 B13R0.412 COC(CCNCCCCCO)OC 34a_100000762737_100000139399 [0,2,0,0,0,0|0,0,0]=2 5584 B13R0.412 COC(CCNCCCN=[N+]=[N-])OC 2230a_100000744732_100009813347 [0,2,0,0,0,0|2,0,0]=4 5585 B13R0.412 COC(CCNCCOCCO)OC 2230a_100000211614_100009813347 [0,2,0,0,0,0|1,0,0]=3 5586 B13R0.412 COC(CCNCCOCCO)OC 34a_100000211614_100000139399 [0,2,0,0,0,0|1,0,0]=3 5587 B13R0.412 COC(CCNCCSCCO)OC 2230a_100011219999_100009813347 [0,2,0,0,0,0|1,0,0]=3 5588 B13R0.412 COC(CCOCCCCCBr)OC 34a_100000746331_100000139399 [0,2,0,0,0,0|0,0,0]=2 5589 B13R0.412 COC(CCOCCCCCBr)OC 7a_100000746331_100009813347 [0,2,0,0,0,0|0,0,0]=2 5590 B13R0.412 COC(CCOCCCCCCl)OC 34a_100000746330_100000139399 [0,2,0,0,0,0|0,0,0]=2 5591 B13R0.412 COC(CCOCCCCCCl)OC 7a_100000746330_100009813347 [0,2,0,0,0,0|0,0,0]=2 5592 B13R0.412 COC(CCOCCCCCI)OC 34a_200012148887_100000139399 [0,2,0,0,0,0|0,0,0]=2 5593 B13R0.412 COC(CCOCCCCCI)OC 7a_200012148887_100009813347 [0,2,0,0,0,0|0,0,0]=2 5594 B13R0.412 COC(CCOCCCCCN)OC 34a_100000762737_100000139399 [0,2,0,0,0,0|0,0,0]=2 5595 B13R0.412 COC(CCOCCCCSC)OC 34a_100011217163_100000139399 [0,2,0,0,0,0|0,0,0]=2 5596 B13R0.412 COC(CCOCCCCSC)OC 7a_100011217163_100009813347 [0,2,0,0,0,0|0,0,0]=2 5597 B13R0.412 COC(CCOCCOCCBr)OC 34a_100000692535_100000139399 [0,2,0,0,0,0|1,0,0]=3 5598 B13R0.412 COC(CCOCCOCCBr)OC 7a_100000692535_100009813347 [0,2,0,0,0,0|1,0,0]=3 5599 B13R0.412 COC(CCOCCOCCCl)OC 34a_100011215305_100000139399 [0,2,0,0,0,0|1,0,0]=3 5600 B13R0.412 COC(CCOCCOCCCl)OC 7a_100011215305_100009813347 [0,2,0,0,0,0|1,0,0]=3 5601 B13R0.412 COC(CCOCCOCCF)OC 34a_200015357709_100000139399 [0,2,0,0,0,0|1,0,0]=3 5602 B13R0.412 COC(CCOCCOCCF)OC 7a_200015357709_100009813347 [0,2,0,0,0,0|1,0,0]=3 5603 B13R0.412 COC(CCOCCOCCI)OC 34a_100012149058_100000139399 [0,2,0,0,0,0|1,0,0]=3 5604 B13R0.412 COC(CCOCCOCCI)OC 7a_100012149058_100009813347 [0,2,0,0,0,0|1,0,0]=3 5605 B13R0.412 COC(CCOCCOCCN)OC 34a_100000211614_100000139399 [0,2,0,0,0,0|1,0,0]=3 5606 B13R0.412 COC(CCSCCCCC#N)OC 62a_100000139399_100000211819 [0,2,0,0,0,0|0,0,1]=3 5607 B13R0.412 COC(CCSCCCCC#N)OC 62a_100011219923_100000139399 [0,2,0,0,0,0|0,0,1]=3 5608 B13R0.412 COC(CCSCCCCC=O)OC 62a_100000139335_100000139399 [0,2,0,0,0,0|0,0,1]=3 5609 B13R0.412 COC(CCSCCCCC=O)OC 62a_100000139399_100000139335 [0,2,0,0,0,0|0,0,1]=3 5610 B13R0.412 COC(CCSCCCCCF)OC 62a_100000139399_100000729378 [0,2,0,0,0,0|0,0,0]=2 5611 B13R0.412 COC(CCSCCCCCF)OC 62a_100000729378_100000139399 [0,2,0,0,0,0|0,0,0]=2 5612 B13R0.412 COC(CCSCCCCCO)OC 62a_100000139399_100000746330 [0,2,0,0,0,0|0,0,0]=2 5613 B13R0.412 COC(CCSCCCCCO)OC 62a_100000746330_100000139399 [0,2,0,0,0,0|0,0,0]=2 5614 B13R0.412 COC(CCSCCOCC#N)OC 62a_100000139399_200000047693 [0,2,0,0,0,0|1,0,1]=4 5615 B13R0.412 COC(CCSCCOCC#N)OC 62a_200000047693_100000139399 [0,2,0,0,0,0|1,0,1]=4 5616 B13R0.412 COC(CCSCCOCCO)OC 62a_100000139399_100011215305 [0,2,0,0,0,0|1,0,0]=3 5617 B13R0.412 COC(CCSCCOCCO)OC 62a_100011215305_100000139399 [0,2,0,0,0,0|1,0,0]=3 5618 B13R0.412 COC(CNCCCCCC#N)OC 270004a_100000061152_100000752162 [0,2,0,0,0,0|0,0,1]=3 5619 B13R0.412 COC(CNCCCCCCO)OC 2230a_100000686447_100000751394 [0,2,0,0,0,0|0,0,0]=2 5620 B13R0.412 COC(CNCCCCCCO)OC 270004a_100000686447_100000752162 [0,2,0,0,0,0|0,0,0]=2 5621 B13R0.412 COC(CNCCCCCCO)OC 34a_100000686447_100000211822 [0,2,0,0,0,0|0,0,0]=2 5622 B13R0.412 COC(CNCCCCN=[N+]=[N-])OC 2230a_100000101370_100000751394 [0,2,0,0,0,0|2,0,0]=4 5623 B13R0.412 COC(CNCCCCN=[N+]=[N-])OC 270004a_100000101370_100000752162 [0,2,0,0,0,0|2,0,0]=4 5624 B13R0.412 COC(COCCCCCCBr)OC 34a_100011215345_100000211822 [0,2,0,0,0,0|0,0,0]=2 5625 B13R0.412 COC(COCCCCCCBr)OC 7a_100011215345_100000751394 [0,2,0,0,0,0|0,0,0]=2 5626 B13R0.412 COC(COCCCCCCCl)OC 34a_100000766143_100000211822 [0,2,0,0,0,0|0,0,0]=2 5627 B13R0.412 COC(COCCCCCCCl)OC 7a_100000766143_100000751394 [0,2,0,0,0,0|0,0,0]=2 5628 B13R0.412 COC(COCCCCCCF)OC 34a_100000732779_100000211822 [0,2,0,0,0,0|0,0,0]=2 5629 B13R0.412 COC(COCCCCCCF)OC 34a_100011216393_100015922095 [0,2,0,0,0,0|0,0,0]=2 5630 B13R0.412 COC(COCCCCCCF)OC 7a_100000732779_100000751394 [0,2,0,0,0,0|0,0,0]=2 5631 B13R0.412 COC(COCCCCCCN)OC 34a_100000686447_100000211822 [0,2,0,0,0,0|0,0,0]=2 5632 B13R0.412 COC(COCCCCCCO)OC 34a_100011216393_100000766143 [0,2,0,0,0,0|0,0,0]=2 5633 B13R0.412 COC(CSCCCCCC#N)OC 62a_100000751394_100009813376 [0,2,0,0,0,0|0,0,1]=3 5634 B13R0.412 COC(CSCCCCCC#N)OC 62a_100009813376_100000751394 [0,2,0,0,0,0|0,0,1]=3 5635 B13R0.412 COC(CSCCCCCC=O)OC 62a_100000139337_100000751394 [0,2,0,0,0,0|0,0,1]=3 5636 B13R0.412 COC(CSCCCCCC=O)OC 62a_100000751394_100000139337 [0,2,0,0,0,0|0,0,1]=3 5637 B13R0.412 COC(CSCCCCCCF)OC 62a_100000751394_100015922095 [0,2,0,0,0,0|0,0,0]=2 5638 B13R0.412 COC(CSCCCCCCF)OC 62a_100015922095_100000751394 [0,2,0,0,0,0|0,0,0]=2 5639 B13R0.412 COC(CSCCCCCCO)OC 62a_100000751394_100000766143 [0,2,0,0,0,0|0,0,0]=2 5640 B13R0.412 COC(CSCCCCCCO)OC 62a_100000766143_100000751394 [0,2,0,0,0,0|0,0,0]=2 5641 B13R0.412 COCCCCCNCC(OC)OC 2230a_100000747528_100000751394 [0,2,0,0,0,0|0,0,0]=2 5642 B13R0.412 COCCCCCNCC(OC)OC 270004a_100000747528_100000752162 [0,2,0,0,0,0|0,0,0]=2 5643 B13R0.412 COCCCCCNCC(OC)OC 34a_100000747528_100000211822 [0,2,0,0,0,0|0,0,0]=2 5644 B13R0.412 COCCCCOCCC(OC)OC 34a_100000740925_100000139399 [0,2,0,0,0,0|0,0,0]=2 5645 B13R0.412 COCCCCSCCC(OC)OC 62a_100000139399_100000730899 [0,2,0,0,0,0|0,0,0]=2 5646 B13R0.412 COCCCCSCCC(OC)OC 62a_100000730899_100000139399 [0,2,0,0,0,0|0,0,0]=2 5647 B13R0.412 COCCCNCCCC(OC)OC 34a_100150723488_100000069011 [0,2,0,0,0,0|0,0,0]=2 5648 B13R0.412 COCCCOCCCC(OC)OC 34a_100000740835_100000069011 [0,2,0,0,0,0|0,0,0]=2 5649 B13R0.412 COCCCSCCCC(OC)OC 62a_100000069011_100000709357 [0,2,0,0,0,0|0,0,0]=2 5650 B13R0.412 COCCCSCCCC(OC)OC 62a_100000709357_100000069011 [0,2,0,0,0,0|0,0,0]=2 5651 B13R0.412 COCCOCCNCC(OC)OC 2230a_100000745349_100000751394 [0,2,0,0,0,0|1,0,0]=3 5652 B13R0.412 COCCOCCNCC(OC)OC 270004a_100000745349_100000752162 [0,2,0,0,0,0|1,0,0]=3 5653 B13R0.412 COCCOCCNCC(OC)OC 34a_100000745349_100000211822 [0,2,0,0,0,0|1,0,0]=3 5654 B13R0.412 COCCOCCOCC(OC)OC 34a_100011215163_100000211822 [0,2,0,0,0,0|1,0,0]=3 5655 B13R0.412 COCCOCCOCC(OC)OC 34a_100011216393_100000695917 [0,2,0,0,0,0|1,0,0]=3 5656 B13R0.412 COCCOCCOCC(OC)OC 7a_100011215163_100000751394 [0,2,0,0,0,0|1,0,0]=3 5657 B13R0.412 COCCOCCSCC(OC)OC 62a_100000695917_100000751394 [0,2,0,0,0,0|1,0,0]=3 5658 B13R0.412 COCCOCCSCC(OC)OC 62a_100000751394_100000695917 [0,2,0,0,0,0|1,0,0]=3 5659 B13R0.412 COCCOCSCCC(OC)OC 62a_100000139399_100000231047 [0,2,0,0,0,0|1,0,0]=3 5660 B13R0.412 COCCOCSCCC(OC)OC 62a_100000231047_100000139399 [0,2,0,0,0,0|1,0,0]=3 5661 B13R0.426 C#CCCCC(=O)CCC(OC)OC 1458a_100000690238_100000139399 [0,2,0,0,0,0|0,0,2]=4 5662 B13R0.426 C#CCCCC(=O)CCC(OC)OC 1458a_200000082759_100000731252 [0,2,0,0,0,0|0,0,2]=4 5663 B13R0.426 C=CCCCC(=O)CCC(OC)OC 1458a_100000766728_100000139399 [0,2,0,0,0,0|0,0,2]=4 5664 B13R0.426 C=CCCCC(=O)CCC(OC)OC 1458a_200000082759_100000757094 [0,2,0,0,0,0|0,0,2]=4 5665 B13R0.426 CC/C=C/CC(=O)CCC(OC)OC 1458a_100016274230_100000139399 [0,2,0,0,0,0|0,0,2]=4 5666 B13R0.426 CC/C=C\CC(=O)CCC(OC)OC 1458a_200000082759_100103147603 [0,2,0,0,0,0|0,0,2]=4 5667 B13R0.426 CCC#CCC(=O)CCC(OC)OC 1458a_200000082759_100009813939 [0,2,0,0,0,0|0,0,2]=4 5668 B13R0.426 CCC#CCC(C)OCC(OC)OC 34a_200000035118_100000211822 [0,2,0,0,0,0|0,0,2]=4 5669 B13R0.426 CCC#CCC(C)OCC(OC)OC 7a_200000035118_100000751394 [0,2,0,0,0,0|0,0,2]=4 5670 B13R0.426 CCC(CNC(C)CCCSC)OC 270004a_100000731041_100011399439 [0,2,0,0,0,0|2,0,0]=4 5671 B13R0.426 CCCC#CC(=O)CCC(OC)OC 1458a_200011218047_100000139399 [0,2,0,0,0,0|0,0,2]=4 5672 B13R0.426 CCCC=CC(=O)CCC(OC)OC 1458a_100000212230_100000139399 [0,2,0,0,0,0|0,0,2]=4 5673 B13R0.426 CCCCCC(=O)CCC(OC)OC 1458a_100000212188_100000139399 [0,2,0,0,0,0|0,0,0]=2 5674 B13R0.426 CCCCCC(=O)CCC(OC)OC 1458a_200000082759_100000210326 [0,2,0,0,0,0|0,0,0]=2 5675 B13R0.426 CCCCCC(=O)NCC(CC)OC 11a_100000731041_100000212188 [0,2,0,0,0,0|1,0,1]=4 5676 B13R0.426 CCCCCC(=O)NCC(CC)OC 1626a_100000731041_100000212188 [0,2,0,0,0,0|1,0,1]=4 5677 B13R0.426 CCCCCC(=O)NCC(CC)OC 240690a_100000731041_100000212188 [0,2,0,0,0,0|1,0,1]=4 5678 B13R0.426 CCCCCC(=O)NCC(CC)OC 527a_100000731041_100000212188 [0,2,0,0,0,0|1,0,1]=4 5679 B13R0.426 CCCCCC(=O)NCC(OC)OC 11a_100000210479_100000212188 [0,2,0,0,0,0|0,0,1]=3 5680 B13R0.426 CCCCCC(=O)NCC(OC)OC 1626a_100000210479_100000212188 [0,2,0,0,0,0|0,0,1]=3 5681 B13R0.426 CCCCCC(=O)NCC(OC)OC 240690a_100000210479_100000212188 [0,2,0,0,0,0|0,0,1]=3 5682 B13R0.426 CCCCCC(=O)NCC(OC)OC 527a_100000210479_100000212188 [0,2,0,0,0,0|0,0,1]=3 5683 B13R0.426 CCCCCC(C)NCC(CC)CC 2230a_100000211957_100011215472 [0,2,0,0,0,0|2,0,0]=4 5684 B13R0.426 CCCCCC(C)NCC(CC)CC 2230a_100102946423_200011218191 [0,2,0,0,0,0|2,0,0]=4 5685 B13R0.426 CCCCCC(C)NCC(CC)CC 269862a_100000211957_100000211137 [0,2,0,0,0,0|2,0,0]=4 5686 B13R0.426 CCCCCC(C)NCC(CC)CC 270004a_100000211957_100000211137 [0,2,0,0,0,0|2,0,0]=4 5687 B13R0.426 CCCCCC(C)NCC(CC)CC 270004a_100102946423_100000211708 [0,2,0,0,0,0|2,0,0]=4 5688 B13R0.426 CCCCCC(C)NCC(CC)OC 270004a_100000731041_100000211708 [0,2,0,0,0,0|1,0,0]=3 5689 B13R0.426 CCCCCC(C)NCC(OC)OC 2230a_100000211957_100000751394 [0,2,0,0,0,0|0,0,0]=2 5690 B13R0.426 CCCCCC(C)NCC(OC)OC 270004a_100000210479_100000211708 [0,2,0,0,0,0|0,0,0]=2 5691 B13R0.426 CCCCCC(C)NCC(OC)OC 270004a_100000211957_100000752162 [0,2,0,0,0,0|0,0,0]=2 5692 B13R0.426 CCCCCC(C)OCC(CC)CC 34a_100011215632_100011215472 [0,2,0,0,0,0|2,0,0]=4 5693 B13R0.426 CCCCCC(C)OCC(CC)CC 7a_100000703878_200011218191 [0,2,0,0,0,0|2,0,0]=4 5694 B13R0.426 CCCCCC(C)OCC(CC)CC 7a_100011215632_100011215472 [0,2,0,0,0,0|2,0,0]=4 5695 B13R0.426 CCCCCC(C)OCC(CC)OC 34a_100011934954_200011218191 [0,2,0,0,0,0|1,0,0]=3 5696 B13R0.426 CCCCCC(C)OCC(CC)OC 7a_100011934954_200011218191 [0,2,0,0,0,0|1,0,0]=3 5697 B13R0.426 CCCCCC(C)OCC(OC)OC 34a_100011215632_100000211822 [0,2,0,0,0,0|0,0,0]=2 5698 B13R0.426 CCCCCC(C)OCC(OC)OC 34a_100011216393_200011218191 [0,2,0,0,0,0|0,0,0]=2 5699 B13R0.426 CCCCCC(C)OCC(OC)OC 7a_100011215632_100000751394 [0,2,0,0,0,0|0,0,0]=2 5700 B13R0.426 CCCCCC(C)SCC(CC)CC 62a_100011215472_200011218191 [0,2,0,0,0,0|2,0,0]=4 5701 B13R0.426 CCCCCC(C)SCC(CC)CC 62a_200011218191_100011215472 [0,2,0,0,0,0|2,0,0]=4 5702 B13R0.426 CCCCCC(C)SCC(OC)OC 62a_100000751394_200011218191 [0,2,0,0,0,0|0,0,0]=2 5703 B13R0.426 CCCCCC(C)SCC(OC)OC 62a_200011218191_100000751394 [0,2,0,0,0,0|0,0,0]=2 5704 B13R0.426 CCCCCN(C)CCC(OC)OC 2230a_100000223495_100009813347 [0,2,0,0,0,0|0,0,0]=2 5705 B13R0.426 CCCCCN(C)CCC(OC)OC 269982a_100000223495_100000139399 [0,2,0,0,0,0|0,0,0]=2 5706 B13R0.426 CCCCNC(=O)CCC(OC)OC 11a_100000102301_200000082759 [0,2,0,0,0,0|0,0,1]=3 5707 B13R0.426 CCCCNC(=O)CCC(OC)OC 1626a_100000102301_200000082759 [0,2,0,0,0,0|0,0,1]=3 5708 B13R0.426 CCCCNC(=O)CCC(OC)OC 240690a_100000102301_200000082759 [0,2,0,0,0,0|0,0,1]=3 5709 B13R0.426 CCCCNC(=O)CCC(OC)OC 527a_100000102301_200000082759 [0,2,0,0,0,0|0,0,1]=3 5710 B13R0.426 CCCCNC(=O)NCC(OC)OC 2708a_100000210479_100000102301 [0,2,0,0,0,0|1,0,1]=4 5711 B13R0.426 CCCCNC(=O)NCC(OC)OC 273464a_100000102301_100000210479 [0,2,0,0,0,0|1,0,1]=4 5712 B13R0.426 CCCCNC(=O)NCC(OC)OC 273464a_100000210479_100000102301 [0,2,0,0,0,0|1,0,1]=4 5713 B13R0.426 CCCCNC(=O)NCC(OC)OC 512a_100000102301_100000210479 [0,2,0,0,0,0|1,0,1]=4 5714 B13R0.426 CCCCNC(=O)NCC(OC)OC 512a_100000210479_100000102301 [0,2,0,0,0,0|1,0,1]=4 5715 B13R0.426 CCCNNC(=O)CCC(OC)OC 22a_100000740057_200000082759 [0,2,0,0,0,0|1,0,1]=4 5716 B13R0.426 CCCOCC(=O)CCC(OC)OC 1458a_100000745993_100000139399 [0,2,0,0,0,0|0,0,1]=3 5717 B13R0.426 CCCOCC(=O)NCC(OC)OC 11a_100000210479_100000745993 [0,2,0,0,0,0|1,0,1]=4 5718 B13R0.426 CCCOCC(=O)NCC(OC)OC 1626a_100000210479_100000745993 [0,2,0,0,0,0|1,0,1]=4 5719 B13R0.426 CCCOCC(=O)NCC(OC)OC 240690a_100000210479_100000745993 [0,2,0,0,0,0|1,0,1]=4 5720 B13R0.426 CCCOCC(=O)NCC(OC)OC 527a_100000210479_100000745993 [0,2,0,0,0,0|1,0,1]=4 5721 B13R0.426 CCCSCC(=O)CCC(OC)OC 1458a_100000217233_100000139399 [0,2,0,0,0,0|0,0,1]=3 5722 B13R0.426 CCCSCC(=O)NCC(OC)OC 11a_100000210479_100000217233 [0,2,0,0,0,0|1,0,1]=4 5723 B13R0.426 CCCSCC(=O)NCC(OC)OC 1626a_100000210479_100000217233 [0,2,0,0,0,0|1,0,1]=4 5724 B13R0.426 CCCSCC(=O)NCC(OC)OC 240690a_100000210479_100000217233 [0,2,0,0,0,0|1,0,1]=4 5725 B13R0.426 CCCSCC(=O)NCC(OC)OC 527a_100000210479_100000217233 [0,2,0,0,0,0|1,0,1]=4 5726 B13R0.426 CCCSCC(C)NCC(CC)OC 270004a_100000731041_100011343953 [0,2,0,0,0,0|2,0,0]=4 5727 B13R0.426 CCCSCC(C)NCC(OC)OC 270004a_100000210479_100011343953 [0,2,0,0,0,0|1,0,0]=3 5728 B13R0.426 CCOCCC(=O)CCC(OC)OC 1458a_100000749530_100000139399 [0,2,0,0,0,0|0,0,1]=3 5729 B13R0.426 CCOCCC(=O)CCC(OC)OC 1458a_200000082759_100011215890 [0,2,0,0,0,0|0,0,1]=3 5730 B13R0.426 CCOCCC(=O)NCC(OC)OC 11a_100000210479_100000749530 [0,2,0,0,0,0|1,0,1]=4 5731 B13R0.426 CCOCCC(=O)NCC(OC)OC 1626a_100000210479_100000749530 [0,2,0,0,0,0|1,0,1]=4 5732 B13R0.426 CCOCCC(=O)NCC(OC)OC 240690a_100000210479_100000749530 [0,2,0,0,0,0|1,0,1]=4 5733 B13R0.426 CCOCCC(=O)NCC(OC)OC 527a_100000210479_100000749530 [0,2,0,0,0,0|1,0,1]=4 5734 B13R0.426 CCOCCC(C)NCC(CC)OC 270004a_100000731041_200011216536 [0,2,0,0,0,0|2,0,0]=4 5735 B13R0.426 CCOCCC(C)NCC(OC)OC 270004a_100000210479_200011216536 [0,2,0,0,0,0|1,0,0]=3 5736 B13R0.426 CCSCCC(=O)CCC(OC)OC 1458a_100000230768_100000139399 [0,2,0,0,0,0|0,0,1]=3 5737 B13R0.426 CCSCCC(=O)CCC(OC)OC 1458a_200000082759_100000757381 [0,2,0,0,0,0|0,0,1]=3 5738 B13R0.426 CCSCCC(=O)NCC(OC)OC 11a_100000210479_100000230768 [0,2,0,0,0,0|1,0,1]=4 5739 B13R0.426 CCSCCC(=O)NCC(OC)OC 1626a_100000210479_100000230768 [0,2,0,0,0,0|1,0,1]=4 5740 B13R0.426 CCSCCC(=O)NCC(OC)OC 240690a_100000210479_100000230768 [0,2,0,0,0,0|1,0,1]=4 5741 B13R0.426 CCSCCC(=O)NCC(OC)OC 527a_100000210479_100000230768 [0,2,0,0,0,0|1,0,1]=4 5742 B13R0.426 COC(CCC(=O)CCCC#N)OC 1458a_100000075515_100000139399 [0,2,0,0,0,0|0,0,2]=4 5743 B13R0.426 COC(CCC(=O)CCCC#N)OC 1458a_200000082759_100000211468 [0,2,0,0,0,0|0,0,2]=4 5744 B13R0.426 COC(CCC(=O)CCCCF)OC 1458a_200000082759_100000729493 [0,2,0,0,0,0|0,0,1]=3 5745 B13R0.426 COC(CCC(=O)CCCCO)OC 1458a_100000695505_100000139399 [0,2,0,0,0,0|0,0,1]=3 5746 B13R0.426 COC(CCC(=O)CCCCO)OC 1458a_200000082759_100000210776 [0,2,0,0,0,0|0,0,1]=3 5747 B13R0.426 COC(CCC(=O)CCCSC)OC 1458a_100000173376_100000139399 [0,2,0,0,0,0|0,0,1]=3 5748 B13R0.426 COC(CCC(=O)COCCO)OC 1458a_100000708028_100000139399 [0,2,0,0,0,0|1,0,1]=4 5749 B13R0.426 COC(CCC(=O)NCCCF)OC 11a_100015189416_200000082759 [0,2,0,0,0,0|1,0,1]=4 5750 B13R0.426 COC(CCC(=O)NCCCF)OC 1626a_100015189416_200000082759 [0,2,0,0,0,0|1,0,1]=4 5751 B13R0.426 COC(CCC(=O)NCCCF)OC 240690a_100015189416_200000082759 [0,2,0,0,0,0|1,0,1]=4 5752 B13R0.426 COC(CCC(=O)NCCCF)OC 527a_100015189416_200000082759 [0,2,0,0,0,0|1,0,1]=4 5753 B13R0.426 COC(CCC(=O)NCCCO)OC 240690a_100000182051_200000082759 [0,2,0,0,0,0|1,0,1]=4 5754 B13R0.426 COC(CCC(=O)NCCCO)OC 527a_100000182051_200000082759 [0,2,0,0,0,0|1,0,1]=4 5755 B13R0.426 COC(CCC(=O)NCCSC)OC 11a_100020590264_200000082759 [0,2,0,0,0,0|1,0,1]=4 5756 B13R0.426 COC(CCC(=O)NCCSC)OC 1626a_100020590264_200000082759 [0,2,0,0,0,0|1,0,1]=4 5757 B13R0.426 COC(CCC(=O)NCCSC)OC 240690a_100020590264_200000082759 [0,2,0,0,0,0|1,0,1]=4 5758 B13R0.426 COC(CCC(=O)NCCSC)OC 527a_100020590264_200000082759 [0,2,0,0,0,0|1,0,1]=4 5759 B13R0.426 COC(CCN(C)CCCCO)OC 2230a_100000717598_100009813347 [0,2,0,0,0,0|1,0,0]=3 5760 B13R0.426 COC(CCN(C)CCCCO)OC 269982a_100000717598_100000139399 [0,2,0,0,0,0|1,0,0]=3 5761 B13R0.426 COC(CNC(=O)CCCCO)OC 1626a_100000210479_100000695505 [0,2,0,0,0,0|1,0,1]=4 5762 B13R0.426 COC(CNC(=O)CCCSC)OC 11a_100000210479_100000173376 [0,2,0,0,0,0|1,0,1]=4 5763 B13R0.426 COC(CNC(=O)CCCSC)OC 1626a_100000210479_100000173376 [0,2,0,0,0,0|1,0,1]=4 5764 B13R0.426 COC(CNC(=O)CCCSC)OC 240690a_100000210479_100000173376 [0,2,0,0,0,0|1,0,1]=4 5765 B13R0.426 COC(CNC(=O)CCCSC)OC 527a_100000210479_100000173376 [0,2,0,0,0,0|1,0,1]=4 5766 B13R0.426 COC(CNC(C)CCCC#N)OC 270004a_100000210479_200000032708 [0,2,0,0,0,0|1,0,1]=4 5767 B13R0.426 COC(CNC(C)CCCSC)OC 270004a_100000210479_100011399439 [0,2,0,0,0,0|1,0,0]=3 5768 B13R0.426 COCCCC(=O)CCC(OC)OC 1458a_100000741012_100000139399 [0,2,0,0,0,0|0,0,1]=3 5769 B13R0.426 COCCCC(=O)CCC(OC)OC 1458a_200000082759_100000740836 [0,2,0,0,0,0|0,0,1]=3 5770 B13R0.426 COCCCC(=O)NCC(OC)OC 11a_100000210479_100000741012 [0,2,0,0,0,0|1,0,1]=4 5771 B13R0.426 COCCCC(=O)NCC(OC)OC 1626a_100000210479_100000741012 [0,2,0,0,0,0|1,0,1]=4 5772 B13R0.426 COCCCC(=O)NCC(OC)OC 240690a_100000210479_100000741012 [0,2,0,0,0,0|1,0,1]=4 5773 B13R0.426 COCCCC(=O)NCC(OC)OC 527a_100000210479_100000741012 [0,2,0,0,0,0|1,0,1]=4 5774 B13R0.426 COCCCC(C)OCC(OC)OC 34a_200011539412_100000211822 [0,2,0,0,0,0|1,0,0]=3 5775 B13R0.426 COCCCC(C)OCC(OC)OC 7a_200011539412_100000751394 [0,2,0,0,0,0|1,0,0]=3 5776 B13R0.426 COCCCN(C)CCC(OC)OC 2230a_100000224831_100009813347 [0,2,0,0,0,0|1,0,0]=3 5777 B13R0.426 COCCCN(C)CCC(OC)OC 269982a_100000224831_100000139399 [0,2,0,0,0,0|1,0,0]=3 5778 B13R0.426 COCCNC(=O)CCC(OC)OC 1626a_100000209980_200000082759 [0,2,0,0,0,0|1,0,1]=4 5779 B13R0.426 COCCNC(=O)CCC(OC)OC 240690a_100000209980_200000082759 [0,2,0,0,0,0|1,0,1]=4 5780 B13R0.426 COCCNC(=O)CCC(OC)OC 527a_100000209980_200000082759 [0,2,0,0,0,0|1,0,1]=4 5781 B13R0.439 C#CCCCCC(=O)CC(OC)OC 1458a_100000082724_100010269958 [0,2,0,0,0,0|0,0,2]=4 5782 B13R0.439 C#CCCCCC(=O)CC(OC)OC 1458a_100000696528_100000751394 [0,2,0,0,0,0|0,0,2]=4 5783 B13R0.439 C#CCCCCN(C)CC(OC)OC 269982a_100000225562_100010269958 [0,2,0,0,0,0|0,0,2]=4 5784 B13R0.439 C#CCCCNC(C)CC(OC)OC 270004a_100000718082_100000210484 [0,2,0,0,0,0|0,0,2]=4 5785 B13R0.439 C#CCCCOC(C)CC(OC)OC 7a_100011018202_100011215417 [0,2,0,0,0,0|0,0,2]=4 5786 B13R0.439 C=CCCCCC(=O)CC(OC)OC 1458a_100000082724_100011215482 [0,2,0,0,0,0|0,0,2]=4 5787 B13R0.439 C=CCCCCC(=O)CC(OC)OC 1458a_100011215552_100000751394 [0,2,0,0,0,0|0,0,2]=4 5788 B13R0.439 C=CCCCCN(C)CC(OC)OC 2230a_100012000471_100000751394 [0,2,0,0,0,0|0,0,2]=4 5789 B13R0.439 C=CCCCCN(C)CC(OC)OC 269982a_100000225562_100011215482 [0,2,0,0,0,0|0,0,2]=4 5790 B13R0.439 C=CCCCCN(C)CC(OC)OC 270004a_100012000471_100000752162 [0,2,0,0,0,0|0,0,2]=4 5791 B13R0.439 C=CCCCNC(C)CC(OC)OC 270004a_100000700776_100000210484 [0,2,0,0,0,0|0,0,2]=4 5792 B13R0.439 C=CCCCOC(C)CC(OC)OC 7a_100011018202_100000757094 [0,2,0,0,0,0|0,0,2]=4 5793 B13R0.439 CC/C=C\CCC(=O)CC(OC)OC 1458a_100000082724_100015370543 [0,2,0,0,0,0|0,0,2]=4 5794 B13R0.439 CC/C=C\CCN(C)CC(OC)OC 269982a_100000225562_100015370543 [0,2,0,0,0,0|0,0,2]=4 5795 B13R0.439 CC/C=C\COC(C)CC(OC)OC 7a_100011018202_100103147603 [0,2,0,0,0,0|0,0,2]=4 5796 B13R0.439 CCC#CCOC(C)CC(OC)OC 7a_100011018202_100009813939 [0,2,0,0,0,0|0,0,2]=4 5797 B13R0.439 CCC/C=C/CC(=O)CC(OC)OC 1458a_200016266809_100000751394 [0,2,0,0,0,0|0,0,2]=4 5798 B13R0.439 CCCCC=CC(=O)CC(OC)OC 1458a_100016266645_100000751394 [0,2,0,0,0,0|0,0,2]=4 5799 B13R0.439 CCCCCCC(=O)CC(CC)CC 1458a_100102632555_100011215472 [0,2,0,0,0,0|2,0,0]=4 5800 B13R0.439 CCCCCCC(=O)CC(OC)OC 1458a_100000082724_100000210757 [0,2,0,0,0,0|0,0,0]=2 5801 B13R0.439 CCCCCCC(=O)CC(OC)OC 1458a_100102632555_100000751394 [0,2,0,0,0,0|0,0,0]=2 5802 B13R0.439 CCCCCCC(C)NC(CC)CC 2230a_100000199018_100011215978 [0,2,0,0,0,0|2,0,0]=4 5803 B13R0.439 CCCCCCC(C)NC(CC)CC 270004a_100000199018_100000210826 [0,2,0,0,0,0|2,0,0]=4 5804 B13R0.439 CCCCCCC(C)NC(CC)CC 270004a_100000210919_100000210860 [0,2,0,0,0,0|2,0,0]=4 5805 B13R0.439 CCCCCCC(C)OC(CC)CC 7a_100000210265_100000210505 [0,2,0,0,0,0|2,0,0]=4 5806 B13R0.439 CCCCCCC(C)OC(CC)CC 7a_100000688536_100011215978 [0,2,0,0,0,0|2,0,0]=4 5807 B13R0.439 CCCCCCC(C)SC(CC)CC 62a_100000210505_100011215978 [0,2,0,0,0,0|2,0,0]=4 5808 B13R0.439 CCCCCCC(C)SC(CC)CC 62a_100011215978_100000210505 [0,2,0,0,0,0|2,0,0]=4 5809 B13R0.439 CCCCCCN(C)CC(CC)CC 2230a_106256046315_100011215472 [0,2,0,0,0,0|2,0,0]=4 5810 B13R0.439 CCCCCCN(C)CC(CC)CC 269982a_106256046315_100011215472 [0,2,0,0,0,0|2,0,0]=4 5811 B13R0.439 CCCCCCN(C)CC(CC)CC 270004a_106256046315_100000211137 [0,2,0,0,0,0|2,0,0]=4 5812 B13R0.439 CCCCCCN(C)CC(OC)OC 2230a_106256046315_100000751394 [0,2,0,0,0,0|0,0,0]=2 5813 B13R0.439 CCCCCCN(C)CC(OC)OC 269982a_100000225562_100000210757 [0,2,0,0,0,0|0,0,0]=2 5814 B13R0.439 CCCCCCN(C)CC(OC)OC 270004a_106256046315_100000752162 [0,2,0,0,0,0|0,0,0]=2 5815 B13R0.439 CCCCCNC(=O)CC(OC)OC 11a_100000209983_100000082724 [0,2,0,0,0,0|0,0,1]=3 5816 B13R0.439 CCCCCNC(=O)CC(OC)OC 1626a_100000209983_100000082724 [0,2,0,0,0,0|0,0,1]=3 5817 B13R0.439 CCCCCNC(=O)CC(OC)OC 240690a_100000209983_100000082724 [0,2,0,0,0,0|0,0,1]=3 5818 B13R0.439 CCCCCNC(=O)CC(OC)OC 527a_100000209983_100000082724 [0,2,0,0,0,0|0,0,1]=3 5819 B13R0.439 CCCCCNC(C)CC(OC)OC 270004a_100000209983_100000210484 [0,2,0,0,0,0|0,0,0]=2 5820 B13R0.439 CCCCCOC(C)CC(OC)OC 7a_100011018202_100000210326 [0,2,0,0,0,0|0,0,0]=2 5821 B13R0.439 CCCCNN=C(C)CC(OC)OC 4a_100025702795_100000210484 [0,2,0,0,0,0|1,0,1]=4 5822 B13R0.439 CCCCNNC(=O)CC(OC)OC 22a_100025702795_100000082724 [0,2,0,0,0,0|1,0,1]=4 5823 B13R0.439 CCCCOCC(=O)CC(OC)OC 1458a_100000082724_100011995733 [0,2,0,0,0,0|0,0,1]=3 5824 B13R0.439 CCCCOCC(=O)CC(OC)OC 1458a_100000757543_100000751394 [0,2,0,0,0,0|0,0,1]=3 5825 B13R0.439 CCCCOCN(C)CC(OC)OC 269982a_100000225562_100011995733 [0,2,0,0,0,0|1,0,0]=3 5826 B13R0.439 CCCCSCC(=O)CC(OC)OC 1458a_100000191162_100000751394 [0,2,0,0,0,0|0,0,1]=3 5827 B13R0.439 CCCOCCC(=O)CC(OC)OC 1458a_100000082724_100011215938 [0,2,0,0,0,0|0,0,1]=3 5828 B13R0.439 CCCOCCN(C)CC(OC)OC 269982a_100000225562_100011215938 [0,2,0,0,0,0|1,0,0]=3 5829 B13R0.439 CCOCCCC(=O)CC(OC)OC 1458a_100000082724_100012232248 [0,2,0,0,0,0|0,0,1]=3 5830 B13R0.439 CCOCCCN(C)CC(OC)OC 269982a_100000225562_100012232248 [0,2,0,0,0,0|1,0,0]=3 5831 B13R0.439 CCOCCNC(=O)CC(OC)OC 11a_100011200944_100000082724 [0,2,0,0,0,0|1,0,1]=4 5832 B13R0.439 CCOCCNC(=O)CC(OC)OC 1626a_102516460346_100000082724 [0,2,0,0,0,0|1,0,1]=4 5833 B13R0.439 CCOCCNC(=O)CC(OC)OC 240690a_100011200944_100000082724 [0,2,0,0,0,0|1,0,1]=4 5834 B13R0.439 CCOCCNC(=O)CC(OC)OC 527a_100011200944_100000082724 [0,2,0,0,0,0|1,0,1]=4 5835 B13R0.439 CCOCCNC(C)CC(OC)OC 270004a_102516460346_100000210484 [0,2,0,0,0,0|1,0,0]=3 5836 B13R0.439 CCOCCOC(C)CC(OC)OC 7a_100011018202_100011215890 [0,2,0,0,0,0|1,0,0]=3 5837 B13R0.439 CCSCCNC(=O)CC(OC)OC 11a_100000106463_100000082724 [0,2,0,0,0,0|1,0,1]=4 5838 B13R0.439 CCSCCNC(=O)CC(OC)OC 1626a_100000106463_100000082724 [0,2,0,0,0,0|1,0,1]=4 5839 B13R0.439 CCSCCNC(=O)CC(OC)OC 240690a_100000106463_100000082724 [0,2,0,0,0,0|1,0,1]=4 5840 B13R0.439 CCSCCNC(=O)CC(OC)OC 527a_100000106463_100000082724 [0,2,0,0,0,0|1,0,1]=4 5841 B13R0.439 CCSCCNC(C)CC(OC)OC 270004a_100000106463_100000210484 [0,2,0,0,0,0|1,0,0]=3 5842 B13R0.439 CCSCCOC(C)CC(OC)OC 7a_100011018202_100000757381 [0,2,0,0,0,0|1,0,0]=3 5843 B13R0.439 COC(CC(=O)CCCCC#N)OC 1458a_100000082724_100000211819 [0,2,0,0,0,0|0,0,2]=4 5844 B13R0.439 COC(CC(=O)CCCCCF)OC 1458a_100000082724_100000729378 [0,2,0,0,0,0|0,0,1]=3 5845 B13R0.439 COC(CC(=O)CCCCCO)OC 1458a_100000082724_100000746330 [0,2,0,0,0,0|0,0,1]=3 5846 B13R0.439 COC(CC(=O)CCCCCO)OC 1458a_100102619762_100000751394 [0,2,0,0,0,0|0,0,1]=3 5847 B13R0.439 COC(CC(=O)CCOCCO)OC 1458a_100000082724_100011215305 [0,2,0,0,0,0|1,0,1]=4 5848 B13R0.439 COC(CC(=O)CCOCCO)OC 1458a_100011229844_100000751394 [0,2,0,0,0,0|1,0,1]=4 5849 B13R0.439 COC(CC(=O)NCCCCO)OC 240690a_100000750430_100000082724 [0,2,0,0,0,0|1,0,1]=4 5850 B13R0.439 COC(CC(=O)NCCCCO)OC 527a_100000750430_100000082724 [0,2,0,0,0,0|1,0,1]=4 5851 B13R0.439 COC(CC(=O)NCCCSC)OC 11a_100000749238_100000082724 [0,2,0,0,0,0|1,0,1]=4 5852 B13R0.439 COC(CC(=O)NCCCSC)OC 1626a_100000749238_100000082724 [0,2,0,0,0,0|1,0,1]=4 5853 B13R0.439 COC(CC(=O)NCCCSC)OC 240690a_100000749238_100000082724 [0,2,0,0,0,0|1,0,1]=4 5854 B13R0.439 COC(CC(=O)NCCCSC)OC 527a_100000749238_100000082724 [0,2,0,0,0,0|1,0,1]=4 5855 B13R0.439 COC(CC(C)NCCCCO)OC 270004a_100000750430_100000210484 [0,2,0,0,0,0|1,0,0]=3 5856 B13R0.439 COC(CC(C)NCCCSC)OC 270004a_100000749238_100000210484 [0,2,0,0,0,0|1,0,0]=3 5857 B13R0.439 COC(CC(C)OCCCC#N)OC 7a_100011018202_100000687738 [0,2,0,0,0,0|1,0,1]=4 5858 B13R0.439 COC(CC(C)OCCCC=O)OC 7a_100011018202_200011292268 [0,2,0,0,0,0|1,0,1]=4 5859 B13R0.439 COC(CC(C)OCCCCF)OC 7a_100011018202_100000729493 [0,2,0,0,0,0|1,0,0]=3 5860 B13R0.439 COC(CC(C)OCCCCO)OC 7a_100011018202_100000210776 [0,2,0,0,0,0|1,0,0]=3 5861 B13R0.439 COC(CN(C)CCCCC#N)OC 269982a_100000225562_100011219923 [0,2,0,0,0,0|1,0,1]=4 5862 B13R0.439 COC(CN(C)CCCCC=O)OC 269982a_100000225562_100000139335 [0,2,0,0,0,0|1,0,1]=4 5863 B13R0.439 COC(CN(C)CCCCCF)OC 269982a_100000225562_100000729378 [0,2,0,0,0,0|1,0,0]=3 5864 B13R0.439 COC(CN(C)CCCCCO)OC 2230a_100000722520_100000751394 [0,2,0,0,0,0|1,0,0]=3 5865 B13R0.439 COC(CN(C)CCCCCO)OC 269982a_100000225562_100000746330 [0,2,0,0,0,0|1,0,0]=3 5866 B13R0.439 COC(CN(C)CCCCCO)OC 270004a_100000722520_100000752162 [0,2,0,0,0,0|1,0,0]=3 5867 B13R0.439 COC(CN(C)CCOCCO)OC 2230a_100000228057_100000751394 [0,2,0,0,0,0|2,0,0]=4 5868 B13R0.439 COC(CN(C)CCOCCO)OC 269982a_100000225562_100011215305 [0,2,0,0,0,0|2,0,0]=4 5869 B13R0.439 COC(CN(C)CCOCCO)OC 270004a_100000228057_100000752162 [0,2,0,0,0,0|2,0,0]=4 5870 B13R0.439 COCCCCC(=O)CC(OC)OC 1458a_100000082724_100000755781 [0,2,0,0,0,0|0,0,1]=3 5871 B13R0.439 COCCCCN(C)CC(OC)OC 269982a_100000225562_100000730899 [0,2,0,0,0,0|1,0,0]=3 5872 B13R0.439 COCCCNC(=O)CC(OC)OC 1626a_100150723488_100000082724 [0,2,0,0,0,0|1,0,1]=4 5873 B13R0.439 COCCCNC(=O)CC(OC)OC 240690a_100150723488_100000082724 [0,2,0,0,0,0|1,0,1]=4 5874 B13R0.439 COCCCNC(=O)CC(OC)OC 527a_100150723488_100000082724 [0,2,0,0,0,0|1,0,1]=4 5875 B13R0.439 COCCCNC(C)CC(OC)OC 270004a_100150723488_100000210484 [0,2,0,0,0,0|1,0,0]=3 5876 B13R0.439 COCCCOC(C)CC(OC)OC 7a_100011018202_100000740836 [0,2,0,0,0,0|1,0,0]=3 5877 B13R0.439 COCCOCC(=O)CC(OC)OC 1458a_100000211095_100000751394 [0,2,0,0,0,0|1,0,1]=4 5878 B13R0.439 COCCOCN(C)CC(OC)OC 269982a_100000225562_100000231047 [0,2,0,0,0,0|2,0,0]=4 5879 B13R0.1115 C#CCC(C)OCCCC(OC)OC 34a_100000685586_100000069011 [0,2,0,0,0,0|0,0,2]=4 5880 B13R0.1115 C#CCC(C)OCCCC(OC)OC 7a_100000685586_100000069011 [0,2,0,0,0,0|0,0,2]=4 5881 B13R0.1115 C/C=C/C(C)OCCCC(OC)OC 34a_200102604097_100000069011 [0,2,0,0,0,0|0,0,2]=4 5882 B13R0.1115 C=CCC(C)COCCC(OC)OC 34a_100009832082_100000139399 [0,2,0,0,0,0|0,0,2]=4 5883 B13R0.1115 C=CCC(C)COCCC(OC)OC 7a_100009832082_100009813347 [0,2,0,0,0,0|0,0,2]=4 5884 B13R0.1115 C=CC[C@@H](C)OCCCC(OC)OC 34a_100000731007_100000069011 [0,2,0,0,0,0|0,0,2]=4 5885 B13R0.1115 C=CC[C@@H](C)OCCCC(OC)OC 7a_100000731007_100000069011 [0,2,0,0,0,0|0,0,2]=4 5886 B13R0.1115 C=CC[C@@H](N)COCCC(OC)OC 34a_100020615467_100000139399 [0,2,0,0,0,0|0,0,2]=4 5887 B13R0.1115 CC#CC(C)OCCCC(OC)OC 34a_100011216543_100000069011 [0,2,0,0,0,0|0,0,2]=4 5888 B13R0.1115 CCCC(=O)CSCCC(OC)OC 62a_100000139399_100000747444 [0,2,0,0,0,0|0,0,1]=3 5889 B13R0.1115 CCCC(=O)CSCCC(OC)OC 62a_100000747444_100000139399 [0,2,0,0,0,0|0,0,1]=3 5890 B13R0.1115 CCCC(=O)NCCCC(OC)OC 11a_100000034021_100000211992 [0,2,0,0,0,0|0,0,1]=3 5891 B13R0.1115 CCCC(=O)NCCCC(OC)OC 1626a_100000034021_100000211992 [0,2,0,0,0,0|0,0,1]=3 5892 B13R0.1115 CCCC(=O)NCCCC(OC)OC 240690a_100000034021_100000211992 [0,2,0,0,0,0|0,0,1]=3 5893 B13R0.1115 CCCC(=O)NCCCC(OC)OC 527a_100000034021_100000211992 [0,2,0,0,0,0|0,0,1]=3 5894 B13R0.1115 CCCC(=O)OCOCC(OC)OC 34a_100011216393_100000034017 [0,2,0,0,0,0|1,0,1]=4 5895 B13R0.1115 CCCC(=O)OCSCC(OC)OC 62a_100000751394_100000034017 [0,2,0,0,0,0|1,0,1]=4 5896 B13R0.1115 CCCC(C)CCCOC(CC)CC 7a_100011713154_100000210505 [0,2,0,0,0,0|2,0,0]=4 5897 B13R0.1115 CCCC(C)CCOCC(CC)CC 34a_100011217855_100011215472 [0,2,0,0,0,0|2,0,0]=4 5898 B13R0.1115 CCCC(C)CCOCC(CC)CC 7a_100011217855_100011215472 [0,2,0,0,0,0|2,0,0]=4 5899 B13R0.1115 CCCC(C)CCOCC(OC)OC 34a_100011217855_100000211822 [0,2,0,0,0,0|0,0,0]=2 5900 B13R0.1115 CCCC(C)CCOCC(OC)OC 7a_100011217855_100000751394 [0,2,0,0,0,0|0,0,0]=2 5901 B13R0.1115 CCCC(C)COCCC(OC)OC 34a_100000688023_100000139399 [0,2,0,0,0,0|0,0,0]=2 5902 B13R0.1115 CCCC(C)COCCC(OC)OC 7a_100000688023_100009813347 [0,2,0,0,0,0|0,0,0]=2 5903 B13R0.1115 CCCC(C)CSCCC(OC)OC 62a_100000139399_100011216630 [0,2,0,0,0,0|0,0,0]=2 5904 B13R0.1115 CCCC(C)CSCCC(OC)OC 62a_100011216630_100000139399 [0,2,0,0,0,0|0,0,0]=2 5905 B13R0.1115 CCCC(C)NCCCC(OC)OC 2230a_100000741246_100000069011 [0,2,0,0,0,0|0,0,0]=2 5906 B13R0.1115 CCCC(C)NCCCC(OC)OC 270004a_100000034021_100000211909 [0,2,0,0,0,0|0,0,0]=2 5907 B13R0.1115 CCCC(C)OCCCC(OC)OC 34a_100000764384_100000069011 [0,2,0,0,0,0|0,0,0]=2 5908 B13R0.1115 CCCC(C)OCCCC(OC)OC 7a_100000764384_100000069011 [0,2,0,0,0,0|0,0,0]=2 5909 B13R0.1115 CCCC(C)SCCCC(OC)OC 62a_100000069011_100000766640 [0,2,0,0,0,0|0,0,0]=2 5910 B13R0.1115 CCCC(C)SCCCC(OC)OC 62a_100000766640_100000069011 [0,2,0,0,0,0|0,0,0]=2 5911 B13R0.1115 CCC[C@H](N)CCOCC(CC)CC 34a_100015193777_100011215472 [0,2,0,0,0,0|2,0,0]=4 5912 B13R0.1115 CCC[C@H](N)CCOCC(OC)OC 34a_100015193777_100000211822 [0,2,0,0,0,0|0,0,0]=2 5913 B13R0.1115 CCC[C@H](N)COCCC(OC)OC 34a_100000732646_100000139399 [0,2,0,0,0,0|0,0,0]=2 5914 B13R0.1115 CCNC(=O)CCNCC(OC)OC 270004a_100025743525_100000752162 [0,2,0,0,0,0|1,0,1]=4 5915 B13R0.1115 CCNC(=O)CCNCC(OC)OC 34a_100025743525_100000211822 [0,2,0,0,0,0|1,0,1]=4 5916 B13R0.1115 CCNC(=O)CCSCC(OC)OC 62a_100000737597_100000751394 [0,2,0,0,0,0|1,0,1]=4 5917 B13R0.1115 CCNC(=O)CCSCC(OC)OC 62a_100000751394_100000737597 [0,2,0,0,0,0|1,0,1]=4 5918 B13R0.1115 CCNC(=O)CNCCC(OC)OC 2230a_100016988866_100009813347 [0,2,0,0,0,0|1,0,1]=4 5919 B13R0.1115 CCNC(=O)CSCCC(OC)OC 62a_100000139399_100000183381 [0,2,0,0,0,0|1,0,1]=4 5920 B13R0.1115 CCNC(=O)CSCCC(OC)OC 62a_100000183381_100000139399 [0,2,0,0,0,0|1,0,1]=4 5921 B13R0.1115 CCNC(=O)NCCCC(OC)OC 2708a_100000034021_100015525214 [0,2,0,0,0,0|1,0,1]=4 5922 B13R0.1115 CCNC(=O)NCCCC(OC)OC 273464a_100000034021_100015525214 [0,2,0,0,0,0|1,0,1]=4 5923 B13R0.1115 CCNC(=O)NCCCC(OC)OC 273464a_100015525214_100000034021 [0,2,0,0,0,0|1,0,1]=4 5924 B13R0.1115 CCNC(=O)NCCCC(OC)OC 512a_100000034021_100015525214 [0,2,0,0,0,0|1,0,1]=4 5925 B13R0.1115 CCNC(=O)NCCCC(OC)OC 512a_100015525214_100000034021 [0,2,0,0,0,0|1,0,1]=4 5926 B13R0.1115 CCOC(=O)CCOCC(OC)OC 34a_100011216393_100000765890 [0,2,0,0,0,0|1,0,1]=4 5927 B13R0.1115 CCOC(=O)CCSCC(OC)OC 62a_100000751394_100000765890 [0,2,0,0,0,0|1,0,1]=4 5928 B13R0.1115 CCOC(=O)CCSCC(OC)OC 62a_100000765890_100000751394 [0,2,0,0,0,0|1,0,1]=4 5929 B13R0.1115 CCOC(=O)CSCCC(OC)OC 62a_100000139399_100000188475 [0,2,0,0,0,0|1,0,1]=4 5930 B13R0.1115 CCOC(=O)CSCCC(OC)OC 62a_100000188475_100000139399 [0,2,0,0,0,0|1,0,1]=4 5931 B13R0.1115 COC(CCCNC(=O)CCO)OC 240690a_100000034021_100011216618 [0,2,0,0,0,0|1,0,1]=4 5932 B13R0.1115 COC(CCCNC(=O)CSC)OC 11a_100000034021_100000184570 [0,2,0,0,0,0|1,0,1]=4 5933 B13R0.1115 COC(CCCNC(=O)CSC)OC 1626a_100000034021_100000184570 [0,2,0,0,0,0|1,0,1]=4 5934 B13R0.1115 COC(CCCNC(=O)CSC)OC 240690a_100000034021_100000184570 [0,2,0,0,0,0|1,0,1]=4 5935 B13R0.1115 COC(CCCNC(=O)CSC)OC 527a_100000034021_100000184570 [0,2,0,0,0,0|1,0,1]=4 5936 B13R0.1115 COC(CCCNC(C)CSC)OC 270004a_100000034021_100011216314 [0,2,0,0,0,0|1,0,0]=3 5937 B13R0.1115 COC(CCCN[C@@H](C)CC#N)OC 2230a_100016994482_100000069011 [0,2,0,0,0,0|1,0,1]=4 5938 B13R0.1115 COC(CCCN[C@H](C)CCO)OC 2230a_100000706166_100000069011 [0,2,0,0,0,0|1,0,0]=3 5939 B13R0.1115 COC(CCCN[C@H](C)CCO)OC 34a_100000706166_100000069011 [0,2,0,0,0,0|1,0,0]=3 5940 B13R0.1115 COC(CCCOC(C)CCBr)OC 34a_100012276601_100000069011 [0,2,0,0,0,0|1,0,0]=3 5941 B13R0.1115 COC(CCCSC(C)CC#N)OC 62a_100000069011_100009813641 [0,2,0,0,0,0|1,0,1]=4 5942 B13R0.1115 COC(CCCSC(C)CC#N)OC 62a_100009813641_100000069011 [0,2,0,0,0,0|1,0,1]=4 5943 B13R0.1115 COC(CCCSC(C)CCO)OC 62a_100000069011_100009893172 [0,2,0,0,0,0|1,0,0]=3 5944 B13R0.1115 COC(CCCSC(C)CCO)OC 62a_100009893172_100000069011 [0,2,0,0,0,0|1,0,0]=3 5945 B13R0.1115 COC(CCOCC(C)CCN)OC 34a_106354213184_100000139399 [0,2,0,0,0,0|1,0,0]=3 5946 B13R0.1115 COC(CCSC[C@@H](O)CC#N)OC 62a_100000001066_100000139399 [0,2,0,0,0,0|1,0,1]=4 5947 B13R0.1115 COC(CCSC[C@@H](O)CC#N)OC 62a_100000139399_100000001066 [0,2,0,0,0,0|1,0,1]=4 5948 B13R0.1115 COCC(=O)NCCCC(OC)OC 11a_100000034021_100000210968 [0,2,0,0,0,0|1,0,1]=4 5949 B13R0.1115 COCC(=O)NCCCC(OC)OC 1626a_100000034021_100000210968 [0,2,0,0,0,0|1,0,1]=4 5950 B13R0.1115 COCC(=O)NCCCC(OC)OC 240690a_100000034021_100000210968 [0,2,0,0,0,0|1,0,1]=4 5951 B13R0.1115 COCC(=O)NCCCC(OC)OC 527a_100000034021_100000210968 [0,2,0,0,0,0|1,0,1]=4 5952 B13R0.1115 COCC(C)NCCCC(OC)OC 270004a_100000034021_100000749346 [0,2,0,0,0,0|1,0,0]=3 5953 B13R0.1115 COCC(C)SCCCC(OC)OC 62a_100000069011_100000765312 [0,2,0,0,0,0|1,0,0]=3 5954 B13R0.1115 COCC(C)SCCCC(OC)OC 62a_100000765312_100000069011 [0,2,0,0,0,0|1,0,0]=3 5955 B13R0.1115 COCC(N)COCCC(OC)OC 34a_100000724102_100000139399 [0,2,0,0,0,0|1,0,0]=3 5956 B13R0.1115 COCC(O)CNCCC(OC)OC 2230a_100000756049_100009813347 [0,2,0,0,0,0|1,0,0]=3 5957 B13R0.1115 COCC(O)CNCCC(OC)OC 34a_100000756049_100000139399 [0,2,0,0,0,0|1,0,0]=3 5958 B13R0.1115 COCC(O)CSCCC(OC)OC 62a_100000139399_100011215053 [0,2,0,0,0,0|1,0,0]=3 5959 B13R0.1115 COCC(O)CSCCC(OC)OC 62a_100011215053_100000139399 [0,2,0,0,0,0|1,0,0]=3 5960 B13R0.1115 COC[C@@H](C)NCCCC(OC)OC 2230a_100000764878_100000069011 [0,2,0,0,0,0|1,0,0]=3 5961 B13R0.1115 COC[C@@H](C)OCCCC(OC)OC 34a_100011934205_100000069011 [0,2,0,0,0,0|1,0,0]=3 5962 B13R0.1120 C=C(Br)CCOCCCC(OC)OC 34a_100009813270_100000069011 [0,2,0,0,0,0|0,0,2]=4 5963 B13R0.1120 C=C(C)CCOCCCC(OC)OC 34a_100000764851_100000069011 [0,2,0,0,0,0|0,0,1]=3 5964 B13R0.1120 C=C(C)CCSCCCC(OC)OC 62a_100000069011_100000730704 [0,2,0,0,0,0|0,0,1]=3 5965 B13R0.1120 C=C(C)CCSCCCC(OC)OC 62a_100000730704_100000069011 [0,2,0,0,0,0|0,0,1]=3 5966 B13R0.1120 CCC(CC)CNCCCCC(C)C 2230a_100102946423_100011216152 [0,2,0,0,0,0|2,0,0]=4 5967 B13R0.1120 CCC(CC)COCCCCC(C)C 34a_100011214890_100011215472 [0,2,0,0,0,0|2,0,0]=4 5968 B13R0.1120 CCC(CC)COCCCCC(C)C 7a_100000703878_100011216152 [0,2,0,0,0,0|2,0,0]=4 5969 B13R0.1120 CCC(CC)COCCCCC(C)C 7a_100011214890_100011215472 [0,2,0,0,0,0|2,0,0]=4 5970 B13R0.1120 CCC(CC)CSCCCCC(C)C 62a_100011215472_100011216152 [0,2,0,0,0,0|2,0,0]=4 5971 B13R0.1120 CCC(CC)CSCCCCC(C)C 62a_100011216152_100011215472 [0,2,0,0,0,0|2,0,0]=4 5972 B13R0.1120 CCC(CC)NCCCCCC(C)C 2230a_100000199018_100000210682 [0,2,0,0,0,0|2,0,0]=4 5973 B13R0.1120 CCC(CC)NCCCCCC(C)C 270004a_100011290863_100000210860 [0,2,0,0,0,0|2,0,0]=4 5974 B13R0.1120 CCC(CC)OCCCCCC(C)C 7a_100000688536_100000210682 [0,2,0,0,0,0|2,0,0]=4 5975 B13R0.1120 CCC(CC)OCCCCCC(C)C 7a_100011995859_100000210505 [0,2,0,0,0,0|2,0,0]=4 5976 B13R0.1120 CCC(CC)SCCCCCC(C)C 62a_100000210505_100000210682 [0,2,0,0,0,0|2,0,0]=4 5977 B13R0.1120 CCC(CC)SCCCCCC(C)C 62a_100000210682_100000210505 [0,2,0,0,0,0|2,0,0]=4 5978 B13R0.1120 CCC(COCCCCC(=O)C)OC 34a_100011934954_100009817362 [0,2,0,0,0,0|1,0,1]=4 5979 B13R0.1120 CCC(COCCCCC(=O)C)OC 7a_100011934954_100000735457 [0,2,0,0,0,0|1,0,1]=4 5980 B13R0.1120 CCC(COCCCCC(C)C)OC 34a_100011934954_100011216152 [0,2,0,0,0,0|1,0,0]=3 5981 B13R0.1120 CCC(COCCCCC(C)C)OC 7a_100011934954_100011216152 [0,2,0,0,0,0|1,0,0]=3 5982 B13R0.1120 COC(CCCNCC=C(C)C)OC 34a_100000718196_100000069011 [0,2,0,0,0,0|0,0,2]=4 5983 B13R0.1120 COC(CCCNCCC(C)O)OC 2230a_200000755665_100000069011 [0,2,0,0,0,0|0,0,0]=2 5984 B13R0.1120 COC(CCCOCC=C(C)C)OC 34a_100000753907_100000069011 [0,2,0,0,0,0|0,0,2]=4 5985 B13R0.1120 COC(CCCOCCC(=O)C)OC 34a_100000759926_100000069011 [0,2,0,0,0,0|0,0,1]=3 5986 B13R0.1120 COC(CCCOCCC(=O)C)OC 7a_100000759926_100000069011 [0,2,0,0,0,0|0,0,1]=3 5987 B13R0.1120 COC(CCCOCCC(=O)N)OC 34a_100000757172_100000069011 [0,2,0,0,0,0|1,0,1]=4 5988 B13R0.1120 COC(CCCOCCC(=O)N)OC 7a_100000757172_100000069011 [0,2,0,0,0,0|1,0,1]=4 5989 B13R0.1120 COC(CCCOCCC(C)Br)OC 34a_100009893172_100000069011 [0,2,0,0,0,0|0,0,0]=2 5990 B13R0.1120 COC(CCCOCCC(C)C)OC 34a_100000210254_100000069011 [0,2,0,0,0,0|0,0,0]=2 5991 B13R0.1120 COC(CCCOCCC(C)C)OC 7a_100000210254_100000069011 [0,2,0,0,0,0|0,0,0]=2 5992 B13R0.1120 COC(CCCOCCC(F)F)OC 34a_100103093639_100000069011 [0,2,0,0,0,0|1,0,0]=3 5993 B13R0.1120 COC(CCCOCC[C@@H](C)N)OC 34a_100000706166_100000069011 [0,2,0,0,0,0|0,0,0]=2 5994 B13R0.1120 COC(CCCSCC=C(C)C)OC 62a_100000069011_100000761012 [0,2,0,0,0,0|0,0,2]=4 5995 B13R0.1120 COC(CCCSCC=C(C)C)OC 62a_100000761012_100000069011 [0,2,0,0,0,0|0,0,2]=4 5996 B13R0.1120 COC(CCCSCCC(=O)C)OC 62a_100000053229_100000069011 [0,2,0,0,0,0|0,0,1]=3 5997 B13R0.1120 COC(CCCSCCC(=O)C)OC 62a_100000069011_100000053229 [0,2,0,0,0,0|0,0,1]=3 5998 B13R0.1120 COC(CCCSCCC(=O)N)OC 62a_100000069011_100000744528 [0,2,0,0,0,0|1,0,1]=4 5999 B13R0.1120 COC(CCCSCCC(=O)N)OC 62a_100000744528_100000069011 [0,2,0,0,0,0|1,0,1]=4 6000 B13R0.1120 COC(CCCSCCC(C)C)OC 62a_100000069011_100000210312 [0,2,0,0,0,0|0,0,0]=2 6001 B13R0.1120 COC(CCCSCCC(C)C)OC 62a_100000210312_100000069011 [0,2,0,0,0,0|0,0,0]=2 6002 B13R0.1120 COC(CCCSCCC(C)O)OC 62a_100000069011_100012276601 [0,2,0,0,0,0|0,0,0]=2 6003 B13R0.1120 COC(CCCSCCC(C)O)OC 62a_100012276601_100000069011 [0,2,0,0,0,0|0,0,0]=2 6004 B13R0.1120 COC(CCCSCCN(C)C)OC 62a_100000069011_100000755713 [0,2,0,0,0,0|1,0,0]=3 6005 B13R0.1120 COC(CCCSCOC(=O)C)OC 62a_100000069011_100000076356 [0,2,0,0,0,0|1,0,1]=4 6006 B13R0.1120 COC(CCCSCOC(=O)C)OC 62a_100000076356_100000069011 [0,2,0,0,0,0|1,0,1]=4 6007 B13R0.1120 COC(CCCSCOC(C)C)OC 62a_100000069011_100000709892 [0,2,0,0,0,0|1,0,0]=3 6008 B13R0.1120 COC(CCCSCOC(C)C)OC 62a_100000709892_100000069011 [0,2,0,0,0,0|1,0,0]=3 6009 B13R0.1120 COC(CCNCCCC(=O)N)OC 34a_100000739312_100000139399 [0,2,0,0,0,0|1,0,1]=4 6010 B13R0.1120 COC(CCNCCCC(C)C)OC 2230a_200000737386_100009813347 [0,2,0,0,0,0|0,0,0]=2 6011 B13R0.1120 COC(CCNCCCC(C)C)OC 34a_200000737386_100000139399 [0,2,0,0,0,0|0,0,0]=2 6012 B13R0.1120 COC(CCNCCCS(=O)C)OC 2230a_200000753449_100009813347 [0,2,0,0,0,0|1,0,0]=3 6013 B13R0.1120 COC(CCNCCNC(=O)C)OC 2230a_100000209853_100009813347 [0,2,0,0,0,0|1,0,1]=4 6014 B13R0.1120 COC(CCNCCOC(C)C)OC 2230a_100000701111_100009813347 [0,2,0,0,0,0|1,0,0]=3 6015 B13R0.1120 COC(CCNCCOC(C)C)OC 34a_100000701111_100000139399 [0,2,0,0,0,0|1,0,0]=3 6016 B13R0.1120 COC(CCNCCSC(C)C)OC 2230a_100000731138_100009813347 [0,2,0,0,0,0|1,0,0]=3 6017 B13R0.1120 COC(CCNCCSC(C)C)OC 34a_100000731138_100000139399 [0,2,0,0,0,0|1,0,0]=3 6018 B13R0.1120 COC(CCOCCCC(=O)C)OC 34a_100000759063_100000139399 [0,2,0,0,0,0|0,0,1]=3 6019 B13R0.1120 COC(CCOCCCC(=O)C)OC 7a_100000759063_100009813347 [0,2,0,0,0,0|0,0,1]=3 6020 B13R0.1120 COC(CCOCCCC(C)C)OC 34a_100000210774_100000139399 [0,2,0,0,0,0|0,0,0]=2 6021 B13R0.1120 COC(CCOCCCC(C)C)OC 7a_100000210774_100009813347 [0,2,0,0,0,0|0,0,0]=2 6022 B13R0.1120 COC(CCOCCC[N+](=O)[O-])OC 34a_200000037920_100000139399 [0,2,0,0,0,0|2,0,0]=4 6023 B13R0.1120 COC(CCOCCNC(=O)C)OC 34a_100000158858_100000139399 [0,2,0,0,0,0|1,0,1]=4 6024 B13R0.1120 COC(CCOCCNC(C)C)OC 34a_100000224655_100000139399 [0,2,0,0,0,0|1,0,0]=3 6025 B13R0.1120 COC(CCOCCOC(C)C)OC 34a_100000211219_100000139399 [0,2,0,0,0,0|1,0,0]=3 6026 B13R0.1120 COC(CCOCCOC(C)C)OC 7a_100000211219_100009813347 [0,2,0,0,0,0|1,0,0]=3 6027 B13R0.1120 COC(CCOCCSC(C)C)OC 34a_200011212901_100000139399 [0,2,0,0,0,0|1,0,0]=3 6028 B13R0.1120 COC(CCOCCSC(C)C)OC 7a_200011212901_100009813347 [0,2,0,0,0,0|1,0,0]=3 6029 B13R0.1120 COC(CCSCCC=C(C)C)OC 62a_100000139399_100011217483 [0,2,0,0,0,0|0,0,2]=4 6030 B13R0.1120 COC(CCSCCC=C(C)C)OC 62a_100011217483_100000139399 [0,2,0,0,0,0|0,0,2]=4 6031 B13R0.1120 COC(CCSCCCC(=O)C)OC 62a_100000139399_100011215641 [0,2,0,0,0,0|0,0,1]=3 6032 B13R0.1120 COC(CCSCCCC(=O)C)OC 62a_100011215641_100000139399 [0,2,0,0,0,0|0,0,1]=3 6033 B13R0.1120 COC(CCSCCCC(=O)N)OC 62a_100000139399_100102525003 [0,2,0,0,0,0|1,0,1]=4 6034 B13R0.1120 COC(CCSCCCC(=O)N)OC 62a_100102525003_100000139399 [0,2,0,0,0,0|1,0,1]=4 6035 B13R0.1120 COC(CCSCCCC(C)C)OC 62a_100000139399_100011214892 [0,2,0,0,0,0|0,0,0]=2 6036 B13R0.1120 COC(CCSCCCC(C)C)OC 62a_100011214892_100000139399 [0,2,0,0,0,0|0,0,0]=2 6037 B13R0.1120 COC(CCSCCCC(C)O)OC 62a_100000139399_200000718107 [0,2,0,0,0,0|0,0,0]=2 6038 B13R0.1120 COC(CCSCCCC(C)O)OC 62a_200000718107_100000139399 [0,2,0,0,0,0|0,0,0]=2 6039 B13R0.1120 COC(CCSCCCN(C)C)OC 62a_100000139399_100000757444 [0,2,0,0,0,0|1,0,0]=3 6040 B13R0.1120 COC(CCSCCNC(=O)C)OC 62a_100000139399_100000189650 [0,2,0,0,0,0|1,0,1]=4 6041 B13R0.1120 COC(CCSCCNC(=O)C)OC 62a_100000189650_100000139399 [0,2,0,0,0,0|1,0,1]=4 6042 B13R0.1120 COC(CCSCCOC(=O)C)OC 62a_100000139399_100009814007 [0,2,0,0,0,0|1,0,1]=4 6043 B13R0.1120 COC(CCSCCOC(=O)C)OC 62a_100009814007_100000139399 [0,2,0,0,0,0|1,0,1]=4 6044 B13R0.1120 COC(CCSCCOC(C)C)OC 62a_100000139399_100000211751 [0,2,0,0,0,0|1,0,0]=3 6045 B13R0.1120 COC(CCSCCOC(C)C)OC 62a_100000211751_100000139399 [0,2,0,0,0,0|1,0,0]=3 6046 B13R0.1120 COC(CCSCCSC(C)C)OC 62a_100000139399_100000730970 [0,2,0,0,0,0|1,0,0]=3 6047 B13R0.1120 COC(CCSCCSC(C)C)OC 62a_100000730970_100000139399 [0,2,0,0,0,0|1,0,0]=3 6048 B13R0.1120 COC(CNCCCCC(=O)N)OC 270004a_100000696515_100000752162 [0,2,0,0,0,0|1,0,1]=4 6049 B13R0.1120 COC(CNCCCCC(=O)N)OC 34a_100000696515_100000211822 [0,2,0,0,0,0|1,0,1]=4 6050 B13R0.1120 COC(CNCCCNC(=O)C)OC 270004a_100000736810_100000752162 [0,2,0,0,0,0|1,0,1]=4 6051 B13R0.1120 COC(CNCCCNC(=O)C)OC 34a_100000736810_100000211822 [0,2,0,0,0,0|1,0,1]=4 6052 B13R0.1120 COC(CNCCCOC(C)C)OC 2230a_100000737246_100000751394 [0,2,0,0,0,0|1,0,0]=3 6053 B13R0.1120 COC(CNCCCOC(C)C)OC 270004a_100000737246_100000752162 [0,2,0,0,0,0|1,0,0]=3 6054 B13R0.1120 COC(CNCCCOC(C)C)OC 34a_100000737246_100000211822 [0,2,0,0,0,0|1,0,0]=3 6055 B13R0.1120 COC(COCCCCB(O)O)OC 34a_100011216393_200009817182 [0,2,0,0,0,0|2,0,0]=4 6056 B13R0.1120 COC(COCCCCC(=O)C)OC 34a_100011216393_100009817362 [0,2,0,0,0,0|0,0,1]=3 6057 B13R0.1120 COC(COCCCCC(=O)N)OC 34a_100012022536_100000211822 [0,2,0,0,0,0|1,0,1]=4 6058 B13R0.1120 COC(COCCCCC(=O)N)OC 7a_100012022536_100000751394 [0,2,0,0,0,0|1,0,1]=4 6059 B13R0.1120 COC(COCCCCC(C)C)OC 34a_100011214890_100000211822 [0,2,0,0,0,0|0,0,0]=2 6060 B13R0.1120 COC(COCCCCC(C)C)OC 34a_100011216393_100011216152 [0,2,0,0,0,0|0,0,0]=2 6061 B13R0.1120 COC(COCCCCC(C)C)OC 7a_100011214890_100000751394 [0,2,0,0,0,0|0,0,0]=2 6062 B13R0.1120 COC(COCCCC[N+](=O)[O-])OC 34a_200015379883_100000211822 [0,2,0,0,0,0|2,0,0]=4 6063 B13R0.1120 COC(COCCCC[N+](=O)[O-])OC 7a_200015379883_100000751394 [0,2,0,0,0,0|2,0,0]=4 6064 B13R0.1120 COC(COCCCNC(=O)C)OC 34a_100000752032_100000211822 [0,2,0,0,0,0|1,0,1]=4 6065 B13R0.1120 COC(COCCCNC(C)C)OC 34a_100000182298_100000211822 [0,2,0,0,0,0|1,0,0]=3 6066 B13R0.1120 COC(COCCCOC(=O)C)OC 34a_100011216393_100000042594 [0,2,0,0,0,0|1,0,1]=4 6067 B13R0.1120 COC(COCCCOC(=S)C)OC 34a_100011216393_200135323944 [0,2,0,0,0,0|1,0,1]=4 6068 B13R0.1120 COC(COCCCSC(=O)C)OC 34a_100011216393_100000038929 [0,2,0,0,0,0|1,0,1]=4 6069 B13R0.1120 COC(COCCNCC(C)C)OC 270004a_100000692409_100000210432 [0,2,0,0,0,0|1,0,0]=3 6070 B13R0.1120 COC(COCCNCC(C)C)OC 34a_100015185251_100000211822 [0,2,0,0,0,0|1,0,0]=3 6071 B13R0.1120 COC(COCCOCC(C)C)OC 34a_100000703358_100000211822 [0,2,0,0,0,0|1,0,0]=3 6072 B13R0.1120 COC(COCCOCC(C)C)OC 7a_100000703358_100000751394 [0,2,0,0,0,0|1,0,0]=3 6073 B13R0.1120 COC(COCCOCC(F)F)OC 34a_100000704375_100000211822 [0,2,0,0,0,0|2,0,0]=4 6074 B13R0.1120 COC(COCCOCC(F)F)OC 34a_100011216393_200012177212 [0,2,0,0,0,0|2,0,0]=4 6075 B13R0.1120 COC(COCCOCC(F)F)OC 7a_100000704375_100000751394 [0,2,0,0,0,0|2,0,0]=4 6076 B13R0.1120 COC(COCCSCC(C)C)OC 34a_200000230437_100000211822 [0,2,0,0,0,0|1,0,0]=3 6077 B13R0.1120 COC(COCCSCC(C)C)OC 7a_200000230437_100000751394 [0,2,0,0,0,0|1,0,0]=3 6078 B13R0.1120 COC(CSCCCCB(O)O)OC 62a_100000751394_200009817182 [0,2,0,0,0,0|2,0,0]=4 6079 B13R0.1120 COC(CSCCCCB(O)O)OC 62a_200009817182_100000751394 [0,2,0,0,0,0|2,0,0]=4 6080 B13R0.1120 COC(CSCCCCC(=O)C)OC 62a_100000735457_100000751394 [0,2,0,0,0,0|0,0,1]=3 6081 B13R0.1120 COC(CSCCCCC(=O)C)OC 62a_100000751394_100000735457 [0,2,0,0,0,0|0,0,1]=3 6082 B13R0.1120 COC(CSCCCCC(C)C)OC 62a_100000751394_100011216152 [0,2,0,0,0,0|0,0,0]=2 6083 B13R0.1120 COC(CSCCCCC(C)C)OC 62a_100011216152_100000751394 [0,2,0,0,0,0|0,0,0]=2 6084 B13R0.1120 COC(CSCCCCN(C)C)OC 62a_100000751394_100000690147 [0,2,0,0,0,0|1,0,0]=3 6085 B13R0.1120 COC(CSCCCOC(=O)C)OC 62a_100000042594_100000751394 [0,2,0,0,0,0|1,0,1]=4 6086 B13R0.1120 COC(CSCCCOC(=O)C)OC 62a_100000751394_100000042594 [0,2,0,0,0,0|1,0,1]=4 6087 B13R0.1120 COC(CSCCCOC(=S)C)OC 62a_100000751394_200135323944 [0,2,0,0,0,0|1,0,1]=4 6088 B13R0.1120 COC(CSCCCOC(=S)C)OC 62a_200135323944_100000751394 [0,2,0,0,0,0|1,0,1]=4 6089 B13R0.1120 COC(CSCCCSC(=O)C)OC 62a_100000038929_100000751394 [0,2,0,0,0,0|1,0,1]=4 6090 B13R0.1120 COC(CSCCCSC(=O)C)OC 62a_100000751394_100000038929 [0,2,0,0,0,0|1,0,1]=4 6091 B13R0.1120 COC(CSCCOCC(F)F)OC 62a_100000751394_200012177212 [0,2,0,0,0,0|2,0,0]=4 6092 B13R0.1120 COC(CSCCOCC(F)F)OC 62a_200012177212_100000751394 [0,2,0,0,0,0|2,0,0]=4 6093 B13R0.1339 C#CCCCCNCC(C)(OC)OC 2230a_100000706060_100000064154 [0,2,0,0,0,0|0,0,2]=4 6094 B13R0.1339 C#CCCCCNCC(C)(OC)OC 2230a_100000732740_100010269958 [0,2,0,0,0,0|0,0,2]=4 6095 B13R0.1339 C#CCCCCNCC(C)(OC)OC 34a_100000706060_100000766008 [0,2,0,0,0,0|0,0,2]=4 6096 B13R0.1339 C#CCCCCOCC(C)(OC)OC 34a_100000766709_100000766008 [0,2,0,0,0,0|0,0,2]=4 6097 B13R0.1339 C#CCCCCSCC(C)(OC)OC 62a_100000766008_100010269958 [0,2,0,0,0,0|0,0,2]=4 6098 B13R0.1339 C#CCCCCSCC(C)(OC)OC 62a_100010269958_100000766008 [0,2,0,0,0,0|0,0,2]=4 6099 B13R0.1339 C=CCCCCNCC(C)(OC)OC 2230a_100000703577_100000064154 [0,2,0,0,0,0|0,0,2]=4 6100 B13R0.1339 C=CCCCCNCC(C)(OC)OC 2230a_100000732740_100011215482 [0,2,0,0,0,0|0,0,2]=4 6101 B13R0.1339 C=CCCCCNCC(C)(OC)OC 34a_100000703577_100000766008 [0,2,0,0,0,0|0,0,2]=4 6102 B13R0.1339 C=CCCCCOCC(C)(OC)OC 34a_100000766645_100000766008 [0,2,0,0,0,0|0,0,2]=4 6103 B13R0.1339 C=CCCCCSCC(C)(OC)OC 62a_100000766008_100011215482 [0,2,0,0,0,0|0,0,2]=4 6104 B13R0.1339 C=CCCCCSCC(C)(OC)OC 62a_100011215482_100000766008 [0,2,0,0,0,0|0,0,2]=4 6105 B13R0.1339 CC/C=C\CCNCC(C)(OC)OC 2230a_100000732740_100015370543 [0,2,0,0,0,0|0,0,2]=4 6106 B13R0.1339 CC/C=C\CCOCC(C)(OC)OC 34a_100016288707_100000766008 [0,2,0,0,0,0|0,0,2]=4 6107 B13R0.1339 CC/C=C\CCSCC(C)(OC)OC 62a_100000766008_100015370543 [0,2,0,0,0,0|0,0,2]=4 6108 B13R0.1339 CC/C=C\CCSCC(C)(OC)OC 62a_100015370543_100000766008 [0,2,0,0,0,0|0,0,2]=4 6109 B13R0.1339 CC=CCCCOCC(C)(OC)OC 34a_100020645299_100000766008 [0,2,0,0,0,0|0,0,2]=4 6110 B13R0.1339 CCC#CCCOCC(C)(OC)OC 34a_100000036655_100000766008 [0,2,0,0,0,0|0,0,2]=4 6111 B13R0.1339 CCC/C=C/COCC(C)(OC)OC 34a_100016278788_100000766008 [0,2,0,0,0,0|0,0,2]=4 6112 B13R0.1339 CCCC#CCOCC(C)(OC)OC 34a_100000034806_100000766008 [0,2,0,0,0,0|0,0,2]=4 6113 B13R0.1339 CCCCCCCOC(C)(CC)CC 7a_100000210272_100009817345 [0,2,0,0,0,0|2,0,0]=4 6114 B13R0.1339 CCCCCCCOC(C)(CC)CC 7a_100000755174_100000210614 [0,2,0,0,0,0|2,0,0]=4 6115 B13R0.1339 CCCCCCCSC(C)(CC)CC 62a_100000210614_100009817345 [0,2,0,0,0,0|2,0,0]=4 6116 B13R0.1339 CCCCCCCSC(C)(CC)CC 62a_100009817345_100000210316 [0,2,0,0,0,0|2,0,0]=4 6117 B13R0.1339 CCCCCCNCC(C)(OC)OC 2230a_100000210581_100000064154 [0,2,0,0,0,0|0,0,0]=2 6118 B13R0.1339 CCCCCCNCC(C)(OC)OC 2230a_100000732740_100000210314 [0,2,0,0,0,0|0,0,0]=2 6119 B13R0.1339 CCCCCCOCC(C)(OC)OC 34a_100000210259_100000766008 [0,2,0,0,0,0|0,0,0]=2 6120 B13R0.1339 CCCCCCOCP(=O)(OC)OC 34a_100000101693_100000210314 [0,2,0,0,0,0|1,0,0]=3 6121 B13R0.1339 CCCCCCSCC(C)(OC)OC 62a_100000210314_100000766008 [0,2,0,0,0,0|0,0,0]=2 6122 B13R0.1339 CCCCCCSCC(C)(OC)OC 62a_100000766008_100000210757 [0,2,0,0,0,0|0,0,0]=2 6123 B13R0.1339 CCCCCCSC[Si](C)(OC)OC 62a_100000067953_100000210757 [0,2,0,0,0,0|0,1,0]=3 6124 B13R0.1339 CCCCCCSC[Si](C)(OC)OC 62a_100000210314_100000067953 [0,2,0,0,0,0|0,1,0]=3 6125 B13R0.1339 CCCCCOCCP(=O)(OC)OC 34a_200000043213_100000718602 [0,2,0,0,0,0|1,0,0]=3 6126 B13R0.1339 CCCCNCCC[Si](C)(OC)OC 7a_106832991798_100000031653 [0,2,0,0,0,0|0,1,0]=3 6127 B13R0.1339 CCCCOCCC[Si](C)(OC)OC 34a_100000210227_100000031653 [0,2,0,0,0,0|0,1,0]=3 6128 B13R0.1339 CCCCOCCC[Si](C)(OC)OC 7a_100000210227_100000031653 [0,2,0,0,0,0|0,1,0]=3 6129 B13R0.1339 CCCCOCNCC(C)(OC)OC 2230a_100000732740_100011995733 [0,2,0,0,0,0|1,0,0]=3 6130 B13R0.1339 CCCCOCOCP(=O)(OC)OC 34a_100000101693_100011995733 [0,2,0,0,0,0|2,0,0]=4 6131 B13R0.1339 CCCCOCSCC(C)(OC)OC 62a_100000766008_100011995733 [0,2,0,0,0,0|1,0,0]=3 6132 B13R0.1339 CCCCOCSCC(C)(OC)OC 62a_100011995733_100000766008 [0,2,0,0,0,0|1,0,0]=3 6133 B13R0.1339 CCCCOCSC[Si](C)(OC)OC 62a_100000067953_100011995733 [0,2,0,0,0,0|1,1,0]=4 6134 B13R0.1339 CCCCOCSC[Si](C)(OC)OC 62a_100011995733_100000067953 [0,2,0,0,0,0|1,1,0]=4 6135 B13R0.1339 CCCCSCCC[Si](C)(OC)OC 62a_100000031653_100000210210 [0,2,0,0,0,0|0,1,0]=3 6136 B13R0.1339 CCCCSCCC[Si](C)(OC)OC 62a_100000210211_100000031653 [0,2,0,0,0,0|0,1,0]=3 6137 B13R0.1339 CCCOCCNCC(C)(OC)OC 2230a_100000732740_100011215938 [0,2,0,0,0,0|1,0,0]=3 6138 B13R0.1339 CCCOCCNCC(C)(OC)OC 2230a_100161115042_100000064154 [0,2,0,0,0,0|1,0,0]=3 6139 B13R0.1339 CCCOCCNCC(C)(OC)OC 34a_100161115042_100000766008 [0,2,0,0,0,0|1,0,0]=3 6140 B13R0.1339 CCCOCCOCC(C)(OC)OC 34a_100000752267_100000766008 [0,2,0,0,0,0|1,0,0]=3 6141 B13R0.1339 CCCOCCOCP(=O)(OC)OC 34a_100000101693_100011215938 [0,2,0,0,0,0|2,0,0]=4 6142 B13R0.1339 CCCOCCSCC(C)(OC)OC 62a_100000766008_100011215938 [0,2,0,0,0,0|1,0,0]=3 6143 B13R0.1339 CCCOCCSCC(C)(OC)OC 62a_100011215938_100000766008 [0,2,0,0,0,0|1,0,0]=3 6144 B13R0.1339 CCCOCCSC[Si](C)(OC)OC 62a_100000067953_100011215938 [0,2,0,0,0,0|1,1,0]=4 6145 B13R0.1339 CCCOCCSC[Si](C)(OC)OC 62a_100011215938_100000067953 [0,2,0,0,0,0|1,1,0]=4 6146 B13R0.1339 CCCSCCNCC(C)(OC)OC 2230a_100020603323_100000064154 [0,2,0,0,0,0|1,0,0]=3 6147 B13R0.1339 CCCSCCOCC(C)(OC)OC 34a_200000230433_100000766008 [0,2,0,0,0,0|1,0,0]=3 6148 B13R0.1339 CCOCCCNCC(C)(OC)OC 2230a_100000210961_100000064154 [0,2,0,0,0,0|1,0,0]=3 6149 B13R0.1339 CCOCCCNCC(C)(OC)OC 2230a_100000732740_100012232248 [0,2,0,0,0,0|1,0,0]=3 6150 B13R0.1339 CCOCCCNCC(C)(OC)OC 34a_100000210961_100000766008 [0,2,0,0,0,0|1,0,0]=3 6151 B13R0.1339 CCOCCCOCC(C)(OC)OC 34a_100000757476_100000766008 [0,2,0,0,0,0|1,0,0]=3 6152 B13R0.1339 CCOCCCOCP(=O)(OC)OC 34a_100000101693_100012232248 [0,2,0,0,0,0|2,0,0]=4 6153 B13R0.1339 CCOCCCSCC(C)(OC)OC 62a_100000766008_100012232248 [0,2,0,0,0,0|1,0,0]=3 6154 B13R0.1339 CCOCCCSCC(C)(OC)OC 62a_100012232248_100000766008 [0,2,0,0,0,0|1,0,0]=3 6155 B13R0.1339 CCOCCCSC[Si](C)(OC)OC 62a_100000067953_100012232248 [0,2,0,0,0,0|1,1,0]=4 6156 B13R0.1339 CCOCCCSC[Si](C)(OC)OC 62a_100012232248_100000067953 [0,2,0,0,0,0|1,1,0]=4 6157 B13R0.1339 CCOCCOCCP(=O)(OC)OC 34a_200000043213_100000210147 [0,2,0,0,0,0|2,0,0]=4 6158 B13R0.1339 CCOCSCCC[Si](C)(OC)OC 62a_100000031653_100000739092 [0,2,0,0,0,0|1,1,0]=4 6159 B13R0.1339 CCOCSCCC[Si](C)(OC)OC 62a_100000739092_100000031653 [0,2,0,0,0,0|1,1,0]=4 6160 B13R0.1339 CCSCCCOCC(C)(OC)OC 34a_100011216438_100000766008 [0,2,0,0,0,0|1,0,0]=3 6161 B13R0.1339 CCSCCOCCP(=O)(OC)OC 34a_200000043213_100000757381 [0,2,0,0,0,0|2,0,0]=4 6162 B13R0.1339 COC(C)(CNCCCCC#N)OC 2230a_100000732740_100000211819 [0,2,0,0,0,0|1,0,1]=4 6163 B13R0.1339 COC(C)(CNCCCCC=O)OC 2230a_100000732740_100000139335 [0,2,0,0,0,0|1,0,1]=4 6164 B13R0.1339 COC(C)(CNCCCCCF)OC 2230a_100000732740_100000729378 [0,2,0,0,0,0|1,0,0]=3 6165 B13R0.1339 COC(C)(CNCCCCCO)OC 2230a_100000732740_100000746330 [0,2,0,0,0,0|1,0,0]=3 6166 B13R0.1339 COC(C)(CNCCCCCO)OC 2230a_100000762737_100000064154 [0,2,0,0,0,0|1,0,0]=3 6167 B13R0.1339 COC(C)(CNCCCCCO)OC 34a_100000762737_100000766008 [0,2,0,0,0,0|1,0,0]=3 6168 B13R0.1339 COC(C)(CNCCOCCO)OC 2230a_100000211614_100000064154 [0,2,0,0,0,0|2,0,0]=4 6169 B13R0.1339 COC(C)(CNCCOCCO)OC 2230a_100000732740_100011215305 [0,2,0,0,0,0|2,0,0]=4 6170 B13R0.1339 COC(C)(CNCCOCCO)OC 34a_100000211614_100000766008 [0,2,0,0,0,0|2,0,0]=4 6171 B13R0.1339 COC(C)(CNCCSCCO)OC 2230a_100011219999_100000064154 [0,2,0,0,0,0|2,0,0]=4 6172 B13R0.1339 COC(C)(COCCCCCBr)OC 34a_100000746331_100000766008 [0,2,0,0,0,0|1,0,0]=3 6173 B13R0.1339 COC(C)(COCCCCCCl)OC 34a_100000746330_100000766008 [0,2,0,0,0,0|1,0,0]=3 6174 B13R0.1339 COC(C)(COCCCCCI)OC 34a_200012148887_100000766008 [0,2,0,0,0,0|1,0,0]=3 6175 B13R0.1339 COC(C)(COCCCCCN)OC 34a_100000762737_100000766008 [0,2,0,0,0,0|1,0,0]=3 6176 B13R0.1339 COC(C)(COCCCCSC)OC 34a_100011217163_100000766008 [0,2,0,0,0,0|1,0,0]=3 6177 B13R0.1339 COC(C)(COCCOCCBr)OC 34a_100000692535_100000766008 [0,2,0,0,0,0|2,0,0]=4 6178 B13R0.1339 COC(C)(COCCOCCCl)OC 34a_100011215305_100000766008 [0,2,0,0,0,0|2,0,0]=4 6179 B13R0.1339 COC(C)(COCCOCCF)OC 34a_200015357709_100000766008 [0,2,0,0,0,0|2,0,0]=4 6180 B13R0.1339 COC(C)(COCCOCCI)OC 34a_100012149058_100000766008 [0,2,0,0,0,0|2,0,0]=4 6181 B13R0.1339 COC(C)(COCCOCCN)OC 34a_100000211614_100000766008 [0,2,0,0,0,0|2,0,0]=4 6182 B13R0.1339 COC(C)(CSCCCCC#N)OC 62a_100000766008_100000211819 [0,2,0,0,0,0|1,0,1]=4 6183 B13R0.1339 COC(C)(CSCCCCC#N)OC 62a_100011219923_100000766008 [0,2,0,0,0,0|1,0,1]=4 6184 B13R0.1339 COC(C)(CSCCCCC=O)OC 62a_100000139335_100000766008 [0,2,0,0,0,0|1,0,1]=4 6185 B13R0.1339 COC(C)(CSCCCCC=O)OC 62a_100000766008_100000139335 [0,2,0,0,0,0|1,0,1]=4 6186 B13R0.1339 COC(C)(CSCCCCCF)OC 62a_100000729378_100000766008 [0,2,0,0,0,0|1,0,0]=3 6187 B13R0.1339 COC(C)(CSCCCCCF)OC 62a_100000766008_100000729378 [0,2,0,0,0,0|1,0,0]=3 6188 B13R0.1339 COC(C)(CSCCCCCO)OC 62a_100000746330_100000766008 [0,2,0,0,0,0|1,0,0]=3 6189 B13R0.1339 COC(C)(CSCCCCCO)OC 62a_100000766008_100000746330 [0,2,0,0,0,0|1,0,0]=3 6190 B13R0.1339 COC(C)(CSCCOCCO)OC 62a_100000766008_100011215305 [0,2,0,0,0,0|2,0,0]=4 6191 B13R0.1339 COC(C)(CSCCOCCO)OC 62a_100011215305_100000766008 [0,2,0,0,0,0|2,0,0]=4 6192 B13R0.1339 COCCCCNCC(C)(OC)OC 2230a_100000732740_100000730899 [0,2,0,0,0,0|1,0,0]=3 6193 B13R0.1339 COCCCCOCC(C)(OC)OC 34a_100000740925_100000766008 [0,2,0,0,0,0|1,0,0]=3 6194 B13R0.1339 COCCCCOCP(=O)(OC)OC 34a_100000101693_100000755781 [0,2,0,0,0,0|2,0,0]=4 6195 B13R0.1339 COCCCCSCC(C)(OC)OC 62a_100000730899_100000766008 [0,2,0,0,0,0|1,0,0]=3 6196 B13R0.1339 COCCCCSCC(C)(OC)OC 62a_100000766008_100000730899 [0,2,0,0,0,0|1,0,0]=3 6197 B13R0.1339 COCCCCSC[Si](C)(OC)OC 62a_100000067953_100000730899 [0,2,0,0,0,0|1,1,0]=4 6198 B13R0.1339 COCCCCSC[Si](C)(OC)OC 62a_100000730899_100000067953 [0,2,0,0,0,0|1,1,0]=4 6199 B13R0.1339 COCCCOCCP(=O)(OC)OC 34a_200000043213_100000740836 [0,2,0,0,0,0|2,0,0]=4 6200 B13R0.1339 COCCOCCC[Si](C)(OC)OC 34a_100000210237_100000031653 [0,2,0,0,0,0|1,1,0]=4 6201 B13R0.1339 COCCOCNCC(C)(OC)OC 2230a_100000732740_100000231047 [0,2,0,0,0,0|2,0,0]=4 6202 B13R0.1339 COCCOCSCC(C)(OC)OC 62a_100000231047_100000766008 [0,2,0,0,0,0|2,0,0]=4 6203 B13R0.1339 COCCOCSCC(C)(OC)OC 62a_100000766008_100000231047 [0,2,0,0,0,0|2,0,0]=4 6204 B13R0.1339 COCCSCCC[Si](C)(OC)OC 62a_100000031653_100000233755 [0,2,0,0,0,0|1,1,0]=4 6205 B13R0.1339 COCCSCCC[Si](C)(OC)OC 62a_100000233755_100000031653 [0,2,0,0,0,0|1,1,0]=4 6206 B13R0.1339 COP(=O)(CCOCCCCF)OC 34a_200000043213_100000729493 [0,2,0,0,0,0|2,0,0]=4 6207 B13R0.1339 COP(=O)(CCOCCCCO)OC 34a_200000043213_100011216708 [0,2,0,0,0,0|2,0,0]=4 6208 B13R0.1339 COP(=O)(COCCCCCF)OC 34a_100000101693_100000729378 [0,2,0,0,0,0|2,0,0]=4 6209 B13R0.1339 COP(=O)(COCCCCCO)OC 34a_100000101693_100000746330 [0,2,0,0,0,0|2,0,0]=4 6210 B13R0.1339 CO[Si](C)(CCCNCCCF)OC 34a_100015189416_100000031653 [0,2,0,0,0,0|1,1,0]=4 6211 B13R0.1339 CO[Si](C)(CCCOCCCBr)OC 34a_100011217188_100000031653 [0,2,0,0,0,0|1,1,0]=4 6212 B13R0.1339 CO[Si](C)(CCCOCCCCl)OC 34a_100000230001_100000031653 [0,2,0,0,0,0|1,1,0]=4 6213 B13R0.1339 CO[Si](C)(CCCOCCCF)OC 34a_100000759539_100000031653 [0,2,0,0,0,0|1,1,0]=4 6214 B13R0.1339 CO[Si](C)(CCCOCCCN)OC 34a_100000182051_100000031653 [0,2,0,0,0,0|1,1,0]=4 6215 B13R0.1339 CO[Si](C)(CCCOCCSC)OC 34a_100000230434_100000031653 [0,2,0,0,0,0|1,1,0]=4 6216 B13R0.1339 CO[Si](C)(CCCOCCSC)OC 7a_100000230434_100000031653 [0,2,0,0,0,0|1,1,0]=4 6217 B13R0.1339 CO[Si](C)(CCCSCCCF)OC 62a_100000031653_100011934791 [0,2,0,0,0,0|1,1,0]=4 6218 B13R0.1339 CO[Si](C)(CCCSCCCF)OC 62a_100011934791_100000031653 [0,2,0,0,0,0|1,1,0]=4 6219 B13R0.1339 CO[Si](C)(CCCSCCCO)OC 62a_100000031653_100011215043 [0,2,0,0,0,0|1,1,0]=4 6220 B13R0.1339 CO[Si](C)(CCCSCCCO)OC 62a_100011215043_100000031653 [0,2,0,0,0,0|1,1,0]=4 6221 B13R0.1339 CO[Si](C)(CCCSCCSC)OC 62a_100000031653_100000751147 [0,2,0,0,0,0|1,1,0]=4 6222 B13R0.1339 CO[Si](C)(CCCSCCSC)OC 62a_100000212216_100000031653 [0,2,0,0,0,0|1,1,0]=4 6223 B13R0.1339 CO[Si](C)(CSCCCCCF)OC 62a_100000067953_100000729378 [0,2,0,0,0,0|1,1,0]=4 6224 B13R0.1339 CO[Si](C)(CSCCCCCF)OC 62a_100000729378_100000067953 [0,2,0,0,0,0|1,1,0]=4 6225 B13R0.1339 CO[Si](C)(CSCCCCCO)OC 62a_100000067953_100000746330 [0,2,0,0,0,0|1,1,0]=4 6226 B13R0.1339 CO[Si](C)(CSCCCCCO)OC 62a_100000746330_100000067953 [0,2,0,0,0,0|1,1,0]=4 6227 B13R0.10 CCC(C)CCNC(=O)C(OC)OC 11a_100020591266_100000046285 [0,2,0,0,0,0|1,0,1]=4 6228 B13R0.10 CCC(C)CCNC(=O)C(OC)OC 240690a_100020591266_100000046285 [0,2,0,0,0,0|1,0,1]=4 6229 B13R0.10 CCC(C)CCNC(=O)C(OC)OC 527a_100020591266_100000046285 [0,2,0,0,0,0|1,0,1]=4 6230 B13R0.10 CCC(C)CCNC(C)C(OC)OC 270004a_100020591266_100000211384 [0,2,0,0,0,0|1,0,0]=3 6231 B13R0.10 CCN(C)CCCC(=O)C(OC)OC 1458a_100000046285_100015186262 [0,2,0,0,0,0|1,0,1]=4 6232 B13R0.10 COC(OC)C(C)NCCC(C)CO 270004a_106354213184_100000211384 [0,2,0,0,0,0|2,0,0]=4 6233 B13R0.10 COC(OC)C(C)NCCC(C)CO 34a_106354213184_100011222894 [0,2,0,0,0,0|2,0,0]=4 6234 B13R0.20 CCCC(=O)COC(C)C(OC)OC 7a_100000754440_100000747444 [0,2,0,0,0,0|1,0,1]=4 6235 B13R0.20 CCCC(=O)CSC(C)C(OC)OC 62a_100000747444_100011222894 [0,2,0,0,0,0|1,0,1]=4 6236 B13R0.20 CCCC(=O)CSC(C)C(OC)OC 62a_100011222894_100000747444 [0,2,0,0,0,0|1,0,1]=4 6237 B13R0.20 CCCC(C)COC(C)C(OC)OC 34a_100000688023_100011222894 [0,2,0,0,0,0|1,0,0]=3 6238 B13R0.20 CCCC(C)COC(C)C(OC)OC 34a_100000754440_100011216630 [0,2,0,0,0,0|1,0,0]=3 6239 B13R0.20 CCCC(C)COC(C)C(OC)OC 7a_100000754440_100011216630 [0,2,0,0,0,0|1,0,0]=3 6240 B13R0.20 CCCC(C)CSC(C)C(OC)OC 62a_100011216630_100011222894 [0,2,0,0,0,0|1,0,0]=3 6241 B13R0.20 CCCC(C)CSC(C)C(OC)OC 62a_100011222894_100011216630 [0,2,0,0,0,0|1,0,0]=3 6242 B13R0.20 CCC[C@H](N)COC(C)C(OC)OC 34a_100000732646_100011222894 [0,2,0,0,0,0|1,0,0]=3 6243 B13R0.20 COC(OC)C(C)OCC(C)CCN 34a_106354213184_100011222894 [0,2,0,0,0,0|2,0,0]=4 6244 B13R0.20 COCC(N)COC(C)C(OC)OC 34a_100000724102_100011222894 [0,2,0,0,0,0|2,0,0]=4 6245 B13R0.20 COCC(O)CNC(C)C(OC)OC 270004a_100000756049_100000211384 [0,2,0,0,0,0|2,0,0]=4 6246 B13R0.20 COCC(O)CNC(C)C(OC)OC 34a_100000756049_100011222894 [0,2,0,0,0,0|2,0,0]=4 6247 B13R0.20 COCC(O)COC(C)C(OC)OC 34a_100000754440_100011215053 [0,2,0,0,0,0|2,0,0]=4 6248 B13R0.20 COCC(O)COC(C)C(OC)OC 7a_100000754440_100011215053 [0,2,0,0,0,0|2,0,0]=4 6249 B13R0.20 COCC(O)CSC(C)C(OC)OC 62a_100011215053_100011222894 [0,2,0,0,0,0|2,0,0]=4 6250 B13R0.20 COCC(O)CSC(C)C(OC)OC 62a_100011222894_100011215053 [0,2,0,0,0,0|2,0,0]=4 6251 B13R0.122 CCCCC(C)NC(=O)C(OC)OC 11a_100000126638_100000046285 [0,2,0,0,0,0|1,0,1]=4 6252 B13R0.122 CCCCC(C)NC(=O)C(OC)OC 240690a_100000126638_100000046285 [0,2,0,0,0,0|1,0,1]=4 6253 B13R0.122 CCCCC(C)NC(=O)C(OC)OC 527a_100000126638_100000046285 [0,2,0,0,0,0|1,0,1]=4 6254 B13R0.122 CCCCC(C)NC(C)C(OC)OC 270004a_100000126638_100000211384 [0,2,0,0,0,0|1,0,0]=3 6255 B13R0.122 CCCCC(C)OC(C)C(OC)OC 34a_100000687866_100011222894 [0,2,0,0,0,0|1,0,0]=3 6256 B13R0.122 CCCCC(C)OC(C)C(OC)OC 34a_100000754440_200011215066 [0,2,0,0,0,0|1,0,0]=3 6257 B13R0.122 CCCCC(C)OC(C)C(OC)OC 7a_100000754440_200011215066 [0,2,0,0,0,0|1,0,0]=3 6258 B13R0.122 CCCCC(C)SC(C)C(OC)OC 62a_100011222894_200011215066 [0,2,0,0,0,0|1,0,0]=3 6259 B13R0.122 CCCCC(C)SC(C)C(OC)OC 62a_200011215066_100011222894 [0,2,0,0,0,0|1,0,0]=3 6260 B13R0.122 CCOCC(C)OC(C)C(OC)OC 34a_100000718985_100011222894 [0,2,0,0,0,0|2,0,0]=4 6261 B13R0.122 COC(OC)C(C)OC(C)CCCCl 34a_200000718107_100011222894 [0,2,0,0,0,0|2,0,0]=4 6262 B13R0.421 CCCCCCN(C)C(CC)COC 270004a_106256046315_100000757811 [0,2,0,0,0,0|2,0,0]=4 6263 B13R0.1285 CCCCCC(C)C(=O)C(CC)OC 1458a_100000747056_200011218191 [0,2,0,0,0,0|1,0,1]=4 6264 B13R0.1285 CCCCCC(C)C(=O)C(OC)OC 1458a_100000046285_200011218191 [0,2,0,0,0,0|0,0,1]=3 6265 B13R0.1285 CCCCCN(C)C(=O)C(OC)OC 11a_100000223495_100000046285 [0,2,0,0,0,0|1,0,1]=4 6266 B13R0.1285 CCCCCN(C)C(=O)C(OC)OC 240690a_100000223495_100000046285 [0,2,0,0,0,0|1,0,1]=4 6267 B13R0.1285 CCCCCN(C)C(=O)C(OC)OC 527a_100000223495_100000046285 [0,2,0,0,0,0|1,0,1]=4 6268 B13R0.1285 CCCCCN(C)C(C)C(OC)OC 2230a_100012024948_100000210326 [0,2,0,0,0,0|1,0,0]=3 6269 B13R0.1285 CCCCCN(C)C(C)C(OC)OC 269982a_100012024948_100000210215 [0,2,0,0,0,0|1,0,0]=3 6270 B13R0.1285 CCCCCN(C)C(C)C(OC)OC 270004a_100000223495_100000211384 [0,2,0,0,0,0|1,0,0]=3 6271 B13R0.1285 CCOCCN(C)C(C)C(OC)OC 2230a_100012024948_100011215890 [0,2,0,0,0,0|2,0,0]=4 6272 B13R0.1285 CCOCCN(C)C(C)C(OC)OC 269982a_100012024948_100011215890 [0,2,0,0,0,0|2,0,0]=4 6273 B13R0.1285 CCSCCN(C)C(C)C(OC)OC 2230a_100012024948_100000757381 [0,2,0,0,0,0|2,0,0]=4 6274 B13R0.1285 CCSCCN(C)C(C)C(OC)OC 269982a_100012024948_100000757381 [0,2,0,0,0,0|2,0,0]=4 6275 B13R0.1285 COC(OC)C(C)N(C)CCCCF 2230a_100012024948_100000729493 [0,2,0,0,0,0|2,0,0]=4 6276 B13R0.1285 COC(OC)C(C)N(C)CCCCF 269982a_100012024948_100000729493 [0,2,0,0,0,0|2,0,0]=4 6277 B13R0.1285 COC(OC)C(C)N(C)CCCCO 2230a_100012024948_100000210776 [0,2,0,0,0,0|2,0,0]=4 6278 B13R0.1285 COC(OC)C(C)N(C)CCCCO 269982a_100012024948_100000210776 [0,2,0,0,0,0|2,0,0]=4 6279 B13R0.1285 COC(OC)C(C)N(C)CCCCO 270004a_100000717598_100000211384 [0,2,0,0,0,0|2,0,0]=4 6280 B13R0.1285 COCCCN(C)C(C)C(OC)OC 2230a_100012024948_100000740836 [0,2,0,0,0,0|2,0,0]=4 6281 B13R0.1285 COCCCN(C)C(C)C(OC)OC 269982a_100012024948_100000740836 [0,2,0,0,0,0|2,0,0]=4 6282 B13R0.1285 COCCCN(C)C(C)C(OC)OC 270004a_100000224831_100000211384 [0,2,0,0,0,0|2,0,0]=4 6283 B13R0.23 CCCC(C)CNCC(CC)OCC 2230a_100015183923_100011216630 [0,2,0,0,0,0|2,0,0]=4 6284 B13R0.23 CCCC(C)CNCC(CC)OCC 270004a_100015183923_100000243154 [0,2,0,0,0,0|2,0,0]=4 6285 B13R0.23 CCCC(C)CNCC(CC)OCC 34a_100015183923_100011216630 [0,2,0,0,0,0|2,0,0]=4 6286 B13R0.60 CCCCCCCN(CC)C(C)OC 269982a_100000228213_100009879195 [0,2,0,0,0,0|2,0,0]=4 6287 B13R0.60 CCCCCCNC(CC)C(=O)OC 2230a_100000210581_100000235869 [0,2,0,0,0,0|2,0,0]=4 6288 B13R0.60 CCCCCCOC(CC)C(=O)OC 34a_100000210259_100000235869 [0,2,0,0,0,0|2,0,0]=4 6289 B13R0.60 CCCCCCOC(CC)C(=O)OC 34a_100000695916_100000210314 [0,2,0,0,0,0|2,0,0]=4 6290 B13R0.60 CCCCCCOC(CC)C(=O)OC 7a_100000210259_100000742303 [0,2,0,0,0,0|2,0,0]=4 6291 B13R0.60 CCCCCCOC(CC)C(=O)OC 7a_100000695916_100000210314 [0,2,0,0,0,0|2,0,0]=4 6292 B13R0.60 CCCCCCOC(OC)C(=O)OC 34a_100000036821_100000210314 [0,2,0,0,0,0|1,0,0]=3 6293 B13R0.60 CCCCCCOC(OC)C(=O)OC 34a_100000210259_100000101307 [0,2,0,0,0,0|1,0,0]=3 6294 B13R0.60 CCCCCCSC(CC)C(=O)OC 62a_100000210314_100000235869 [0,2,0,0,0,0|2,0,0]=4 6295 B13R0.60 CCCCCCSC(CC)C(=O)OC 62a_100000235869_100000210757 [0,2,0,0,0,0|2,0,0]=4 6296 B13R0.60 CCCCCCSC(OC)C(=O)OC 62a_100000101307_100000210757 [0,2,0,0,0,0|1,0,0]=3 6297 B13R0.60 CCCCCCSC(OC)C(=O)OC 62a_100000210314_100000101307 [0,2,0,0,0,0|1,0,0]=3 6298 B13R0.60 CCCCOCOC(OC)C(=O)OC 34a_100000036821_100011995733 [0,2,0,0,0,0|2,0,0]=4 6299 B13R0.60 CCCCOCSC(OC)C(=O)OC 62a_100000101307_100011995733 [0,2,0,0,0,0|2,0,0]=4 6300 B13R0.60 CCCCOCSC(OC)C(=O)OC 62a_100011995733_100000101307 [0,2,0,0,0,0|2,0,0]=4 6301 B13R0.60 CCCOCCNC(OC)C(=O)OC 34a_100161115042_100000101307 [0,2,0,0,0,0|2,0,0]=4 6302 B13R0.60 CCCOCCOC(OC)C(=O)OC 34a_100000036821_100011215938 [0,2,0,0,0,0|2,0,0]=4 6303 B13R0.60 CCCOCCOC(OC)C(=O)OC 34a_100000752267_100000101307 [0,2,0,0,0,0|2,0,0]=4 6304 B13R0.60 CCCOCCSC(OC)C(=O)OC 62a_100000101307_100011215938 [0,2,0,0,0,0|2,0,0]=4 6305 B13R0.60 CCCOCCSC(OC)C(=O)OC 62a_100011215938_100000101307 [0,2,0,0,0,0|2,0,0]=4 6306 B13R0.60 CCCSCCOC(OC)C(=O)OC 34a_200000230433_100000101307 [0,2,0,0,0,0|2,0,0]=4 6307 B13R0.60 CCOCCCNC(OC)C(=O)OC 34a_100000210961_100000101307 [0,2,0,0,0,0|2,0,0]=4 6308 B13R0.60 CCOCCCOC(OC)C(=O)OC 34a_100000036821_100012232248 [0,2,0,0,0,0|2,0,0]=4 6309 B13R0.60 CCOCCCOC(OC)C(=O)OC 34a_100000757476_100000101307 [0,2,0,0,0,0|2,0,0]=4 6310 B13R0.60 CCOCCCSC(OC)C(=O)OC 62a_100000101307_100012232248 [0,2,0,0,0,0|2,0,0]=4 6311 B13R0.60 CCOCCCSC(OC)C(=O)OC 62a_100012232248_100000101307 [0,2,0,0,0,0|2,0,0]=4 6312 B13R0.60 CCSCCCOC(OC)C(=O)OC 34a_100011216438_100000101307 [0,2,0,0,0,0|2,0,0]=4 6313 B13R0.60 COC(=O)C(NCCCCCO)OC 34a_100000762737_100000101307 [0,2,0,0,0,0|2,0,0]=4 6314 B13R0.60 COC(=O)C(OC)OCCCCCBr 34a_100000746331_100000101307 [0,2,0,0,0,0|2,0,0]=4 6315 B13R0.60 COC(=O)C(OC)OCCCCCCl 34a_100000746330_100000101307 [0,2,0,0,0,0|2,0,0]=4 6316 B13R0.60 COC(=O)C(OC)OCCCCCF 34a_100000036821_100000729378 [0,2,0,0,0,0|2,0,0]=4 6317 B13R0.60 COC(=O)C(OC)OCCCCCI 34a_200012148887_100000101307 [0,2,0,0,0,0|2,0,0]=4 6318 B13R0.60 COC(=O)C(OC)OCCCCCN 34a_100000762737_100000101307 [0,2,0,0,0,0|2,0,0]=4 6319 B13R0.60 COC(=O)C(OC)OCCCCCO 34a_100000036821_100000746330 [0,2,0,0,0,0|2,0,0]=4 6320 B13R0.60 COC(=O)C(OC)OCCCCSC 34a_100011217163_100000101307 [0,2,0,0,0,0|2,0,0]=4 6321 B13R0.60 COC(=O)C(OC)SCCCCCF 62a_100000101307_100000729378 [0,2,0,0,0,0|2,0,0]=4 6322 B13R0.60 COC(=O)C(OC)SCCCCCF 62a_100000729378_100000101307 [0,2,0,0,0,0|2,0,0]=4 6323 B13R0.60 COC(=O)C(OC)SCCCCCO 62a_100000101307_100000746330 [0,2,0,0,0,0|2,0,0]=4 6324 B13R0.60 COC(=O)C(OC)SCCCCCO 62a_100000746330_100000101307 [0,2,0,0,0,0|2,0,0]=4 6325 B13R0.60 COCCCCOC(OC)C(=O)OC 34a_100000036821_100000755781 [0,2,0,0,0,0|2,0,0]=4 6326 B13R0.60 COCCCCOC(OC)C(=O)OC 34a_100000740925_100000101307 [0,2,0,0,0,0|2,0,0]=4 6327 B13R0.60 COCCCCSC(OC)C(=O)OC 62a_100000101307_100000730899 [0,2,0,0,0,0|2,0,0]=4 6328 B13R0.60 COCCCCSC(OC)C(=O)OC 62a_100000730899_100000101307 [0,2,0,0,0,0|2,0,0]=4 6329 B13R0.62 C=CC(CCCCCCC)OC(C)C 34a_200011934235_100000210206 [0,2,0,0,0,0|1,0,1]=4 6330 B13R0.62 C=CC(CCCCCCC)OC(C)C 7a_200011934235_100000210206 [0,2,0,0,0,0|1,0,1]=4 6331 B13R0.62 CCCCCCCC(CC(C)C)NC 270004a_106832991635_100011217263 [0,2,0,0,0,0|2,0,0]=4 6332 B13R0.62 CCCCCCCC(CC)OC(C)C 34a_200011217053_100000210206 [0,2,0,0,0,0|1,0,0]=3 6333 B13R0.62 CCCCCCCC(CC)OC(C)C 7a_200011217053_100000210206 [0,2,0,0,0,0|1,0,0]=3 6334 B13R0.63 CCCCCCCC(CCC)N(C)C 270004a_100102631434_200011216337 [0,2,0,0,0,0|2,0,0]=4 6335 B13R0.63 CCCCCCNC(COC)C(C)C 2230a_100000760233_100000210314 [0,2,0,0,0,0|2,0,0]=4 6336 B13R0.65 CCCCCCCC(CCC)NCC 270004a_100015525214_200011216337 [0,2,0,0,0,0|2,0,0]=4 6337 B13R0.65 CCCCCCNC(COC)COC 2230a_100011997029_100000210314 [0,2,0,0,0,0|1,0,0]=3 6338 B13R0.65 CCCCCCNC(COC)COC 270004a_100000210581_100000761750 [0,2,0,0,0,0|1,0,0]=3 6339 B13R0.65 CCCCCCOC(COC)COC 34a_100000766098_100000210314 [0,2,0,0,0,0|1,0,0]=3 6340 B13R0.65 CCCCCNCC(OCC)OCC 2230a_100000209983_100000210512 [0,2,0,0,0,0|1,0,0]=3 6341 B13R0.65 CCCCCNCC(OCC)OCC 34a_100000211098_100000718602 [0,2,0,0,0,0|1,0,0]=3 6342 B13R0.65 CCCCCOCC(OCC)OCC 34a_100000210253_100000210512 [0,2,0,0,0,0|1,0,0]=3 6343 B13R0.65 CCCCCOCC(OCC)OCC 34a_100011216334_100000718602 [0,2,0,0,0,0|1,0,0]=3 6344 B13R0.65 CCCCCOCC(OCC)OCC 7a_100000210253_100000210512 [0,2,0,0,0,0|1,0,0]=3 6345 B13R0.65 CCCCCOCC(OCC)OCC 7a_100011216334_100000210326 [0,2,0,0,0,0|1,0,0]=3 6346 B13R0.65 CCCCCSCC(OCC)OCC 62a_100000210326_100000210512 [0,2,0,0,0,0|1,0,0]=3 6347 B13R0.65 CCCCCSCC(OCC)OCC 62a_100000210512_100000210326 [0,2,0,0,0,0|1,0,0]=3 6348 B13R0.65 CCCCNCCC(OCC)OCC 2230a_100000102301_100000033671 [0,2,0,0,0,0|1,0,0]=3 6349 B13R0.65 CCCCNCCC(OCC)OCC 34a_100000748396_100000210210 [0,2,0,0,0,0|1,0,0]=3 6350 B13R0.65 CCCCNCCC(OCC)OCC 7a_106832991798_100000033671 [0,2,0,0,0,0|1,0,0]=3 6351 B13R0.65 CCCCOCCC(OCC)OCC 34a_100000210227_100000033671 [0,2,0,0,0,0|1,0,0]=3 6352 B13R0.65 CCCCOCCC(OCC)OCC 34a_100011218310_100000210210 [0,2,0,0,0,0|1,0,0]=3 6353 B13R0.65 CCCCOCCC(OCC)OCC 7a_100000210227_100000033671 [0,2,0,0,0,0|1,0,0]=3 6354 B13R0.65 CCCCOCCC(OCC)OCC 7a_100011218310_100000210211 [0,2,0,0,0,0|1,0,0]=3 6355 B13R0.65 CCCCOCNC(COC)COC 2230a_100011997029_100011995733 [0,2,0,0,0,0|2,0,0]=4 6356 B13R0.65 CCCCOCOC(COC)COC 34a_100000766098_100011995733 [0,2,0,0,0,0|2,0,0]=4 6357 B13R0.65 CCCCSCCC(OCC)OCC 62a_100000033671_100000210210 [0,2,0,0,0,0|1,0,0]=3 6358 B13R0.65 CCCCSCCC(OCC)OCC 62a_100000210211_100000033671 [0,2,0,0,0,0|1,0,0]=3 6359 B13R0.65 CCCNCCCC(OCC)OCC 34a_100000211155_100000210303 [0,2,0,0,0,0|1,0,0]=3 6360 B13R0.65 CCCOCCCC(OCC)OCC 34a_100000210258_100000034166 [0,2,0,0,0,0|1,0,0]=3 6361 B13R0.65 CCCOCCNC(COC)COC 2230a_100011997029_100011215938 [0,2,0,0,0,0|2,0,0]=4 6362 B13R0.65 CCCOCCNC(COC)COC 270004a_100161115042_100000761750 [0,2,0,0,0,0|2,0,0]=4 6363 B13R0.65 CCCOCCOC(COC)COC 34a_100000766098_100011215938 [0,2,0,0,0,0|2,0,0]=4 6364 B13R0.65 CCCSCCCC(OCC)OCC 62a_100000034166_100000210303 [0,2,0,0,0,0|1,0,0]=3 6365 B13R0.65 CCCSCCCC(OCC)OCC 62a_100000210303_100000034166 [0,2,0,0,0,0|1,0,0]=3 6366 B13R0.65 CCCSCCNC(COC)COC 270004a_100020603323_100000761750 [0,2,0,0,0,0|2,0,0]=4 6367 B13R0.65 CCOC(CCCNCCF)OCC 34a_100000211155_100011217306 [0,2,0,0,0,0|2,0,0]=4 6368 B13R0.65 CCOC(CCCNCCF)OCC 34a_100000724931_100000034166 [0,2,0,0,0,0|2,0,0]=4 6369 B13R0.65 CCOC(CCCNCCO)OCC 2230a_100016997473_100000034166 [0,2,0,0,0,0|2,0,0]=4 6370 B13R0.65 CCOC(CCCNCCO)OCC 34a_100000211155_100000211926 [0,2,0,0,0,0|2,0,0]=4 6371 B13R0.65 CCOC(CCCNCCO)OCC 34a_100016990907_100000034166 [0,2,0,0,0,0|2,0,0]=4 6372 B13R0.65 CCOC(CCCNCSC)OCC 34a_100000211155_100011218213 [0,2,0,0,0,0|2,0,0]=4 6373 B13R0.65 CCOC(CCCOCCBr)OCC 34a_100000211926_100000034166 [0,2,0,0,0,0|2,0,0]=4 6374 B13R0.65 CCOC(CCCOCCN)OCC 34a_100000210304_100000034166 [0,2,0,0,0,0|2,0,0]=4 6375 B13R0.65 CCOC(CCCSCCF)OCC 62a_100000034166_100011217306 [0,2,0,0,0,0|2,0,0]=4 6376 B13R0.65 CCOC(CCCSCCF)OCC 62a_100011217306_100000034166 [0,2,0,0,0,0|2,0,0]=4 6377 B13R0.65 CCOC(CCCSCCO)OCC 62a_100000034166_100000211926 [0,2,0,0,0,0|2,0,0]=4 6378 B13R0.65 CCOC(CCCSCCO)OCC 62a_100000211926_100000034166 [0,2,0,0,0,0|2,0,0]=4 6379 B13R0.65 CCOC(CCCSCOC)OCC 62a_100000034166_100000766300 [0,2,0,0,0,0|2,0,0]=4 6380 B13R0.65 CCOC(CCCSCOC)OCC 62a_100000766300_100000034166 [0,2,0,0,0,0|2,0,0]=4 6381 B13R0.65 CCOC(CCCSCSC)OCC 62a_100000034166_100011218213 [0,2,0,0,0,0|2,0,0]=4 6382 B13R0.65 CCOC(CCCSCSC)OCC 62a_100011218213_100000034166 [0,2,0,0,0,0|2,0,0]=4 6383 B13R0.65 CCOC(CCNCCCF)OCC 2230a_100015189416_100000033671 [0,2,0,0,0,0|2,0,0]=4 6384 B13R0.65 CCOC(CCNCCCF)OCC 34a_100000748396_100011934791 [0,2,0,0,0,0|2,0,0]=4 6385 B13R0.65 CCOC(CCNCCCF)OCC 34a_100015189416_100000033671 [0,2,0,0,0,0|2,0,0]=4 6386 B13R0.65 CCOC(CCNCCCO)OCC 34a_100000748396_100000230001 [0,2,0,0,0,0|2,0,0]=4 6387 B13R0.65 CCOC(CCNCCOC)OCC 2230a_100000209980_100000033671 [0,2,0,0,0,0|2,0,0]=4 6388 B13R0.65 CCOC(CCNCCOC)OCC 34a_100000748396_100011201679 [0,2,0,0,0,0|2,0,0]=4 6389 B13R0.65 CCOC(CCNCCSC)OCC 2230a_100020590264_100000033671 [0,2,0,0,0,0|2,0,0]=4 6390 B13R0.65 CCOC(CCNCCSC)OCC 34a_100000748396_100000212216 [0,2,0,0,0,0|2,0,0]=4 6391 B13R0.65 CCOC(CCOCCCBr)OCC 34a_100011217188_100000033671 [0,2,0,0,0,0|2,0,0]=4 6392 B13R0.65 CCOC(CCOCCCCl)OCC 34a_100000230001_100000033671 [0,2,0,0,0,0|2,0,0]=4 6393 B13R0.65 CCOC(CCOCCCF)OCC 34a_100000759539_100000033671 [0,2,0,0,0,0|2,0,0]=4 6394 B13R0.65 CCOC(CCOCCCF)OCC 34a_100011218310_100011934791 [0,2,0,0,0,0|2,0,0]=4 6395 B13R0.65 CCOC(CCOCCCF)OCC 7a_100011218310_100011934791 [0,2,0,0,0,0|2,0,0]=4 6396 B13R0.65 CCOC(CCOCCCN)OCC 34a_100000182051_100000033671 [0,2,0,0,0,0|2,0,0]=4 6397 B13R0.65 CCOC(CCOCCCO)OCC 34a_100011218310_100000230001 [0,2,0,0,0,0|2,0,0]=4 6398 B13R0.65 CCOC(CCOCCCO)OCC 7a_100011218310_100011215043 [0,2,0,0,0,0|2,0,0]=4 6399 B13R0.65 CCOC(CCOCCOC)OCC 34a_100000210237_100000033671 [0,2,0,0,0,0|2,0,0]=4 6400 B13R0.65 CCOC(CCOCCOC)OCC 34a_100011218310_100011201679 [0,2,0,0,0,0|2,0,0]=4 6401 B13R0.65 CCOC(CCOCCOC)OCC 7a_100011218310_100000233755 [0,2,0,0,0,0|2,0,0]=4 6402 B13R0.65 CCOC(CCOCCSC)OCC 34a_100000230434_100000033671 [0,2,0,0,0,0|2,0,0]=4 6403 B13R0.65 CCOC(CCOCCSC)OCC 34a_100011218310_100000212216 [0,2,0,0,0,0|2,0,0]=4 6404 B13R0.65 CCOC(CCOCCSC)OCC 7a_100000230434_100000033671 [0,2,0,0,0,0|2,0,0]=4 6405 B13R0.65 CCOC(CCOCCSC)OCC 7a_100011218310_100000212216 [0,2,0,0,0,0|2,0,0]=4 6406 B13R0.65 CCOC(CCSCCCF)OCC 62a_100000033671_100011934791 [0,2,0,0,0,0|2,0,0]=4 6407 B13R0.65 CCOC(CCSCCCF)OCC 62a_100011934791_100000033671 [0,2,0,0,0,0|2,0,0]=4 6408 B13R0.65 CCOC(CCSCCCO)OCC 62a_100000033671_100011215043 [0,2,0,0,0,0|2,0,0]=4 6409 B13R0.65 CCOC(CCSCCCO)OCC 62a_100011215043_100000033671 [0,2,0,0,0,0|2,0,0]=4 6410 B13R0.65 CCOC(CCSCCOC)OCC 62a_100000033671_100000233755 [0,2,0,0,0,0|2,0,0]=4 6411 B13R0.65 CCOC(CCSCCOC)OCC 62a_100000233755_100000033671 [0,2,0,0,0,0|2,0,0]=4 6412 B13R0.65 CCOC(CCSCCSC)OCC 62a_100000033671_100000751147 [0,2,0,0,0,0|2,0,0]=4 6413 B13R0.65 CCOC(CCSCCSC)OCC 62a_100000212216_100000033671 [0,2,0,0,0,0|2,0,0]=4 6414 B13R0.65 CCOC(CNCCCCF)OCC 34a_100000211098_100000729493 [0,2,0,0,0,0|2,0,0]=4 6415 B13R0.65 CCOC(CNCCCCO)OCC 2230a_100000750430_100000210512 [0,2,0,0,0,0|2,0,0]=4 6416 B13R0.65 CCOC(CNCCCCO)OCC 34a_100000211098_100011216708 [0,2,0,0,0,0|2,0,0]=4 6417 B13R0.65 CCOC(CNCCCCO)OCC 34a_100000750430_100000210512 [0,2,0,0,0,0|2,0,0]=4 6418 B13R0.65 CCOC(CNCCCOC)OCC 34a_100000211098_100000740836 [0,2,0,0,0,0|2,0,0]=4 6419 B13R0.65 CCOC(CNCCCOC)OCC 34a_100150723488_100000210512 [0,2,0,0,0,0|2,0,0]=4 6420 B13R0.65 CCOC(CNCCCSC)OCC 2230a_100000749238_100000210512 [0,2,0,0,0,0|2,0,0]=4 6421 B13R0.65 CCOC(CNCCSCC)OCC 2230a_100000106463_100000210512 [0,2,0,0,0,0|2,0,0]=4 6422 B13R0.65 CCOC(CNCCSCC)OCC 34a_100000211098_100000757381 [0,2,0,0,0,0|2,0,0]=4 6423 B13R0.65 CCOC(COCCCCBr)OCC 34a_100011216708_100000210512 [0,2,0,0,0,0|2,0,0]=4 6424 B13R0.65 CCOC(COCCCCCl)OCC 34a_100000210776_100000210512 [0,2,0,0,0,0|2,0,0]=4 6425 B13R0.65 CCOC(COCCCCCl)OCC 7a_100000210776_100000210512 [0,2,0,0,0,0|2,0,0]=4 6426 B13R0.65 CCOC(COCCCCF)OCC 34a_100011216334_100000729493 [0,2,0,0,0,0|2,0,0]=4 6427 B13R0.65 CCOC(COCCCCF)OCC 34a_100011995726_100000210512 [0,2,0,0,0,0|2,0,0]=4 6428 B13R0.65 CCOC(COCCCCF)OCC 7a_100011216334_100000729493 [0,2,0,0,0,0|2,0,0]=4 6429 B13R0.65 CCOC(COCCCCF)OCC 7a_100011995726_100000210512 [0,2,0,0,0,0|2,0,0]=4 6430 B13R0.65 CCOC(COCCCCI)OCC 34a_200012148704_100000210512 [0,2,0,0,0,0|2,0,0]=4 6431 B13R0.65 CCOC(COCCCCN)OCC 34a_100000750430_100000210512 [0,2,0,0,0,0|2,0,0]=4 6432 B13R0.65 CCOC(COCCCCO)OCC 34a_100011216334_100011216708 [0,2,0,0,0,0|2,0,0]=4 6433 B13R0.65 CCOC(COCCCCO)OCC 7a_100011216334_100000210776 [0,2,0,0,0,0|2,0,0]=4 6434 B13R0.65 CCOC(COCCCNC)OCC 34a_100000213112_100000210512 [0,2,0,0,0,0|2,0,0]=4 6435 B13R0.65 CCOC(COCCCOC)OCC 34a_100000740835_100000210512 [0,2,0,0,0,0|2,0,0]=4 6436 B13R0.65 CCOC(COCCCOC)OCC 34a_100011216334_100000740836 [0,2,0,0,0,0|2,0,0]=4 6437 B13R0.65 CCOC(COCCCOC)OCC 7a_100011216334_100000740836 [0,2,0,0,0,0|2,0,0]=4 6438 B13R0.65 CCOC(COCCCSC)OCC 34a_100000690336_100000210512 [0,2,0,0,0,0|2,0,0]=4 6439 B13R0.65 CCOC(COCCCSC)OCC 7a_100000690336_100000210512 [0,2,0,0,0,0|2,0,0]=4 6440 B13R0.65 CCOC(COCCSCC)OCC 34a_100000212035_100000210512 [0,2,0,0,0,0|2,0,0]=4 6441 B13R0.65 CCOC(COCCSCC)OCC 34a_100011216334_100000757381 [0,2,0,0,0,0|2,0,0]=4 6442 B13R0.65 CCOC(COCCSCC)OCC 7a_100000212035_100000210512 [0,2,0,0,0,0|2,0,0]=4 6443 B13R0.65 CCOC(COCCSCC)OCC 7a_100011216334_100000757381 [0,2,0,0,0,0|2,0,0]=4 6444 B13R0.65 CCOC(CSCCCCF)OCC 62a_100000210512_100000729493 [0,2,0,0,0,0|2,0,0]=4 6445 B13R0.65 CCOC(CSCCCCF)OCC 62a_100000729493_100000210512 [0,2,0,0,0,0|2,0,0]=4 6446 B13R0.65 CCOC(CSCCCCO)OCC 62a_100000210512_100000210776 [0,2,0,0,0,0|2,0,0]=4 6447 B13R0.65 CCOC(CSCCCCO)OCC 62a_100000210776_100000210512 [0,2,0,0,0,0|2,0,0]=4 6448 B13R0.65 CCOC(CSCCCOC)OCC 62a_100000210512_100000709357 [0,2,0,0,0,0|2,0,0]=4 6449 B13R0.65 CCOC(CSCCCOC)OCC 62a_100000709357_100000210512 [0,2,0,0,0,0|2,0,0]=4 6450 B13R0.65 CCOC(CSCCSCC)OCC 62a_100000210512_100000757381 [0,2,0,0,0,0|2,0,0]=4 6451 B13R0.65 CCOC(CSCCSCC)OCC 62a_100000757381_100000210512 [0,2,0,0,0,0|2,0,0]=4 6452 B13R0.65 CCOCCCNC(COC)COC 2230a_100011997029_100012232248 [0,2,0,0,0,0|2,0,0]=4 6453 B13R0.65 CCOCCCNC(COC)COC 270004a_100000210961_100000761750 [0,2,0,0,0,0|2,0,0]=4 6454 B13R0.65 CCOCCCOC(COC)COC 34a_100000766098_100012232248 [0,2,0,0,0,0|2,0,0]=4 6455 B13R0.65 CCOCCNCC(OCC)OCC 2230a_102516460346_100000210512 [0,2,0,0,0,0|2,0,0]=4 6456 B13R0.65 CCOCCNCC(OCC)OCC 34a_100000211098_100000210147 [0,2,0,0,0,0|2,0,0]=4 6457 B13R0.65 CCOCCNCC(OCC)OCC 34a_102516460346_100000210512 [0,2,0,0,0,0|2,0,0]=4 6458 B13R0.65 CCOCCOCC(OCC)OCC 34a_100000210136_100000210512 [0,2,0,0,0,0|2,0,0]=4 6459 B13R0.65 CCOCCOCC(OCC)OCC 34a_100011216334_100000210147 [0,2,0,0,0,0|2,0,0]=4 6460 B13R0.65 CCOCCOCC(OCC)OCC 7a_100000210136_100000210512 [0,2,0,0,0,0|2,0,0]=4 6461 B13R0.65 CCOCCOCC(OCC)OCC 7a_100011216334_100011215890 [0,2,0,0,0,0|2,0,0]=4 6462 B13R0.65 CCOCCSCC(OCC)OCC 62a_100000210147_100000210512 [0,2,0,0,0,0|2,0,0]=4 6463 B13R0.65 CCOCCSCC(OCC)OCC 62a_100000210512_100011215890 [0,2,0,0,0,0|2,0,0]=4 6464 B13R0.65 CCOCSCCC(OCC)OCC 62a_100000033671_100000739092 [0,2,0,0,0,0|2,0,0]=4 6465 B13R0.65 CCOCSCCC(OCC)OCC 62a_100000739092_100000033671 [0,2,0,0,0,0|2,0,0]=4 6466 B13R0.65 COCC(COC)NCCCCCF 2230a_100011997029_100000729378 [0,2,0,0,0,0|2,0,0]=4 6467 B13R0.65 COCC(COC)NCCCCCO 2230a_100011997029_100000746330 [0,2,0,0,0,0|2,0,0]=4 6468 B13R0.65 COCC(COC)NCCCCCO 270004a_100000762737_100000761750 [0,2,0,0,0,0|2,0,0]=4 6469 B13R0.65 COCC(COC)OCCCCCF 34a_100000766098_100000729378 [0,2,0,0,0,0|2,0,0]=4 6470 B13R0.65 COCC(COC)OCCCCCO 34a_100000766098_100000746330 [0,2,0,0,0,0|2,0,0]=4 6471 B13R0.65 COCCCCNC(COC)COC 2230a_100011997029_100000730899 [0,2,0,0,0,0|2,0,0]=4 6472 B13R0.65 COCCCCOC(COC)COC 34a_100000766098_100000755781 [0,2,0,0,0,0|2,0,0]=4 6473 B13R0.126 CCCCC(C)NCC(CC)OCC 2230a_100015183923_200011215066 [0,2,0,0,0,0|2,0,0]=4 6474 B13R0.126 CCCCC(C)NCC(CC)OCC 270004a_100015183923_100000210087 [0,2,0,0,0,0|2,0,0]=4 6475 B13R0.126 CCCCC(C)NCC(CC)OCC 34a_100015183923_200011215066 [0,2,0,0,0,0|2,0,0]=4 6476 B13R0.272 C#CCOC(C=C)CCCCCCC 34a_200011934235_100000184674 [0,2,0,0,0,0|1,0,1]=4 6477 B13R0.272 C#CCOC(C=C)CCCCCCC 7a_200011934235_100000038162 [0,2,0,0,0,0|1,0,1]=4 6478 B13R0.272 C#CCOC(CC)CCCCCCC 34a_200011217053_100000184674 [0,2,0,0,0,0|1,0,0]=3 6479 B13R0.272 C#CCOC(CC)CCCCCCC 7a_200011217053_100000038162 [0,2,0,0,0,0|1,0,0]=3 6480 B13R0.272 C=CC(CCCCCCC)OCC#N 7a_200011934235_100011215382 [0,2,0,0,0,0|1,0,1]=4 6481 B13R0.272 C=CC(CCCCCCC)OCC=O 34a_200011934235_200009817547 [0,2,0,0,0,0|1,0,1]=4 6482 B13R0.272 C=CC(CCCCCCC)OCC=O 7a_200011934235_200015260668 [0,2,0,0,0,0|1,0,1]=4 6483 B13R0.272 C=CC(CCCCCCC)OCCC 34a_200011934235_100000210303 [0,2,0,0,0,0|1,0,1]=4 6484 B13R0.272 C=CC(CCCCCCC)OCCC 7a_200011934235_100000210303 [0,2,0,0,0,0|1,0,1]=4 6485 B13R0.272 C=CC(CCCCCCC)OCCF 34a_200011934235_100011217306 [0,2,0,0,0,0|1,0,1]=4 6486 B13R0.272 C=CC(CCCCCCC)OCCF 7a_200011934235_100011217306 [0,2,0,0,0,0|1,0,1]=4 6487 B13R0.272 C=CC(CCCCCCC)OCCO 34a_200011934235_100000211926 [0,2,0,0,0,0|1,0,1]=4 6488 B13R0.272 C=CC(CCCCCCC)OCCO 7a_200011934235_100000211926 [0,2,0,0,0,0|1,0,1]=4 6489 B13R0.272 C=CC(CCCCCCC)OCSC 34a_200011934235_100011218213 [0,2,0,0,0,0|1,0,1]=4 6490 B13R0.272 C=CCNC(CC)CCCCCCC 270004a_100020586998_200011217162 [0,2,0,0,0,0|2,0,0]=4 6491 B13R0.272 C=CCOC(C=C)CCCCCCC 34a_200011934235_100015514636 [0,2,0,0,0,0|1,0,1]=4 6492 B13R0.272 C=CCOC(C=C)CCCCCCC 7a_200011934235_100015514636 [0,2,0,0,0,0|1,0,1]=4 6493 B13R0.272 C=CCOC(CC)CCCCCCC 34a_200011217053_100015514636 [0,2,0,0,0,0|1,0,0]=3 6494 B13R0.272 C=CCOC(CC)CCCCCCC 7a_200011217053_100015514636 [0,2,0,0,0,0|1,0,0]=3 6495 B13R0.272 CCCCCCCC(CC)NCCC 270004a_100020643023_200011217162 [0,2,0,0,0,0|2,0,0]=4 6496 B13R0.272 CCCCCCCC(CC)NCCO 270004a_100000210304_200011217162 [0,2,0,0,0,0|2,0,0]=4 6497 B13R0.272 CCCCCCCC(CC)OCC#N 7a_200011217053_100011215382 [0,2,0,0,0,0|1,0,0]=3 6498 B13R0.272 CCCCCCCC(CC)OCC=O 34a_200011217053_200009817547 [0,2,0,0,0,0|1,0,0]=3 6499 B13R0.272 CCCCCCCC(CC)OCC=O 7a_200011217053_200015260668 [0,2,0,0,0,0|1,0,0]=3 6500 B13R0.272 CCCCCCCC(CC)OCCC 34a_200011217053_100000210303 [0,2,0,0,0,0|1,0,0]=3 6501 B13R0.272 CCCCCCCC(CC)OCCC 7a_200011217053_100000210303 [0,2,0,0,0,0|1,0,0]=3 6502 B13R0.272 CCCCCCCC(CC)OCCF 34a_200011217053_100011217306 [0,2,0,0,0,0|1,0,0]=3 6503 B13R0.272 CCCCCCCC(CC)OCCF 7a_200011217053_100011217306 [0,2,0,0,0,0|1,0,0]=3 6504 B13R0.272 CCCCCCCC(CC)OCCO 34a_200011217053_100000211926 [0,2,0,0,0,0|1,0,0]=3 6505 B13R0.272 CCCCCCCC(CC)OCCO 7a_200011217053_100000211926 [0,2,0,0,0,0|1,0,0]=3 6506 B13R0.272 CCCCCCCC(CC)OCSC 34a_200011217053_100011218213 [0,2,0,0,0,0|1,0,0]=3 6507 B13R0.272 CCCCCCCC(CCCC)NC 270004a_106832991635_200011217844 [0,2,0,0,0,0|2,0,0]=4 6508 B13R0.272 CCCCCCCN(CC)CCOC 2230a_100000228213_100011201679 [0,2,0,0,0,0|2,0,0]=4 6509 B13R0.272 CCCCCCCN(CC)CCOC 2230a_100000731262_100000210681 [0,2,0,0,0,0|2,0,0]=4 6510 B13R0.272 CCCCCCCN(CC)CCOC 269982a_100000228213_100000233755 [0,2,0,0,0,0|2,0,0]=4 6511 B13R0.272 CCCCCCCN(CC)CCOC 269982a_100000731262_100000210681 [0,2,0,0,0,0|2,0,0]=4 6512 B13R0.272 CCCCCCCN(CC)COCC 269982a_100000228213_100000739092 [0,2,0,0,0,0|2,0,0]=4 6513 B13R0.1289 CCCCCC(C)NC(CC)COC 2230a_100000757820_200011218191 [0,2,0,0,0,0|2,0,0]=4 6514 B13R0.1289 CCCCCC(C)NC(CC)COC 270004a_100000211957_100000757811 [0,2,0,0,0,0|2,0,0]=4 6515 B13R0.1289 CCCCCC(C)NC(CC)COC 270004a_100000757820_100000211708 [0,2,0,0,0,0|2,0,0]=4 6516 B13R0.1289 CCCCCC(C)OC(CC)COC 7a_200011214946_200011218191 [0,2,0,0,0,0|2,0,0]=4 6517 B13R0.481 CCC(=O)COC(C)CC(OC)OC 7a_100011018202_100000747405 [0,2,0,0,0,0|1,0,1]=4 6518 B13R0.481 CCC(C)CCC(=O)CC(OC)OC 1458a_100000701222_100000751394 [0,2,0,0,0,0|0,0,1]=3 6519 B13R0.481 CCC(C)CNC(=O)CC(OC)OC 11a_100020588543_100000082724 [0,2,0,0,0,0|1,0,1]=4 6520 B13R0.481 CCC(C)CNC(=O)CC(OC)OC 1626a_100020588543_100000082724 [0,2,0,0,0,0|1,0,1]=4 6521 B13R0.481 CCC(C)CNC(=O)CC(OC)OC 240690a_100020588543_100000082724 [0,2,0,0,0,0|1,0,1]=4 6522 B13R0.481 CCC(C)CNC(=O)CC(OC)OC 527a_100020588543_100000082724 [0,2,0,0,0,0|1,0,1]=4 6523 B13R0.481 CCC(C)CNC(C)CC(OC)OC 270004a_100020588543_100000210484 [0,2,0,0,0,0|1,0,0]=3 6524 B13R0.481 CCC(C)COC(C)CC(OC)OC 7a_100011018202_100000748023 [0,2,0,0,0,0|1,0,0]=3 6525 B13R0.481 CCC(O)CNC(=O)CC(OC)OC 11a_100011218483_100000082724 [0,2,0,0,0,0|1,0,1]=4 6526 B13R0.481 CCC(O)CNC(=O)CC(OC)OC 240690a_100011218483_100000082724 [0,2,0,0,0,0|1,0,1]=4 6527 B13R0.481 CCC(O)CNC(=O)CC(OC)OC 527a_100011218483_100000082724 [0,2,0,0,0,0|1,0,1]=4 6528 B13R0.481 CCC(O)CNC(C)CC(OC)OC 270004a_100011218483_100000210484 [0,2,0,0,0,0|1,0,0]=3 6529 B13R0.481 CCC(O)COC(C)CC(OC)OC 7a_100011018202_100011218378 [0,2,0,0,0,0|1,0,0]=3 6530 B13R0.481 CCN(C)CCC(=O)CC(OC)OC 1458a_100000755305_100000751394 [0,2,0,0,0,0|1,0,1]=4 6531 B13R0.481 CCS(=O)CCC(=O)CC(OC)OC 1458a_100011387550_100000751394 [0,2,0,0,0,0|1,0,1]=4 6532 B13R0.481 CC[C@H](C)COC(C)CC(OC)OC 7a_100011018202_100009816398 [0,2,0,0,0,0|1,0,0]=3 6533 B13R0.481 COC(CC(C)NC[C@@H](C)OC)OC 270004a_100020591295_100000210484 [0,2,0,0,0,0|2,0,0]=4 6534 B13R0.481 COC(CC(C)NC[C@@H](F)CO)OC 270004a_100015665980_100000210484 [0,2,0,0,0,0|2,0,0]=4 6535 B13R0.481 COC(CC(C)OCC(O)CO)OC 7a_100011018202_100011219619 [0,2,0,0,0,0|2,0,0]=4 6536 B13R0.481 COC(CC(C)OC[C@@H](C)CO)OC 7a_100011018202_100000059175 [0,2,0,0,0,0|2,0,0]=4 6537 B13R0.481 COC(CC(C)OC[C@@H](O)CF)OC 7a_100011018202_100015614560 [0,2,0,0,0,0|2,0,0]=4 6538 B13R0.481 COC(CC(C)OC[C@@H](O)CO)OC 7a_100011018202_100009815848 [0,2,0,0,0,0|2,0,0]=4 6539 B13R0.963 CCC(C)CCNCC(C)(OC)OC 2230a_100020591266_100000064154 [0,2,0,0,0,0|1,0,0]=3 6540 B13R0.963 CCC(C)COCCP(=O)(OC)OC 34a_200000043213_100000748023 [0,2,0,0,0,0|2,0,0]=4 6541 B13R0.963 CCC(C)OCCC[Si](C)(OC)OC 7a_100000210228_100000031653 [0,2,0,0,0,0|1,1,0]=4 6542 B13R0.963 CCC(C)SCCC[Si](C)(OC)OC 62a_100000031653_100000758301 [0,2,0,0,0,0|1,1,0]=4 6543 B13R0.963 CCC(C)SCCC[Si](C)(OC)OC 62a_100000758301_100000031653 [0,2,0,0,0,0|1,1,0]=4 6544 B13R0.963 CCC(O)COCCP(=O)(OC)OC 34a_200000043213_100011218378 [0,2,0,0,0,0|2,0,0]=4 6545 B13R0.963 CC[C@H](C)COCCP(=O)(OC)OC 34a_200000043213_100009816398 [0,2,0,0,0,0|2,0,0]=4 6546 B13R0.963 COC(C)(CNCCC(C)CO)OC 2230a_106354213184_100000064154 [0,2,0,0,0,0|2,0,0]=4 6547 B13R0.963 COC(C)(CNCCC(C)CO)OC 34a_106354213184_100000766008 [0,2,0,0,0,0|2,0,0]=4 6548 B13R0.1127 CCC(C)(C)COCCC(OC)OC 7a_100000765029_100009813347 [0,2,0,0,0,0|1,0,0]=3 6549 B13R0.1127 CCC(C)(C)NCCCC(OC)OC 2230a_100000211385_100000069011 [0,2,0,0,0,0|1,0,0]=3 6550 B13R0.1127 CCC(C)(C)OCCCC(OC)OC 7a_100000210230_100000069011 [0,2,0,0,0,0|1,0,0]=3 6551 B13R0.1127 CCC(C)(C)SCCCC(OC)OC 62a_100000032637_100000069011 [0,2,0,0,0,0|1,0,0]=3 6552 B13R0.1127 CCC(C)(C)SCCCC(OC)OC 62a_100000069011_100000032637 [0,2,0,0,0,0|1,0,0]=3 6553 B13R0.1127 CCS(=O)(=O)CCNCC(OC)OC 2230a_100000751051_100000751394 [0,2,0,0,0,0|2,0,0]=4 6554 B13R0.1127 CCS(=O)(=O)CCNCC(OC)OC 270004a_100000751051_100000752162 [0,2,0,0,0,0|2,0,0]=4 6555 B13R0.1127 CCS(=O)(=O)CCNCC(OC)OC 34a_100000751051_100000211822 [0,2,0,0,0,0|2,0,0]=4 6556 B13R0.1127 CCS(=O)(=O)CCOCC(OC)OC 34a_100011216393_100000756660 [0,2,0,0,0,0|2,0,0]=4 6557 B13R0.1127 CCS(=O)(=O)CCOCC(OC)OC 34a_200011216379_100000211822 [0,2,0,0,0,0|2,0,0]=4 6558 B13R0.1127 CCS(=O)(=O)CCOCC(OC)OC 7a_200011216379_100000751394 [0,2,0,0,0,0|2,0,0]=4 6559 B13R0.1127 CCS(=O)(=O)CCSCC(OC)OC 62a_100000751394_100000756660 [0,2,0,0,0,0|2,0,0]=4 6560 B13R0.1127 CCS(=O)(=O)CCSCC(OC)OC 62a_100000756660_100000751394 [0,2,0,0,0,0|2,0,0]=4 6561 B13R0.1127 CCS(=O)(=O)NCCCC(OC)OC 274078a_100000034021_100000211323 [0,2,0,0,0,0|2,0,0]=4 6562 B13R0.1127 COC(CCCNC(C)(C)CO)OC 2230a_100000210608_100000069011 [0,2,0,0,0,0|2,0,0]=4 6563 B13R0.1127 COC(CCCOC(C)(C)CCl)OC 7a_100000764493_100000069011 [0,2,0,0,0,0|2,0,0]=4 6564 B13R0.1127 COC(CCCSC(F)(F)CO)OC 62a_100000069011_100011217949 [0,2,0,0,0,0|2,0,0]=4 6565 B13R0.1127 COC(CCCSC(F)(F)CO)OC 62a_100011217949_100000069011 [0,2,0,0,0,0|2,0,0]=4 6566 B13R0.1127 COC(CCNCC(C)(C)CO)OC 2230a_100020635058_100009813347 [0,2,0,0,0,0|2,0,0]=4 6567 B13R0.1127 COC(CCNCC(C)(C)OC)OC 2230a_100000763424_100009813347 [0,2,0,0,0,0|2,0,0]=4 6568 B13R0.1127 COC(CCOCC(C)(C)CCl)OC 7a_100011217199_100009813347 [0,2,0,0,0,0|2,0,0]=4 6569 B13R0.1127 COC(CCOCC(F)(F)CN)OC 34a_100000703232_100000139399 [0,2,0,0,0,0|2,0,0]=4 6570 B13R0.1127 COC(CCSCC(C)(C)CO)OC 62a_100000139399_100009813988 [0,2,0,0,0,0|2,0,0]=4 6571 B13R0.1127 COC(CCSCC(C)(C)CO)OC 62a_100009813988_100000139399 [0,2,0,0,0,0|2,0,0]=4 6572 B13R0.1127 COC(CCSCC(C)(C)OC)OC 62a_100000139399_100000701081 [0,2,0,0,0,0|2,0,0]=4 6573 B13R0.1127 COC(CCSCC(C)(C)OC)OC 62a_100000701081_100000139399 [0,2,0,0,0,0|2,0,0]=4 6574 B13R0.1127 COC(COCCC(C)(C)OC)OC 7a_100000699976_100000751394 [0,2,0,0,0,0|2,0,0]=4 6575 B13R0.1213 C#CC(CC)OCCCC(OC)OC 34a_100000758843_100000069011 [0,2,0,0,0,0|1,0,0]=3 6576 B13R0.1213 C#CC(CC)OCCCC(OC)OC 7a_100000758843_100000069011 [0,2,0,0,0,0|1,0,0]=3 6577 B13R0.1213 C=CC(CC)OCCCC(OC)OC 34a_100000766422_100000069011 [0,2,0,0,0,0|1,0,0]=3 6578 B13R0.1213 C=CC(CC)OCCCC(OC)OC 7a_100000766422_100000069011 [0,2,0,0,0,0|1,0,0]=3 6579 B13R0.1213 C=C[C@@H](CO)NCCCC(OC)OC 2230a_100016989147_100000069011 [0,2,0,0,0,0|2,0,0]=4 6580 B13R0.1213 C=C[C@@H](CO)NCCCC(OC)OC 34a_100016989147_100000069011 [0,2,0,0,0,0|2,0,0]=4 6581 B13R0.1213 CCC(CC)CNCCC(OC)OC 2230a_100102946423_100009813347 [0,2,0,0,0,0|1,0,0]=3 6582 B13R0.1213 CCC(CC)COCCC(OC)OC 7a_100000703878_100009813347 [0,2,0,0,0,0|1,0,0]=3 6583 B13R0.1213 CCC(CC)CSCCC(OC)OC 62a_100000139399_100011215472 [0,2,0,0,0,0|1,0,0]=3 6584 B13R0.1213 CCC(CC)CSCCC(OC)OC 62a_100011215472_100000139399 [0,2,0,0,0,0|1,0,0]=3 6585 B13R0.1213 CCC(CC)NCCCC(OC)OC 2230a_100000199018_100000069011 [0,2,0,0,0,0|1,0,0]=3 6586 B13R0.1213 CCC(CC)NCCCC(OC)OC 270004a_100000034021_100000210860 [0,2,0,0,0,0|1,0,0]=3 6587 B13R0.1213 CCC(CC)OCCCC(OC)OC 7a_100000688536_100000069011 [0,2,0,0,0,0|1,0,0]=3 6588 B13R0.1213 CCC(CC)SCCCC(OC)OC 62a_100000069011_100000210505 [0,2,0,0,0,0|1,0,0]=3 6589 B13R0.1213 CCC(CC)SCCCC(OC)OC 62a_100000210505_100000069011 [0,2,0,0,0,0|1,0,0]=3 6590 B13R0.1213 CCC(COCCC(OC)OC)OC 34a_100011934954_100000139399 [0,2,0,0,0,0|1,0,0]=3 6591 B13R0.1213 CCC(COCCC(OC)OC)OC 7a_100011934954_100009813347 [0,2,0,0,0,0|1,0,0]=3 6592 B13R0.1213 CCN(CC)CCNCC(OC)OC 2230a_100015382049_100000751394 [0,2,0,0,0,0|2,0,0]=4 6593 B13R0.1213 CCN(CC)CCNCC(OC)OC 270004a_100015382049_100000752162 [0,2,0,0,0,0|2,0,0]=4 6594 B13R0.1213 CCN(CC)CCOCC(OC)OC 7a_100016990331_100000751394 [0,2,0,0,0,0|2,0,0]=4 6595 B13R0.1213 CCN(CC)CCSCC(OC)OC 62a_100000751394_100000700428 [0,2,0,0,0,0|2,0,0]=4 6596 B13R0.1213 CCN(CC)COCCC(OC)OC 7a_200015374951_100009813347 [0,2,0,0,0,0|2,0,0]=4 6597 B13R0.1213 CC[C@@H](CO)NCCCC(OC)OC 2230a_100000709445_100000069011 [0,2,0,0,0,0|1,0,0]=3 6598 B13R0.1213 COC(CCCNC(CO)CO)OC 2230a_100000759517_100000069011 [0,2,0,0,0,0|2,0,0]=4 6599 B13R0.1213 COC(CCCOC(CCl)CCl)OC 7a_100000737055_100000069011 [0,2,0,0,0,0|2,0,0]=4 6600 B13R0.1213 COC(CCCOC(CF)CF)OC 34a_100000032261_100000069011 [0,2,0,0,0,0|2,0,0]=4 6601 B13R0.1213 COC(CCCOC(CF)CF)OC 7a_100000032261_100000069011 [0,2,0,0,0,0|2,0,0]=4 6602 B13R0.1213 COC(CCCOC(CN)CN)OC 34a_100000031598_100000069011 [0,2,0,0,0,0|2,0,0]=4 6603 B13R0.1213 COC(CCCO[C@@H](CF)CCl)OC 34a_100015614560_100000069011 [0,2,0,0,0,0|2,0,0]=4 6604 B13R0.1213 COC(CCCO[C@@H](CF)CCl)OC 7a_100015614560_100000069011 [0,2,0,0,0,0|2,0,0]=4 6605 B13R0.1213 COC(CCOCC(OC)OC)OC 34a_100011216393_100000139399 [0,2,0,0,0,0|2,0,0]=4 6606 B13R0.1213 COC(CCSCC(OC)OC)OC 62a_100000139399_100000751394 [0,2,0,0,0,0|2,0,0]=4 6607 B13R0.1213 COC(CCSCC(OC)OC)OC 62a_100000751394_100000139399 [0,2,0,0,0,0|2,0,0]=4 6608 B13R0.1220 CCC(=O)CC(=O)CCC(OC)OC 1458a_200000082759_100000747405 [0,2,0,0,0,0|0,0,2]=4 6609 B13R0.1220 CCC(C)CC(=O)CCC(OC)OC 1458a_100000708755_100000139399 [0,2,0,0,0,0|0,0,1]=3 6610 B13R0.1220 CCC(C)CC(=O)CCC(OC)OC 1458a_200000082759_100000748023 [0,2,0,0,0,0|0,0,1]=3 6611 B13R0.1220 CCC(C)CC(=O)NCC(OC)OC 11a_100000210479_100000708755 [0,2,0,0,0,0|1,0,1]=4 6612 B13R0.1220 CCC(C)CC(=O)NCC(OC)OC 1626a_100000210479_100000708755 [0,2,0,0,0,0|1,0,1]=4 6613 B13R0.1220 CCC(C)CC(=O)NCC(OC)OC 240690a_100000210479_100000708755 [0,2,0,0,0,0|1,0,1]=4 6614 B13R0.1220 CCC(C)CC(=O)NCC(OC)OC 527a_100000210479_100000708755 [0,2,0,0,0,0|1,0,1]=4 6615 B13R0.1220 CCC(C)CC(C)NCC(CC)OC 270004a_100000731041_100011710205 [0,2,0,0,0,0|2,0,0]=4 6616 B13R0.1220 CCC(C)CC(C)NCC(OC)OC 2230a_100000763565_100000751394 [0,2,0,0,0,0|1,0,0]=3 6617 B13R0.1220 CCC(C)CC(C)NCC(OC)OC 270004a_100000210479_100011710205 [0,2,0,0,0,0|1,0,0]=3 6618 B13R0.1220 CCC(C)CC(C)NCC(OC)OC 270004a_100000763565_100000752162 [0,2,0,0,0,0|1,0,0]=3 6619 B13R0.1220 CCC(C)CN(C)CCC(OC)OC 2230a_100000753921_100009813347 [0,2,0,0,0,0|1,0,0]=3 6620 B13R0.1220 CCC(C)CN(C)CCC(OC)OC 269982a_100000753921_100000139399 [0,2,0,0,0,0|1,0,0]=3 6621 B13R0.1220 CCC(C)NC(=O)CCC(OC)OC 11a_100000209981_200000082759 [0,2,0,0,0,0|1,0,1]=4 6622 B13R0.1220 CCC(C)NC(=O)CCC(OC)OC 1626a_100000209981_200000082759 [0,2,0,0,0,0|1,0,1]=4 6623 B13R0.1220 CCC(C)NC(=O)CCC(OC)OC 240690a_100000209981_200000082759 [0,2,0,0,0,0|1,0,1]=4 6624 B13R0.1220 CCC(C)NC(=O)CCC(OC)OC 527a_100000209981_200000082759 [0,2,0,0,0,0|1,0,1]=4 6625 B13R0.1220 CCC(O)CC(=O)CCC(OC)OC 1458a_100011667805_100000139399 [0,2,0,0,0,0|0,0,1]=3 6626 B13R0.1220 CCC(O)CC(=O)CCC(OC)OC 1458a_200000082759_100011218378 [0,2,0,0,0,0|0,0,1]=3 6627 B13R0.1220 CCC(O)CC(=O)NCC(OC)OC 1626a_100000210479_100011667805 [0,2,0,0,0,0|1,0,1]=4 6628 B13R0.1220 CCC(O)CC(=O)NCC(OC)OC 240690a_100000210479_100011667805 [0,2,0,0,0,0|1,0,1]=4 6629 B13R0.1220 CCN(C)CC(=O)CCC(OC)OC 1458a_100116209913_100000139399 [0,2,0,0,0,0|1,0,1]=4 6630 B13R0.1220 CC[C@H](C)CC(=O)CCC(OC)OC 1458a_200000082759_100009816398 [0,2,0,0,0,0|0,0,1]=3 6631 B13R0.1220 COC(CCC(=O)C[C@@H](C)CO)OC 1458a_200000082759_100000059175 [0,2,0,0,0,0|1,0,1]=4 6632 B13R0.1220 COC(CCN(C)CC(O)CO)OC 2230a_100011216503_100009813347 [0,2,0,0,0,0|2,0,0]=4 6633 B13R0.1220 COC(CCN(C)CC(O)CO)OC 269982a_100011216503_100000139399 [0,2,0,0,0,0|2,0,0]=4 6634 B13R0.1239 CCC(=O)C(C)SCCC(OC)OC 62a_100000139399_100000742827 [0,2,0,0,0,0|1,0,1]=4 6635 B13R0.1239 CCC(=O)C(C)SCCC(OC)OC 62a_100000742827_100000139399 [0,2,0,0,0,0|1,0,1]=4 6636 B13R0.1239 CCC(C)C(=O)CCCC(OC)OC 1458a_100011192722_100000069011 [0,2,0,0,0,0|0,0,1]=3 6637 B13R0.1239 CCC(C)C(C)OCCC(OC)OC 7a_100011215189_100009813347 [0,2,0,0,0,0|1,0,0]=3 6638 B13R0.1239 CCC(C)N(C)CCCC(OC)OC 2230a_100000741768_100000069011 [0,2,0,0,0,0|1,0,0]=3 6639 B13R0.1239 CCC(C)N(C)CCCC(OC)OC 269982a_100000741768_100000069011 [0,2,0,0,0,0|1,0,0]=3 6640 B13R0.1239 CCC(O)C(=O)CCCC(OC)OC 1458a_100011196387_100000069011 [0,2,0,0,0,0|0,0,1]=3 6641 B13R0.1239 CCN(C)C(C)COCC(OC)OC 7a_100000732741_100000751394 [0,2,0,0,0,0|2,0,0]=4 6642 B13R0.1239 COC(CCCC(=O)C(C)OC)OC 1458a_100000743197_100000069011 [0,2,0,0,0,0|1,0,1]=4 6643 B13R0.1239 COC(CCCC(=O)C(C)SC)OC 1458a_100000149566_100000069011 [0,2,0,0,0,0|1,0,1]=4 6644 B13R0.1239 COC(CCCC(=O)C(O)CO)OC 1458a_100011215603_100000069011 [0,2,0,0,0,0|1,0,1]=4 6645 B13R0.1239 COC(CCCN(C)C(C)CO)OC 2230a_100000693034_100000069011 [0,2,0,0,0,0|2,0,0]=4 6646 B13R0.1239 COC(CCCN(C)C(C)CO)OC 269982a_100000693034_100000069011 [0,2,0,0,0,0|2,0,0]=4 6647 B13R0.245 CCCC(C)C(=O)CCC(OC)OC 1458a_100000210906_100000139399 [0,2,0,0,0,0|0,0,1]=3 6648 B13R0.245 CCCC(C)C(=O)CCC(OC)OC 1458a_200000082759_100000766640 [0,2,0,0,0,0|0,0,1]=3 6649 B13R0.245 CCCC(C)C(=O)NCC(OC)OC 11a_100000210479_100000210906 [0,2,0,0,0,0|1,0,1]=4 6650 B13R0.245 CCCC(C)C(=O)NCC(OC)OC 1626a_100000210479_100000210906 [0,2,0,0,0,0|1,0,1]=4 6651 B13R0.245 CCCC(C)C(=O)NCC(OC)OC 240690a_100000210479_100000210906 [0,2,0,0,0,0|1,0,1]=4 6652 B13R0.245 CCCC(C)C(=O)NCC(OC)OC 527a_100000210479_100000210906 [0,2,0,0,0,0|1,0,1]=4 6653 B13R0.245 CCCC(C)C(C)NCC(CC)OC 270004a_100000731041_100011216282 [0,2,0,0,0,0|2,0,0]=4 6654 B13R0.245 CCCC(C)C(C)NCC(OC)OC 270004a_100000210479_100011216282 [0,2,0,0,0,0|1,0,0]=3 6655 B13R0.245 CCCC(C)C(C)OCC(OC)OC 34a_100000708338_100000211822 [0,2,0,0,0,0|1,0,0]=3 6656 B13R0.245 CCCC(C)C(C)OCC(OC)OC 7a_100000708338_100000751394 [0,2,0,0,0,0|1,0,0]=3 6657 B13R0.245 CCCN(C)C(=O)CCC(OC)OC 11a_100000747261_200000082759 [0,2,0,0,0,0|1,0,1]=4 6658 B13R0.245 CCCN(C)C(=O)CCC(OC)OC 1626a_100000747261_200000082759 [0,2,0,0,0,0|1,0,1]=4 6659 B13R0.245 CCCN(C)C(=O)CCC(OC)OC 240690a_100000747261_200000082759 [0,2,0,0,0,0|1,0,1]=4 6660 B13R0.245 CCCN(C)C(=O)CCC(OC)OC 527a_100000747261_200000082759 [0,2,0,0,0,0|1,0,1]=4 6661 B13R0.245 CCC[C@H](O)C(=O)CCC(OC)OC 1458a_100009822183_100000139399 [0,2,0,0,0,0|0,0,1]=3 6662 B13R0.245 CCC[C@H](O)C(=O)NCC(OC)OC 240690a_100000210479_100009822183 [0,2,0,0,0,0|1,0,1]=4 6663 B13R0.245 CCOC(C)C(=O)CCC(OC)OC 1458a_100000739345_100000139399 [0,2,0,0,0,0|1,0,1]=4 6664 B13R0.245 CCSC(C)C(=O)CCC(OC)OC 1458a_100000230601_100000139399 [0,2,0,0,0,0|1,0,1]=4 6665 B13R0.245 COC(CCC(=O)C(C)CCO)OC 1458a_200000082759_100009893172 [0,2,0,0,0,0|1,0,1]=4 6666 B13R0.245 COC(CCC(=O)C(C)CSC)OC 1458a_100000753918_100000139399 [0,2,0,0,0,0|1,0,1]=4 6667 B13R0.245 COC(CCN(C)C(C)CCO)OC 2230a_100000731037_100009813347 [0,2,0,0,0,0|2,0,0]=4 6668 B13R0.245 COC(CCN(C)C(C)CCO)OC 269982a_100000731037_100000139399 [0,2,0,0,0,0|2,0,0]=4 6669 B13R0.245 COCC(C)C(=O)CCC(OC)OC 1458a_100000751857_100000139399 [0,2,0,0,0,0|1,0,1]=4 6670 B13R0.245 COCC(C)C(=O)CCC(OC)OC 1458a_200000082759_100000765312 [0,2,0,0,0,0|1,0,1]=4 6671 B13R0.466 CCCCC(=O)N(C)CC(OC)OC 11a_100000225562_100000210183 [0,2,0,0,0,0|1,0,1]=4 6672 B13R0.466 CCCCC(=O)N(C)CC(OC)OC 1626a_100000225562_100000210183 [0,2,0,0,0,0|1,0,1]=4 6673 B13R0.466 CCCCC(=O)N(C)CC(OC)OC 240690a_100000225562_100000210183 [0,2,0,0,0,0|1,0,1]=4 6674 B13R0.466 CCCCC(=O)N(C)CC(OC)OC 527a_100000225562_100000210183 [0,2,0,0,0,0|1,0,1]=4 6675 B13R0.466 CCCCC(C)C(=O)CC(OC)OC 1458a_100000082724_200011215066 [0,2,0,0,0,0|0,0,1]=3 6676 B13R0.466 CCCCC(C)C(=O)CC(OC)OC 1458a_100000725509_100000751394 [0,2,0,0,0,0|0,0,1]=3 6677 B13R0.466 CCCCC(C)N(C)CC(OC)OC 269982a_100000225562_200011215066 [0,2,0,0,0,0|1,0,0]=3 6678 B13R0.466 CCCCC(C)N(C)CC(OC)OC 270004a_100000225562_100000210087 [0,2,0,0,0,0|1,0,0]=3 6679 B13R0.466 CCCCC(O)C(=O)CC(OC)OC 1458a_100000720857_100000751394 [0,2,0,0,0,0|0,0,1]=3 6680 B13R0.466 CCCCN(C)C(=O)CC(OC)OC 11a_100000207549_100000082724 [0,2,0,0,0,0|1,0,1]=4 6681 B13R0.466 CCCCN(C)C(=O)CC(OC)OC 1626a_100000207549_100000082724 [0,2,0,0,0,0|1,0,1]=4 6682 B13R0.466 CCCCN(C)C(=O)CC(OC)OC 240690a_100000207549_100000082724 [0,2,0,0,0,0|1,0,1]=4 6683 B13R0.466 CCCCN(C)C(=O)CC(OC)OC 527a_100000207549_100000082724 [0,2,0,0,0,0|1,0,1]=4 6684 B13R0.466 CCCCN(C)C(C)CC(OC)OC 270004a_100000207549_100000210484 [0,2,0,0,0,0|1,0,0]=3 6685 B13R0.466 CCSCC(C)N(C)CC(OC)OC 270004a_100000225562_200011216171 [0,2,0,0,0,0|2,0,0]=4 6686 B13R0.466 COC(CC(=O)C(O)CCSC)OC 1458a_100000685904_100000751394 [0,2,0,0,0,0|1,0,1]=4 6687 B13R0.466 COC(CC(C)N(C)CCCO)OC 270004a_100000213112_100000210484 [0,2,0,0,0,0|2,0,0]=4 6688 B13R0.466 COC(CC(C)N(C)CCSC)OC 270004a_100000686725_100000210484 [0,2,0,0,0,0|2,0,0]=4 6689 B13R0.466 COC(CN(C)C(C)CCSC)OC 270004a_100000225562_100011217047 [0,2,0,0,0,0|2,0,0]=4 6690 B13R0.466 COCCC(C)N(C)CC(OC)OC 270004a_100000225562_100000742357 [0,2,0,0,0,0|2,0,0]=4 6691 B13R0.466 COCCN(C)C(C)CC(OC)OC 270004a_100000743101_100000210484 [0,2,0,0,0,0|2,0,0]=4 6692 B13R0.658 C#CC(CCCC)OCC(OC)OC 34a_200011217967_100000211822 [0,2,0,0,0,0|1,0,0]=3 6693 B13R0.658 C#CC(CCCC)OCC(OC)OC 7a_200011217967_100000751394 [0,2,0,0,0,0|1,0,0]=3 6694 B13R0.658 C=CC(CCCC)OCC(OC)OC 34a_200011215037_100000211822 [0,2,0,0,0,0|1,0,0]=3 6695 B13R0.658 C=CC(CCCC)OCC(OC)OC 7a_200011215037_100000751394 [0,2,0,0,0,0|1,0,0]=3 6696 B13R0.658 CCCCC(CC)NCC(CC)OC 270004a_100000731041_100000753412 [0,2,0,0,0,0|2,0,0]=4 6697 B13R0.658 CCCCC(CC)NCC(OC)OC 270004a_100000210479_100000753412 [0,2,0,0,0,0|1,0,0]=3 6698 B13R0.658 CCCCC(CC)OCC(CC)OC 34a_100011934954_200011216223 [0,2,0,0,0,0|2,0,0]=4 6699 B13R0.658 CCCCC(CC)OCC(CC)OC 7a_100011934954_200011216223 [0,2,0,0,0,0|2,0,0]=4 6700 B13R0.658 CCCCC(CC)OCC(OC)OC 34a_100011215227_100000211822 [0,2,0,0,0,0|1,0,0]=3 6701 B13R0.658 CCCCC(CC)OCC(OC)OC 34a_100011216393_200011216223 [0,2,0,0,0,0|1,0,0]=3 6702 B13R0.658 CCCCC(CC)OCC(OC)OC 7a_100011215227_100000751394 [0,2,0,0,0,0|1,0,0]=3 6703 B13R0.658 CCCCC(CC)SCC(OC)OC 62a_100000751394_200011216223 [0,2,0,0,0,0|1,0,0]=3 6704 B13R0.658 CCCCC(CC)SCC(OC)OC 62a_200011216223_100000751394 [0,2,0,0,0,0|1,0,0]=3 6705 B13R0.658 CCCCN(CC)CCC(OC)OC 2230a_100000207695_100009813347 [0,2,0,0,0,0|1,0,0]=3 6706 B13R0.658 CCCCN(CC)CCC(OC)OC 269982a_100000207695_100000139399 [0,2,0,0,0,0|1,0,0]=3 6707 B13R0.658 CCCC[C@@H](CO)NCC(OC)OC 2230a_100011934283_100000751394 [0,2,0,0,0,0|1,0,0]=3 6708 B13R0.658 CCCC[C@@H](CO)NCC(OC)OC 270004a_100011934283_100000752162 [0,2,0,0,0,0|1,0,0]=3 6709 B13R0.658 CCCC[C@@H](CO)NCC(OC)OC 34a_100011934283_100000211822 [0,2,0,0,0,0|1,0,0]=3 6710 B13R0.658 CCN(CCOC)CCC(OC)OC 2230a_100000731262_100009813347 [0,2,0,0,0,0|2,0,0]=4 6711 B13R0.658 CCN(CCOC)CCC(OC)OC 269982a_100000731262_100000139399 [0,2,0,0,0,0|2,0,0]=4 6712 B13R0.658 CCOCC(CN)OCC(OC)OC 34a_102515437182_100000211822 [0,2,0,0,0,0|2,0,0]=4 6713 B13R0.658 COC(CN[C@H](CO)CCSC)OC 2230a_100011827619_100000751394 [0,2,0,0,0,0|2,0,0]=4 6714 B13R0.658 COC(CN[C@H](CO)CCSC)OC 270004a_100011827619_100000752162 [0,2,0,0,0,0|2,0,0]=4 6715 B13R0.794 CCCCC(=O)NCC(C)(OC)OC 11a_100000732740_100000210183 [0,2,0,0,0,0|1,0,1]=4 6716 B13R0.794 CCCCC(=O)NCC(C)(OC)OC 1626a_100000732740_100000210183 [0,2,0,0,0,0|1,0,1]=4 6717 B13R0.794 CCCCC(=O)NCC(C)(OC)OC 527a_100000732740_100000210183 [0,2,0,0,0,0|1,0,1]=4 6718 B13R0.794 CCCCC(C)NCC(C)(OC)OC 2230a_100000126638_100000064154 [0,2,0,0,0,0|1,0,0]=3 6719 B13R0.794 CCCCC(C)NCC(C)(OC)OC 2230a_100000732740_200011215066 [0,2,0,0,0,0|1,0,0]=3 6720 B13R0.794 CCCCC(C)OCC(C)(OC)OC 34a_100000687866_100000766008 [0,2,0,0,0,0|1,0,0]=3 6721 B13R0.794 CCCCC(C)OCP(=O)(OC)OC 34a_100000101693_200011215066 [0,2,0,0,0,0|2,0,0]=4 6722 B13R0.794 CCCCC(C)SCC(C)(OC)OC 62a_100000766008_200011215066 [0,2,0,0,0,0|1,0,0]=3 6723 B13R0.794 CCCCC(C)SCC(C)(OC)OC 62a_200011215066_100000766008 [0,2,0,0,0,0|1,0,0]=3 6724 B13R0.794 CCCCC(C)SC[Si](C)(OC)OC 62a_100000067953_200011215066 [0,2,0,0,0,0|1,1,0]=4 6725 B13R0.794 CCCCC(C)SC[Si](C)(OC)OC 62a_200011215066_100000067953 [0,2,0,0,0,0|1,1,0]=4 6726 B13R0.794 CCOCC(C)OCC(C)(OC)OC 34a_100000718985_100000766008 [0,2,0,0,0,0|2,0,0]=4 6727 B13R0.794 COC(C)(COC(C)CCCCl)OC 34a_200000718107_100000766008 [0,2,0,0,0,0|2,0,0]=4 6728 B13R0.1333 CCCCC(C)(C)OCC(OC)OC 7a_100011219641_100000751394 [0,2,0,0,0,0|1,0,0]=3 6729 B13R0.1333 CCCCS(=O)(=O)NCC(OC)OC 274078a_100000210479_100000212082 [0,2,0,0,0,0|2,0,0]=4 6730 B13R0.1333 COC(COC(C)(C)CCCBr)OC 7a_100009888830_100000751394 [0,2,0,0,0,0|2,0,0]=4 6731 B13R0.414 C=C(CCC)CC(=O)CC(OC)OC 1458a_100000138376_100000751394 [0,2,0,0,0,0|0,0,2]=4 6732 B13R0.414 CCCC(=O)CC(=O)CC(OC)OC 1458a_100000082724_100000747444 [0,2,0,0,0,0|0,0,2]=4 6733 B13R0.414 CCCC(=O)CN(C)CC(OC)OC 269982a_100000225562_100000747444 [0,2,0,0,0,0|1,0,1]=4 6734 B13R0.414 CCCC(C)CC(=O)CC(OC)OC 1458a_100000082724_100011216630 [0,2,0,0,0,0|0,0,1]=3 6735 B13R0.414 CCCC(C)CC(=O)CC(OC)OC 1458a_100000748435_100000751394 [0,2,0,0,0,0|0,0,1]=3 6736 B13R0.414 CCCC(C)CN(C)CC(OC)OC 269982a_100000225562_100011216630 [0,2,0,0,0,0|1,0,0]=3 6737 B13R0.414 CCCC(C)CN(C)CC(OC)OC 270004a_100000225562_100000243154 [0,2,0,0,0,0|1,0,0]=3 6738 B13R0.414 CCCC(C)NC(=O)CC(OC)OC 11a_100000741246_100000082724 [0,2,0,0,0,0|1,0,1]=4 6739 B13R0.414 CCCC(C)NC(=O)CC(OC)OC 1626a_100000741246_100000082724 [0,2,0,0,0,0|1,0,1]=4 6740 B13R0.414 CCCC(C)NC(=O)CC(OC)OC 240690a_100000741246_100000082724 [0,2,0,0,0,0|1,0,1]=4 6741 B13R0.414 CCCC(C)NC(=O)CC(OC)OC 527a_100000741246_100000082724 [0,2,0,0,0,0|1,0,1]=4 6742 B13R0.414 CCCC(C)NC(C)CC(OC)OC 270004a_100000741246_100000210484 [0,2,0,0,0,0|1,0,0]=3 6743 B13R0.414 CCCC(C)OC(C)CC(OC)OC 7a_100011018202_100000766640 [0,2,0,0,0,0|1,0,0]=3 6744 B13R0.414 CCCS(=O)CC(=O)CC(OC)OC 1458a_100011387404_100000751394 [0,2,0,0,0,0|1,0,1]=4 6745 B13R0.414 CCSC(C)CC(=O)CC(OC)OC 1458a_200011311441_100000751394 [0,2,0,0,0,0|1,0,1]=4 6746 B13R0.414 COC(CC(C)N[C@H](C)CCO)OC 270004a_100000706166_100000210484 [0,2,0,0,0,0|2,0,0]=4 6747 B13R0.414 COC(CC(C)OC(C)CCO)OC 7a_100011018202_100009893172 [0,2,0,0,0,0|2,0,0]=4 6748 B13R0.414 COCC(C)OC(C)CC(OC)OC 7a_100011018202_100000765312 [0,2,0,0,0,0|2,0,0]=4 6749 B13R0.414 COCC(O)CN(C)CC(OC)OC 2230a_100000739405_100000751394 [0,2,0,0,0,0|2,0,0]=4 6750 B13R0.414 COCC(O)CN(C)CC(OC)OC 270004a_100000739405_100000752162 [0,2,0,0,0,0|2,0,0]=4 6751 B13R0.414 COC[C@@H](C)NC(C)CC(OC)OC 270004a_100000764878_100000210484 [0,2,0,0,0,0|2,0,0]=4 6752 B13R0.473 CCN(CCCCO)CC(OC)OC 2230a_100011217355_100000751394 [0,2,0,0,0,0|2,0,0]=4 6753 B13R0.473 CCN(CCCCO)CC(OC)OC 270004a_100011217355_100000752162 [0,2,0,0,0,0|2,0,0]=4 6754 B13R0.824 CCCCCC(=O)CP(=O)(OC)OC 1458a_100000034275_100000210326 [0,2,0,0,0,0|1,0,1]=4 6755 B13R0.824 CCCCCN(C)CC(C)(OC)OC 2230a_100000223495_100000064154 [0,2,0,0,0,0|1,0,0]=3 6756 B13R0.824 CCCCCN(C)CC(C)(OC)OC 269982a_100000223495_100000766008 [0,2,0,0,0,0|1,0,0]=3 6757 B13R0.824 CCCCCN(C)C[Si](C)(OC)OC 269982a_100000223495_100000067953 [0,2,0,0,0,0|1,1,0]=4 6758 B13R0.824 CCCCNC(C)CP(=O)(OC)OC 270004a_100000102301_100000751076 [0,2,0,0,0,0|2,0,0]=4 6759 B13R0.824 COC(C)(CN(C)CCCCO)OC 2230a_100000717598_100000064154 [0,2,0,0,0,0|2,0,0]=4 6760 B13R0.824 COC(C)(CN(C)CCCCO)OC 269982a_100000717598_100000766008 [0,2,0,0,0,0|2,0,0]=4 6761 B13R0.824 COCCCN(C)CC(C)(OC)OC 2230a_100000224831_100000064154 [0,2,0,0,0,0|2,0,0]=4 6762 B13R0.824 COCCCN(C)CC(C)(OC)OC 269982a_100000224831_100000766008 [0,2,0,0,0,0|2,0,0]=4 6763 B13R0.1264 C#CC(CCC)OCCC(OC)OC 34a_200011217317_100000139399 [0,2,0,0,0,0|1,0,0]=3 6764 B13R0.1264 C#CC(CCC)OCCC(OC)OC 7a_200011217317_100009813347 [0,2,0,0,0,0|1,0,0]=3 6765 B13R0.1264 C=CC(CCC)OCCC(OC)OC 34a_100011216692_100000139399 [0,2,0,0,0,0|1,0,0]=3 6766 B13R0.1264 C=CC(CCC)OCCC(OC)OC 7a_100011216692_100009813347 [0,2,0,0,0,0|1,0,0]=3 6767 B13R0.1264 CCC(COC)NCCC(OC)OC 2230a_100000757820_100009813347 [0,2,0,0,0,0|2,0,0]=4 6768 B13R0.1264 CCC(COC)OCCC(OC)OC 7a_200011214946_100009813347 [0,2,0,0,0,0|2,0,0]=4 6769 B13R0.1264 CCCC(C#N)OCCC(OC)OC 34a_100000686963_100000139399 [0,2,0,0,0,0|1,0,0]=3 6770 B13R0.1264 CCCC(C#N)OCCC(OC)OC 7a_100000686963_100009813347 [0,2,0,0,0,0|1,0,0]=3 6771 B13R0.1264 CCCC(CC)NCCC(OC)OC 2230a_100000747048_100009813347 [0,2,0,0,0,0|1,0,0]=3 6772 B13R0.1264 CCCC(CC)OCCC(OC)OC 34a_100000687864_100000139399 [0,2,0,0,0,0|1,0,0]=3 6773 B13R0.1264 CCCC(CC)OCCC(OC)OC 7a_100000687864_100009813347 [0,2,0,0,0,0|1,0,0]=3 6774 B13R0.1264 CCCC(CC)SCCC(OC)OC 62a_100000139399_100011219200 [0,2,0,0,0,0|1,0,0]=3 6775 B13R0.1264 CCCC(CC)SCCC(OC)OC 62a_100011219200_100000139399 [0,2,0,0,0,0|1,0,0]=3 6776 B13R0.1264 CCCN(CC)CCCC(OC)OC 2230a_100000226822_100000069011 [0,2,0,0,0,0|1,0,0]=3 6777 B13R0.1264 CCCN(CC)CCCC(OC)OC 269982a_100000226822_100000069011 [0,2,0,0,0,0|1,0,0]=3 6778 B13R0.1264 CCC[C@@H](CO)NCCC(OC)OC 2230a_100000732646_100009813347 [0,2,0,0,0,0|1,0,0]=3 6779 B13R0.1264 CCC[C@@H](CO)NCCC(OC)OC 34a_100000732646_100000139399 [0,2,0,0,0,0|1,0,0]=3 6780 B13R0.1264 CCN(CCO)CCCC(OC)OC 2230a_100000210973_100000069011 [0,2,0,0,0,0|2,0,0]=4 6781 B13R0.1264 CCN(CCO)CCCC(OC)OC 269982a_100000210973_100000069011 [0,2,0,0,0,0|2,0,0]=4 6782 B13R0.1264 CCOC(CC)CNCC(OC)OC 2230a_100015183923_100000751394 [0,2,0,0,0,0|2,0,0]=4 6783 B13R0.1264 CCOC(CC)CNCC(OC)OC 270004a_100015183923_100000752162 [0,2,0,0,0,0|2,0,0]=4 6784 B13R0.1264 CCOC(CC)CNCC(OC)OC 34a_100015183923_100000211822 [0,2,0,0,0,0|2,0,0]=4 6785 B13R0.1264 COCC(CCl)OCCC(OC)OC 34a_100011215053_100000139399 [0,2,0,0,0,0|2,0,0]=4 6786 B13R0.1264 COCC(CN)OCCC(OC)OC 34a_100000756049_100000139399 [0,2,0,0,0,0|2,0,0]=4 6787 B13R0.1264 COCC(CO)NCCC(OC)OC 2230a_100000724102_100009813347 [0,2,0,0,0,0|2,0,0]=4 6788 B13R0.1264 COCC(CO)NCCC(OC)OC 34a_100000724102_100000139399 [0,2,0,0,0,0|2,0,0]=4 6789 B13R0.1448 CCCC(C)(C)COCC(OC)OC 7a_100011995695_100000751394 [0,2,0,0,0,0|1,0,0]=3 6790 B13R0.1448 CCCC(C)(C)OCCC(OC)OC 7a_100000748436_100009813347 [0,2,0,0,0,0|1,0,0]=3 6791 B13R0.1448 CCNC(C)(C)COCC(OC)OC 7a_100000747347_100000751394 [0,2,0,0,0,0|2,0,0]=4 6792 B13R0.1448 COC(CCNC(C)(C)CSC)OC 2230a_100000759623_100009813347 [0,2,0,0,0,0|2,0,0]=4 6793 B13R0.1448 COC(CCNC(C)(C)CSC)OC 7a_100000759623_100009813347 [0,2,0,0,0,0|2,0,0]=4 6794 B13R0.1448 COC(CCOC(C)(C)CCBr)OC 7a_100000702414_100009813347 [0,2,0,0,0,0|2,0,0]=4 6795 B13R0.1448 COCC(C)(C)CNCC(OC)OC 2230a_100000734190_100000751394 [0,2,0,0,0,0|2,0,0]=4 6796 B13R0.1448 COCC(C)(C)CNCC(OC)OC 270004a_100000734190_100000752162 [0,2,0,0,0,0|2,0,0]=4 6797 B13R0.1448 COCC(C)(C)NCCC(OC)OC 2230a_100000752728_100009813347 [0,2,0,0,0,0|2,0,0]=4 6798 B13R0.1524 CCCC(=O)CNCC(C)(OC)OC 2230a_100000732740_100000747444 [0,2,0,0,0,0|1,0,1]=4 6799 B13R0.1524 CCCC(=O)CSCC(C)(OC)OC 62a_100000747444_100000766008 [0,2,0,0,0,0|1,0,1]=4 6800 B13R0.1524 CCCC(=O)CSCC(C)(OC)OC 62a_100000766008_100000747444 [0,2,0,0,0,0|1,0,1]=4 6801 B13R0.1524 CCCC(C)CNCC(C)(OC)OC 2230a_100000732740_100011216630 [0,2,0,0,0,0|1,0,0]=3 6802 B13R0.1524 CCCC(C)COCC(C)(OC)OC 34a_100000688023_100000766008 [0,2,0,0,0,0|1,0,0]=3 6803 B13R0.1524 CCCC(C)COCP(=O)(OC)OC 34a_100000101693_100011216630 [0,2,0,0,0,0|2,0,0]=4 6804 B13R0.1524 CCCC(C)CSCC(C)(OC)OC 62a_100000766008_100011216630 [0,2,0,0,0,0|1,0,0]=3 6805 B13R0.1524 CCCC(C)CSCC(C)(OC)OC 62a_100011216630_100000766008 [0,2,0,0,0,0|1,0,0]=3 6806 B13R0.1524 CCCC(C)CSC[Si](C)(OC)OC 62a_100000067953_100011216630 [0,2,0,0,0,0|1,1,0]=4 6807 B13R0.1524 CCCC(C)CSC[Si](C)(OC)OC 62a_100011216630_100000067953 [0,2,0,0,0,0|1,1,0]=4 6808 B13R0.1524 CCCC(C)OCCP(=O)(OC)OC 34a_200000043213_100000766640 [0,2,0,0,0,0|2,0,0]=4 6809 B13R0.1524 CCCN(C)CCC[Si](C)(OC)OC 269982a_100000747261_100000031653 [0,2,0,0,0,0|1,1,0]=4 6810 B13R0.1524 CCC[C@H](N)COCC(C)(OC)OC 34a_100000732646_100000766008 [0,2,0,0,0,0|1,0,0]=3 6811 B13R0.1524 COC(C)(COCC(C)CCN)OC 34a_106354213184_100000766008 [0,2,0,0,0,0|2,0,0]=4 6812 B13R0.1524 COCC(N)COCC(C)(OC)OC 34a_100000724102_100000766008 [0,2,0,0,0,0|2,0,0]=4 6813 B13R0.1524 COCC(O)CNCC(C)(OC)OC 2230a_100000756049_100000064154 [0,2,0,0,0,0|2,0,0]=4 6814 B13R0.1524 COCC(O)CNCC(C)(OC)OC 34a_100000756049_100000766008 [0,2,0,0,0,0|2,0,0]=4 6815 B13R0.1524 COCC(O)CSCC(C)(OC)OC 62a_100000766008_100011215053 [0,2,0,0,0,0|2,0,0]=4 6816 B13R0.1524 COCC(O)CSCC(C)(OC)OC 62a_100011215053_100000766008 [0,2,0,0,0,0|2,0,0]=4 6817 B13R0.1301 CCCCCOCC(OC)(OC)OC 34a_100000210253_100000037187 [0,2,0,0,0,0|1,0,0]=3 6818 B13R0.1301 CCCCCSCC(OC)(OC)OC 62a_100000037187_100000210326 [0,2,0,0,0,0|1,0,0]=3 6819 B13R0.1301 CCCCCSCC(OC)(OC)OC 62a_100000210326_100000037187 [0,2,0,0,0,0|1,0,0]=3 6820 B13R0.1301 CCCCCSC[Si](OC)(OC)OC 62a_100000066200_100000210326 [0,2,0,0,0,0|1,1,0]=4 6821 B13R0.1301 CCCCCSC[Si](OC)(OC)OC 62a_100000210326_100000066200 [0,2,0,0,0,0|1,1,0]=4 6822 B13R0.1301 CCCOCCCC(OC)(OC)OC 34a_100000210258_200009813395 [0,2,0,0,0,0|1,0,0]=3 6823 B13R0.1301 CCCOCCC[Si](OC)(OC)OC 34a_100000210258_100000033577 [0,2,0,0,0,0|1,1,0]=4 6824 B13R0.1301 CCCSCCCC(OC)(OC)OC 62a_100000210303_200009813395 [0,2,0,0,0,0|1,0,0]=3 6825 B13R0.1301 CCCSCCCC(OC)(OC)OC 62a_200009813395_100000210303 [0,2,0,0,0,0|1,0,0]=3 6826 B13R0.1301 CCCSCCC[Si](OC)(OC)OC 62a_100000033577_100000210303 [0,2,0,0,0,0|1,1,0]=4 6827 B13R0.1301 CCCSCCC[Si](OC)(OC)OC 62a_100000210303_100000033577 [0,2,0,0,0,0|1,1,0]=4 6828 B13R0.1301 CCOCCCC[Si](OC)(OC)OC 34a_100121572206_100010219032 [0,2,0,0,0,0|1,1,0]=4 6829 B13R0.1301 CCOCCNCC(OC)(OC)OC 34a_102516460346_100000037187 [0,2,0,0,0,0|2,0,0]=4 6830 B13R0.1301 CCOCCOCC(OC)(OC)OC 34a_100000210136_100000037187 [0,2,0,0,0,0|2,0,0]=4 6831 B13R0.1301 CCOCCSCC(OC)(OC)OC 62a_100000037187_100011215890 [0,2,0,0,0,0|2,0,0]=4 6832 B13R0.1301 CCOCCSCC(OC)(OC)OC 62a_100000210147_100000037187 [0,2,0,0,0,0|2,0,0]=4 6833 B13R0.1301 CCSCCCC[Si](OC)(OC)OC 62a_100000210202_100010219032 [0,2,0,0,0,0|1,1,0]=4 6834 B13R0.1301 CCSCCCC[Si](OC)(OC)OC 62a_100010219032_100000210202 [0,2,0,0,0,0|1,1,0]=4 6835 B13R0.1301 CCSCCOCC(OC)(OC)OC 34a_100000212035_100000037187 [0,2,0,0,0,0|2,0,0]=4 6836 B13R0.1301 CCSCCSCC(OC)(OC)OC 62a_100000037187_100000757381 [0,2,0,0,0,0|2,0,0]=4 6837 B13R0.1301 CCSCCSCC(OC)(OC)OC 62a_100000757381_100000037187 [0,2,0,0,0,0|2,0,0]=4 6838 B13R0.1301 CNCCCOCC(OC)(OC)OC 34a_100000213112_100000037187 [0,2,0,0,0,0|2,0,0]=4 6839 B13R0.1301 COC(CCCNCCF)(OC)OC 34a_100000724931_200009813395 [0,2,0,0,0,0|2,0,0]=4 6840 B13R0.1301 COC(CCCNCCO)(OC)OC 34a_100016990907_200009813395 [0,2,0,0,0,0|2,0,0]=4 6841 B13R0.1301 COC(CCCOCCBr)(OC)OC 34a_100000211926_200009813395 [0,2,0,0,0,0|2,0,0]=4 6842 B13R0.1301 COC(CCCOCCN)(OC)OC 34a_100000210304_200009813395 [0,2,0,0,0,0|2,0,0]=4 6843 B13R0.1301 COC(CCCSCCF)(OC)OC 62a_100011217306_200009813395 [0,2,0,0,0,0|2,0,0]=4 6844 B13R0.1301 COC(CCCSCCF)(OC)OC 62a_200009813395_100011217306 [0,2,0,0,0,0|2,0,0]=4 6845 B13R0.1301 COC(CCCSCCO)(OC)OC 62a_100000211926_200009813395 [0,2,0,0,0,0|2,0,0]=4 6846 B13R0.1301 COC(CCCSCCO)(OC)OC 62a_200009813395_100000211926 [0,2,0,0,0,0|2,0,0]=4 6847 B13R0.1301 COC(CCCSCSC)(OC)OC 62a_100011218213_200009813395 [0,2,0,0,0,0|2,0,0]=4 6848 B13R0.1301 COC(CCCSCSC)(OC)OC 62a_200009813395_100011218213 [0,2,0,0,0,0|2,0,0]=4 6849 B13R0.1301 COC(CNCCCCO)(OC)OC 34a_100000750430_100000037187 [0,2,0,0,0,0|2,0,0]=4 6850 B13R0.1301 COC(COCCCCBr)(OC)OC 34a_100011216708_100000037187 [0,2,0,0,0,0|2,0,0]=4 6851 B13R0.1301 COC(COCCCCCl)(OC)OC 34a_100000210776_100000037187 [0,2,0,0,0,0|2,0,0]=4 6852 B13R0.1301 COC(COCCCCF)(OC)OC 34a_100011995726_100000037187 [0,2,0,0,0,0|2,0,0]=4 6853 B13R0.1301 COC(COCCCCI)(OC)OC 34a_200012148704_100000037187 [0,2,0,0,0,0|2,0,0]=4 6854 B13R0.1301 COC(COCCCCN)(OC)OC 34a_100000750430_100000037187 [0,2,0,0,0,0|2,0,0]=4 6855 B13R0.1301 COC(COCCCSC)(OC)OC 34a_100000690336_100000037187 [0,2,0,0,0,0|2,0,0]=4 6856 B13R0.1301 COC(CSCCCCF)(OC)OC 62a_100000037187_100000729493 [0,2,0,0,0,0|2,0,0]=4 6857 B13R0.1301 COC(CSCCCCF)(OC)OC 62a_100000729493_100000037187 [0,2,0,0,0,0|2,0,0]=4 6858 B13R0.1301 COC(CSCCCCO)(OC)OC 62a_100000037187_100000210776 [0,2,0,0,0,0|2,0,0]=4 6859 B13R0.1301 COC(CSCCCCO)(OC)OC 62a_100000210776_100000037187 [0,2,0,0,0,0|2,0,0]=4 6860 B13R0.1301 COCCCNCC(OC)(OC)OC 34a_100150723488_100000037187 [0,2,0,0,0,0|2,0,0]=4 6861 B13R0.1301 COCCCOCC(OC)(OC)OC 34a_100000740835_100000037187 [0,2,0,0,0,0|2,0,0]=4 6862 B13R0.1301 COCCCSCC(OC)(OC)OC 62a_100000037187_100000709357 [0,2,0,0,0,0|2,0,0]=4 6863 B13R0.1301 COCCCSCC(OC)(OC)OC 62a_100000709357_100000037187 [0,2,0,0,0,0|2,0,0]=4 6864 B13R0.1301 COCSCCCC(OC)(OC)OC 62a_100000766300_200009813395 [0,2,0,0,0,0|2,0,0]=4 6865 B13R0.1301 COCSCCCC(OC)(OC)OC 62a_200009813395_100000766300 [0,2,0,0,0,0|2,0,0]=4 6866 B11R1.4 BrCCCOCC1OCCO1 34a_100011217188_100000755774 [1,0,0,1,0,0|2,0,0]=4 6867 B11R1.4 BrCCOCCC1OCCO1 34a_100000211926_100000740749 [1,0,0,1,0,0|2,0,0]=4 6868 B11R1.4 CCCCCOC1CCCO1 34a_100000085407_100000718602 [1,0,0,1,0,0|2,0,0]=4 6869 B11R1.4 CCCCNCC1CCCO1 2230a_100000102301_100000203698 [1,0,0,1,0,0|2,0,0]=4 6870 B11R1.4 CCCCNCC1CCCO1 7a_106832991798_100000203698 [1,0,0,1,0,0|2,0,0]=4 6871 B11R1.4 CCCCNCC1OCCO1 2230a_100000036311_100000210211 [1,0,0,1,0,0|1,0,0]=3 6872 B11R1.4 CCCCNCC1OCCO1 2230a_100000102301_100000755774 [1,0,0,1,0,0|1,0,0]=3 6873 B11R1.4 CCCCNCC1OCCO1 34a_100000036311_100000210210 [1,0,0,1,0,0|1,0,0]=3 6874 B11R1.4 CCCCNCC1OCCO1 7a_106832991798_100000755774 [1,0,0,1,0,0|1,0,0]=3 6875 B11R1.4 CCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210211 [1,0,0,1,0,0|2,0,0]=4 6876 B11R1.4 CCCCNC[C@@H]1CCCO1 34a_100020590478_100000210210 [1,0,0,1,0,0|2,0,0]=4 6877 B11R1.4 CCCCOCC1CCCO1 34a_100000210270_100000210210 [1,0,0,1,0,0|2,0,0]=4 6878 B11R1.4 CCCCOCC1CCCO1 7a_100000210227_100000203698 [1,0,0,1,0,0|2,0,0]=4 6879 B11R1.4 CCCCOCC1CCCO1 7a_100000210270_100000210211 [1,0,0,1,0,0|2,0,0]=4 6880 B11R1.4 CCCCOCC1OCCO1 34a_100000087154_100000210210 [1,0,0,1,0,0|1,0,0]=3 6881 B11R1.4 CCCCOCC1OCCO1 34a_100000210227_100000755774 [1,0,0,1,0,0|1,0,0]=3 6882 B11R1.4 CCCCOCC1OCCO1 7a_100000210227_100000755774 [1,0,0,1,0,0|1,0,0]=3 6883 B11R1.4 CCCCSCC1CCCO1 62a_100000203698_100000210210 [1,0,0,1,0,0|2,0,0]=4 6884 B11R1.4 CCCCSCC1CCCO1 62a_100000210211_100000203698 [1,0,0,1,0,0|2,0,0]=4 6885 B11R1.4 CCCCSCC1OCCO1 62a_100000210211_100000755774 [1,0,0,1,0,0|1,0,0]=3 6886 B11R1.4 CCCCSCC1OCCO1 62a_100000755774_100000210210 [1,0,0,1,0,0|1,0,0]=3 6887 B11R1.4 CCCNCCC1OCCO1 2230a_100000034215_100000210303 [1,0,0,1,0,0|1,0,0]=3 6888 B11R1.4 CCCNCCC1OCCO1 34a_100000034215_100000210303 [1,0,0,1,0,0|1,0,0]=3 6889 B11R1.4 CCCOCCC1OCCO1 34a_100000210258_100000740749 [1,0,0,1,0,0|1,0,0]=3 6890 B11R1.4 CCCSCCC1OCCO1 62a_100000210303_100000740749 [1,0,0,1,0,0|1,0,0]=3 6891 B11R1.4 CCNCCCC1OCCO1 2230a_100015525214_100000042513 [1,0,0,1,0,0|1,0,0]=3 6892 B11R1.4 CCOCCCC1OCCO1 34a_100009871617_100000210202 [1,0,0,1,0,0|1,0,0]=3 6893 B11R1.4 CCOCCCC1OCCO1 34a_100121572206_100009861162 [1,0,0,1,0,0|1,0,0]=3 6894 B11R1.4 CCOCCCC1OCCO1 7a_100009871617_100000210202 [1,0,0,1,0,0|1,0,0]=3 6895 B11R1.4 CCOCSCC1OCCO1 62a_100000739092_100000755774 [1,0,0,1,0,0|2,0,0]=4 6896 B11R1.4 CCOCSCC1OCCO1 62a_100000755774_100000739092 [1,0,0,1,0,0|2,0,0]=4 6897 B11R1.4 CCSCCCC1OCCO1 62a_100000210202_100000042513 [1,0,0,1,0,0|1,0,0]=3 6898 B11R1.4 CNCCCCC1OCCO1 2230a_106832991635_100000034956 [1,0,0,1,0,0|1,0,0]=3 6899 B11R1.4 CNCCCCC1OCCO1 34a_100102657272_200009813554 [1,0,0,1,0,0|1,0,0]=3 6900 B11R1.4 CNCCCCC1OCCO1 7a_106832991635_100000034956 [1,0,0,1,0,0|1,0,0]=3 6901 B11R1.4 COCCCCC1OCCO1 34a_100138415774_200009813554 [1,0,0,1,0,0|1,0,0]=3 6902 B11R1.4 COCCNCC1OCCO1 2230a_100000036311_100011201679 [1,0,0,1,0,0|2,0,0]=4 6903 B11R1.4 COCCNCC1OCCO1 2230a_100000209980_100000755774 [1,0,0,1,0,0|2,0,0]=4 6904 B11R1.4 COCCNCC1OCCO1 34a_100000036311_100011201679 [1,0,0,1,0,0|2,0,0]=4 6905 B11R1.4 COCCOCC1OCCO1 34a_100000087154_100011201679 [1,0,0,1,0,0|2,0,0]=4 6906 B11R1.4 COCCOCC1OCCO1 34a_100000210237_100000755774 [1,0,0,1,0,0|2,0,0]=4 6907 B11R1.4 COCCSCC1OCCO1 62a_100000233755_100000755774 [1,0,0,1,0,0|2,0,0]=4 6908 B11R1.4 COCCSCC1OCCO1 62a_100000755774_100000233755 [1,0,0,1,0,0|2,0,0]=4 6909 B11R1.4 COCNCCC1OCCO1 2230a_100000034215_100000766300 [1,0,0,1,0,0|2,0,0]=4 6910 B11R1.4 COCSCCC1OCCO1 62a_100000766300_100000740749 [1,0,0,1,0,0|2,0,0]=4 6911 B11R1.4 CSCCCCC1OCCO1 62a_200000210301_100000034956 [1,0,0,1,0,0|1,0,0]=3 6912 B11R1.4 CSCCNCC1OCCO1 2230a_100000036311_100000751147 [1,0,0,1,0,0|2,0,0]=4 6913 B11R1.4 CSCCNCC1OCCO1 2230a_100020590264_100000755774 [1,0,0,1,0,0|2,0,0]=4 6914 B11R1.4 CSCCNCC1OCCO1 34a_100000036311_100000212216 [1,0,0,1,0,0|2,0,0]=4 6915 B11R1.4 CSCCOCC1OCCO1 34a_100000087154_100000212216 [1,0,0,1,0,0|2,0,0]=4 6916 B11R1.4 CSCCOCC1OCCO1 34a_100000230434_100000755774 [1,0,0,1,0,0|2,0,0]=4 6917 B11R1.4 CSCCOCC1OCCO1 7a_100000230434_100000755774 [1,0,0,1,0,0|2,0,0]=4 6918 B11R1.4 CSCCSCC1OCCO1 62a_100000212216_100000755774 [1,0,0,1,0,0|2,0,0]=4 6919 B11R1.4 CSCCSCC1OCCO1 62a_100000755774_100000751147 [1,0,0,1,0,0|2,0,0]=4 6920 B11R1.4 CSCNCCC1OCCO1 2230a_100000034215_100011218213 [1,0,0,1,0,0|2,0,0]=4 6921 B11R1.4 CSCNCCC1OCCO1 34a_100000034215_100011218213 [1,0,0,1,0,0|2,0,0]=4 6922 B11R1.4 CSCSCCC1OCCO1 62a_100011218213_100000740749 [1,0,0,1,0,0|2,0,0]=4 6923 B11R1.4 ClCCCOCC1OCCO1 34a_100000230001_100000755774 [1,0,0,1,0,0|2,0,0]=4 6924 B11R1.4 FCCCNCC1OCCO1 2230a_100000036311_100011934791 [1,0,0,1,0,0|2,0,0]=4 6925 B11R1.4 FCCCNCC1OCCO1 2230a_100015189416_100000755774 [1,0,0,1,0,0|2,0,0]=4 6926 B11R1.4 FCCCNCC1OCCO1 34a_100000036311_100011934791 [1,0,0,1,0,0|2,0,0]=4 6927 B11R1.4 FCCCNCC1OCCO1 34a_100015189416_100000755774 [1,0,0,1,0,0|2,0,0]=4 6928 B11R1.4 FCCCOCC1OCCO1 34a_100000087154_100011934791 [1,0,0,1,0,0|2,0,0]=4 6929 B11R1.4 FCCCOCC1OCCO1 34a_100000759539_100000755774 [1,0,0,1,0,0|2,0,0]=4 6930 B11R1.4 FCCCSCC1OCCO1 62a_100000755774_100011934791 [1,0,0,1,0,0|2,0,0]=4 6931 B11R1.4 FCCCSCC1OCCO1 62a_100011934791_100000755774 [1,0,0,1,0,0|2,0,0]=4 6932 B11R1.4 FCCNCCC1OCCO1 2230a_100000034215_100011217306 [1,0,0,1,0,0|2,0,0]=4 6933 B11R1.4 FCCNCCC1OCCO1 34a_100000034215_100011217306 [1,0,0,1,0,0|2,0,0]=4 6934 B11R1.4 FCCNCCC1OCCO1 34a_100000724931_100000740749 [1,0,0,1,0,0|2,0,0]=4 6935 B11R1.4 FCCSCCC1OCCO1 62a_100011217306_100000740749 [1,0,0,1,0,0|2,0,0]=4 6936 B11R1.4 FCOCCCC1OCCO1 34a_100009871617_100015361967 [1,0,0,1,0,0|2,0,0]=4 6937 B11R1.4 FCOCCCC1OCCO1 7a_100009871617_100015361967 [1,0,0,1,0,0|2,0,0]=4 6938 B11R1.4 FCSCCCC1OCCO1 62a_100015361967_100000042513 [1,0,0,1,0,0|2,0,0]=4 6939 B11R1.4 NCCCOCC1OCCO1 34a_100000182051_100000755774 [1,0,0,1,0,0|2,0,0]=4 6940 B11R1.4 NCCOCCC1OCCO1 34a_100000210304_100000740749 [1,0,0,1,0,0|2,0,0]=4 6941 B11R1.4 OCCCNCC1OCCO1 2230a_100000036311_100000230001 [1,0,0,1,0,0|2,0,0]=4 6942 B11R1.4 OCCCNCC1OCCO1 34a_100000036311_100000230001 [1,0,0,1,0,0|2,0,0]=4 6943 B11R1.4 OCCCOCC1OCCO1 34a_100000087154_100000230001 [1,0,0,1,0,0|2,0,0]=4 6944 B11R1.4 OCCCSCC1OCCO1 62a_100000755774_100011215043 [1,0,0,1,0,0|2,0,0]=4 6945 B11R1.4 OCCCSCC1OCCO1 62a_100011215043_100000755774 [1,0,0,1,0,0|2,0,0]=4 6946 B11R1.4 OCCNCCC1OCCO1 2230a_100000034215_100000211926 [1,0,0,1,0,0|2,0,0]=4 6947 B11R1.4 OCCNCCC1OCCO1 2230a_100016997473_100000740749 [1,0,0,1,0,0|2,0,0]=4 6948 B11R1.4 OCCNCCC1OCCO1 34a_100000034215_100000211926 [1,0,0,1,0,0|2,0,0]=4 6949 B11R1.4 OCCNCCC1OCCO1 34a_100016990907_100000740749 [1,0,0,1,0,0|2,0,0]=4 6950 B11R1.4 OCCSCCC1OCCO1 62a_100000211926_100000740749 [1,0,0,1,0,0|2,0,0]=4 6951 B11R1.4 [13CH3]SCCCCC1OCCO1 62a_200025704644_100000034956 [1,0,0,1,0,0|1,0,0]=3 6952 B11R1.12 CCC(NC)C1CCCCC1 269862a_106832991636_100011216311 [1,0,0,1,0,0|2,0,0]=4 6953 B11R1.12 CCC(OC)C1CCCCC1 34a_100011215090_200000210301 [1,0,0,1,0,0|1,0,0]=3 6954 B11R1.12 CCC(OC)C1CCCCC1 7a_100011215090_200000210301 [1,0,0,1,0,0|1,0,0]=3 6955 B11R1.12 CCC(OC)C1CCNCC1 34a_100011935121_200000210301 [1,0,0,1,0,0|2,0,0]=4 6956 B11R1.12 CCC(O[13CH3])C1CCCCC1 34a_100011215090_200025704644 [1,0,0,1,0,0|1,0,0]=3 6957 B11R1.12 CCC(O[13CH3])C1CCCCC1 7a_100011215090_200025704644 [1,0,0,1,0,0|1,0,0]=3 6958 B11R1.12 CCC(O[13CH3])C1CCNCC1 34a_100011935121_200025704644 [1,0,0,1,0,0|2,0,0]=4 6959 B11R1.12 CC[C@H](NC)C1CCCCC1 2230a_100020639352_200000210301 [1,0,0,1,0,0|2,0,0]=4 6960 B11R1.12 CC[C@H](NC)C1CCCCC1 34a_100020639352_200000210301 [1,0,0,1,0,0|2,0,0]=4 6961 B11R1.12 CC[C@H](N[13CH3])C1CCCCC1 2230a_100020639352_200025704644 [1,0,0,1,0,0|2,0,0]=4 6962 B11R1.12 CC[C@H](N[13CH3])C1CCCCC1 34a_100020639352_200025704644 [1,0,0,1,0,0|2,0,0]=4 6963 B11R1.83 CCCC1CCC(CC1)NC 2230a_100011234333_200000210301 [1,0,0,1,0,0|2,0,0]=4 6964 B11R1.83 CCCC1CCC(CC1)NC 270004a_106832991635_100000185488 [1,0,0,1,0,0|2,0,0]=4 6965 B11R1.83 CCCC1CCC(CC1)NC 34a_100011234333_200000210301 [1,0,0,1,0,0|2,0,0]=4 6966 B11R1.83 CCCC1CCC(CC1)N[13CH3] 2230a_100011234333_200025704644 [1,0,0,1,0,0|2,0,0]=4 6967 B11R1.83 CCCC1CCC(CC1)N[13CH3] 34a_100011234333_200025704644 [1,0,0,1,0,0|2,0,0]=4 6968 B11R1.83 CCCC1CCC(CC1)OC 34a_100011218949_200000210301 [1,0,0,1,0,0|1,0,0]=3 6969 B11R1.83 CCCC1CCC(CC1)OC 7a_100011218949_200000210301 [1,0,0,1,0,0|1,0,0]=3 6970 B11R1.83 CCCC1CCC(CC1)O[13CH3] 34a_100011218949_200025704644 [1,0,0,1,0,0|1,0,0]=3 6971 B11R1.83 CCCC1CCC(CC1)O[13CH3] 7a_100011218949_200025704644 [1,0,0,1,0,0|1,0,0]=3 6972 B11R1.83 CCCN1CCC(CC1)OC 2230a_100000234800_100000210303 [1,0,0,1,0,0|2,0,0]=4 6973 B11R1.83 CCCN1CCC(CC1)OC 269982a_100000234800_100000210303 [1,0,0,1,0,0|2,0,0]=4 6974 B11R1.83 CCCN1CCC(CC1)OC 34a_100000234800_100000210303 [1,0,0,1,0,0|2,0,0]=4 6975 B11R1.83 CCNC1CCC(CC1)OC 270004a_100015525214_100000747084 [1,0,0,1,0,0|2,0,0]=4 6976 B11R1.83 CCNC1CCC(CC1)OC 34a_100015205214_100000210202 [1,0,0,1,0,0|2,0,0]=4 6977 B11R1.83 CCOC1CCC(CC1)OC 34a_100011581665_100000210202 [1,0,0,1,0,0|2,0,0]=4 6978 B11R1.83 CCOC1CCC(CC1)OC 7a_100011581665_100000210202 [1,0,0,1,0,0|2,0,0]=4 6979 B11R1.83 CNCC1CCC(CC1)OC 2230a_106832991635_100013032858 [1,0,0,1,0,0|2,0,0]=4 6980 B11R1.83 CNCC1CCC(CC1)OC 34a_100102657272_100013032858 [1,0,0,1,0,0|2,0,0]=4 6981 B11R1.83 CNCC1CCC(CC1)OC 7a_106832991635_100013032858 [1,0,0,1,0,0|2,0,0]=4 6982 B11R1.83 COC1CCC(CC1)CCN 34a_200011935226_200000210301 [1,0,0,1,0,0|2,0,0]=4 6983 B11R1.83 COC1CCC(CC1)CSC 62a_100013032858_200000210301 [1,0,0,1,0,0|2,0,0]=4 6984 B11R1.83 COC1CCC(CC1)CSC 62a_200000210301_100013032858 [1,0,0,1,0,0|2,0,0]=4 6985 B11R1.83 COC1CCC(CC1)CS[13CH3] 62a_100013032858_200025704644 [1,0,0,1,0,0|2,0,0]=4 6986 B11R1.83 COC1CCC(CC1)CS[13CH3] 62a_200025704644_100013032858 [1,0,0,1,0,0|2,0,0]=4 6987 B11R1.83 COCC1CCC(CC1)OC 34a_100138415774_100013032858 [1,0,0,1,0,0|2,0,0]=4 6988 B11R1.83 [13CH3]OC1CCC(CC1)CCN 34a_200011935226_200025704644 [1,0,0,1,0,0|2,0,0]=4 6989 B11R1.84 COC(CN1CCCC1)OC 2230a_100000188435_100000751394 [1,0,0,1,0,0|1,0,0]=3 6990 B11R1.84 COC(CN1CCCC1)OC 270004a_100000188435_100000752162 [1,0,0,1,0,0|1,0,0]=3 6991 B11R1.84 COC(CN1CCSC1)OC 2230a_100011215254_100000751394 [1,0,0,1,0,0|2,0,0]=4 6992 B11R1.84 COC(CN1CCSC1)OC 270004a_100011215254_100000752162 [1,0,0,1,0,0|2,0,0]=4 6993 B11R1.170 CCC(CNC1CCC1)OC 270004a_100000731041_100000241760 [1,0,0,1,0,0|2,0,0]=4 6994 B11R1.170 CCC(COC1CCC1)OC 34a_100011934954_100000749161 [1,0,0,1,0,0|2,0,0]=4 6995 B11R1.170 COC(CCN1CCC1)OC 269982a_100000754969_100000139399 [1,0,0,1,0,0|1,0,0]=3 6996 B11R1.170 COC(CNC1CCC1)OC 2230a_100000749019_100000751394 [1,0,0,1,0,0|1,0,0]=3 6997 B11R1.170 COC(CNC1CCC1)OC 270004a_100000210479_100000241760 [1,0,0,1,0,0|1,0,0]=3 6998 B11R1.170 COC(CNC1CCC1)OC 34a_100000749019_100000211822 [1,0,0,1,0,0|1,0,0]=3 6999 B11R1.170 COC(CNC1COC1)OC 2230a_100016991112_100000751394 [1,0,0,1,0,0|2,0,0]=4 7000 B11R1.170 COC(CNC1COC1)OC 270004a_100016991112_100000752162 [1,0,0,1,0,0|2,0,0]=4 7001 B11R1.170 COC(CNC1CSC1)OC 270004a_100016994217_100000752162 [1,0,0,1,0,0|2,0,0]=4 7002 B11R1.170 COC(COC1CCC1)OC 34a_100000748187_100000211822 [1,0,0,1,0,0|1,0,0]=3 7003 B11R1.170 COC(COC1CCC1)OC 34a_100011216393_100000749161 [1,0,0,1,0,0|1,0,0]=3 7004 B11R1.170 COC(COC1COC1)OC 34a_100011216393_100009818527 [1,0,0,1,0,0|2,0,0]=4 7005 B11R1.170 COC(COC1CSC1)OC 7a_100000072292_100000751394 [1,0,0,1,0,0|2,0,0]=4 7006 B11R1.170 COC(CSC1CCC1)OC 62a_100000751394_100000749161 [1,0,0,1,0,0|1,0,0]=3 7007 B11R1.170 COC(CSC1COC1)OC 62a_100000751394_100009818527 [1,0,0,1,0,0|2,0,0]=4 7008 B11R1.171 CCC(CNCC1CC1)OC 269862a_100000731041_100000741477 [1,0,0,1,0,0|2,0,0]=4 7009 B11R1.171 CCC(COCC1CC1)OC 34a_100011934954_100000742324 [1,0,0,1,0,0|2,0,0]=4 7010 B11R1.171 CCC(COCC1CC1)OC 7a_100011934954_100000742324 [1,0,0,1,0,0|2,0,0]=4 7011 B11R1.171 COC(CCNC1CC1)OC 34a_100000212008_100000139399 [1,0,0,1,0,0|1,0,0]=3 7012 B11R1.171 COC(CCSC1CC1)OC 62a_100000139399_100000211595 [1,0,0,1,0,0|1,0,0]=3 7013 B11R1.171 COC(CNCC1CC1)OC 2230a_100000735609_100000751394 [1,0,0,1,0,0|1,0,0]=3 7014 B11R1.171 COC(CNCC1CC1)OC 270004a_100000735609_100000752162 [1,0,0,1,0,0|1,0,0]=3 7015 B11R1.171 COC(CNCC1CC1)OC 34a_100000735609_100000211822 [1,0,0,1,0,0|1,0,0]=3 7016 B11R1.171 COC(COCC1CC1)OC 34a_100000211283_100000211822 [1,0,0,1,0,0|1,0,0]=3 7017 B11R1.171 COC(COCC1CC1)OC 34a_100011216393_100000742324 [1,0,0,1,0,0|1,0,0]=3 7018 B11R1.171 COC(COCC1CO1)OC 34a_100011216393_102125554688 [1,0,0,1,0,0|2,0,0]=4 7019 B11R1.171 COC(COC[C@@H]1CO1)OC 34a_100000757423_100000211822 [1,0,0,1,0,0|2,0,0]=4 7020 B11R1.171 COC(CSCC1CC1)OC 62a_100000751394_100000742324 [1,0,0,1,0,0|1,0,0]=3 7021 B11R1.171 COC(CSCC1CC1)OC 62a_100000756562_100000751394 [1,0,0,1,0,0|1,0,0]=3 7022 B11R1.171 COC(CSCC1CO1)OC 62a_100000751394_102125554688 [1,0,0,1,0,0|2,0,0]=4 7023 B11R1.171 COC(CSCC1CO1)OC 62a_102125554688_100000751394 [1,0,0,1,0,0|2,0,0]=4 7024 B11R1.171 COC(CSCC1CS1)OC 62a_100000031435_100000751394 [1,0,0,1,0,0|2,0,0]=4 7025 B11R1.171 COC(CSCC1CS1)OC 62a_100000751394_100000031435 [1,0,0,1,0,0|2,0,0]=4 7026 B11R1.171 COC(CSC[C@@H]1CO1)OC 62a_100000745022_100000751394 [1,0,0,1,0,0|2,0,0]=4 7027 B11R1.171 COC(CSC[C@@H]1CO1)OC 62a_100000751394_100000745022 [1,0,0,1,0,0|2,0,0]=4 7028 B11R1.214 CCCCN1CC[C@H](C1)OC 2230a_100000766984_100000210211 [1,0,0,1,0,0|2,0,0]=4 7029 B11R1.214 CCCCN1CC[C@H](C1)OC 269982a_100000766984_100000210211 [1,0,0,1,0,0|2,0,0]=4 7030 B11R1.248 CNC1CCCCCCCC1 270004a_106832991635_100000038600 [1,0,0,1,0,0|2,0,0]=4 7031 B11R1.493 COC(CN[C@@H]1C[C@@H]1F)OC 2230a_100015190264_100000751394 [1,0,0,1,0,0|2,0,0]=4 7032 B11R1.493 COC(CN[C@@H]1C[C@H]1F)OC 2230a_100025746932_100000751394 [1,0,0,1,0,0|2,0,0]=4 7033 B11R1.493 COC(CN[C@@H]1C[C@H]1F)OC 34a_100025746932_100000211822 [1,0,0,1,0,0|2,0,0]=4 7034 B11R1.542 CCCCNCC1(CO1)CC 7a_106832991798_200000139556 [1,0,0,1,0,0|2,0,0]=4 7035 B11R1.542 CCCCOCC1(CO1)CC 34a_100000210227_200000139556 [1,0,0,1,0,0|2,0,0]=4 7036 B11R1.542 CCCCOCC1(CO1)CC 7a_100000210227_200000139556 [1,0,0,1,0,0|2,0,0]=4 7037 B11R1.542 CCCCSCC1(CO1)CC 62a_100000210211_200000139556 [1,0,0,1,0,0|2,0,0]=4 7038 B11R1.542 CCCCSCC1(CO1)CC 62a_200000139556_100000210210 [1,0,0,1,0,0|2,0,0]=4 7039 B11R1.807 COC(CN1CCC1C)OC 34a_100000755817_100000211822 [1,0,0,1,0,0|1,0,0]=3 7040 B11R1.951 CCN1CCCC(CC1)OC 2230a_100016993962_100000210202 [1,0,0,1,0,0|2,0,0]=4 7041 B11R1.951 CCN1CCCC(CC1)OC 269982a_100016993962_100000204670 [1,0,0,1,0,0|2,0,0]=4 7042 B11R1.951 CCN1CCCC(CC1)OC 34a_100016993962_100000210202 [1,0,0,1,0,0|2,0,0]=4 7043 B11R1.1 CCCCC1CCN(CC1)C 2230a_200016987432_200000210301 [1,0,0,1,0,0|2,0,0]=4 7044 B11R1.1 CCCCC1CCN(CC1)C 269982a_200016987432_200000210301 [1,0,0,1,0,0|2,0,0]=4 7045 B11R1.1 CCCCC1CCN(CC1)C 34a_200016987432_200000210301 [1,0,0,1,0,0|2,0,0]=4 7046 B11R1.1 CCCCC1CCN(CC1)[13CH3] 2230a_200016987432_200025704644 [1,0,0,1,0,0|2,0,0]=4 7047 B11R1.1 CCCCC1CCN(CC1)[13CH3] 269982a_200016987432_200025704644 [1,0,0,1,0,0|2,0,0]=4 7048 B11R1.1 CCCCC1CCN(CC1)[13CH3] 34a_200016987432_200025704644 [1,0,0,1,0,0|2,0,0]=4 7049 B11R1.1 CCCCN1CCC(CC1)C 2230a_100000188429_100000210211 [1,0,0,1,0,0|2,0,0]=4 7050 B11R1.1 CCCCN1CCC(CC1)C 269982a_100000188429_100000210211 [1,0,0,1,0,0|2,0,0]=4 7051 B11R1.1 CCCCN1CCC(CC1)C 34a_100000188429_100000210210 [1,0,0,1,0,0|2,0,0]=4 7052 B11R1.1 CCCCN1CCC(CC1)O 2230a_100025773856_100000210211 [1,0,0,1,0,0|2,0,0]=4 7053 B11R1.1 CCCCN1CCC(CC1)O 269982a_100025773856_100000210211 [1,0,0,1,0,0|2,0,0]=4 7054 B11R1.1 CCCNC1CCC(CC1)C 270004a_100020643023_100000185489 [1,0,0,1,0,0|2,0,0]=4 7055 B11R1.1 CCCNC1CCC(CC1)O 270004a_100020643023_100000764474 [1,0,0,1,0,0|2,0,0]=4 7056 B11R1.1 CCCN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100000210303 [1,0,0,1,0,0|2,0,0]=4 7057 B11R1.1 CCCN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100000210303 [1,0,0,1,0,0|2,0,0]=4 7058 B11R1.1 CCCOC1CCC(CC1)C 34a_100000210258_200011216234 [1,0,0,1,0,0|2,0,0]=4 7059 B11R1.1 CCCOC1CCC(CC1)C 34a_100000210714_100000210303 [1,0,0,1,0,0|2,0,0]=4 7060 B11R1.1 CCCOC1CCC(CC1)C 7a_100000210714_100000210303 [1,0,0,1,0,0|2,0,0]=4 7061 B11R1.1 CCCSC1CCC(CC1)C 62a_100000210303_200011216234 [1,0,0,1,0,0|2,0,0]=4 7062 B11R1.1 CCNCC1CCC(CC1)C 2230a_103436935547_100000210202 [1,0,0,1,0,0|2,0,0]=4 7063 B11R1.1 CCNCC1CCC(CC1)C 34a_103436935547_100000210202 [1,0,0,1,0,0|2,0,0]=4 7064 B11R1.1 CCOCC1CCC(CC1)C 34a_100000701341_100000210202 [1,0,0,1,0,0|2,0,0]=4 7065 B11R1.1 CNCCC1CCC(CC1)O 34a_200011935226_200000210301 [1,0,0,1,0,0|2,0,0]=4 7066 B11R1.1 [13CH3]NCCC1CCC(CC1)O 34a_200011935226_200025704644 [1,0,0,1,0,0|2,0,0]=4 7067 B11R1.13 CCNC1CCCC(C1C)C 2230a_100000211273_100000210202 [1,0,0,1,0,0|2,0,0]=4 7068 B11R1.13 CCNC1CCCC(C1C)C 34a_100000211273_100000210202 [1,0,0,1,0,0|2,0,0]=4 7069 B11R1.13 CCOC1CCCC(C1C)C 34a_100011217532_100000210202 [1,0,0,1,0,0|2,0,0]=4 7070 B11R1.13 CCOC1CCCC(C1C)C 7a_100011217532_100000210202 [1,0,0,1,0,0|2,0,0]=4 7071 B11R1.25 CCC(C)CNC1CCCC1 2230a_100000211070_100000748023 [1,0,0,1,0,0|2,0,0]=4 7072 B11R1.25 CCC(C)CNC1CCCC1 2230a_100020588543_100000179811 [1,0,0,1,0,0|2,0,0]=4 7073 B11R1.25 CCC(C)CNC1CCCC1 270004a_100000211070_100000243153 [1,0,0,1,0,0|2,0,0]=4 7074 B11R1.25 CCC(C)CNC1CCCC1 270004a_100020588543_100000210133 [1,0,0,1,0,0|2,0,0]=4 7075 B11R1.25 CCC(C)CNC1CCCC1 34a_100000211070_100000748023 [1,0,0,1,0,0|2,0,0]=4 7076 B11R1.25 CCC(C)COC1CCCC1 34a_100000210269_100000748023 [1,0,0,1,0,0|2,0,0]=4 7077 B11R1.25 CCC(C)COC1CCCC1 7a_100000210269_100000748023 [1,0,0,1,0,0|2,0,0]=4 7078 B11R1.25 CCC(C)CSC1CCCC1 62a_100000748023_100000179811 [1,0,0,1,0,0|2,0,0]=4 7079 B11R1.25 CCC(C)CSC1CCCC1 62a_100011217020_100000748023 [1,0,0,1,0,0|2,0,0]=4 7080 B11R1.25 CCC(C)NCC1CCCC1 2230a_100000209981_100000740388 [1,0,0,1,0,0|2,0,0]=4 7081 B11R1.25 CCC(C)NCC1CCCC1 2230a_100000737975_100000758301 [1,0,0,1,0,0|2,0,0]=4 7082 B11R1.25 CCC(C)NCC1CCCC1 269862a_100000209981_100000746403 [1,0,0,1,0,0|2,0,0]=4 7083 B11R1.25 CCC(C)NCC1CCCC1 34a_100000737975_100011215416 [1,0,0,1,0,0|2,0,0]=4 7084 B11R1.25 CCC(C)OCC1CCCC1 34a_100000742336_100011215416 [1,0,0,1,0,0|2,0,0]=4 7085 B11R1.25 CCC(C)OCC1CCCC1 7a_100000210228_100000740388 [1,0,0,1,0,0|2,0,0]=4 7086 B11R1.25 CCC(C)OCC1CCCC1 7a_100000742336_100000758301 [1,0,0,1,0,0|2,0,0]=4 7087 B11R1.25 CCC(C)SCC1CCCC1 62a_100000740388_100000758301 [1,0,0,1,0,0|2,0,0]=4 7088 B11R1.25 CCC(C)SCC1CCCC1 62a_100000758301_100000740388 [1,0,0,1,0,0|2,0,0]=4 7089 B11R1.25 CCC(O)CNC1CCCC1 2230a_100000211070_100011218378 [1,0,0,1,0,0|2,0,0]=4 7090 B11R1.25 CCC(O)CNC1CCCC1 2230a_100011218483_100000179811 [1,0,0,1,0,0|2,0,0]=4 7091 B11R1.25 CCC(O)CNC1CCCC1 270004a_100011218483_100000210133 [1,0,0,1,0,0|2,0,0]=4 7092 B11R1.25 CCC(O)CNC1CCCC1 34a_100000211070_100011218378 [1,0,0,1,0,0|2,0,0]=4 7093 B11R1.25 CCC(O)COC1CCCC1 34a_100000210269_100011218378 [1,0,0,1,0,0|2,0,0]=4 7094 B11R1.25 CCC(O)COC1CCCC1 7a_100000210269_100011218378 [1,0,0,1,0,0|2,0,0]=4 7095 B11R1.25 CCC(O)CSC1CCCC1 62a_100011217020_100011218378 [1,0,0,1,0,0|2,0,0]=4 7096 B11R1.25 CCC(O)CSC1CCCC1 62a_100011218378_100000179811 [1,0,0,1,0,0|2,0,0]=4 7097 B11R1.25 CCN(C)CCC1CCCC1 2230a_100000225621_100000760354 [1,0,0,1,0,0|2,0,0]=4 7098 B11R1.25 CCN(C)CCC1CCCC1 269982a_100000225621_100000760354 [1,0,0,1,0,0|2,0,0]=4 7099 B11R1.25 CC[C@H](C)CNC1CCCC1 2230a_100000211070_100009816398 [1,0,0,1,0,0|2,0,0]=4 7100 B11R1.25 CC[C@H](C)CNC1CCCC1 34a_100000211070_100009816398 [1,0,0,1,0,0|2,0,0]=4 7101 B11R1.25 CC[C@H](C)COC1CCCC1 34a_100000210269_100009816398 [1,0,0,1,0,0|2,0,0]=4 7102 B11R1.25 CC[C@H](C)COC1CCCC1 7a_100000210269_100009816398 [1,0,0,1,0,0|2,0,0]=4 7103 B11R1.25 CC[C@H](C)COC1CCCC1 7a_100009816381_100000179811 [1,0,0,1,0,0|2,0,0]=4 7104 B11R1.25 CC[C@H](C)CSC1CCCC1 62a_100009816398_100000179811 [1,0,0,1,0,0|2,0,0]=4 7105 B11R1.25 CC[C@H](C)CSC1CCCC1 62a_100011217020_100009816398 [1,0,0,1,0,0|2,0,0]=4 7106 B11R1.25 COC(C)COC1CCCC1 34a_100000690652_100000179811 [1,0,0,1,0,0|1,0,0]=3 7107 B11R1.25 COC(C)COC1CCOC1 34a_100000690652_100000690089 [1,0,0,1,0,0|2,0,0]=4 7108 B11R1.25 COC(C)SCC1CCCC1 62a_100000740388_100009879195 [1,0,0,1,0,0|1,0,0]=3 7109 B11R1.25 COC(C)SCC1CCCC1 62a_100009879195_100000740388 [1,0,0,1,0,0|1,0,0]=3 7110 B11R1.25 COC(C)SCC1CCCO1 62a_100000203698_100009879195 [1,0,0,1,0,0|2,0,0]=4 7111 B11R1.25 COC(C)SCC1CCCO1 62a_100009879195_100000203698 [1,0,0,1,0,0|2,0,0]=4 7112 B11R1.25 COC(C)SCC1CCOC1 62a_100000702531_100009879195 [1,0,0,1,0,0|2,0,0]=4 7113 B11R1.25 COC(C)SCC1CCOC1 62a_100009879195_100000702531 [1,0,0,1,0,0|2,0,0]=4 7114 B11R1.25 CO[C@H](C)CNC1CCCC1 2230a_100020591295_100000179811 [1,0,0,1,0,0|1,0,0]=3 7115 B11R1.25 CO[C@H](C)CNC1CCCC1 270004a_100020591295_100000210133 [1,0,0,1,0,0|1,0,0]=3 7116 B11R1.25 CO[C@H](C)CNC1CCOC1 2230a_100020591295_100000731011 [1,0,0,1,0,0|2,0,0]=4 7117 B11R1.25 CO[C@H](C)CNC1CCOC1 270004a_100020591295_100000752484 [1,0,0,1,0,0|2,0,0]=4 7118 B11R1.25 CO[C@H](C)CNC1CCSC1 270004a_100020591295_100000212027 [1,0,0,1,0,0|2,0,0]=4 7119 B11R1.27 CCCCCN1CCC(C1)O 2230a_100011215560_100000210326 [1,0,0,1,0,0|2,0,0]=4 7120 B11R1.27 CCCCCN1CCC(C1)O 269982a_100011215560_100000210215 [1,0,0,1,0,0|2,0,0]=4 7121 B11R1.27 CCCCCN1CC[C@H](C1)C 2230a_100016987628_100000210326 [1,0,0,1,0,0|2,0,0]=4 7122 B11R1.27 CCCCCN1CC[C@H](C1)C 269982a_100016987628_100000210215 [1,0,0,1,0,0|2,0,0]=4 7123 B11R1.27 CCCCCN1CC[C@H](C1)C 34a_100016987628_100000718602 [1,0,0,1,0,0|2,0,0]=4 7124 B11R1.27 CCCCNC1CCC(C1)C 270004a_100000102301_100011215218 [1,0,0,1,0,0|2,0,0]=4 7125 B11R1.27 CCCCNC1CCC(C1)O 270004a_100000102301_100012614533 [1,0,0,1,0,0|2,0,0]=4 7126 B11R1.27 CCCCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000210211 [1,0,0,1,0,0|2,0,0]=4 7127 B11R1.27 CCCCOC1CCC(C1)C 34a_100000698185_100000210210 [1,0,0,1,0,0|2,0,0]=4 7128 B11R1.40 CC(CN1CCCCC1)N[13CH3] 2230a_100000738326_200025704644 [1,0,0,1,0,0|2,0,0]=4 7129 B11R1.40 CC(CN1CCCCC1)S[13CH3] 62a_100009831500_200025704644 [1,0,0,1,0,0|1,1,0]=4 7130 B11R1.40 CC(CN1CCCCC1)S[13CH3] 62a_200025704644_100009831500 [1,0,0,1,0,0|1,1,0]=4 7131 B11R1.40 CCC(C)NC1CCCCC1 2230a_100000182618_100000758301 [1,0,0,1,0,0|2,0,0]=4 7132 B11R1.40 CCC(C)NC1CCCCC1 270004a_100000209981_100000210434 [1,0,0,1,0,0|2,0,0]=4 7133 B11R1.40 CCC(C)NC1CCCCC1 34a_100000182618_100011215416 [1,0,0,1,0,0|2,0,0]=4 7134 B11R1.40 CCC(C)OC1CCCCC1 34a_100000210231_100011215416 [1,0,0,1,0,0|2,0,0]=4 7135 B11R1.40 CCC(C)OC1CCCCC1 7a_100000210228_100000210327 [1,0,0,1,0,0|2,0,0]=4 7136 B11R1.40 CCC(C)OC1CCCCC1 7a_100000210231_100000758301 [1,0,0,1,0,0|2,0,0]=4 7137 B11R1.40 CCC(C)SC1CCCCC1 62a_100000210327_100000758301 [1,0,0,1,0,0|2,0,0]=4 7138 B11R1.40 CCC(C)SC1CCCCC1 62a_100000758301_100000210327 [1,0,0,1,0,0|2,0,0]=4 7139 B11R1.40 CCN(C)CC1CCCCC1 2230a_100000225621_100000211423 [1,0,0,1,0,0|2,0,0]=4 7140 B11R1.40 CCN(C)CC1CCCCC1 2230a_100000736448_100000210202 [1,0,0,1,0,0|2,0,0]=4 7141 B11R1.40 CCN(C)CC1CCCCC1 269982a_100000225621_100000211423 [1,0,0,1,0,0|2,0,0]=4 7142 B11R1.40 CCN(C)CC1CCCCC1 269982a_100000736448_100000204670 [1,0,0,1,0,0|2,0,0]=4 7143 B11R1.40 CCN(C)CC1CCCCC1 34a_100000736448_100000210202 [1,0,0,1,0,0|2,0,0]=4 7144 B11R1.40 CNC(C)CC1CCCCC1 270004a_106832991635_100011215996 [1,0,0,1,0,0|1,0,0]=3 7145 B11R1.40 CNC(C)CN1CCCCC1 2230a_100000738326_200000210301 [1,0,0,1,0,0|2,0,0]=4 7146 B11R1.40 COC(C)SC1CCCCC1 62a_100000210327_100009879195 [1,0,0,1,0,0|1,0,0]=3 7147 B11R1.40 COC(C)SC1CCCCC1 62a_100009879195_100000210327 [1,0,0,1,0,0|1,0,0]=3 7148 B11R1.40 COC(C)SC1CCCOC1 62a_100009879195_100000693364 [1,0,0,1,0,0|2,0,0]=4 7149 B11R1.40 COC(C)SC1CCOCC1 62a_100009879195_100011324220 [1,0,0,1,0,0|2,0,0]=4 7150 B11R1.40 COC(C)SC1CCSCC1 62a_100009879195_100000069128 [1,0,0,1,0,0|2,0,0]=4 7151 B11R1.40 CSC(C)CN1CCCCC1 62a_100009831500_200000210301 [1,0,0,1,0,0|1,1,0]=4 7152 B11R1.40 CSC(C)CN1CCCCC1 62a_200000210301_100009831500 [1,0,0,1,0,0|1,1,0]=4 7153 B11R1.46 CCCCCOCC1CC1C 34a_100000744939_100000718602 [1,0,0,1,0,0|2,0,0]=4 7154 B11R1.46 CCCCCOCC1CC1C 7a_100000744939_100000210326 [1,0,0,1,0,0|2,0,0]=4 7155 B11R1.47 BrCCCCOCC1CCO1 34a_100011216708_100000103362 [1,0,0,1,0,0|2,0,0]=4 7156 B11R1.47 CCCCCCCN1CCC1 269982a_100000754969_100000210681 [1,0,0,1,0,0|2,0,0]=4 7157 B11R1.47 CCCCCCNC1CCC1 2230a_100000749019_100000210314 [1,0,0,1,0,0|2,0,0]=4 7158 B11R1.47 CCCCCCNC1CCC1 270004a_100000210581_100000241760 [1,0,0,1,0,0|2,0,0]=4 7159 B11R1.47 CCCCCCNC1CCC1 34a_100000749019_100000210314 [1,0,0,1,0,0|2,0,0]=4 7160 B11R1.47 CCCCCCOC1CCC1 34a_100000210259_100000749161 [1,0,0,1,0,0|2,0,0]=4 7161 B11R1.47 CCCCCCOC1CCC1 34a_100000748187_100000210314 [1,0,0,1,0,0|2,0,0]=4 7162 B11R1.47 CCCCCCSC1CCC1 62a_100000210314_100000749161 [1,0,0,1,0,0|2,0,0]=4 7163 B11R1.47 CCCCCNCC1CCC1 2230a_100000209983_100000763275 [1,0,0,1,0,0|2,0,0]=4 7164 B11R1.47 CCCCCNCC1CCC1 2230a_100000738700_100000210326 [1,0,0,1,0,0|2,0,0]=4 7165 B11R1.47 CCCCCNCC1CCC1 269862a_100000209983_100000753134 [1,0,0,1,0,0|2,0,0]=4 7166 B11R1.47 CCCCCNCC1CCC1 34a_100000738700_100000718602 [1,0,0,1,0,0|2,0,0]=4 7167 B11R1.47 CCCCCNCC1CCO1 2230a_100000209983_100000103362 [1,0,0,1,0,0|1,0,0]=3 7168 B11R1.47 CCCCCNC[C@@H]1CCO1 2230a_100020831831_100000210326 [1,0,0,1,0,0|1,0,0]=3 7169 B11R1.47 CCCCCNC[C@@H]1CCO1 34a_100020831831_100000718602 [1,0,0,1,0,0|1,0,0]=3 7170 B11R1.47 CCCCCOCC1CCC1 34a_100000210253_100000763275 [1,0,0,1,0,0|2,0,0]=4 7171 B11R1.47 CCCCCOCC1CCC1 34a_100000760304_100000718602 [1,0,0,1,0,0|2,0,0]=4 7172 B11R1.47 CCCCCOCC1CCC1 7a_100000210253_100000763275 [1,0,0,1,0,0|2,0,0]=4 7173 B11R1.47 CCCCCOCC1CCO1 34a_100000039022_100000718602 [1,0,0,1,0,0|1,0,0]=3 7174 B11R1.47 CCCCCOCC1CCO1 34a_100000210253_100000103362 [1,0,0,1,0,0|1,0,0]=3 7175 B11R1.47 CCCCCOCC1CCO1 7a_100000210253_100000103362 [1,0,0,1,0,0|1,0,0]=3 7176 B11R1.47 CCCCCSCC1CCC1 62a_100000210326_100000763275 [1,0,0,1,0,0|2,0,0]=4 7177 B11R1.47 CCCCCSCC1CCC1 62a_100000763275_100000210326 [1,0,0,1,0,0|2,0,0]=4 7178 B11R1.47 CCCCCSCC1CCO1 62a_100000103362_100000210326 [1,0,0,1,0,0|1,0,0]=3 7179 B11R1.47 CCCCCSCC1CCO1 62a_100000210326_100000103362 [1,0,0,1,0,0|1,0,0]=3 7180 B11R1.47 CCOCCNCC1CCO1 2230a_102516460346_100000103362 [1,0,0,1,0,0|2,0,0]=4 7181 B11R1.47 CCOCCNCC1CCO1 34a_102516460346_100000103362 [1,0,0,1,0,0|2,0,0]=4 7182 B11R1.47 CCOCCNC[C@@H]1CCO1 2230a_100020831831_100011215890 [1,0,0,1,0,0|2,0,0]=4 7183 B11R1.47 CCOCCNC[C@@H]1CCO1 34a_100020831831_100000210147 [1,0,0,1,0,0|2,0,0]=4 7184 B11R1.47 CCOCCOCC1CCO1 34a_100000039022_100000210147 [1,0,0,1,0,0|2,0,0]=4 7185 B11R1.47 CCOCCOCC1CCO1 34a_100000210136_100000103362 [1,0,0,1,0,0|2,0,0]=4 7186 B11R1.47 CCOCCOCC1CCO1 7a_100000210136_100000103362 [1,0,0,1,0,0|2,0,0]=4 7187 B11R1.47 CCOCCSCC1CCO1 62a_100000103362_100011215890 [1,0,0,1,0,0|2,0,0]=4 7188 B11R1.47 CCOCCSCC1CCO1 62a_100000210147_100000103362 [1,0,0,1,0,0|2,0,0]=4 7189 B11R1.47 CCSCCNCC1CCO1 2230a_100000106463_100000103362 [1,0,0,1,0,0|2,0,0]=4 7190 B11R1.47 CCSCCNC[C@@H]1CCO1 2230a_100020831831_100000757381 [1,0,0,1,0,0|2,0,0]=4 7191 B11R1.47 CCSCCNC[C@@H]1CCO1 34a_100020831831_100000757381 [1,0,0,1,0,0|2,0,0]=4 7192 B11R1.47 CCSCCOCC1CCO1 34a_100000039022_100000757381 [1,0,0,1,0,0|2,0,0]=4 7193 B11R1.47 CCSCCOCC1CCO1 34a_100000212035_100000103362 [1,0,0,1,0,0|2,0,0]=4 7194 B11R1.47 CCSCCOCC1CCO1 7a_100000212035_100000103362 [1,0,0,1,0,0|2,0,0]=4 7195 B11R1.47 CCSCCSCC1CCO1 62a_100000103362_100000757381 [1,0,0,1,0,0|2,0,0]=4 7196 B11R1.47 CCSCCSCC1CCO1 62a_100000757381_100000103362 [1,0,0,1,0,0|2,0,0]=4 7197 B11R1.47 CNCCCOCC1CCO1 34a_100000213112_100000103362 [1,0,0,1,0,0|2,0,0]=4 7198 B11R1.47 COCCCNCC1CCO1 34a_100150723488_100000103362 [1,0,0,1,0,0|2,0,0]=4 7199 B11R1.47 COCCCNC[C@@H]1CCO1 2230a_100020831831_100000740836 [1,0,0,1,0,0|2,0,0]=4 7200 B11R1.47 COCCCNC[C@@H]1CCO1 34a_100020831831_100000740836 [1,0,0,1,0,0|2,0,0]=4 7201 B11R1.47 COCCCOCC1CCO1 34a_100000039022_100000740836 [1,0,0,1,0,0|2,0,0]=4 7202 B11R1.47 COCCCOCC1CCO1 34a_100000740835_100000103362 [1,0,0,1,0,0|2,0,0]=4 7203 B11R1.47 COCCCSCC1CCO1 62a_100000103362_100000709357 [1,0,0,1,0,0|2,0,0]=4 7204 B11R1.47 COCCCSCC1CCO1 62a_100000709357_100000103362 [1,0,0,1,0,0|2,0,0]=4 7205 B11R1.47 CSCCCNCC1CCO1 2230a_100000749238_100000103362 [1,0,0,1,0,0|2,0,0]=4 7206 B11R1.47 CSCCCOCC1CCO1 34a_100000690336_100000103362 [1,0,0,1,0,0|2,0,0]=4 7207 B11R1.47 CSCCCOCC1CCO1 7a_100000690336_100000103362 [1,0,0,1,0,0|2,0,0]=4 7208 B11R1.47 ClCCCCOCC1CCO1 34a_100000210776_100000103362 [1,0,0,1,0,0|2,0,0]=4 7209 B11R1.47 ClCCCCOCC1CCO1 7a_100000210776_100000103362 [1,0,0,1,0,0|2,0,0]=4 7210 B11R1.47 FCCCCNC[C@@H]1CCO1 2230a_100020831831_100000729493 [1,0,0,1,0,0|2,0,0]=4 7211 B11R1.47 FCCCCNC[C@@H]1CCO1 34a_100020831831_100000729493 [1,0,0,1,0,0|2,0,0]=4 7212 B11R1.47 FCCCCOCC1CCO1 34a_100000039022_100000729493 [1,0,0,1,0,0|2,0,0]=4 7213 B11R1.47 FCCCCOCC1CCO1 34a_100011995726_100000103362 [1,0,0,1,0,0|2,0,0]=4 7214 B11R1.47 FCCCCOCC1CCO1 7a_100011995726_100000103362 [1,0,0,1,0,0|2,0,0]=4 7215 B11R1.47 FCCCCSCC1CCO1 62a_100000103362_100000729493 [1,0,0,1,0,0|2,0,0]=4 7216 B11R1.47 FCCCCSCC1CCO1 62a_100000729493_100000103362 [1,0,0,1,0,0|2,0,0]=4 7217 B11R1.47 ICCCCOCC1CCO1 34a_200012148704_100000103362 [1,0,0,1,0,0|2,0,0]=4 7218 B11R1.47 NCCCCOCC1CCO1 34a_100000750430_100000103362 [1,0,0,1,0,0|2,0,0]=4 7219 B11R1.47 OCCCCNCC1CCO1 2230a_100000750430_100000103362 [1,0,0,1,0,0|2,0,0]=4 7220 B11R1.47 OCCCCNCC1CCO1 34a_100000750430_100000103362 [1,0,0,1,0,0|2,0,0]=4 7221 B11R1.47 OCCCCNC[C@@H]1CCO1 2230a_100020831831_100000210776 [1,0,0,1,0,0|2,0,0]=4 7222 B11R1.47 OCCCCNC[C@@H]1CCO1 34a_100020831831_100011216708 [1,0,0,1,0,0|2,0,0]=4 7223 B11R1.47 OCCCCOCC1CCO1 34a_100000039022_100011216708 [1,0,0,1,0,0|2,0,0]=4 7224 B11R1.47 OCCCCSCC1CCO1 62a_100000103362_100000210776 [1,0,0,1,0,0|2,0,0]=4 7225 B11R1.47 OCCCCSCC1CCO1 62a_100000210776_100000103362 [1,0,0,1,0,0|2,0,0]=4 7226 B11R1.59 CCC(C)N1CCCC1CC 2230a_100000754278_100000758301 [1,0,0,1,0,0|2,0,0]=4 7227 B11R1.59 CCC(C)N1CCCC1CC 269982a_100000754278_100000758301 [1,0,0,1,0,0|2,0,0]=4 7228 B11R1.59 CCC(C)N1CCCC1CC 34a_100000754278_100011215416 [1,0,0,1,0,0|2,0,0]=4 7229 B11R1.59 CCC1CCCN1C(C)OC 269982a_100000754278_100009879195 [1,0,0,1,0,0|1,0,0]=3 7230 B11R1.59 COC(C)N1CCC[C@@H]1CO 269982a_100000745186_100009879195 [1,0,0,1,0,0|2,0,0]=4 7231 B11R1.115 COCC1CCN1C(C)OC 269982a_100015195929_100009879195 [1,0,0,1,0,0|2,0,0]=4 7232 B11R1.135 CCCN1CCCC(CC1)C 2230a_100025706717_100000210303 [1,0,0,1,0,0|2,0,0]=4 7233 B11R1.135 CCCN1CCCC(CC1)C 269982a_100025706717_100000210303 [1,0,0,1,0,0|2,0,0]=4 7234 B11R1.135 CCCN1CCCC(CC1)C 34a_100025706717_100000210303 [1,0,0,1,0,0|2,0,0]=4 7235 B11R1.135 CCCN1CCCC(CC1)O 2230a_100015186869_100000210303 [1,0,0,1,0,0|2,0,0]=4 7236 B11R1.135 CCCN1CCCC(CC1)O 269982a_100015186869_100000210303 [1,0,0,1,0,0|2,0,0]=4 7237 B11R1.189 CCCC1CC(CCN1)NC 270004a_106832991635_100016991347 [1,0,0,1,0,0|2,0,0]=4 7238 B11R1.189 CCCN1CCCC(C1)NC 2230a_100011435248_200000210301 [1,0,0,1,0,0|2,0,0]=4 7239 B11R1.189 CCCN1CCCC(C1)N[13CH3] 2230a_100011435248_200025704644 [1,0,0,1,0,0|2,0,0]=4 7240 B11R1.189 CCCN1CCCC(C1)OC 2230a_100000695604_100000210303 [1,0,0,1,0,0|1,0,0]=3 7241 B11R1.189 CCCN1CCCC(C1)OC 269982a_100000695604_100000210303 [1,0,0,1,0,0|1,0,0]=3 7242 B11R1.189 CCCN1CCCC(C1)OC 34a_100000695604_100000210303 [1,0,0,1,0,0|1,0,0]=3 7243 B11R1.189 CCNC1CCCC(C1)CC 270004a_100015525214_100000756783 [1,0,0,1,0,0|2,0,0]=4 7244 B11R1.189 CCNC1CCCC(C1)SC 270004a_100015525214_100012138059 [1,0,0,1,0,0|1,1,0]=4 7245 B11R1.189 CCOC1CCCC(C1)CC 7a_100011985506_100000210202 [1,0,0,1,0,0|2,0,0]=4 7246 B11R1.189 COC1CCCN(C1)CCF 2230a_100000695604_100011217306 [1,0,0,1,0,0|2,0,0]=4 7247 B11R1.189 COC1CCCN(C1)CCF 269982a_100000695604_100011217306 [1,0,0,1,0,0|2,0,0]=4 7248 B11R1.189 COC1CCCN(C1)CCF 34a_100000695604_100011217306 [1,0,0,1,0,0|2,0,0]=4 7249 B11R1.189 COC1CCCN(C1)CCO 2230a_100000695604_100000211926 [1,0,0,1,0,0|2,0,0]=4 7250 B11R1.189 COC1CCCN(C1)CCO 269982a_100000695604_100000211926 [1,0,0,1,0,0|2,0,0]=4 7251 B11R1.189 COC1CCCN(C1)CCO 34a_100000695604_100000211926 [1,0,0,1,0,0|2,0,0]=4 7252 B11R1.189 COC1CCCN(C1)CSC 2230a_100000695604_100011218213 [1,0,0,1,0,0|2,0,0]=4 7253 B11R1.189 COC1CCCN(C1)CSC 269982a_100000695604_100011218213 [1,0,0,1,0,0|2,0,0]=4 7254 B11R1.189 COC1CCCN(C1)CSC 34a_100000695604_100011218213 [1,0,0,1,0,0|2,0,0]=4 7255 B11R1.189 COCN1CCCC(C1)OC 2230a_100000695604_100000766300 [1,0,0,1,0,0|2,0,0]=4 7256 B11R1.189 COCN1CCCC(C1)OC 269982a_100000695604_100000766300 [1,0,0,1,0,0|2,0,0]=4 7257 B11R1.222 CCC(C)N1CCCCC1C 2230a_100000211376_100000758301 [1,0,0,1,0,0|2,0,0]=4 7258 B11R1.222 CCC(C)N1CCCCC1C 269982a_100000211376_100000758301 [1,0,0,1,0,0|2,0,0]=4 7259 B11R1.222 CCC(C)N1CCCCC1C 34a_100000211376_100011215416 [1,0,0,1,0,0|2,0,0]=4 7260 B11R1.222 COC(C)N1CCCCC1C 269982a_100000211376_100009879195 [1,0,0,1,0,0|1,0,0]=3 7261 B11R1.222 COC(C)N1CCOC[C@@H]1C 269982a_100009815349_100009879195 [1,0,0,1,0,0|2,0,0]=4 7262 B11R1.228 CCC(C)CN1CCC[C@@H]1C 2230a_100020605311_100000748023 [1,0,0,1,0,0|2,0,0]=4 7263 B11R1.228 CCC(C)CN1CCC[C@@H]1C 269982a_100020605311_100000748023 [1,0,0,1,0,0|2,0,0]=4 7264 B11R1.228 CCC(C)CN1CCC[C@@H]1C 270004a_100020605311_100000243153 [1,0,0,1,0,0|2,0,0]=4 7265 B11R1.228 CCC(C)CN1CCC[C@H]1C 2230a_100015189458_100000748023 [1,0,0,1,0,0|2,0,0]=4 7266 B11R1.228 CCC(C)CN1CCC[C@H]1C 269982a_100015189458_100000748023 [1,0,0,1,0,0|2,0,0]=4 7267 B11R1.228 CCC(C)CN1CCC[C@H]1C 270004a_100015189458_100000243153 [1,0,0,1,0,0|2,0,0]=4 7268 B11R1.228 CCC(C)CN1CCC[C@H]1C 34a_100015189458_100000748023 [1,0,0,1,0,0|2,0,0]=4 7269 B11R1.228 CCC(C)NC1CCCC1C 269862a_100000209981_100000752053 [1,0,0,1,0,0|2,0,0]=4 7270 B11R1.228 CCC(C)OC1CCCC1C 34a_100011216460_100011215416 [1,0,0,1,0,0|2,0,0]=4 7271 B11R1.228 CCC(C)OC1CCCC1C 7a_100011216460_100000758301 [1,0,0,1,0,0|2,0,0]=4 7272 B11R1.228 CCC(O)CN1CCC[C@@H]1C 2230a_100020605311_100011218378 [1,0,0,1,0,0|2,0,0]=4 7273 B11R1.228 CCC(O)CN1CCC[C@@H]1C 269982a_100020605311_100011218378 [1,0,0,1,0,0|2,0,0]=4 7274 B11R1.228 CCC(O)CN1CCC[C@H]1C 2230a_100015189458_100011218378 [1,0,0,1,0,0|2,0,0]=4 7275 B11R1.228 CCC(O)CN1CCC[C@H]1C 269982a_100015189458_100011218378 [1,0,0,1,0,0|2,0,0]=4 7276 B11R1.228 CCC(O)CN1CCC[C@H]1C 34a_100015189458_100011218378 [1,0,0,1,0,0|2,0,0]=4 7277 B11R1.228 CC[C@H](C)CN1CCC[C@@H]1C 2230a_100020605311_100009816398 [1,0,0,1,0,0|2,0,0]=4 7278 B11R1.228 CC[C@H](C)CN1CCC[C@@H]1C 269982a_100020605311_100009816398 [1,0,0,1,0,0|2,0,0]=4 7279 B11R1.228 CC[C@H](C)CN1CCC[C@H]1C 2230a_100015189458_100009816398 [1,0,0,1,0,0|2,0,0]=4 7280 B11R1.228 CC[C@H](C)CN1CCC[C@H]1C 269982a_100015189458_100009816398 [1,0,0,1,0,0|2,0,0]=4 7281 B11R1.228 CC[C@H](C)CN1CCC[C@H]1C 34a_100015189458_100009816398 [1,0,0,1,0,0|2,0,0]=4 7282 B11R1.228 COC(C)S[C@@H]1CCC[C@H]1O 62a_100009879195_200016002552 [1,0,0,1,0,0|2,0,0]=4 7283 B11R1.228 COC(C)S[C@@H]1CCC[C@H]1O 62a_200016002552_100009879195 [1,0,0,1,0,0|2,0,0]=4 7284 B11R1.235 CCC(C)COCC1CC1C 34a_100000744939_100000748023 [1,0,0,1,0,0|2,0,0]=4 7285 B11R1.235 CCC(C)COCC1CC1C 7a_100000744939_100000748023 [1,0,0,1,0,0|2,0,0]=4 7286 B11R1.235 CCC(O)COCC1CC1C 34a_100000744939_100011218378 [1,0,0,1,0,0|2,0,0]=4 7287 B11R1.235 CCC(O)COCC1CC1C 7a_100000744939_100011218378 [1,0,0,1,0,0|2,0,0]=4 7288 B11R1.235 CC[C@H](C)COCC1CC1C 34a_100000744939_100009816398 [1,0,0,1,0,0|2,0,0]=4 7289 B11R1.235 CC[C@H](C)COCC1CC1C 7a_100000744939_100009816398 [1,0,0,1,0,0|2,0,0]=4 7290 B11R1.236 CCC(C)CCNC1CCC1 270004a_100020591266_100000241760 [1,0,0,1,0,0|2,0,0]=4 7291 B11R1.236 CCC(C)CNCC1CCC1 2230a_100000738700_100000748023 [1,0,0,1,0,0|2,0,0]=4 7292 B11R1.236 CCC(C)CNCC1CCC1 2230a_100020588543_100000763275 [1,0,0,1,0,0|2,0,0]=4 7293 B11R1.236 CCC(C)CNCC1CCC1 269862a_100020588543_100000753134 [1,0,0,1,0,0|2,0,0]=4 7294 B11R1.236 CCC(C)CNCC1CCC1 270004a_100000738700_100000243153 [1,0,0,1,0,0|2,0,0]=4 7295 B11R1.236 CCC(C)CNCC1CCC1 34a_100000738700_100000748023 [1,0,0,1,0,0|2,0,0]=4 7296 B11R1.236 CCC(C)COCC1CCC1 34a_100000760304_100000748023 [1,0,0,1,0,0|2,0,0]=4 7297 B11R1.236 CCC(C)CSCC1CCC1 62a_100000748023_100000763275 [1,0,0,1,0,0|2,0,0]=4 7298 B11R1.236 CCC(C)CSCC1CCC1 62a_100000763275_100000748023 [1,0,0,1,0,0|2,0,0]=4 7299 B11R1.236 CCC(O)CNCC1CCC1 2230a_100000738700_100011218378 [1,0,0,1,0,0|2,0,0]=4 7300 B11R1.236 CCC(O)CNCC1CCC1 2230a_100011218483_100000763275 [1,0,0,1,0,0|2,0,0]=4 7301 B11R1.236 CCC(O)CNCC1CCC1 269862a_100011218483_100000753134 [1,0,0,1,0,0|2,0,0]=4 7302 B11R1.236 CCC(O)CNCC1CCC1 34a_100000738700_100011218378 [1,0,0,1,0,0|2,0,0]=4 7303 B11R1.236 CCC(O)COCC1CCC1 34a_100000760304_100011218378 [1,0,0,1,0,0|2,0,0]=4 7304 B11R1.236 CCC(O)CSCC1CCC1 62a_100000763275_100011218378 [1,0,0,1,0,0|2,0,0]=4 7305 B11R1.236 CCC(O)CSCC1CCC1 62a_100011218378_100000763275 [1,0,0,1,0,0|2,0,0]=4 7306 B11R1.236 CC[C@H](C)CNCC1CCC1 2230a_100000738700_100009816398 [1,0,0,1,0,0|2,0,0]=4 7307 B11R1.236 CC[C@H](C)CNCC1CCC1 34a_100000738700_100009816398 [1,0,0,1,0,0|2,0,0]=4 7308 B11R1.236 CC[C@H](C)COCC1CCC1 34a_100000760304_100009816398 [1,0,0,1,0,0|2,0,0]=4 7309 B11R1.236 CC[C@H](C)COCC1CCC1 7a_100009816381_100000763275 [1,0,0,1,0,0|2,0,0]=4 7310 B11R1.236 CC[C@H](C)CSCC1CCC1 62a_100000763275_100009816398 [1,0,0,1,0,0|2,0,0]=4 7311 B11R1.236 CC[C@H](C)CSCC1CCC1 62a_100009816398_100000763275 [1,0,0,1,0,0|2,0,0]=4 7312 B11R1.236 COC(C)CCOC1COC1 7a_100000764861_100009818527 [1,0,0,1,0,0|2,0,0]=4 7313 B11R1.236 COC(C)COCC1CCC1 34a_100000690652_100000763275 [1,0,0,1,0,0|1,0,0]=3 7314 B11R1.236 COC(C)COCC1CCO1 34a_100000690652_100000103362 [1,0,0,1,0,0|2,0,0]=4 7315 B11R1.236 COC(C)COCC1COC1 34a_100000690652_100010264016 [1,0,0,1,0,0|2,0,0]=4 7316 B11R1.236 CO[C@H](C)CNCC1CCC1 2230a_100020591295_100000763275 [1,0,0,1,0,0|1,0,0]=3 7317 B11R1.236 CO[C@H](C)CNCC1CCC1 269862a_100020591295_100000753134 [1,0,0,1,0,0|1,0,0]=3 7318 B11R1.236 CO[C@H](C)CNCC1CCO1 2230a_100020591295_100000103362 [1,0,0,1,0,0|2,0,0]=4 7319 B11R1.236 CO[C@H](C)CNCC1COC1 2230a_100020591295_100010264016 [1,0,0,1,0,0|2,0,0]=4 7320 B11R1.237 CCC(C)CCNCC1CC1 2230a_100020591266_100000742324 [1,0,0,1,0,0|2,0,0]=4 7321 B11R1.237 CCC(C)CCNCC1CC1 269862a_100020591266_100000741477 [1,0,0,1,0,0|2,0,0]=4 7322 B11R1.237 CCC(C)CCOCC1CC1 7a_100011215188_100000742324 [1,0,0,1,0,0|2,0,0]=4 7323 B11R1.237 CCC(C)CNCCC1CC1 2230a_100020588543_100000694398 [1,0,0,1,0,0|2,0,0]=4 7324 B11R1.237 CCC(C)CNCCC1CC1 270004a_100000764129_100000243153 [1,0,0,1,0,0|2,0,0]=4 7325 B11R1.237 CCC(C)CNCCC1CC1 34a_100000764129_100000748023 [1,0,0,1,0,0|2,0,0]=4 7326 B11R1.237 CCC(C)COCCC1CC1 34a_100000754188_100000748023 [1,0,0,1,0,0|2,0,0]=4 7327 B11R1.237 CCC(C)COCCC1CC1 7a_100000754188_100000748023 [1,0,0,1,0,0|2,0,0]=4 7328 B11R1.237 CCC(C)CSCCC1CC1 62a_100000748023_100000764125 [1,0,0,1,0,0|2,0,0]=4 7329 B11R1.237 CCC(C)CSCCC1CC1 62a_100000764125_100000748023 [1,0,0,1,0,0|2,0,0]=4 7330 B11R1.237 CCC(O)CNCCC1CC1 2230a_100011218483_100000694398 [1,0,0,1,0,0|2,0,0]=4 7331 B11R1.237 CCC(O)CNCCC1CC1 34a_100000764129_100011218378 [1,0,0,1,0,0|2,0,0]=4 7332 B11R1.237 CCC(O)COCCC1CC1 34a_100000754188_100011218378 [1,0,0,1,0,0|2,0,0]=4 7333 B11R1.237 CCC(O)COCCC1CC1 7a_100000754188_100011218378 [1,0,0,1,0,0|2,0,0]=4 7334 B11R1.237 CCC(O)CSCCC1CC1 62a_100000764125_100011218378 [1,0,0,1,0,0|2,0,0]=4 7335 B11R1.237 CCC(O)CSCCC1CC1 62a_100011218378_100000764125 [1,0,0,1,0,0|2,0,0]=4 7336 B11R1.237 CC[C@H](C)CNCCC1CC1 34a_100000764129_100009816398 [1,0,0,1,0,0|2,0,0]=4 7337 B11R1.237 CC[C@H](C)COCCC1CC1 34a_100000754188_100009816398 [1,0,0,1,0,0|2,0,0]=4 7338 B11R1.237 CC[C@H](C)COCCC1CC1 7a_100000754188_100009816398 [1,0,0,1,0,0|2,0,0]=4 7339 B11R1.237 CC[C@H](C)COCCC1CC1 7a_100009816381_100000764125 [1,0,0,1,0,0|2,0,0]=4 7340 B11R1.237 CC[C@H](C)CSCCC1CC1 62a_100000764125_100009816398 [1,0,0,1,0,0|2,0,0]=4 7341 B11R1.237 CC[C@H](C)CSCCC1CC1 62a_100009816398_100000764125 [1,0,0,1,0,0|2,0,0]=4 7342 B11R1.237 COC(C)CCOCC1CC1 7a_100000764861_100000742324 [1,0,0,1,0,0|1,0,0]=3 7343 B11R1.237 COC(C)CCOCC1CO1 7a_100000764861_102125554688 [1,0,0,1,0,0|2,0,0]=4 7344 B11R1.237 COC(C)CCOCC1CS1 7a_100000764861_100000031435 [1,0,0,1,0,0|2,0,0]=4 7345 B11R1.237 COC(C)CCOC[C@@H]1CO1 7a_100000764861_100000745022 [1,0,0,1,0,0|2,0,0]=4 7346 B11R1.237 COC(C)COCCC1CC1 34a_100000690652_100000694398 [1,0,0,1,0,0|1,0,0]=3 7347 B11R1.237 COC(C)COCCC1CO1 34a_100000690652_100000732470 [1,0,0,1,0,0|2,0,0]=4 7348 B11R1.237 COC(C)SCCCC1CO1 62a_100000733510_100009879195 [1,0,0,1,0,0|2,0,0]=4 7349 B11R1.237 COC(C)SCCCC1CO1 62a_100009879195_100000733510 [1,0,0,1,0,0|2,0,0]=4 7350 B11R1.237 CO[C@H](C)CNCCC1CC1 2230a_100020591295_100000694398 [1,0,0,1,0,0|1,0,0]=3 7351 B11R1.237 CO[C@H](C)CNCCC1CO1 2230a_100020591295_100000732470 [1,0,0,1,0,0|2,0,0]=4 7352 B11R1.320 CC1(CO1)CNCCCCO 34a_100000750430_100000760498 [1,0,0,1,0,0|2,0,0]=4 7353 B11R1.320 CC1(CO1)COCCCCBr 34a_100011216708_100000760498 [1,0,0,1,0,0|2,0,0]=4 7354 B11R1.320 CC1(CO1)COCCCCCl 34a_100000210776_100000760498 [1,0,0,1,0,0|2,0,0]=4 7355 B11R1.320 CC1(CO1)COCCCCF 34a_100011995726_100000760498 [1,0,0,1,0,0|2,0,0]=4 7356 B11R1.320 CC1(CO1)COCCCCI 34a_200012148704_100000760498 [1,0,0,1,0,0|2,0,0]=4 7357 B11R1.320 CC1(CO1)COCCCCN 34a_100000750430_100000760498 [1,0,0,1,0,0|2,0,0]=4 7358 B11R1.320 CC1(CO1)CSCCCCF 62a_100000729493_100000760498 [1,0,0,1,0,0|2,0,0]=4 7359 B11R1.320 CC1(CO1)CSCCCCF 62a_100000760498_100000729493 [1,0,0,1,0,0|2,0,0]=4 7360 B11R1.320 CC1(CO1)CSCCCCO 62a_100000210776_100000760498 [1,0,0,1,0,0|2,0,0]=4 7361 B11R1.320 CC1(CO1)CSCCCCO 62a_100000760498_100000210776 [1,0,0,1,0,0|2,0,0]=4 7362 B11R1.320 CCCCCCNC1(CC1)C 2230a_100000757604_100000210314 [1,0,0,1,0,0|2,0,0]=4 7363 B11R1.320 CCCCCCOC1(CC1)C 7a_100011725673_100000210314 [1,0,0,1,0,0|2,0,0]=4 7364 B11R1.320 CCCCCNCC1(CC1)C 2230a_100000766693_100000210326 [1,0,0,1,0,0|2,0,0]=4 7365 B11R1.320 CCCCCNCC1(CC1)O 2230a_100011936951_100000210326 [1,0,0,1,0,0|2,0,0]=4 7366 B11R1.320 CCCCCOCC1(CC1)C 7a_100000698024_100000210326 [1,0,0,1,0,0|2,0,0]=4 7367 B11R1.320 CCCCCOCC1(CO1)C 34a_100000210253_100000760498 [1,0,0,1,0,0|1,0,0]=3 7368 B11R1.320 CCCCCSCC1(CO1)C 62a_100000210326_100000760498 [1,0,0,1,0,0|1,0,0]=3 7369 B11R1.320 CCCCCSCC1(CO1)C 62a_100000760498_100000210326 [1,0,0,1,0,0|1,0,0]=3 7370 B11R1.320 CCOCCNCC1(CO1)C 34a_102516460346_100000760498 [1,0,0,1,0,0|2,0,0]=4 7371 B11R1.320 CCOCCOCC1(CO1)C 34a_100000210136_100000760498 [1,0,0,1,0,0|2,0,0]=4 7372 B11R1.320 CCOCCSCC1(CO1)C 62a_100000210147_100000760498 [1,0,0,1,0,0|2,0,0]=4 7373 B11R1.320 CCOCCSCC1(CO1)C 62a_100000760498_100011215890 [1,0,0,1,0,0|2,0,0]=4 7374 B11R1.320 CCSCCOCC1(CO1)C 34a_100000212035_100000760498 [1,0,0,1,0,0|2,0,0]=4 7375 B11R1.320 CCSCCSCC1(CO1)C 62a_100000757381_100000760498 [1,0,0,1,0,0|2,0,0]=4 7376 B11R1.320 CCSCCSCC1(CO1)C 62a_100000760498_100000757381 [1,0,0,1,0,0|2,0,0]=4 7377 B11R1.320 CNCCCOCC1(CO1)C 34a_100000213112_100000760498 [1,0,0,1,0,0|2,0,0]=4 7378 B11R1.320 COCCCNCC1(CO1)C 34a_100150723488_100000760498 [1,0,0,1,0,0|2,0,0]=4 7379 B11R1.320 COCCCOCC1(CO1)C 34a_100000740835_100000760498 [1,0,0,1,0,0|2,0,0]=4 7380 B11R1.320 COCCCSCC1(CO1)C 62a_100000709357_100000760498 [1,0,0,1,0,0|2,0,0]=4 7381 B11R1.320 COCCCSCC1(CO1)C 62a_100000760498_100000709357 [1,0,0,1,0,0|2,0,0]=4 7382 B11R1.320 CSCCCOCC1(CO1)C 34a_100000690336_100000760498 [1,0,0,1,0,0|2,0,0]=4 7383 B11R1.757 CCCCCN1C[C@@H]([C@@H]1C)O 2230a_206633788156_100000210326 [1,0,0,1,0,0|2,0,0]=4 7384 B11R1.757 CCCCCN1C[C@@H]([C@@H]1C)O 269982a_206633788156_100000210215 [1,0,0,1,0,0|2,0,0]=4 7385 B11R1.759 CCCCCN1CC(C1)CC 2230a_100015205115_100000210326 [1,0,0,1,0,0|2,0,0]=4 7386 B11R1.759 CCCCCN1CC(C1)CC 269982a_100015205115_100000210215 [1,0,0,1,0,0|2,0,0]=4 7387 B11R1.759 CCCCCN1CC(C1)OC 269982a_100000755009_100000210215 [1,0,0,1,0,0|1,0,0]=3 7388 B11R1.759 CCCCCN1CC(C1)SC 269982a_100016990038_100000210215 [1,0,0,1,0,0|1,1,0]=4 7389 B11R1.759 CCCCN[C@H]1C[C@@H](C1)OC 2230a_100121570643_100000210211 [1,0,0,1,0,0|1,0,0]=3 7390 B11R1.759 CCOCCN1CC(C1)OC 269982a_100000755009_100011215890 [1,0,0,1,0,0|2,0,0]=4 7391 B11R1.759 CCSCCN1CC(C1)OC 269982a_100000755009_100000757381 [1,0,0,1,0,0|2,0,0]=4 7392 B11R1.759 COC1CN(C1)CCCCF 269982a_100000755009_100000729493 [1,0,0,1,0,0|2,0,0]=4 7393 B11R1.759 COC1CN(C1)CCCCO 269982a_100000755009_100000210776 [1,0,0,1,0,0|2,0,0]=4 7394 B11R1.759 COCCCN1CC(C1)OC 269982a_100000755009_100000740836 [1,0,0,1,0,0|2,0,0]=4 7395 B11R1.759 COCCN[C@H]1C[C@@H](C1)OC 2230a_100121570643_100011201679 [1,0,0,1,0,0|2,0,0]=4 7396 B11R1.759 CO[C@H]1C[C@@H](C1)NCCCF 2230a_100121570643_100011934791 [1,0,0,1,0,0|2,0,0]=4 7397 B11R1.759 CO[C@H]1C[C@@H](C1)NCCCO 2230a_100121570643_100000230001 [1,0,0,1,0,0|2,0,0]=4 7398 B11R1.759 CO[C@H]1C[C@@H](C1)NCCSC 2230a_100121570643_100000751147 [1,0,0,1,0,0|2,0,0]=4 7399 B11R1.852 CCC(C)N1CCCCCC1 2230a_100000185865_100000758301 [1,0,0,1,0,0|2,0,0]=4 7400 B11R1.852 CCC(C)N1CCCCCC1 269982a_100000185865_100000758301 [1,0,0,1,0,0|2,0,0]=4 7401 B11R1.852 CCC(C)N1CCCCCC1 34a_100000185865_100011215416 [1,0,0,1,0,0|2,0,0]=4 7402 B11R1.852 CCN(C)C1CCCCCC1 2230a_100015185097_100000210202 [1,0,0,1,0,0|2,0,0]=4 7403 B11R1.852 CCN(C)C1CCCCCC1 2230a_114901603759_200000210301 [1,0,0,1,0,0|2,0,0]=4 7404 B11R1.852 CCN(C)C1CCCCCC1 269982a_100000225621_100011217769 [1,0,0,1,0,0|2,0,0]=4 7405 B11R1.852 CCN(C)C1CCCCCC1 269982a_100015185097_100000204670 [1,0,0,1,0,0|2,0,0]=4 7406 B11R1.852 CCN(C)C1CCCCCC1 269982a_114901603759_200000210301 [1,0,0,1,0,0|2,0,0]=4 7407 B11R1.852 CCN(C)C1CCCCCC1 34a_100015185097_100000210202 [1,0,0,1,0,0|2,0,0]=4 7408 B11R1.852 CCN(C)C1CCCCCC1 34a_114901603759_200000210301 [1,0,0,1,0,0|2,0,0]=4 7409 B11R1.852 CCN([13CH3])C1CCCCCC1 2230a_114901603759_200025704644 [1,0,0,1,0,0|2,0,0]=4 7410 B11R1.852 CCN([13CH3])C1CCCCCC1 269982a_114901603759_200025704644 [1,0,0,1,0,0|2,0,0]=4 7411 B11R1.852 CCN([13CH3])C1CCCCCC1 34a_114901603759_200025704644 [1,0,0,1,0,0|2,0,0]=4 7412 B11R1.852 COC(C)N1CCCCCC1 269982a_100000185865_100009879195 [1,0,0,1,0,0|1,0,0]=3 7413 B11R1.852 COC(C)N1CCCOCC1 269982a_100000685342_100009879195 [1,0,0,1,0,0|2,0,0]=4 7414 B13R1.3 COC1CCC(CC1)CNC(C)C 2230a_100138425928_100013032858 [0,1,0,1,0,0|2,0,0]=4 7415 B13R1.3 COC1CCC(CC1)CNC(C)C 34a_100138425928_100013032858 [0,1,0,1,0,0|2,0,0]=4 7416 B13R1.3 COC1CCC(CC1)COC(C)C 34a_100000212225_100013032858 [0,1,0,1,0,0|2,0,0]=4 7417 B13R1.3 COC1CCC(CC1)CSC(C)C 62a_100000210206_100013032858 [0,1,0,1,0,0|2,0,0]=4 7418 B13R1.3 COC1CCC(CC1)CSC(C)C 62a_100013032858_100000210206 [0,1,0,1,0,0|2,0,0]=4 7419 B13R1.3 COC1CCC(CC1)NCC(C)C 270004a_100000210953_100000747084 [0,1,0,1,0,0|2,0,0]=4 7420 B13R1.3 COC1CCC(CC1)NCC(C)C 270004a_100015205214_100000210432 [0,1,0,1,0,0|2,0,0]=4 7421 B13R1.3 COC1CCC(CC1)NCC(C)C 34a_100015205214_100000210624 [0,1,0,1,0,0|2,0,0]=4 7422 B13R1.3 COC1CCC(CC1)NCC(C)O 270004a_100000210904_100000747084 [0,1,0,1,0,0|2,0,0]=4 7423 B13R1.3 COC1CCC(CC1)NCC(C)O 34a_100015205214_100011218427 [0,1,0,1,0,0|2,0,0]=4 7424 B13R1.3 COC1CCC(CC1)NC[C@@H](C)O 34a_100015205214_100009817552 [0,1,0,1,0,0|2,0,0]=4 7425 B13R1.3 COC1CCC(CC1)OCC(C)C 34a_100011581665_100000210624 [0,1,0,1,0,0|2,0,0]=4 7426 B13R1.3 COC1CCC(CC1)OCC(C)C 7a_100011581665_100000210760 [0,1,0,1,0,0|2,0,0]=4 7427 B13R1.3 COC1CCC(CC1)OCC(C)O 34a_100011581665_100011218427 [0,1,0,1,0,0|2,0,0]=4 7428 B13R1.3 COC1CCC(CC1)OCC(C)O 7a_100011581665_100011218427 [0,1,0,1,0,0|2,0,0]=4 7429 B13R1.3 COC1CCC(CC1)OC[C@@H](C)O 34a_100011581665_100009817552 [0,1,0,1,0,0|2,0,0]=4 7430 B13R1.3 COC1CCC(CC1)OC[C@@H](C)O 7a_100011581665_100009817552 [0,1,0,1,0,0|2,0,0]=4 7431 B13R1.3 COC1CCN(CC1)CCC(C)C 2230a_100000234800_100000210312 [0,1,0,1,0,0|2,0,0]=4 7432 B13R1.3 COC1CCN(CC1)CCC(C)C 269982a_100000234800_100000210312 [0,1,0,1,0,0|2,0,0]=4 7433 B13R1.3 COC1CCN(CC1)CCC(C)C 34a_100000234800_100000210312 [0,1,0,1,0,0|2,0,0]=4 7434 B13R1.3 COC1CCN(CC1)CCC(C)O 2230a_100000234800_100012276601 [0,1,0,1,0,0|2,0,0]=4 7435 B13R1.3 COC1CCN(CC1)CCC(C)O 269982a_100000234800_100012276601 [0,1,0,1,0,0|2,0,0]=4 7436 B13R1.3 COC1CCN(CC1)CCC(C)O 34a_100000234800_100012276601 [0,1,0,1,0,0|2,0,0]=4 7437 B13R1.60 CO[C@@H]1CCN(C1)CCCC(C)C 2230a_100000766984_100011214892 [0,1,0,1,0,0|2,0,0]=4 7438 B13R1.60 CO[C@@H]1CCN(C1)CCCC(C)C 269982a_100000766984_100011214892 [0,1,0,1,0,0|2,0,0]=4 7439 B13R1.60 CO[C@@H]1CCN(C1)CCCC(C)O 2230a_100000766984_200000718107 [0,1,0,1,0,0|2,0,0]=4 7440 B13R1.60 CO[C@@H]1CCN(C1)CCCC(C)O 269982a_100000766984_200000718107 [0,1,0,1,0,0|2,0,0]=4 7441 B13R1.146 COC(CN1CCCC(C1)F)OC 2230a_100000697950_100000751394 [0,1,0,1,0,0|1,0,0]=3 7442 B13R1.146 COC(CN1CCCC(C1)F)OC 270004a_100000697950_100000752162 [0,1,0,1,0,0|1,0,0]=3 7443 B13R1.146 COC(CN1CCCC(C1)F)OC 34a_100000697950_100000211822 [0,1,0,1,0,0|1,0,0]=3 7444 B13R1.146 COC(CN1CCCC(C1)O)OC 2230a_100000211013_100000751394 [0,1,0,1,0,0|1,0,0]=3 7445 B13R1.146 COC(CN1CCCC(C1)O)OC 270004a_100000211013_100000752162 [0,1,0,1,0,0|1,0,0]=3 7446 B13R1.146 COC(CN1CCC[C@@H](C1)C)OC 2230a_100000717927_100000751394 [0,1,0,1,0,0|1,0,0]=3 7447 B13R1.146 COC(CN1CCC[C@@H](C1)C)OC 270004a_100000717927_100000752162 [0,1,0,1,0,0|1,0,0]=3 7448 B13R1.146 COC(CN1CCC[C@@H](C1)C)OC 34a_100000717927_100000211822 [0,1,0,1,0,0|1,0,0]=3 7449 B13R1.146 COC(CN1CCOC(C1)C)OC 2230a_100000729577_100000751394 [0,1,0,1,0,0|2,0,0]=4 7450 B13R1.146 COC(CN1CCOC(C1)C)OC 270004a_100000729577_100000752162 [0,1,0,1,0,0|2,0,0]=4 7451 B13R1.146 COC(CN1CCOC(C1)C)OC 34a_100000729577_100000211822 [0,1,0,1,0,0|2,0,0]=4 7452 B13R1.146 COC(CN1CCOC(C1)O)OC 2230a_100000688207_100000751394 [0,1,0,1,0,0|2,0,0]=4 7453 B13R1.146 COC(CN1CCOC(C1)O)OC 270004a_100000688207_100000752162 [0,1,0,1,0,0|2,0,0]=4 7454 B13R1.318 COC(CCCN[C@@H]1C[C@@H]1F)OC 2230a_100015190264_100000069011 [0,1,0,1,0,0|1,0,0]=3 7455 B13R1.318 COC(CCCN[C@@H]1C[C@H]1F)OC 2230a_100025746932_100000069011 [0,1,0,1,0,0|1,0,0]=3 7456 B13R1.318 COC(CCCN[C@@H]1C[C@H]1F)OC 34a_100025746932_100000069011 [0,1,0,1,0,0|1,0,0]=3 7457 B13R1.318 COC(CCOCC1CC1C)OC 34a_100000744939_100000139399 [0,1,0,1,0,0|0,0,0]=2 7458 B13R1.318 COC(CCOCC1CC1C)OC 7a_100000744939_100009813347 [0,1,0,1,0,0|0,0,0]=2 7459 B13R1.323 CCC(COCCCC1CO1)OC 34a_100011934954_100000733510 [0,1,0,1,0,0|2,0,0]=4 7460 B13R1.323 CCC(COCCCC1CO1)OC 7a_100011934954_100000733510 [0,1,0,1,0,0|2,0,0]=4 7461 B13R1.323 COC(CCCNCC1CC1)OC 2230a_100000735609_100000069011 [0,1,0,1,0,0|0,0,0]=2 7462 B13R1.323 COC(CCCNCC1CC1)OC 34a_100000735609_100000069011 [0,1,0,1,0,0|0,0,0]=2 7463 B13R1.323 COC(CCCOCC1CC1)OC 34a_100000211283_100000069011 [0,1,0,1,0,0|0,0,0]=2 7464 B13R1.323 COC(CCCOC[C@@H]1CO1)OC 34a_100000757423_100000069011 [0,1,0,1,0,0|1,0,0]=3 7465 B13R1.323 COC(CCCSCC1CC1)OC 62a_100000069011_100000742324 [0,1,0,1,0,0|0,0,0]=2 7466 B13R1.323 COC(CCCSCC1CC1)OC 62a_100000756562_100000069011 [0,1,0,1,0,0|0,0,0]=2 7467 B13R1.323 COC(CCCSCC1CO1)OC 62a_100000069011_102125554688 [0,1,0,1,0,0|1,0,0]=3 7468 B13R1.323 COC(CCCSCC1CO1)OC 62a_102125554688_100000069011 [0,1,0,1,0,0|1,0,0]=3 7469 B13R1.323 COC(CCCSCC1CS1)OC 62a_100000031435_100000069011 [0,1,0,1,0,0|1,0,0]=3 7470 B13R1.323 COC(CCCSCC1CS1)OC 62a_100000069011_100000031435 [0,1,0,1,0,0|1,0,0]=3 7471 B13R1.323 COC(CCCSC[C@@H]1CO1)OC 62a_100000069011_100000745022 [0,1,0,1,0,0|1,0,0]=3 7472 B13R1.323 COC(CCCSC[C@@H]1CO1)OC 62a_100000745022_100000069011 [0,1,0,1,0,0|1,0,0]=3 7473 B13R1.323 COC(CCNCCC1CC1)OC 34a_100000764129_100000139399 [0,1,0,1,0,0|0,0,0]=2 7474 B13R1.323 COC(CCOCCC1CC1)OC 34a_100000754188_100000139399 [0,1,0,1,0,0|0,0,0]=2 7475 B13R1.323 COC(CCOCCC1CC1)OC 7a_100000754188_100009813347 [0,1,0,1,0,0|0,0,0]=2 7476 B13R1.323 COC(CCOCC[C@@H]1CO1)OC 34a_100009820653_100000139399 [0,1,0,1,0,0|1,0,0]=3 7477 B13R1.323 COC(CCSCCC1CC1)OC 62a_100000139399_100000764125 [0,1,0,1,0,0|0,0,0]=2 7478 B13R1.323 COC(CCSCCC1CC1)OC 62a_100000764125_100000139399 [0,1,0,1,0,0|0,0,0]=2 7479 B13R1.323 COC(CCSCCC1CO1)OC 62a_100000139399_100000732470 [0,1,0,1,0,0|1,0,0]=3 7480 B13R1.323 COC(CCSCCC1CO1)OC 62a_100000732470_100000139399 [0,1,0,1,0,0|1,0,0]=3 7481 B13R1.323 COC(COCC#CC1CC1)OC 34a_100000083941_100000211822 [0,1,0,1,0,0|0,0,2]=4 7482 B13R1.323 COC(COCC#CC1CC1)OC 34a_100011216393_100009895102 [0,1,0,1,0,0|0,0,2]=4 7483 B13R1.323 COC(COCC#CC1CC1)OC 7a_100000083941_100000751394 [0,1,0,1,0,0|0,0,2]=4 7484 B13R1.323 COC(COCCCC1CO1)OC 34a_100011216393_100000733510 [0,1,0,1,0,0|1,0,0]=3 7485 B13R1.323 COC(COCCNC1CC1)OC 34a_100000738766_100000211822 [0,1,0,1,0,0|1,0,0]=3 7486 B13R1.323 COC(CSCC#CC1CC1)OC 62a_100000751394_100009895102 [0,1,0,1,0,0|0,0,2]=4 7487 B13R1.323 COC(CSCC#CC1CC1)OC 62a_100009895102_100000751394 [0,1,0,1,0,0|0,0,2]=4 7488 B13R1.323 COC(CSCCCC1CO1)OC 62a_100000733510_100000751394 [0,1,0,1,0,0|1,0,0]=3 7489 B13R1.323 COC(CSCCCC1CO1)OC 62a_100000751394_100000733510 [0,1,0,1,0,0|1,0,0]=3 7490 B13R1.328 C=C1CC(C1)CNCC(OC)OC 2230a_100102567296_100000751394 [0,1,0,1,0,0|1,0,1]=4 7491 B13R1.328 C=C1CC(C1)CNCC(OC)OC 270004a_100102567296_100000752162 [0,1,0,1,0,0|1,0,1]=4 7492 B13R1.328 C=C1CC(C1)CNCC(OC)OC 34a_100102567296_100000211822 [0,1,0,1,0,0|1,0,1]=4 7493 B13R1.328 C=C1CC(C1)COCC(OC)OC 34a_100011011225_100000211822 [0,1,0,1,0,0|1,0,1]=4 7494 B13R1.328 C=C1CC(C1)NCCC(OC)OC 2230a_100132301982_100009813347 [0,1,0,1,0,0|1,0,1]=4 7495 B13R1.328 COC(CCCN1CC(C1)C)OC 2230a_100000702820_100000069011 [0,1,0,1,0,0|1,0,0]=3 7496 B13R1.328 COC(CCCN1CC(C1)C)OC 269982a_100000702820_100000069011 [0,1,0,1,0,0|1,0,0]=3 7497 B13R1.328 COC(CCCN1CC(C1)C)OC 34a_100000702820_100000069011 [0,1,0,1,0,0|1,0,0]=3 7498 B13R1.328 COC(CCCN1CC(C1)F)OC 2230a_100000690557_100000069011 [0,1,0,1,0,0|1,0,0]=3 7499 B13R1.328 COC(CCCN1CC(C1)F)OC 269982a_100000690557_100000069011 [0,1,0,1,0,0|1,0,0]=3 7500 B13R1.328 COC(CCCN1CC(C1)F)OC 34a_100000690557_100000069011 [0,1,0,1,0,0|1,0,0]=3 7501 B13R1.328 COC(CCCN1CC(C1)O)OC 269982a_100000749847_100000069011 [0,1,0,1,0,0|1,0,0]=3 7502 B13R1.328 COC(CCNC1CC(C1)F)OC 2230a_100016993743_100009813347 [0,1,0,1,0,0|1,0,0]=3 7503 B13R1.328 COC(CCN[C@H]1C[C@@H](C1)O)OC 2230a_100020629032_100009813347 [0,1,0,1,0,0|1,0,0]=3 7504 B13R1.328 COC(CCSC1CC(=O)C1)OC 62a_100009894365_100000139399 [0,1,0,1,0,0|1,0,1]=4 7505 B13R1.328 COC(CNCC1CC(C1)O)OC 2230a_100016992100_100000751394 [0,1,0,1,0,0|1,0,0]=3 7506 B13R1.328 COC(CNCC1CC(C1)O)OC 270004a_100016992100_100000752162 [0,1,0,1,0,0|1,0,0]=3 7507 B13R1.328 COC(CNCC1CN(C1)C)OC 270004a_100000723568_100000752162 [0,1,0,1,0,0|2,0,0]=4 7508 B13R1.328 COC(COCC1CC(=O)C1)OC 34a_100000101936_100000211822 [0,1,0,1,0,0|1,0,1]=4 7509 B13R1.328 COC(COCC1CC(C1)Cl)OC 34a_100009874164_100000211822 [0,1,0,1,0,0|1,0,0]=3 7510 B13R1.328 COC(CSCC1CC(=O)C1)OC 62a_100000751394_100009874392 [0,1,0,1,0,0|1,0,1]=4 7511 B13R1.328 COC(CSCC1CC(=O)C1)OC 62a_100009874392_100000751394 [0,1,0,1,0,0|1,0,1]=4 7512 B13R1.343 C=C(C)CCNCCC1OCCO1 2230a_100000034215_100000730704 [0,1,0,1,0,0|1,0,1]=4 7513 B13R1.343 C=C(C)CCNCCC1OCCO1 34a_100000034215_100000730704 [0,1,0,1,0,0|1,0,1]=4 7514 B13R1.343 C=C(C)CCOCCC1OCCO1 34a_100000764851_100000740749 [0,1,0,1,0,0|1,0,1]=4 7515 B13R1.343 C=C(C)CCSCCC1OCCO1 62a_100000730704_100000740749 [0,1,0,1,0,0|1,0,1]=4 7516 B13R1.343 C=C(C)COCCCC1OCCO1 34a_100000210245_100009861162 [0,1,0,1,0,0|1,0,1]=4 7517 B13R1.343 C=C(C)COCCCC1OCCO1 34a_100009871617_100000748629 [0,1,0,1,0,0|1,0,1]=4 7518 B13R1.343 C=C(C)COCCCC1OCCO1 7a_100009871617_100000748629 [0,1,0,1,0,0|1,0,1]=4 7519 B13R1.343 C=C(C)CSCCCC1OCCO1 62a_100000748629_100000042513 [0,1,0,1,0,0|1,0,1]=4 7520 B13R1.343 CC(=O)CCCNCC1OCCO1 34a_100000036311_100000685027 [0,1,0,1,0,0|1,0,1]=4 7521 B13R1.343 CC(=O)CCCOCC1OCCO1 34a_100000087154_100000685027 [0,1,0,1,0,0|1,0,1]=4 7522 B13R1.343 CC(=O)CCCOCC1OCCO1 34a_100000759063_100000755774 [0,1,0,1,0,0|1,0,1]=4 7523 B13R1.343 CC(=O)CCCOCC1OCCO1 7a_100000759063_100000755774 [0,1,0,1,0,0|1,0,1]=4 7524 B13R1.343 CC(=O)CCCSCC1OCCO1 62a_100000755774_100011215641 [0,1,0,1,0,0|1,0,1]=4 7525 B13R1.343 CC(=O)CCCSCC1OCCO1 62a_100011215641_100000755774 [0,1,0,1,0,0|1,0,1]=4 7526 B13R1.343 CC(=O)CCOCCC1OCCO1 34a_100000759926_100000740749 [0,1,0,1,0,0|1,0,1]=4 7527 B13R1.343 CC(=O)CCOCCC1OCCO1 7a_100000759926_100000740749 [0,1,0,1,0,0|1,0,1]=4 7528 B13R1.343 CC(=O)CCSCCC1OCCO1 62a_100000053229_100000740749 [0,1,0,1,0,0|1,0,1]=4 7529 B13R1.343 CC(=O)COCCCC1OCCO1 34a_100000211253_100009861162 [0,1,0,1,0,0|1,0,1]=4 7530 B13R1.343 CC(Br)CCOCCC1OCCO1 34a_100009893172_100000740749 [0,1,0,1,0,0|1,0,0]=3 7531 B13R1.343 CC(Br)COCCCC1OCCO1 34a_100012180447_100009861162 [0,1,0,1,0,0|1,0,0]=3 7532 B13R1.343 CC(C)CCCCOC1CCCO1 34a_100000085407_100011216152 [0,1,0,1,0,0|2,0,0]=4 7533 B13R1.343 CC(C)CCCNCC1CCCO1 2230a_200000737386_100000203698 [0,1,0,1,0,0|2,0,0]=4 7534 B13R1.343 CC(C)CCCNCC1OCCO1 2230a_100000036311_100011214892 [0,1,0,1,0,0|1,0,0]=3 7535 B13R1.343 CC(C)CCCNCC1OCCO1 2230a_200000737386_100000755774 [0,1,0,1,0,0|1,0,0]=3 7536 B13R1.343 CC(C)CCCNCC1OCCO1 34a_100000036311_100011214892 [0,1,0,1,0,0|1,0,0]=3 7537 B13R1.343 CC(C)CCCNCC1OCCO1 34a_200000737386_100000755774 [0,1,0,1,0,0|1,0,0]=3 7538 B13R1.343 CC(C)CCCNC[C@@H]1CCCO1 2230a_100020590478_100011214892 [0,1,0,1,0,0|2,0,0]=4 7539 B13R1.343 CC(C)CCCNC[C@@H]1CCCO1 34a_100020590478_100011214892 [0,1,0,1,0,0|2,0,0]=4 7540 B13R1.343 CC(C)CCCOCC1CCCO1 34a_100000210270_100011214892 [0,1,0,1,0,0|2,0,0]=4 7541 B13R1.343 CC(C)CCCOCC1CCCO1 7a_100000210270_100011214892 [0,1,0,1,0,0|2,0,0]=4 7542 B13R1.343 CC(C)CCCOCC1CCCO1 7a_100000210774_100000203698 [0,1,0,1,0,0|2,0,0]=4 7543 B13R1.343 CC(C)CCCOCC1OCCO1 34a_100000087154_100011214892 [0,1,0,1,0,0|1,0,0]=3 7544 B13R1.343 CC(C)CCCOCC1OCCO1 34a_100000210774_100000755774 [0,1,0,1,0,0|1,0,0]=3 7545 B13R1.343 CC(C)CCCOCC1OCCO1 7a_100000210774_100000755774 [0,1,0,1,0,0|1,0,0]=3 7546 B13R1.343 CC(C)CCCSCC1CCCO1 62a_100000203698_100011214892 [0,1,0,1,0,0|2,0,0]=4 7547 B13R1.343 CC(C)CCCSCC1CCCO1 62a_100011214892_100000203698 [0,1,0,1,0,0|2,0,0]=4 7548 B13R1.343 CC(C)CCCSCC1OCCO1 62a_100000755774_100011214892 [0,1,0,1,0,0|1,0,0]=3 7549 B13R1.343 CC(C)CCCSCC1OCCO1 62a_100011214892_100000755774 [0,1,0,1,0,0|1,0,0]=3 7550 B13R1.343 CC(C)CCNCCC1OCCO1 2230a_100000034215_100000210312 [0,1,0,1,0,0|1,0,0]=3 7551 B13R1.343 CC(C)CCNCCC1OCCO1 34a_100000034215_100000210312 [0,1,0,1,0,0|1,0,0]=3 7552 B13R1.343 CC(C)CCOCCC1OCCO1 34a_100000210254_100000740749 [0,1,0,1,0,0|1,0,0]=3 7553 B13R1.343 CC(C)CCOCCC1OCCO1 7a_100000210254_100000740749 [0,1,0,1,0,0|1,0,0]=3 7554 B13R1.343 CC(C)CCSCCC1OCCO1 62a_100000210312_100000740749 [0,1,0,1,0,0|1,0,0]=3 7555 B13R1.343 CC(C)CNCCCC1OCCO1 2230a_100000210953_100000042513 [0,1,0,1,0,0|1,0,0]=3 7556 B13R1.343 CC(C)CNCCCC1OCCO1 34a_100000210953_100009861162 [0,1,0,1,0,0|1,0,0]=3 7557 B13R1.343 CC(C)COCCCC1OCCO1 34a_100000210257_100009861162 [0,1,0,1,0,0|1,0,0]=3 7558 B13R1.343 CC(C)COCCCC1OCCO1 34a_100009871617_100000210624 [0,1,0,1,0,0|1,0,0]=3 7559 B13R1.343 CC(C)COCCCC1OCCO1 7a_100009871617_100000210760 [0,1,0,1,0,0|1,0,0]=3 7560 B13R1.343 CC(C)CSCCCC1OCCO1 62a_100000210624_100000042513 [0,1,0,1,0,0|1,0,0]=3 7561 B13R1.343 CC(C)NCCCCC1OCCO1 2230a_100138425928_100000034956 [0,1,0,1,0,0|1,0,0]=3 7562 B13R1.343 CC(C)NCCCCC1OCCO1 34a_100138425928_200009813554 [0,1,0,1,0,0|1,0,0]=3 7563 B13R1.343 CC(C)NCCOCC1OCCO1 34a_100000224655_100000755774 [0,1,0,1,0,0|2,0,0]=4 7564 B13R1.343 CC(C)OCCCCC1OCCO1 34a_100000212225_200009813554 [0,1,0,1,0,0|1,0,0]=3 7565 B13R1.343 CC(C)OCCNCC1OCCO1 2230a_100000036311_100000211751 [0,1,0,1,0,0|2,0,0]=4 7566 B13R1.343 CC(C)OCCNCC1OCCO1 2230a_100000701111_100000755774 [0,1,0,1,0,0|2,0,0]=4 7567 B13R1.343 CC(C)OCCNCC1OCCO1 34a_100000036311_100000211751 [0,1,0,1,0,0|2,0,0]=4 7568 B13R1.343 CC(C)OCCNCC1OCCO1 34a_100000701111_100000755774 [0,1,0,1,0,0|2,0,0]=4 7569 B13R1.343 CC(C)OCCOCC1OCCO1 34a_100000087154_100000211751 [0,1,0,1,0,0|2,0,0]=4 7570 B13R1.343 CC(C)OCCOCC1OCCO1 34a_100000211219_100000755774 [0,1,0,1,0,0|2,0,0]=4 7571 B13R1.343 CC(C)OCCOCC1OCCO1 7a_100000211219_100000755774 [0,1,0,1,0,0|2,0,0]=4 7572 B13R1.343 CC(C)OCCSCC1OCCO1 62a_100000211751_100000755774 [0,1,0,1,0,0|2,0,0]=4 7573 B13R1.343 CC(C)OCCSCC1OCCO1 62a_100000755774_100000211751 [0,1,0,1,0,0|2,0,0]=4 7574 B13R1.343 CC(C)OCNCCC1OCCO1 2230a_100000034215_100000709892 [0,1,0,1,0,0|2,0,0]=4 7575 B13R1.343 CC(C)OCNCCC1OCCO1 34a_100000034215_100000709892 [0,1,0,1,0,0|2,0,0]=4 7576 B13R1.343 CC(C)OCSCCC1OCCO1 62a_100000709892_100000740749 [0,1,0,1,0,0|2,0,0]=4 7577 B13R1.343 CC(C)SCCCCC1OCCO1 62a_100000210206_100000034956 [0,1,0,1,0,0|1,0,0]=3 7578 B13R1.343 CC(C)SCCNCC1OCCO1 2230a_100000036311_100000730970 [0,1,0,1,0,0|2,0,0]=4 7579 B13R1.343 CC(C)SCCNCC1OCCO1 2230a_100000731138_100000755774 [0,1,0,1,0,0|2,0,0]=4 7580 B13R1.343 CC(C)SCCNCC1OCCO1 34a_100000036311_100000730970 [0,1,0,1,0,0|2,0,0]=4 7581 B13R1.343 CC(C)SCCNCC1OCCO1 34a_100000731138_100000755774 [0,1,0,1,0,0|2,0,0]=4 7582 B13R1.343 CC(C)SCCOCC1OCCO1 34a_100000087154_100000730970 [0,1,0,1,0,0|2,0,0]=4 7583 B13R1.343 CC(C)SCCOCC1OCCO1 34a_200011212901_100000755774 [0,1,0,1,0,0|2,0,0]=4 7584 B13R1.343 CC(C)SCCOCC1OCCO1 7a_200011212901_100000755774 [0,1,0,1,0,0|2,0,0]=4 7585 B13R1.343 CC(C)SCCSCC1OCCO1 62a_100000730970_100000755774 [0,1,0,1,0,0|2,0,0]=4 7586 B13R1.343 CC(C)SCCSCC1OCCO1 62a_100000755774_100000730970 [0,1,0,1,0,0|2,0,0]=4 7587 B13R1.343 CC(F)COCCCC1OCCO1 34a_100015925927_100009861162 [0,1,0,1,0,0|1,0,0]=3 7588 B13R1.343 CC(O)CCCNCC1OCCO1 2230a_100000036311_200000718107 [0,1,0,1,0,0|1,0,0]=3 7589 B13R1.343 CC(O)CCCNCC1OCCO1 34a_100000036311_200000718107 [0,1,0,1,0,0|1,0,0]=3 7590 B13R1.343 CC(O)CCCNC[C@@H]1CCCO1 2230a_100020590478_200000718107 [0,1,0,1,0,0|2,0,0]=4 7591 B13R1.343 CC(O)CCCNC[C@@H]1CCCO1 34a_100020590478_200000718107 [0,1,0,1,0,0|2,0,0]=4 7592 B13R1.343 CC(O)CCCOCC1CCCO1 34a_100000210270_200000718107 [0,1,0,1,0,0|2,0,0]=4 7593 B13R1.343 CC(O)CCCOCC1CCCO1 7a_100000210270_200000718107 [0,1,0,1,0,0|2,0,0]=4 7594 B13R1.343 CC(O)CCCOCC1OCCO1 34a_100000087154_200000718107 [0,1,0,1,0,0|1,0,0]=3 7595 B13R1.343 CC(O)CCCSCC1CCCO1 62a_100000203698_200000718107 [0,1,0,1,0,0|2,0,0]=4 7596 B13R1.343 CC(O)CCCSCC1CCCO1 62a_200000718107_100000203698 [0,1,0,1,0,0|2,0,0]=4 7597 B13R1.343 CC(O)CCCSCC1OCCO1 62a_100000755774_200000718107 [0,1,0,1,0,0|1,0,0]=3 7598 B13R1.343 CC(O)CCCSCC1OCCO1 62a_200000718107_100000755774 [0,1,0,1,0,0|1,0,0]=3 7599 B13R1.343 CC(O)CCNCCC1OCCO1 2230a_100000034215_100012276601 [0,1,0,1,0,0|1,0,0]=3 7600 B13R1.343 CC(O)CCNCCC1OCCO1 2230a_200000755665_100000740749 [0,1,0,1,0,0|1,0,0]=3 7601 B13R1.343 CC(O)CCNCCC1OCCO1 34a_100000034215_100012276601 [0,1,0,1,0,0|1,0,0]=3 7602 B13R1.343 CC(O)CCSCCC1OCCO1 62a_100012276601_100000740749 [0,1,0,1,0,0|1,0,0]=3 7603 B13R1.343 CC(O)CNCCCC1OCCO1 2230a_100000210904_100000042513 [0,1,0,1,0,0|1,0,0]=3 7604 B13R1.343 CC(O)CNCCCC1OCCO1 34a_100000210904_100009861162 [0,1,0,1,0,0|1,0,0]=3 7605 B13R1.343 CC(O)COCCCC1OCCO1 34a_100009871617_100011218427 [0,1,0,1,0,0|1,0,0]=3 7606 B13R1.343 CC(O)COCCCC1OCCO1 7a_100009871617_100011218427 [0,1,0,1,0,0|1,0,0]=3 7607 B13R1.343 CC(O)CSCCCC1OCCO1 62a_100011218427_100000042513 [0,1,0,1,0,0|1,0,0]=3 7608 B13R1.343 CN(C)CCCSCC1OCCO1 62a_100000755774_100000757444 [0,1,0,1,0,0|2,0,0]=4 7609 B13R1.343 CS(=O)CCCNCC1OCCO1 2230a_200000753449_100000755774 [0,1,0,1,0,0|2,0,0]=4 7610 B13R1.343 C[C@@H](Cl)COCCCC1OCCO1 34a_100016084084_100009861162 [0,1,0,1,0,0|1,0,0]=3 7611 B13R1.343 C[C@@H](N)CCOCCC1OCCO1 34a_100000706166_100000740749 [0,1,0,1,0,0|1,0,0]=3 7612 B13R1.343 C[C@@H](N)COCCCC1OCCO1 34a_100000737577_100009861162 [0,1,0,1,0,0|1,0,0]=3 7613 B13R1.343 C[C@@H](O)COCCCC1OCCO1 34a_100009871617_100009817552 [0,1,0,1,0,0|1,0,0]=3 7614 B13R1.343 C[C@@H](O)COCCCC1OCCO1 7a_100009871617_100009817552 [0,1,0,1,0,0|1,0,0]=3 7615 B13R1.343 C[C@@H](O)CSCCCC1OCCO1 62a_100009817552_100000042513 [0,1,0,1,0,0|1,0,0]=3 7616 B13R1.343 FC(F)CCOCCC1OCCO1 34a_100103093639_100000740749 [0,1,0,1,0,0|2,0,0]=4 7617 B13R1.343 FC(F)CNCCCC1OCCO1 34a_100000765723_100009861162 [0,1,0,1,0,0|2,0,0]=4 7618 B13R1.343 FC(F)COCCCC1OCCO1 34a_100000743014_100009861162 [0,1,0,1,0,0|2,0,0]=4 7619 B13R1.343 FC(F)COCCCC1OCCO1 34a_100009871617_100011934356 [0,1,0,1,0,0|2,0,0]=4 7620 B13R1.343 FC(F)COCCCC1OCCO1 7a_100009871617_100011934356 [0,1,0,1,0,0|2,0,0]=4 7621 B13R1.343 FC(F)CSCCCC1OCCO1 62a_100011934356_100000042513 [0,1,0,1,0,0|2,0,0]=4 7622 B13R1.416 CCC(CNC1CCC(C1)C)OC 270004a_100000731041_100011215218 [0,1,0,1,0,0|2,0,0]=4 7623 B13R1.416 CCC(CNC1CCC(C1)O)OC 270004a_100000731041_100012614533 [0,1,0,1,0,0|2,0,0]=4 7624 B13R1.416 COC(CCN1CCC(C1)O)OC 2230a_100011215560_100009813347 [0,1,0,1,0,0|1,0,0]=3 7625 B13R1.416 COC(CCN1CCC(C1)O)OC 269982a_100011215560_100000139399 [0,1,0,1,0,0|1,0,0]=3 7626 B13R1.416 COC(CCN1CC[C@@H](C1)F)OC 2230a_100015203821_100009813347 [0,1,0,1,0,0|1,0,0]=3 7627 B13R1.416 COC(CCN1CC[C@@H](C1)F)OC 269982a_100015203821_100000139399 [0,1,0,1,0,0|1,0,0]=3 7628 B13R1.416 COC(CCN1CC[C@@H](C1)F)OC 34a_100015203821_100000139399 [0,1,0,1,0,0|1,0,0]=3 7629 B13R1.416 COC(CCN1CC[C@H](C1)C)OC 2230a_100016987628_100009813347 [0,1,0,1,0,0|1,0,0]=3 7630 B13R1.416 COC(CCN1CC[C@H](C1)C)OC 269982a_100016987628_100000139399 [0,1,0,1,0,0|1,0,0]=3 7631 B13R1.416 COC(CCN1CC[C@H](C1)C)OC 34a_100016987628_100000139399 [0,1,0,1,0,0|1,0,0]=3 7632 B13R1.416 COC(CNC1CCC(C1)C)OC 270004a_100000210479_100011215218 [0,1,0,1,0,0|1,0,0]=3 7633 B13R1.416 COC(CNC1CCC(C1)O)OC 270004a_100000210479_100012614533 [0,1,0,1,0,0|1,0,0]=3 7634 B13R1.416 COC(CNC1CCN(C1)C)OC 270004a_100000744687_100000752162 [0,1,0,1,0,0|2,0,0]=4 7635 B13R1.416 COC(CN[C@H]1CC[C@H](C1)O)OC 2230a_100015195300_100000751394 [0,1,0,1,0,0|1,0,0]=3 7636 B13R1.416 COC(CN[C@H]1CC[C@H](C1)O)OC 270004a_100015195300_100000752162 [0,1,0,1,0,0|1,0,0]=3 7637 B13R1.416 COC(COC1CCC(=O)C1)OC 34a_100012614533_100000211822 [0,1,0,1,0,0|1,0,1]=4 7638 B13R1.416 COC(COC1CCC(C1)C)OC 34a_100000698185_100000211822 [0,1,0,1,0,0|1,0,0]=3 7639 B13R1.416 COC(CSC1CCN(C1)C)OC 62a_100000751394_200012183744 [0,1,0,1,0,0|2,0,0]=4 7640 B13R1.955 COC(CCNC1CC1(F)F)OC 2230a_100020610826_100009813347 [0,1,0,1,0,0|2,0,0]=4 7641 B13R1.955 COC(CCNC1CC1(F)F)OC 34a_100020610826_100000139399 [0,1,0,1,0,0|2,0,0]=4 7642 B13R1.955 COC(COCC1CC1(C)C)OC 34a_100000728257_100000211822 [0,1,0,1,0,0|1,0,0]=3 7643 B13R1.955 COC(COCC1CC1(C)C)OC 7a_100000728257_100000751394 [0,1,0,1,0,0|1,0,0]=3 7644 B13R1.955 COC(COCC1CC1(F)F)OC 34a_100000056500_100000211822 [0,1,0,1,0,0|2,0,0]=4 7645 B13R1.955 COC(COCC1CC1(F)F)OC 34a_100011216393_100009817841 [0,1,0,1,0,0|2,0,0]=4 7646 B13R1.955 COC(COCC1CC1(F)F)OC 7a_100000056500_100000751394 [0,1,0,1,0,0|2,0,0]=4 7647 B13R1.955 COC(COCC1OC1(C)C)OC 34a_200010283642_100000211822 [0,1,0,1,0,0|2,0,0]=4 7648 B13R1.955 COC(COCC1OC1(C)C)OC 7a_200010283642_100000751394 [0,1,0,1,0,0|2,0,0]=4 7649 B13R1.955 COC(CSCC1CC1(F)F)OC 62a_100000751394_100009817841 [0,1,0,1,0,0|2,0,0]=4 7650 B13R1.955 COC(CSCC1CC1(F)F)OC 62a_100009817841_100000751394 [0,1,0,1,0,0|2,0,0]=4 7651 B13R1.2174 COC1CCCN(CC1)CC(C)C 2230a_100016993962_100000210760 [0,1,0,1,0,0|2,0,0]=4 7652 B13R1.2174 COC1CCCN(CC1)CC(C)C 269982a_100016993962_100000210624 [0,1,0,1,0,0|2,0,0]=4 7653 B13R1.2174 COC1CCCN(CC1)CC(C)C 270004a_100016993962_100000210432 [0,1,0,1,0,0|2,0,0]=4 7654 B13R1.2174 COC1CCCN(CC1)CC(C)C 34a_100016993962_100000210624 [0,1,0,1,0,0|2,0,0]=4 7655 B13R1.2174 COC1CCCN(CC1)CC(C)O 2230a_100016993962_100011218427 [0,1,0,1,0,0|2,0,0]=4 7656 B13R1.2174 COC1CCCN(CC1)CC(C)O 269982a_100016993962_100011218427 [0,1,0,1,0,0|2,0,0]=4 7657 B13R1.2174 COC1CCCN(CC1)CC(C)O 34a_100016993962_100011218427 [0,1,0,1,0,0|2,0,0]=4 7658 B13R1.2174 COC1CCCN(CC1)C[C@@H](C)O 2230a_100016993962_100009817552 [0,1,0,1,0,0|2,0,0]=4 7659 B13R1.2174 COC1CCCN(CC1)C[C@@H](C)O 269982a_100016993962_100009817552 [0,1,0,1,0,0|2,0,0]=4 7660 B13R1.2174 COC1CCCN(CC1)C[C@@H](C)O 34a_100016993962_100009817552 [0,1,0,1,0,0|2,0,0]=4 7661 B13R1.3121 CCC1(CO1)CNCCCC(C)C 34a_200000737386_200000139556 [0,1,0,1,0,0|2,0,0]=4 7662 B13R1.3121 CCC1(CO1)COCCCC(C)C 34a_100000210774_200000139556 [0,1,0,1,0,0|2,0,0]=4 7663 B13R1.3121 CCC1(CO1)COCCCC(C)C 7a_100000210774_200000139556 [0,1,0,1,0,0|2,0,0]=4 7664 B13R1.3121 CCC1(CO1)CSCCCC(C)C 62a_100011214892_200000139556 [0,1,0,1,0,0|2,0,0]=4 7665 B13R1.3121 CCC1(CO1)CSCCCC(C)C 62a_200000139556_100011214892 [0,1,0,1,0,0|2,0,0]=4 7666 B13R1.3121 CCC1(CO1)CSCCCC(C)O 62a_200000139556_200000718107 [0,1,0,1,0,0|2,0,0]=4 7667 B13R1.3121 CCC1(CO1)CSCCCC(C)O 62a_200000718107_200000139556 [0,1,0,1,0,0|2,0,0]=4 7668 B13R1.3491 COC(CN1CCCC1(C)C)OC 2230a_100000761399_100000751394 [0,1,0,1,0,0|1,0,0]=3 7669 B13R1.3491 COC(CN1CCCC1(C)C)OC 270004a_100000761399_100000752162 [0,1,0,1,0,0|1,0,0]=3 7670 B13R1.3491 COC(CN1CCCC1(C)C)OC 34a_100000761399_100000211822 [0,1,0,1,0,0|1,0,0]=3 7671 B13R1.3491 COC(CN1CCSC1(C)C)OC 2230a_100011217261_100000751394 [0,1,0,1,0,0|2,0,0]=4 7672 B13R1.3491 COC(CN1CCSC1(C)C)OC 270004a_100011217261_100000752162 [0,1,0,1,0,0|2,0,0]=4 7673 B13R1.3491 COC(CN1CCSC1(C)C)OC 34a_100011217261_100000211822 [0,1,0,1,0,0|2,0,0]=4 7674 B13R1.3491 COC(CN1COCC1(C)C)OC 2230a_100000043020_100000751394 [0,1,0,1,0,0|2,0,0]=4 7675 B13R1.3491 COC(CN1COCC1(C)C)OC 270004a_100000043020_100000752162 [0,1,0,1,0,0|2,0,0]=4 7676 B13R1.92 CCC(CC)N1CCCCC1CC 269982a_100000210034_100000210505 [0,1,0,1,0,0|2,0,0]=4 7677 B13R1.92 CCC(CC)N1CCCCC1CC 270004a_100000210034_100000210860 [0,1,0,1,0,0|2,0,0]=4 7678 B13R1.119 BrCCCCCOCC1CCCO1 7a_100000746331_100000203698 [0,1,0,1,0,0|2,0,0]=4 7679 B13R1.119 BrCCCCCOCC1OCCO1 34a_100000746331_100000755774 [0,1,0,1,0,0|1,0,0]=3 7680 B13R1.119 BrCCCCCOCC1OCCO1 7a_100000746331_100000755774 [0,1,0,1,0,0|1,0,0]=3 7681 B13R1.119 BrCCCCOCCC1OCCO1 34a_100011216708_100000740749 [0,1,0,1,0,0|1,0,0]=3 7682 B13R1.119 BrCCCOCCCC1OCCO1 34a_100011217188_100009861162 [0,1,0,1,0,0|1,0,0]=3 7683 B13R1.119 BrCCOCCCCC1OCCO1 34a_100000211926_200009813554 [0,1,0,1,0,0|1,0,0]=3 7684 B13R1.119 BrCCOCCOCC1OCCO1 34a_100000692535_100000755774 [0,1,0,1,0,0|2,0,0]=4 7685 B13R1.119 BrCCOCCOCC1OCCO1 7a_100000692535_100000755774 [0,1,0,1,0,0|2,0,0]=4 7686 B13R1.119 C#CCCCCNCC1OCCO1 2230a_100000036311_100010269958 [0,1,0,1,0,0|0,0,2]=4 7687 B13R1.119 C#CCCCCNCC1OCCO1 2230a_100000706060_100000755774 [0,1,0,1,0,0|0,0,2]=4 7688 B13R1.119 C#CCCCCNCC1OCCO1 34a_100000036311_100010269958 [0,1,0,1,0,0|0,0,2]=4 7689 B13R1.119 C#CCCCCNCC1OCCO1 34a_100000706060_100000755774 [0,1,0,1,0,0|0,0,2]=4 7690 B13R1.119 C#CCCCCOCC1OCCO1 34a_100000087154_100010269958 [0,1,0,1,0,0|0,0,2]=4 7691 B13R1.119 C#CCCCCOCC1OCCO1 34a_100000766709_100000755774 [0,1,0,1,0,0|0,0,2]=4 7692 B13R1.119 C#CCCCCOCC1OCCO1 7a_100000766709_100000755774 [0,1,0,1,0,0|0,0,2]=4 7693 B13R1.119 C#CCCCCSCC1OCCO1 62a_100000755774_100010269958 [0,1,0,1,0,0|0,0,2]=4 7694 B13R1.119 C#CCCCCSCC1OCCO1 62a_100010269958_100000755774 [0,1,0,1,0,0|0,0,2]=4 7695 B13R1.119 C#CCCCNCCC1OCCO1 2230a_100000034215_100000731252 [0,1,0,1,0,0|0,0,2]=4 7696 B13R1.119 C#CCCCNCCC1OCCO1 34a_100000034215_100000695029 [0,1,0,1,0,0|0,0,2]=4 7697 B13R1.119 C#CCCCNCCC1OCCO1 34a_100000718082_100000740749 [0,1,0,1,0,0|0,0,2]=4 7698 B13R1.119 C#CCCCOCCC1OCCO1 34a_100000215630_100000740749 [0,1,0,1,0,0|0,0,2]=4 7699 B13R1.119 C#CCCCOCCC1OCCO1 7a_100000215630_100000740749 [0,1,0,1,0,0|0,0,2]=4 7700 B13R1.119 C#CCCCSCCC1OCCO1 62a_100011215417_100000740749 [0,1,0,1,0,0|0,0,2]=4 7701 B13R1.119 C#CCCNCCCC1OCCO1 34a_100000755551_100009861162 [0,1,0,1,0,0|0,0,2]=4 7702 B13R1.119 C#CCCOCCCC1OCCO1 34a_100009871617_100000688953 [0,1,0,1,0,0|0,0,2]=4 7703 B13R1.119 C#CCCOCCCC1OCCO1 34a_100011215631_100009861162 [0,1,0,1,0,0|0,0,2]=4 7704 B13R1.119 C#CCCOCCCC1OCCO1 7a_100009871617_100000688953 [0,1,0,1,0,0|0,0,2]=4 7705 B13R1.119 C#CCCSCCCC1OCCO1 62a_100000688953_100000042513 [0,1,0,1,0,0|0,0,2]=4 7706 B13R1.119 C#CCNCCCCC1OCCO1 34a_100000212058_200009813554 [0,1,0,1,0,0|0,0,2]=4 7707 B13R1.119 C#CCOCCCCC1OCCO1 34a_100000210247_200009813554 [0,1,0,1,0,0|0,0,2]=4 7708 B13R1.119 C#CCSCCCCC1OCCO1 62a_100000038162_100000034956 [0,1,0,1,0,0|0,0,2]=4 7709 B13R1.119 C/C=C/CCOCCC1OCCO1 34a_100016278192_100000740749 [0,1,0,1,0,0|0,0,2]=4 7710 B13R1.119 C/C=C/COCCCC1OCCO1 34a_100009871617_100102629194 [0,1,0,1,0,0|0,0,2]=4 7711 B13R1.119 C/C=C/COCCCC1OCCO1 34a_100016270725_100009861162 [0,1,0,1,0,0|0,0,2]=4 7712 B13R1.119 C/C=C/COCCCC1OCCO1 7a_100009871617_100102629194 [0,1,0,1,0,0|0,0,2]=4 7713 B13R1.119 C/C=C/CSCCCC1OCCO1 62a_100102629194_100000042513 [0,1,0,1,0,0|0,0,2]=4 7714 B13R1.119 C=CCCCCNCC1OCCO1 2230a_100000036311_100011215482 [0,1,0,1,0,0|0,0,2]=4 7715 B13R1.119 C=CCCCCNCC1OCCO1 2230a_100000703577_100000755774 [0,1,0,1,0,0|0,0,2]=4 7716 B13R1.119 C=CCCCCNCC1OCCO1 34a_100000036311_100011215482 [0,1,0,1,0,0|0,0,2]=4 7717 B13R1.119 C=CCCCCNCC1OCCO1 34a_100000703577_100000755774 [0,1,0,1,0,0|0,0,2]=4 7718 B13R1.119 C=CCCCCOCC1OCCO1 34a_100000087154_100011215482 [0,1,0,1,0,0|0,0,2]=4 7719 B13R1.119 C=CCCCCOCC1OCCO1 34a_100000766645_100000755774 [0,1,0,1,0,0|0,0,2]=4 7720 B13R1.119 C=CCCCCOCC1OCCO1 7a_100000766645_100000755774 [0,1,0,1,0,0|0,0,2]=4 7721 B13R1.119 C=CCCCCSCC1OCCO1 62a_100000755774_100011215482 [0,1,0,1,0,0|0,0,2]=4 7722 B13R1.119 C=CCCCCSCC1OCCO1 62a_100011215482_100000755774 [0,1,0,1,0,0|0,0,2]=4 7723 B13R1.119 C=CCCCNCCC1OCCO1 2230a_100000034215_100011713584 [0,1,0,1,0,0|0,0,2]=4 7724 B13R1.119 C=CCCCNCCC1OCCO1 2230a_100000700776_100000740749 [0,1,0,1,0,0|0,0,2]=4 7725 B13R1.119 C=CCCCNCCC1OCCO1 34a_100000034215_100000757094 [0,1,0,1,0,0|0,0,2]=4 7726 B13R1.119 C=CCCCNCCC1OCCO1 34a_100000700776_100000740749 [0,1,0,1,0,0|0,0,2]=4 7727 B13R1.119 C=CCCCOCCC1OCCO1 34a_100000758997_100000740749 [0,1,0,1,0,0|0,0,2]=4 7728 B13R1.119 C=CCCCOCCC1OCCO1 7a_100000758997_100000740749 [0,1,0,1,0,0|0,0,2]=4 7729 B13R1.119 C=CCCCSCCC1OCCO1 62a_100011713584_100000740749 [0,1,0,1,0,0|0,0,2]=4 7730 B13R1.119 C=CCCNCCCC1OCCO1 2230a_100015191253_100000042513 [0,1,0,1,0,0|0,0,2]=4 7731 B13R1.119 C=CCCOCCCC1OCCO1 34a_100009871617_100000754431 [0,1,0,1,0,0|0,0,2]=4 7732 B13R1.119 C=CCCOCCCC1OCCO1 34a_100011205117_100009861162 [0,1,0,1,0,0|0,0,2]=4 7733 B13R1.119 C=CCCOCCCC1OCCO1 7a_100009871617_100000754431 [0,1,0,1,0,0|0,0,2]=4 7734 B13R1.119 C=CCCSCCCC1OCCO1 62a_100000754431_100000042513 [0,1,0,1,0,0|0,0,2]=4 7735 B13R1.119 C=CCNCCCCC1OCCO1 2230a_100020586998_100000034956 [0,1,0,1,0,0|0,0,2]=4 7736 B13R1.119 C=CCOCCCCC1OCCO1 34a_200000210373_200009813554 [0,1,0,1,0,0|0,0,2]=4 7737 B13R1.119 C=CCSCCCCC1OCCO1 62a_100000210623_100000034956 [0,1,0,1,0,0|0,0,2]=4 7738 B13R1.119 CC#CCCOCCC1OCCO1 34a_100000750427_100000740749 [0,1,0,1,0,0|0,0,2]=4 7739 B13R1.119 CC#CCNCCCC1OCCO1 2230a_100000685387_100000042513 [0,1,0,1,0,0|0,0,2]=4 7740 B13R1.119 CC#CCNCCCC1OCCO1 34a_100000685387_100009861162 [0,1,0,1,0,0|0,0,2]=4 7741 B13R1.119 CC#CCOCCCC1OCCO1 34a_100000761923_100009861162 [0,1,0,1,0,0|0,0,2]=4 7742 B13R1.119 CC#CCOCCCC1OCCO1 34a_100009871617_100000748600 [0,1,0,1,0,0|0,0,2]=4 7743 B13R1.119 CC#CCOCCCC1OCCO1 7a_100009871617_100000748600 [0,1,0,1,0,0|0,0,2]=4 7744 B13R1.119 CC#CCSCCCC1OCCO1 62a_100000748600_100000042513 [0,1,0,1,0,0|0,0,2]=4 7745 B13R1.119 CC/C=C\CCNCC1OCCO1 2230a_100000036311_100015370543 [0,1,0,1,0,0|0,0,2]=4 7746 B13R1.119 CC/C=C\CCNCC1OCCO1 34a_100000036311_100015370543 [0,1,0,1,0,0|0,0,2]=4 7747 B13R1.119 CC/C=C\CCOCC1OCCO1 34a_100000087154_100015370543 [0,1,0,1,0,0|0,0,2]=4 7748 B13R1.119 CC/C=C\CCOCC1OCCO1 34a_100016288707_100000755774 [0,1,0,1,0,0|0,0,2]=4 7749 B13R1.119 CC/C=C\CCOCC1OCCO1 7a_100016288707_100000755774 [0,1,0,1,0,0|0,0,2]=4 7750 B13R1.119 CC/C=C\CCSCC1OCCO1 62a_100000755774_100015370543 [0,1,0,1,0,0|0,0,2]=4 7751 B13R1.119 CC/C=C\CCSCC1OCCO1 62a_100015370543_100000755774 [0,1,0,1,0,0|0,0,2]=4 7752 B13R1.119 CC/C=C\CNCCC1OCCO1 2230a_100000034215_100103147603 [0,1,0,1,0,0|0,0,2]=4 7753 B13R1.119 CC/C=C\CNCCC1OCCO1 34a_100000034215_100103147603 [0,1,0,1,0,0|0,0,2]=4 7754 B13R1.119 CC/C=C\COCCC1OCCO1 34a_100016268518_100000740749 [0,1,0,1,0,0|0,0,2]=4 7755 B13R1.119 CC/C=C\CSCCC1OCCO1 62a_100103147603_100000740749 [0,1,0,1,0,0|0,0,2]=4 7756 B13R1.119 CC=CCCCOCC1OCCO1 34a_100020645299_100000755774 [0,1,0,1,0,0|0,0,2]=4 7757 B13R1.119 CC=CCOCCCC1OCCO1 34a_100009871617_100000070051 [0,1,0,1,0,0|0,0,2]=4 7758 B13R1.119 CC=CCOCCCC1OCCO1 7a_100009871617_100000070051 [0,1,0,1,0,0|0,0,2]=4 7759 B13R1.119 CC=CCSCCCC1OCCO1 62a_100000070051_100000042513 [0,1,0,1,0,0|0,0,2]=4 7760 B13R1.119 CCC#CCCOCC1OCCO1 34a_100000036655_100000755774 [0,1,0,1,0,0|0,0,2]=4 7761 B13R1.119 CCC#CCCOCC1OCCO1 7a_100000036655_100000755774 [0,1,0,1,0,0|0,0,2]=4 7762 B13R1.119 CCC#CCNCCC1OCCO1 2230a_100000034215_100009813939 [0,1,0,1,0,0|0,0,2]=4 7763 B13R1.119 CCC#CCNCCC1OCCO1 34a_100000034215_100009813939 [0,1,0,1,0,0|0,0,2]=4 7764 B13R1.119 CCC#CCOCCC1OCCO1 34a_100000032950_100000740749 [0,1,0,1,0,0|0,0,2]=4 7765 B13R1.119 CCC#CCSCCC1OCCO1 62a_100009813939_100000740749 [0,1,0,1,0,0|0,0,2]=4 7766 B13R1.119 CCC/C=C/COCC1OCCO1 34a_100016278788_100000755774 [0,1,0,1,0,0|0,0,2]=4 7767 B13R1.119 CCC/C=C/COCC1OCCO1 7a_100016278788_100000755774 [0,1,0,1,0,0|0,0,2]=4 7768 B13R1.119 CCCC#CCOCC1OCCO1 34a_100000034806_100000755774 [0,1,0,1,0,0|0,0,2]=4 7769 B13R1.119 CCCC#CCOCC1OCCO1 7a_100000034806_100000755774 [0,1,0,1,0,0|0,0,2]=4 7770 B13R1.119 CCCCCCCNC1CCCC1 2230a_100000211070_100000210681 [0,1,0,1,0,0|2,0,0]=4 7771 B13R1.119 CCCCCCCNC1CCCC1 2230a_100000229938_100000179811 [0,1,0,1,0,0|2,0,0]=4 7772 B13R1.119 CCCCCCCNC1CCCC1 270004a_100000229938_100000210133 [0,1,0,1,0,0|2,0,0]=4 7773 B13R1.119 CCCCCCCNC1CCCC1 34a_100000211070_100000210614 [0,1,0,1,0,0|2,0,0]=4 7774 B13R1.119 CCCCCCCOC1CCCC1 34a_100000210269_100000210614 [0,1,0,1,0,0|2,0,0]=4 7775 B13R1.119 CCCCCCCOC1CCCC1 34a_100000210272_100000179811 [0,1,0,1,0,0|2,0,0]=4 7776 B13R1.119 CCCCCCCOC1CCCC1 7a_100000210269_100000210614 [0,1,0,1,0,0|2,0,0]=4 7777 B13R1.119 CCCCCCCOC1CCCC1 7a_100000210272_100000179811 [0,1,0,1,0,0|2,0,0]=4 7778 B13R1.119 CCCCCCCOC1CCCO1 34a_100000085407_100000210614 [0,1,0,1,0,0|1,0,0]=3 7779 B13R1.119 CCCCCCCSC1CCCC1 62a_100000210614_100000179811 [0,1,0,1,0,0|2,0,0]=4 7780 B13R1.119 CCCCCCCSC1CCCC1 62a_100011217020_100000210316 [0,1,0,1,0,0|2,0,0]=4 7781 B13R1.119 CCCCCCNCC1CCCC1 2230a_100000210581_100000740388 [0,1,0,1,0,0|2,0,0]=4 7782 B13R1.119 CCCCCCNCC1CCCC1 2230a_100000737975_100000210314 [0,1,0,1,0,0|2,0,0]=4 7783 B13R1.119 CCCCCCNCC1CCCC1 269862a_100000210581_100000746403 [0,1,0,1,0,0|2,0,0]=4 7784 B13R1.119 CCCCCCNCC1CCCC1 34a_100000737975_100000210314 [0,1,0,1,0,0|2,0,0]=4 7785 B13R1.119 CCCCCCNCC1CCCO1 2230a_100000210581_100000203698 [0,1,0,1,0,0|1,0,0]=3 7786 B13R1.119 CCCCCCNCC1OCCO1 2230a_100000036311_100000210314 [0,1,0,1,0,0|0,0,0]=2 7787 B13R1.119 CCCCCCNCC1OCCO1 2230a_100000210581_100000755774 [0,1,0,1,0,0|0,0,0]=2 7788 B13R1.119 CCCCCCNCC1OCCO1 34a_100000036311_100000210314 [0,1,0,1,0,0|0,0,0]=2 7789 B13R1.119 CCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210314 [0,1,0,1,0,0|1,0,0]=3 7790 B13R1.119 CCCCCCNC[C@@H]1CCCO1 34a_100020590478_100000210314 [0,1,0,1,0,0|1,0,0]=3 7791 B13R1.119 CCCCCCOCC1CCCC1 34a_100000210259_100000740388 [0,1,0,1,0,0|2,0,0]=4 7792 B13R1.119 CCCCCCOCC1CCCC1 34a_100000742336_100000210314 [0,1,0,1,0,0|2,0,0]=4 7793 B13R1.119 CCCCCCOCC1CCCC1 7a_100000210259_100000740388 [0,1,0,1,0,0|2,0,0]=4 7794 B13R1.119 CCCCCCOCC1CCCC1 7a_100000742336_100000210314 [0,1,0,1,0,0|2,0,0]=4 7795 B13R1.119 CCCCCCOCC1CCCO1 34a_100000210270_100000210314 [0,1,0,1,0,0|1,0,0]=3 7796 B13R1.119 CCCCCCOCC1CCCO1 7a_100000210259_100000203698 [0,1,0,1,0,0|1,0,0]=3 7797 B13R1.119 CCCCCCOCC1CCCO1 7a_100000210270_100000210314 [0,1,0,1,0,0|1,0,0]=3 7798 B13R1.119 CCCCCCOCC1COCO1 34a_100011216627_100000210314 [0,1,0,1,0,0|2,0,0]=4 7799 B13R1.119 CCCCCCOCC1OCCO1 34a_100000087154_100000210314 [0,1,0,1,0,0|0,0,0]=2 7800 B13R1.119 CCCCCCOCC1OCCO1 34a_100000210259_100000755774 [0,1,0,1,0,0|0,0,0]=2 7801 B13R1.119 CCCCCCOCC1OCCO1 7a_100000210259_100000755774 [0,1,0,1,0,0|0,0,0]=2 7802 B13R1.119 CCCCCCOC[C@H]1CCCN1 34a_100000745186_100000210314 [0,1,0,1,0,0|2,0,0]=4 7803 B13R1.119 CCCCCCSCC1CCCC1 62a_100000210314_100000740388 [0,1,0,1,0,0|2,0,0]=4 7804 B13R1.119 CCCCCCSCC1CCCC1 62a_100000740388_100000210757 [0,1,0,1,0,0|2,0,0]=4 7805 B13R1.119 CCCCCCSCC1CCCO1 62a_100000203698_100000210757 [0,1,0,1,0,0|1,0,0]=3 7806 B13R1.119 CCCCCCSCC1CCCO1 62a_100000210314_100000203698 [0,1,0,1,0,0|1,0,0]=3 7807 B13R1.119 CCCCCCSCC1OCCO1 62a_100000210314_100000755774 [0,1,0,1,0,0|0,0,0]=2 7808 B13R1.119 CCCCCCSCC1OCCO1 62a_100000755774_100000210757 [0,1,0,1,0,0|0,0,0]=2 7809 B13R1.119 CCCCCNCCC1CCCC1 2230a_100000209983_100000760354 [0,1,0,1,0,0|2,0,0]=4 7810 B13R1.119 CCCCCNCCC1CCCC1 2230a_100000739158_100000210326 [0,1,0,1,0,0|2,0,0]=4 7811 B13R1.119 CCCCCNCCC1CCCC1 34a_100000739158_100000718602 [0,1,0,1,0,0|2,0,0]=4 7812 B13R1.119 CCCCCNCCC1OCCO1 2230a_100000034215_100000210326 [0,1,0,1,0,0|0,0,0]=2 7813 B13R1.119 CCCCCNCCC1OCCO1 2230a_100000209983_100000740749 [0,1,0,1,0,0|0,0,0]=2 7814 B13R1.119 CCCCCNCCC1OCCO1 34a_100000034215_100000718602 [0,1,0,1,0,0|0,0,0]=2 7815 B13R1.119 CCCCCOCCC1CCCC1 34a_100000210253_100000760354 [0,1,0,1,0,0|2,0,0]=4 7816 B13R1.119 CCCCCOCCC1CCCC1 34a_100000749090_100000718602 [0,1,0,1,0,0|2,0,0]=4 7817 B13R1.119 CCCCCOCCC1CCCC1 7a_100000210253_100000760354 [0,1,0,1,0,0|2,0,0]=4 7818 B13R1.119 CCCCCOCCC1CCCC1 7a_100000749090_100000210326 [0,1,0,1,0,0|2,0,0]=4 7819 B13R1.119 CCCCCOCCC1OCCO1 34a_100000210253_100000740749 [0,1,0,1,0,0|0,0,0]=2 7820 B13R1.119 CCCCCOCCC1OCCO1 7a_100000210253_100000740749 [0,1,0,1,0,0|0,0,0]=2 7821 B13R1.119 CCCCCSCCC1CCCC1 62a_100000210326_100000760354 [0,1,0,1,0,0|2,0,0]=4 7822 B13R1.119 CCCCCSCCC1CCCC1 62a_100000760354_100000210326 [0,1,0,1,0,0|2,0,0]=4 7823 B13R1.119 CCCCCSCCC1OCCO1 62a_100000210326_100000740749 [0,1,0,1,0,0|0,0,0]=2 7824 B13R1.119 CCCCNCCCC1CCCC1 2230a_100000102301_100011713738 [0,1,0,1,0,0|2,0,0]=4 7825 B13R1.119 CCCCNCCCC1CCCC1 2230a_100000736752_100000210211 [0,1,0,1,0,0|2,0,0]=4 7826 B13R1.119 CCCCNCCCC1CCCC1 34a_100000736752_100000210210 [0,1,0,1,0,0|2,0,0]=4 7827 B13R1.119 CCCCNCCCC1CCCC1 7a_106832991798_100011713738 [0,1,0,1,0,0|2,0,0]=4 7828 B13R1.119 CCCCNCCCC1OCCO1 2230a_100000102301_100000042513 [0,1,0,1,0,0|0,0,0]=2 7829 B13R1.119 CCCCNCCCC1OCCO1 7a_106832991798_100000042513 [0,1,0,1,0,0|0,0,0]=2 7830 B13R1.119 CCCCOCCCC1CCCC1 34a_100000210227_100011713738 [0,1,0,1,0,0|2,0,0]=4 7831 B13R1.119 CCCCOCCCC1CCCC1 34a_100011215328_100000210210 [0,1,0,1,0,0|2,0,0]=4 7832 B13R1.119 CCCCOCCCC1CCCC1 7a_100000210227_100011713738 [0,1,0,1,0,0|2,0,0]=4 7833 B13R1.119 CCCCOCCCC1CCCC1 7a_100011215328_100000210211 [0,1,0,1,0,0|2,0,0]=4 7834 B13R1.119 CCCCOCCCC1OCCO1 34a_100000210227_100009861162 [0,1,0,1,0,0|0,0,0]=2 7835 B13R1.119 CCCCOCCCC1OCCO1 34a_100009871617_100000210210 [0,1,0,1,0,0|0,0,0]=2 7836 B13R1.119 CCCCOCCCC1OCCO1 7a_100000210227_100000042513 [0,1,0,1,0,0|0,0,0]=2 7837 B13R1.119 CCCCOCCCC1OCCO1 7a_100009871617_100000210211 [0,1,0,1,0,0|0,0,0]=2 7838 B13R1.119 CCCCOCCOC1CCCO1 34a_100000085407_100000743108 [0,1,0,1,0,0|2,0,0]=4 7839 B13R1.119 CCCCOCNCC1OCCO1 2230a_100000036311_100011995733 [0,1,0,1,0,0|1,0,0]=3 7840 B13R1.119 CCCCOCNCC1OCCO1 34a_100000036311_100011995733 [0,1,0,1,0,0|1,0,0]=3 7841 B13R1.119 CCCCOCNC[C@@H]1CCCO1 2230a_100020590478_100011995733 [0,1,0,1,0,0|2,0,0]=4 7842 B13R1.119 CCCCOCNC[C@@H]1CCCO1 34a_100020590478_100011995733 [0,1,0,1,0,0|2,0,0]=4 7843 B13R1.119 CCCCOCOCC1CCCO1 34a_100000210270_100011995733 [0,1,0,1,0,0|2,0,0]=4 7844 B13R1.119 CCCCOCOCC1OCCO1 34a_100000087154_100011995733 [0,1,0,1,0,0|1,0,0]=3 7845 B13R1.119 CCCCOCSCC1CCCO1 62a_100000203698_100011995733 [0,1,0,1,0,0|2,0,0]=4 7846 B13R1.119 CCCCOCSCC1CCCO1 62a_100011995733_100000203698 [0,1,0,1,0,0|2,0,0]=4 7847 B13R1.119 CCCCOCSCC1OCCO1 62a_100000755774_100011995733 [0,1,0,1,0,0|1,0,0]=3 7848 B13R1.119 CCCCOCSCC1OCCO1 62a_100011995733_100000755774 [0,1,0,1,0,0|1,0,0]=3 7849 B13R1.119 CCCCSCCCC1CCCC1 62a_100000210211_100011713738 [0,1,0,1,0,0|2,0,0]=4 7850 B13R1.119 CCCCSCCCC1CCCC1 62a_100011713738_100000210210 [0,1,0,1,0,0|2,0,0]=4 7851 B13R1.119 CCCCSCCCC1OCCO1 62a_100000210211_100000042513 [0,1,0,1,0,0|0,0,0]=2 7852 B13R1.119 CCCOCCCCC1OCCO1 34a_100000210258_200009813554 [0,1,0,1,0,0|0,0,0]=2 7853 B13R1.119 CCCOCCNCC1CCCO1 2230a_100161115042_100000203698 [0,1,0,1,0,0|2,0,0]=4 7854 B13R1.119 CCCOCCNCC1OCCO1 2230a_100000036311_100011215938 [0,1,0,1,0,0|1,0,0]=3 7855 B13R1.119 CCCOCCNCC1OCCO1 2230a_100161115042_100000755774 [0,1,0,1,0,0|1,0,0]=3 7856 B13R1.119 CCCOCCNCC1OCCO1 34a_100000036311_100011215938 [0,1,0,1,0,0|1,0,0]=3 7857 B13R1.119 CCCOCCNCC1OCCO1 34a_100161115042_100000755774 [0,1,0,1,0,0|1,0,0]=3 7858 B13R1.119 CCCOCCNC[C@@H]1CCCO1 2230a_100020590478_100011215938 [0,1,0,1,0,0|2,0,0]=4 7859 B13R1.119 CCCOCCNC[C@@H]1CCCO1 34a_100020590478_100011215938 [0,1,0,1,0,0|2,0,0]=4 7860 B13R1.119 CCCOCCOCC1CCCO1 34a_100000210270_100011215938 [0,1,0,1,0,0|2,0,0]=4 7861 B13R1.119 CCCOCCOCC1CCCO1 7a_100000210270_100011215938 [0,1,0,1,0,0|2,0,0]=4 7862 B13R1.119 CCCOCCOCC1CCCO1 7a_100000752267_100000203698 [0,1,0,1,0,0|2,0,0]=4 7863 B13R1.119 CCCOCCOCC1OCCO1 34a_100000087154_100011215938 [0,1,0,1,0,0|1,0,0]=3 7864 B13R1.119 CCCOCCOCC1OCCO1 34a_100000752267_100000755774 [0,1,0,1,0,0|1,0,0]=3 7865 B13R1.119 CCCOCCOCC1OCCO1 7a_100000752267_100000755774 [0,1,0,1,0,0|1,0,0]=3 7866 B13R1.119 CCCOCCSCC1CCCO1 62a_100000203698_100011215938 [0,1,0,1,0,0|2,0,0]=4 7867 B13R1.119 CCCOCCSCC1CCCO1 62a_100011215938_100000203698 [0,1,0,1,0,0|2,0,0]=4 7868 B13R1.119 CCCOCCSCC1OCCO1 62a_100000755774_100011215938 [0,1,0,1,0,0|1,0,0]=3 7869 B13R1.119 CCCOCCSCC1OCCO1 62a_100011215938_100000755774 [0,1,0,1,0,0|1,0,0]=3 7870 B13R1.119 CCCSCCCCC1OCCO1 62a_100000210303_100000034956 [0,1,0,1,0,0|0,0,0]=2 7871 B13R1.119 CCCSCCNCC1CCCO1 2230a_100020603323_100000203698 [0,1,0,1,0,0|2,0,0]=4 7872 B13R1.119 CCCSCCNCC1OCCO1 2230a_100020603323_100000755774 [0,1,0,1,0,0|1,0,0]=3 7873 B13R1.119 CCCSCCOCC1CCCO1 7a_200000230433_100000203698 [0,1,0,1,0,0|2,0,0]=4 7874 B13R1.119 CCCSCCOCC1OCCO1 34a_200000230433_100000755774 [0,1,0,1,0,0|1,0,0]=3 7875 B13R1.119 CCCSCCOCC1OCCO1 7a_200000230433_100000755774 [0,1,0,1,0,0|1,0,0]=3 7876 B13R1.119 CCOCCCCOC1CCCO1 34a_100011018183_100000210202 [0,1,0,1,0,0|2,0,0]=4 7877 B13R1.119 CCOCCCCOC1CCCO1 7a_100011018183_100000210202 [0,1,0,1,0,0|2,0,0]=4 7878 B13R1.119 CCOCCCNCC1CCCO1 2230a_100000210961_100000203698 [0,1,0,1,0,0|2,0,0]=4 7879 B13R1.119 CCOCCCNCC1OCCO1 2230a_100000036311_100012232248 [0,1,0,1,0,0|1,0,0]=3 7880 B13R1.119 CCOCCCNCC1OCCO1 2230a_100000210961_100000755774 [0,1,0,1,0,0|1,0,0]=3 7881 B13R1.119 CCOCCCNCC1OCCO1 34a_100000036311_100012232248 [0,1,0,1,0,0|1,0,0]=3 7882 B13R1.119 CCOCCCNCC1OCCO1 34a_100000210961_100000755774 [0,1,0,1,0,0|1,0,0]=3 7883 B13R1.119 CCOCCCNC[C@@H]1CCCO1 2230a_100020590478_100012232248 [0,1,0,1,0,0|2,0,0]=4 7884 B13R1.119 CCOCCCNC[C@@H]1CCCO1 34a_100020590478_100012232248 [0,1,0,1,0,0|2,0,0]=4 7885 B13R1.119 CCOCCCOCC1CCCO1 34a_100000210270_100012232248 [0,1,0,1,0,0|2,0,0]=4 7886 B13R1.119 CCOCCCOCC1CCCO1 7a_100000210270_100012232248 [0,1,0,1,0,0|2,0,0]=4 7887 B13R1.119 CCOCCCOCC1CCCO1 7a_100000757476_100000203698 [0,1,0,1,0,0|2,0,0]=4 7888 B13R1.119 CCOCCCOCC1OCCO1 34a_100000087154_100012232248 [0,1,0,1,0,0|1,0,0]=3 7889 B13R1.119 CCOCCCOCC1OCCO1 34a_100000757476_100000755774 [0,1,0,1,0,0|1,0,0]=3 7890 B13R1.119 CCOCCCOCC1OCCO1 7a_100000757476_100000755774 [0,1,0,1,0,0|1,0,0]=3 7891 B13R1.119 CCOCCCSCC1CCCO1 62a_100000203698_100012232248 [0,1,0,1,0,0|2,0,0]=4 7892 B13R1.119 CCOCCCSCC1CCCO1 62a_100012232248_100000203698 [0,1,0,1,0,0|2,0,0]=4 7893 B13R1.119 CCOCCCSCC1OCCO1 62a_100000755774_100012232248 [0,1,0,1,0,0|1,0,0]=3 7894 B13R1.119 CCOCCCSCC1OCCO1 62a_100012232248_100000755774 [0,1,0,1,0,0|1,0,0]=3 7895 B13R1.119 CCOCCNCCC1OCCO1 2230a_100000034215_100011215890 [0,1,0,1,0,0|1,0,0]=3 7896 B13R1.119 CCOCCNCCC1OCCO1 2230a_102516460346_100000740749 [0,1,0,1,0,0|1,0,0]=3 7897 B13R1.119 CCOCCNCCC1OCCO1 34a_100000034215_100000210147 [0,1,0,1,0,0|1,0,0]=3 7898 B13R1.119 CCOCCNCCC1OCCO1 34a_102516460346_100000740749 [0,1,0,1,0,0|1,0,0]=3 7899 B13R1.119 CCOCCOCCC1OCCO1 34a_100000210136_100000740749 [0,1,0,1,0,0|1,0,0]=3 7900 B13R1.119 CCOCCOCCC1OCCO1 7a_100000210136_100000740749 [0,1,0,1,0,0|1,0,0]=3 7901 B13R1.119 CCOCCSCCC1OCCO1 62a_100000210147_100000740749 [0,1,0,1,0,0|1,0,0]=3 7902 B13R1.119 CCOCSCCCC1OCCO1 62a_100000739092_100000042513 [0,1,0,1,0,0|1,0,0]=3 7903 B13R1.119 CCSCCCOCC1CCCO1 7a_100011216438_100000203698 [0,1,0,1,0,0|2,0,0]=4 7904 B13R1.119 CCSCCCOCC1OCCO1 34a_100011216438_100000755774 [0,1,0,1,0,0|1,0,0]=3 7905 B13R1.119 CCSCCCOCC1OCCO1 7a_100011216438_100000755774 [0,1,0,1,0,0|1,0,0]=3 7906 B13R1.119 CCSCCNCCC1OCCO1 2230a_100000034215_100000757381 [0,1,0,1,0,0|1,0,0]=3 7907 B13R1.119 CCSCCNCCC1OCCO1 2230a_100000106463_100000740749 [0,1,0,1,0,0|1,0,0]=3 7908 B13R1.119 CCSCCNCCC1OCCO1 34a_100000034215_100000757381 [0,1,0,1,0,0|1,0,0]=3 7909 B13R1.119 CCSCCOCCC1OCCO1 34a_100000212035_100000740749 [0,1,0,1,0,0|1,0,0]=3 7910 B13R1.119 CCSCCOCCC1OCCO1 7a_100000212035_100000740749 [0,1,0,1,0,0|1,0,0]=3 7911 B13R1.119 CCSCCSCCC1OCCO1 62a_100000757381_100000740749 [0,1,0,1,0,0|1,0,0]=3 7912 B13R1.119 CNCCCOCCC1OCCO1 34a_100000213112_100000740749 [0,1,0,1,0,0|1,0,0]=3 7913 B13R1.119 COCCCCNCC1OCCO1 2230a_100000036311_100000730899 [0,1,0,1,0,0|1,0,0]=3 7914 B13R1.119 COCCCCNCC1OCCO1 34a_100000036311_100000755781 [0,1,0,1,0,0|1,0,0]=3 7915 B13R1.119 COCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000730899 [0,1,0,1,0,0|2,0,0]=4 7916 B13R1.119 COCCCCNC[C@@H]1CCCO1 34a_100020590478_100000755781 [0,1,0,1,0,0|2,0,0]=4 7917 B13R1.119 COCCCCOCC1CCCO1 34a_100000210270_100000755781 [0,1,0,1,0,0|2,0,0]=4 7918 B13R1.119 COCCCCOCC1CCCO1 7a_100000210270_100000730899 [0,1,0,1,0,0|2,0,0]=4 7919 B13R1.119 COCCCCOCC1OCCO1 34a_100000087154_100000755781 [0,1,0,1,0,0|1,0,0]=3 7920 B13R1.119 COCCCCOCC1OCCO1 34a_100000740925_100000755774 [0,1,0,1,0,0|1,0,0]=3 7921 B13R1.119 COCCCCSCC1CCCO1 62a_100000203698_100000730899 [0,1,0,1,0,0|2,0,0]=4 7922 B13R1.119 COCCCCSCC1CCCO1 62a_100000730899_100000203698 [0,1,0,1,0,0|2,0,0]=4 7923 B13R1.119 COCCCCSCC1OCCO1 62a_100000730899_100000755774 [0,1,0,1,0,0|1,0,0]=3 7924 B13R1.119 COCCCCSCC1OCCO1 62a_100000755774_100000730899 [0,1,0,1,0,0|1,0,0]=3 7925 B13R1.119 COCCCNCCC1OCCO1 2230a_100000034215_100000740836 [0,1,0,1,0,0|1,0,0]=3 7926 B13R1.119 COCCCNCCC1OCCO1 34a_100000034215_100000740836 [0,1,0,1,0,0|1,0,0]=3 7927 B13R1.119 COCCCNCCC1OCCO1 34a_100150723488_100000740749 [0,1,0,1,0,0|1,0,0]=3 7928 B13R1.119 COCCCOCCC1OCCO1 34a_100000740835_100000740749 [0,1,0,1,0,0|1,0,0]=3 7929 B13R1.119 COCCCSCCC1OCCO1 62a_100000709357_100000740749 [0,1,0,1,0,0|1,0,0]=3 7930 B13R1.119 COCCNCCCC1OCCO1 2230a_100000209980_100000042513 [0,1,0,1,0,0|1,0,0]=3 7931 B13R1.119 COCCOCCCC1OCCO1 34a_100000210237_100009861162 [0,1,0,1,0,0|1,0,0]=3 7932 B13R1.119 COCCOCCCC1OCCO1 34a_100009871617_100011201679 [0,1,0,1,0,0|1,0,0]=3 7933 B13R1.119 COCCOCCCC1OCCO1 7a_100009871617_100000233755 [0,1,0,1,0,0|1,0,0]=3 7934 B13R1.119 COCCOCNCC1OCCO1 2230a_100000036311_100000231047 [0,1,0,1,0,0|2,0,0]=4 7935 B13R1.119 COCCOCSCC1OCCO1 62a_100000231047_100000755774 [0,1,0,1,0,0|2,0,0]=4 7936 B13R1.119 COCCOCSCC1OCCO1 62a_100000755774_100000231047 [0,1,0,1,0,0|2,0,0]=4 7937 B13R1.119 COCCSCCCC1OCCO1 62a_100000233755_100000042513 [0,1,0,1,0,0|1,0,0]=3 7938 B13R1.119 COCSCCCCC1OCCO1 62a_100000766300_100000034956 [0,1,0,1,0,0|1,0,0]=3 7939 B13R1.119 CSCCCCOCC1CCCO1 7a_100011217163_100000203698 [0,1,0,1,0,0|2,0,0]=4 7940 B13R1.119 CSCCCCOCC1OCCO1 34a_100011217163_100000755774 [0,1,0,1,0,0|1,0,0]=3 7941 B13R1.119 CSCCCCOCC1OCCO1 7a_100011217163_100000755774 [0,1,0,1,0,0|1,0,0]=3 7942 B13R1.119 CSCCCNCCC1OCCO1 2230a_100000749238_100000740749 [0,1,0,1,0,0|1,0,0]=3 7943 B13R1.119 CSCCCOCCC1OCCO1 34a_100000690336_100000740749 [0,1,0,1,0,0|1,0,0]=3 7944 B13R1.119 CSCCCOCCC1OCCO1 7a_100000690336_100000740749 [0,1,0,1,0,0|1,0,0]=3 7945 B13R1.119 CSCCNCCCC1OCCO1 2230a_100020590264_100000042513 [0,1,0,1,0,0|1,0,0]=3 7946 B13R1.119 CSCCOCCCC1OCCO1 34a_100000230434_100009861162 [0,1,0,1,0,0|1,0,0]=3 7947 B13R1.119 CSCCOCCCC1OCCO1 34a_100009871617_100000212216 [0,1,0,1,0,0|1,0,0]=3 7948 B13R1.119 CSCCOCCCC1OCCO1 7a_100000230434_100000042513 [0,1,0,1,0,0|1,0,0]=3 7949 B13R1.119 CSCCOCCCC1OCCO1 7a_100009871617_100000212216 [0,1,0,1,0,0|1,0,0]=3 7950 B13R1.119 CSCCSCCCC1OCCO1 62a_100000212216_100000042513 [0,1,0,1,0,0|1,0,0]=3 7951 B13R1.119 CSCSCCCCC1OCCO1 62a_100011218213_100000034956 [0,1,0,1,0,0|1,0,0]=3 7952 B13R1.119 ClCCCCCOCC1CCCO1 7a_100000746330_100000203698 [0,1,0,1,0,0|2,0,0]=4 7953 B13R1.119 ClCCCCCOCC1OCCO1 34a_100000746330_100000755774 [0,1,0,1,0,0|1,0,0]=3 7954 B13R1.119 ClCCCCCOCC1OCCO1 7a_100000746330_100000755774 [0,1,0,1,0,0|1,0,0]=3 7955 B13R1.119 ClCCCCOCCC1OCCO1 34a_100000210776_100000740749 [0,1,0,1,0,0|1,0,0]=3 7956 B13R1.119 ClCCCCOCCC1OCCO1 7a_100000210776_100000740749 [0,1,0,1,0,0|1,0,0]=3 7957 B13R1.119 ClCCCOCCCC1OCCO1 34a_100000230001_100009861162 [0,1,0,1,0,0|1,0,0]=3 7958 B13R1.119 ClCCOCCOCC1OCCO1 34a_100011215305_100000755774 [0,1,0,1,0,0|2,0,0]=4 7959 B13R1.119 ClCCOCCOCC1OCCO1 7a_100011215305_100000755774 [0,1,0,1,0,0|2,0,0]=4 7960 B13R1.119 FCCCCCCOC1CCCO1 34a_100000085407_100015922095 [0,1,0,1,0,0|2,0,0]=4 7961 B13R1.119 FCCCCCNCC1OCCO1 2230a_100000036311_100000729378 [0,1,0,1,0,0|1,0,0]=3 7962 B13R1.119 FCCCCCNCC1OCCO1 34a_100000036311_100000729378 [0,1,0,1,0,0|1,0,0]=3 7963 B13R1.119 FCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000729378 [0,1,0,1,0,0|2,0,0]=4 7964 B13R1.119 FCCCCCNC[C@@H]1CCCO1 34a_100020590478_100000729378 [0,1,0,1,0,0|2,0,0]=4 7965 B13R1.119 FCCCCCOCC1CCCO1 34a_100000210270_100000729378 [0,1,0,1,0,0|2,0,0]=4 7966 B13R1.119 FCCCCCOCC1CCCO1 7a_100000210270_100000729378 [0,1,0,1,0,0|2,0,0]=4 7967 B13R1.119 FCCCCCOCC1OCCO1 34a_100000087154_100000729378 [0,1,0,1,0,0|1,0,0]=3 7968 B13R1.119 FCCCCCSCC1CCCO1 62a_100000203698_100000729378 [0,1,0,1,0,0|2,0,0]=4 7969 B13R1.119 FCCCCCSCC1CCCO1 62a_100000729378_100000203698 [0,1,0,1,0,0|2,0,0]=4 7970 B13R1.119 FCCCCCSCC1OCCO1 62a_100000729378_100000755774 [0,1,0,1,0,0|1,0,0]=3 7971 B13R1.119 FCCCCCSCC1OCCO1 62a_100000755774_100000729378 [0,1,0,1,0,0|1,0,0]=3 7972 B13R1.119 FCCCCNCCC1OCCO1 2230a_100000034215_100000729493 [0,1,0,1,0,0|1,0,0]=3 7973 B13R1.119 FCCCCNCCC1OCCO1 34a_100000034215_100000729493 [0,1,0,1,0,0|1,0,0]=3 7974 B13R1.119 FCCCCOCCC1OCCO1 34a_100011995726_100000740749 [0,1,0,1,0,0|1,0,0]=3 7975 B13R1.119 FCCCCOCCC1OCCO1 7a_100011995726_100000740749 [0,1,0,1,0,0|1,0,0]=3 7976 B13R1.119 FCCCCSCCC1OCCO1 62a_100000729493_100000740749 [0,1,0,1,0,0|1,0,0]=3 7977 B13R1.119 FCCCNCCCC1OCCO1 2230a_100015189416_100000042513 [0,1,0,1,0,0|1,0,0]=3 7978 B13R1.119 FCCCNCCCC1OCCO1 34a_100015189416_100009861162 [0,1,0,1,0,0|1,0,0]=3 7979 B13R1.119 FCCCOCCCC1OCCO1 34a_100000759539_100009861162 [0,1,0,1,0,0|1,0,0]=3 7980 B13R1.119 FCCCOCCCC1OCCO1 34a_100009871617_100011934791 [0,1,0,1,0,0|1,0,0]=3 7981 B13R1.119 FCCCOCCCC1OCCO1 7a_100009871617_100011934791 [0,1,0,1,0,0|1,0,0]=3 7982 B13R1.119 FCCCSCCCC1OCCO1 62a_100011934791_100000042513 [0,1,0,1,0,0|1,0,0]=3 7983 B13R1.119 FCCNCCCCC1OCCO1 34a_100000724931_200009813554 [0,1,0,1,0,0|1,0,0]=3 7984 B13R1.119 FCCOCCOCC1OCCO1 34a_200015357709_100000755774 [0,1,0,1,0,0|2,0,0]=4 7985 B13R1.119 FCCOCCOCC1OCCO1 7a_200015357709_100000755774 [0,1,0,1,0,0|2,0,0]=4 7986 B13R1.119 FCCSCCCCC1OCCO1 62a_100011217306_100000034956 [0,1,0,1,0,0|1,0,0]=3 7987 B13R1.119 ICCCCCOCC1CCCO1 7a_200012148887_100000203698 [0,1,0,1,0,0|2,0,0]=4 7988 B13R1.119 ICCCCCOCC1OCCO1 34a_200012148887_100000755774 [0,1,0,1,0,0|1,0,0]=3 7989 B13R1.119 ICCCCCOCC1OCCO1 7a_200012148887_100000755774 [0,1,0,1,0,0|1,0,0]=3 7990 B13R1.119 ICCCCOCCC1OCCO1 34a_200012148704_100000740749 [0,1,0,1,0,0|1,0,0]=3 7991 B13R1.119 ICCOCCOCC1OCCO1 34a_100012149058_100000755774 [0,1,0,1,0,0|2,0,0]=4 7992 B13R1.119 ICCOCCOCC1OCCO1 7a_100012149058_100000755774 [0,1,0,1,0,0|2,0,0]=4 7993 B13R1.119 N#CCCCCNCC1OCCO1 2230a_100000036311_100000211819 [0,1,0,1,0,0|1,0,1]=4 7994 B13R1.119 N#CCCCCSCC1OCCO1 62a_100000755774_100000211819 [0,1,0,1,0,0|1,0,1]=4 7995 B13R1.119 N#CCCCCSCC1OCCO1 62a_100011219923_100000755774 [0,1,0,1,0,0|1,0,1]=4 7996 B13R1.119 N#CCCCNCCC1OCCO1 2230a_100000034215_100000687738 [0,1,0,1,0,0|1,0,1]=4 7997 B13R1.119 N#CCCCSCCC1OCCO1 62a_100000687738_100000740749 [0,1,0,1,0,0|1,0,1]=4 7998 B13R1.119 N#CCCOCCCC1OCCO1 7a_100009871617_100000184422 [0,1,0,1,0,0|1,0,1]=4 7999 B13R1.119 N#CCCSCCCC1OCCO1 62a_100011215226_100000042513 [0,1,0,1,0,0|1,0,1]=4 8000 B13R1.119 N#CCSCCCCC1OCCO1 62a_100011215382_100000034956 [0,1,0,1,0,0|1,0,1]=4 8001 B13R1.119 NCCCCCOCC1OCCO1 34a_100000762737_100000755774 [0,1,0,1,0,0|1,0,0]=3 8002 B13R1.119 NCCCCOCCC1OCCO1 34a_100000750430_100000740749 [0,1,0,1,0,0|1,0,0]=3 8003 B13R1.119 NCCCOCCCC1OCCO1 34a_100000182051_100009861162 [0,1,0,1,0,0|1,0,0]=3 8004 B13R1.119 NCCOCCCCC1OCCO1 34a_100000210304_200009813554 [0,1,0,1,0,0|1,0,0]=3 8005 B13R1.119 NCCOCCOCC1OCCO1 34a_100000211614_100000755774 [0,1,0,1,0,0|2,0,0]=4 8006 B13R1.119 NOCCOCCCC1OCCO1 34a_100000700252_100009861162 [0,1,0,1,0,0|2,0,0]=4 8007 B13R1.119 O=CCCCCNCC1OCCO1 2230a_100000036311_100000139335 [0,1,0,1,0,0|1,0,1]=4 8008 B13R1.119 O=CCCCCSCC1OCCO1 62a_100000139335_100000755774 [0,1,0,1,0,0|1,0,1]=4 8009 B13R1.119 O=CCCCCSCC1OCCO1 62a_100000755774_100000139335 [0,1,0,1,0,0|1,0,1]=4 8010 B13R1.119 O=CCCCNCCC1OCCO1 2230a_100000034215_200011292268 [0,1,0,1,0,0|1,0,1]=4 8011 B13R1.119 O=CCCCSCCC1OCCO1 62a_200011292268_100000740749 [0,1,0,1,0,0|1,0,1]=4 8012 B13R1.119 O=CCSCCCCC1OCCO1 62a_200015260668_100000034956 [0,1,0,1,0,0|1,0,1]=4 8013 B13R1.119 OCCCCCCOC1CCCO1 34a_100000085407_100000766143 [0,1,0,1,0,0|2,0,0]=4 8014 B13R1.119 OCCCCCNCC1CCCO1 2230a_100000762737_100000203698 [0,1,0,1,0,0|2,0,0]=4 8015 B13R1.119 OCCCCCNCC1OCCO1 2230a_100000036311_100000746330 [0,1,0,1,0,0|1,0,0]=3 8016 B13R1.119 OCCCCCNCC1OCCO1 2230a_100000762737_100000755774 [0,1,0,1,0,0|1,0,0]=3 8017 B13R1.119 OCCCCCNCC1OCCO1 34a_100000036311_100000746330 [0,1,0,1,0,0|1,0,0]=3 8018 B13R1.119 OCCCCCNCC1OCCO1 34a_100000762737_100000755774 [0,1,0,1,0,0|1,0,0]=3 8019 B13R1.119 OCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000746330 [0,1,0,1,0,0|2,0,0]=4 8020 B13R1.119 OCCCCCNC[C@@H]1CCCO1 34a_100020590478_100000746330 [0,1,0,1,0,0|2,0,0]=4 8021 B13R1.119 OCCCCCOCC1CCCO1 34a_100000210270_100000746330 [0,1,0,1,0,0|2,0,0]=4 8022 B13R1.119 OCCCCCOCC1CCCO1 7a_100000210270_100000746330 [0,1,0,1,0,0|2,0,0]=4 8023 B13R1.119 OCCCCCOCC1OCCO1 34a_100000087154_100000746330 [0,1,0,1,0,0|1,0,0]=3 8024 B13R1.119 OCCCCCSCC1CCCO1 62a_100000203698_100000746330 [0,1,0,1,0,0|2,0,0]=4 8025 B13R1.119 OCCCCCSCC1CCCO1 62a_100000746330_100000203698 [0,1,0,1,0,0|2,0,0]=4 8026 B13R1.119 OCCCCCSCC1OCCO1 62a_100000746330_100000755774 [0,1,0,1,0,0|1,0,0]=3 8027 B13R1.119 OCCCCCSCC1OCCO1 62a_100000755774_100000746330 [0,1,0,1,0,0|1,0,0]=3 8028 B13R1.119 OCCCCNCCC1OCCO1 2230a_100000034215_100000210776 [0,1,0,1,0,0|1,0,0]=3 8029 B13R1.119 OCCCCNCCC1OCCO1 2230a_100000750430_100000740749 [0,1,0,1,0,0|1,0,0]=3 8030 B13R1.119 OCCCCNCCC1OCCO1 34a_100000034215_100011216708 [0,1,0,1,0,0|1,0,0]=3 8031 B13R1.119 OCCCCNCCC1OCCO1 34a_100000750430_100000740749 [0,1,0,1,0,0|1,0,0]=3 8032 B13R1.119 OCCCCSCCC1OCCO1 62a_100000210776_100000740749 [0,1,0,1,0,0|1,0,0]=3 8033 B13R1.119 OCCCOCCCC1OCCO1 34a_100009871617_100000230001 [0,1,0,1,0,0|1,0,0]=3 8034 B13R1.119 OCCCOCCCC1OCCO1 7a_100009871617_100011215043 [0,1,0,1,0,0|1,0,0]=3 8035 B13R1.119 OCCCSCCCC1OCCO1 62a_100011215043_100000042513 [0,1,0,1,0,0|1,0,0]=3 8036 B13R1.119 OCCNCCCCC1OCCO1 2230a_100016997473_100000034956 [0,1,0,1,0,0|1,0,0]=3 8037 B13R1.119 OCCNCCCCC1OCCO1 34a_100016990907_200009813554 [0,1,0,1,0,0|1,0,0]=3 8038 B13R1.119 OCCOCCNCC1OCCO1 2230a_100000036311_100011215305 [0,1,0,1,0,0|2,0,0]=4 8039 B13R1.119 OCCOCCNCC1OCCO1 2230a_100000211614_100000755774 [0,1,0,1,0,0|2,0,0]=4 8040 B13R1.119 OCCOCCNCC1OCCO1 34a_100000036311_100000692535 [0,1,0,1,0,0|2,0,0]=4 8041 B13R1.119 OCCOCCNCC1OCCO1 34a_100000211614_100000755774 [0,1,0,1,0,0|2,0,0]=4 8042 B13R1.119 OCCOCCOCC1OCCO1 34a_100000087154_100000692535 [0,1,0,1,0,0|2,0,0]=4 8043 B13R1.119 OCCOCCSCC1OCCO1 62a_100000755774_100011215305 [0,1,0,1,0,0|2,0,0]=4 8044 B13R1.119 OCCOCCSCC1OCCO1 62a_100011215305_100000755774 [0,1,0,1,0,0|2,0,0]=4 8045 B13R1.119 OCCSCCCCC1OCCO1 62a_100000211926_100000034956 [0,1,0,1,0,0|1,0,0]=3 8046 B13R1.119 OCCSCCNCC1OCCO1 2230a_100011219999_100000755774 [0,1,0,1,0,0|2,0,0]=4 8047 B13R1.189 CCCCCCN1CC[C@H](C1)OC 2230a_100000766984_100000210314 [0,1,0,1,0,0|1,0,0]=3 8048 B13R1.189 CCCCCCN1CC[C@H](C1)OC 269982a_100000766984_100000210757 [0,1,0,1,0,0|1,0,0]=3 8049 B13R1.189 CCCCCNC1CCC(C1)CC 270004a_100000209983_100011218773 [0,1,0,1,0,0|2,0,0]=4 8050 B13R1.189 CCCCOCN1CC[C@H](C1)OC 2230a_100000766984_100011995733 [0,1,0,1,0,0|2,0,0]=4 8051 B13R1.189 CCCCOCN1CC[C@H](C1)OC 269982a_100000766984_100011995733 [0,1,0,1,0,0|2,0,0]=4 8052 B13R1.189 CCCOCCN1CC[C@H](C1)OC 2230a_100000766984_100011215938 [0,1,0,1,0,0|2,0,0]=4 8053 B13R1.189 CCCOCCN1CC[C@H](C1)OC 269982a_100000766984_100011215938 [0,1,0,1,0,0|2,0,0]=4 8054 B13R1.189 CCOCCCN1CC[C@H](C1)OC 2230a_100000766984_100012232248 [0,1,0,1,0,0|2,0,0]=4 8055 B13R1.189 CCOCCCN1CC[C@H](C1)OC 269982a_100000766984_100012232248 [0,1,0,1,0,0|2,0,0]=4 8056 B13R1.189 COCCCCN1CC[C@H](C1)OC 2230a_100000766984_100000730899 [0,1,0,1,0,0|2,0,0]=4 8057 B13R1.189 COCCCCN1CC[C@H](C1)OC 269982a_100000766984_100000730899 [0,1,0,1,0,0|2,0,0]=4 8058 B13R1.189 CO[C@@H]1CCN(C1)CCCCCF 2230a_100000766984_100000729378 [0,1,0,1,0,0|2,0,0]=4 8059 B13R1.189 CO[C@@H]1CCN(C1)CCCCCF 269982a_100000766984_100000729378 [0,1,0,1,0,0|2,0,0]=4 8060 B13R1.189 CO[C@@H]1CCN(C1)CCCCCO 2230a_100000766984_100000746330 [0,1,0,1,0,0|2,0,0]=4 8061 B13R1.189 CO[C@@H]1CCN(C1)CCCCCO 269982a_100000766984_100000746330 [0,1,0,1,0,0|2,0,0]=4 8062 B13R1.316 CCC(CC)CNC1CCCC1C 269862a_100102946423_100000752053 [0,1,0,1,0,0|2,0,0]=4 8063 B13R1.316 CCC(CC)COC1CCCC1C 34a_100011216460_100011215472 [0,1,0,1,0,0|2,0,0]=4 8064 B13R1.316 CCC(CC)COC1CCCC1C 7a_100011216460_100011215472 [0,1,0,1,0,0|2,0,0]=4 8065 B13R1.316 CCC(CNC1CCCC1C)OC 269862a_100000731041_100000752053 [0,1,0,1,0,0|1,0,0]=3 8066 B13R1.316 CCC(CNC1CCOC1C)OC 270004a_100000731041_100000691750 [0,1,0,1,0,0|2,0,0]=4 8067 B13R1.316 COC(CCN1CCC[C@@H]1C)OC 2230a_100020605311_100009813347 [0,1,0,1,0,0|0,0,0]=2 8068 B13R1.316 COC(CCN1CCC[C@@H]1C)OC 269982a_100020605311_100000139399 [0,1,0,1,0,0|0,0,0]=2 8069 B13R1.316 COC(CCN1CCC[C@H]1C)OC 2230a_100015189458_100009813347 [0,1,0,1,0,0|0,0,0]=2 8070 B13R1.316 COC(CCN1CCC[C@H]1C)OC 269982a_100015189458_100000139399 [0,1,0,1,0,0|0,0,0]=2 8071 B13R1.316 COC(CCN1CCC[C@H]1C)OC 34a_100015189458_100000139399 [0,1,0,1,0,0|0,0,0]=2 8072 B13R1.316 COC(CCN1CCSC1C)OC 2230a_200011216479_100009813347 [0,1,0,1,0,0|1,0,0]=3 8073 B13R1.316 COC(CCN1CCSC1C)OC 269982a_200011216479_100000139399 [0,1,0,1,0,0|1,0,0]=3 8074 B13R1.316 COC(CCN1CCSC1C)OC 34a_200011216479_100000139399 [0,1,0,1,0,0|1,0,0]=3 8075 B13R1.316 COC(CNC1CCOC1C)OC 270004a_100000210479_100000691750 [0,1,0,1,0,0|1,0,0]=3 8076 B13R1.316 COC(CN[C@H]1CCC[C@@H]1O)OC 270004a_100000748460_100000752162 [0,1,0,1,0,0|1,0,0]=3 8077 B13R1.316 COC(CN[C@H]1COC[C@@H]1O)OC 2230a_100015191717_100000751394 [0,1,0,1,0,0|2,0,0]=4 8078 B13R1.316 COC(CN[C@H]1COC[C@@H]1O)OC 270004a_100015191717_100000752162 [0,1,0,1,0,0|2,0,0]=4 8079 B13R1.316 COC(COC1CCCC1=O)OC 34a_100011216393_100000709159 [0,1,0,1,0,0|1,0,1]=4 8080 B13R1.316 COC(COC1CCCC1=O)OC 34a_200000719330_100000211822 [0,1,0,1,0,0|1,0,1]=4 8081 B13R1.316 COC(COC1CCCC1C)OC 34a_100011216460_100000211822 [0,1,0,1,0,0|0,0,0]=2 8082 B13R1.316 COC(COC1CCCC1C)OC 7a_100011216460_100000751394 [0,1,0,1,0,0|0,0,0]=2 8083 B13R1.316 COC(COC1COCC1O)OC 34a_100011216393_200000725654 [0,1,0,1,0,0|2,0,0]=4 8084 B13R1.316 COC(CO[C@@H]1CCC[C@H]1Cl)OC 34a_200016002552_100000211822 [0,1,0,1,0,0|1,0,0]=3 8085 B13R1.316 COC(CO[C@H]1CCC[C@@H]1N)OC 34a_100000748460_100000211822 [0,1,0,1,0,0|1,0,0]=3 8086 B13R1.316 COC(CO[C@H]1CNC[C@H]1C)OC 34a_200015306588_100000211822 [0,1,0,1,0,0|1,0,0]=3 8087 B13R1.316 COC(CO[C@H]1COC[C@@H]1N)OC 34a_100015191717_100000211822 [0,1,0,1,0,0|2,0,0]=4 8088 B13R1.316 COC(CSC1CCCC1=O)OC 62a_100000211823_100000751394 [0,1,0,1,0,0|1,0,1]=4 8089 B13R1.316 COC(CSC1CCCC1=O)OC 62a_100000751394_100000211823 [0,1,0,1,0,0|1,0,1]=4 8090 B13R1.316 COC(CSC1COCC1O)OC 62a_100000751394_200000725654 [0,1,0,1,0,0|2,0,0]=4 8091 B13R1.316 COC(CSC1COCC1O)OC 62a_200000725654_100000751394 [0,1,0,1,0,0|2,0,0]=4 8092 B13R1.316 COC(CS[C@@H]1CCC[C@H]1O)OC 62a_100000751394_200016002552 [0,1,0,1,0,0|1,0,0]=3 8093 B13R1.316 COC(CS[C@@H]1CCC[C@H]1O)OC 62a_200016002552_100000751394 [0,1,0,1,0,0|1,0,0]=3 8094 B13R1.319 COC(C=NNCC1CCC1)OC 4a_200020586977_100000752162 [0,1,0,1,0,0|1,0,1]=4 8095 B13R1.319 COC(CCCNC1CCC1)OC 2230a_100000749019_100000069011 [0,1,0,1,0,0|0,0,0]=2 8096 B13R1.319 COC(CCCNC1CCC1)OC 270004a_100000034021_100000241760 [0,1,0,1,0,0|0,0,0]=2 8097 B13R1.319 COC(CCCNC1CCC1)OC 34a_100000749019_100000069011 [0,1,0,1,0,0|0,0,0]=2 8098 B13R1.319 COC(CCCNC1COC1)OC 2230a_100016991112_100000069011 [0,1,0,1,0,0|1,0,0]=3 8099 B13R1.319 COC(CCCOC1CCC1)OC 34a_100000748187_100000069011 [0,1,0,1,0,0|0,0,0]=2 8100 B13R1.319 COC(CCCOC1CSC1)OC 7a_100000072292_100000069011 [0,1,0,1,0,0|1,0,0]=3 8101 B13R1.319 COC(CCCSC1CCC1)OC 62a_100000069011_100000749161 [0,1,0,1,0,0|0,0,0]=2 8102 B13R1.319 COC(CCCSC1COC1)OC 62a_100000069011_100009818527 [0,1,0,1,0,0|1,0,0]=3 8103 B13R1.319 COC(CCNCC1CCC1)OC 2230a_100000738700_100009813347 [0,1,0,1,0,0|0,0,0]=2 8104 B13R1.319 COC(CCNCC1CCC1)OC 34a_100000738700_100000139399 [0,1,0,1,0,0|0,0,0]=2 8105 B13R1.319 COC(CCNCC1COC1)OC 2230a_100015281925_100009813347 [0,1,0,1,0,0|1,0,0]=3 8106 B13R1.319 COC(CCNCC1COC1)OC 34a_100015281925_100000139399 [0,1,0,1,0,0|1,0,0]=3 8107 B13R1.319 COC(CCNC[C@@H]1CCO1)OC 2230a_100020831831_100009813347 [0,1,0,1,0,0|1,0,0]=3 8108 B13R1.319 COC(CCNC[C@@H]1CCO1)OC 34a_100020831831_100000139399 [0,1,0,1,0,0|1,0,0]=3 8109 B13R1.319 COC(CCOCC1CCC1)OC 34a_100000760304_100000139399 [0,1,0,1,0,0|0,0,0]=2 8110 B13R1.319 COC(CCOCC1CCO1)OC 34a_100000039022_100000139399 [0,1,0,1,0,0|1,0,0]=3 8111 B13R1.319 COC(CCOCC1CNC1)OC 34a_100016987283_100000139399 [0,1,0,1,0,0|1,0,0]=3 8112 B13R1.319 COC(CCOCC1COC1)OC 34a_100000060846_100000139399 [0,1,0,1,0,0|1,0,0]=3 8113 B13R1.319 COC(CCSCC1CCC1)OC 62a_100000139399_100000763275 [0,1,0,1,0,0|0,0,0]=2 8114 B13R1.319 COC(CCSCC1CCC1)OC 62a_100000763275_100000139399 [0,1,0,1,0,0|0,0,0]=2 8115 B13R1.319 COC(CCSCC1CCO1)OC 62a_100000103362_100000139399 [0,1,0,1,0,0|1,0,0]=3 8116 B13R1.319 COC(CCSCC1CCO1)OC 62a_100000139399_100000103362 [0,1,0,1,0,0|1,0,0]=3 8117 B13R1.319 COC(CCSCC1COC1)OC 62a_100000139399_100010264016 [0,1,0,1,0,0|1,0,0]=3 8118 B13R1.319 COC(CCSCC1COC1)OC 62a_100010264016_100000139399 [0,1,0,1,0,0|1,0,0]=3 8119 B13R1.319 COC(COCCC1COC1)OC 34a_100009855314_100000211822 [0,1,0,1,0,0|1,0,0]=3 8120 B13R1.327 COC(CCCN1CCC1C)OC 269982a_100000755817_100000069011 [0,1,0,1,0,0|0,0,0]=2 8121 B13R1.327 COC(CCCN1CCC1C)OC 34a_100000755817_100000069011 [0,1,0,1,0,0|0,0,0]=2 8122 B13R1.327 COC(CCSC1CCC1=O)OC 62a_100000139399_100009892977 [0,1,0,1,0,0|1,0,1]=4 8123 B13R1.327 COC(CCSC1CCC1=O)OC 62a_100009892977_100000139399 [0,1,0,1,0,0|1,0,1]=4 8124 B13R1.335 CCC(CC)CN1CCCCC1C 2230a_100000211376_100011215472 [0,1,0,1,0,0|2,0,0]=4 8125 B13R1.335 CCC(CC)CN1CCCCC1C 269982a_100000211376_100011215472 [0,1,0,1,0,0|2,0,0]=4 8126 B13R1.335 CCC(CC)CN1CCCCC1C 270004a_100000211376_100000211137 [0,1,0,1,0,0|2,0,0]=4 8127 B13R1.335 CCC(CC)CN1CCCCC1C 34a_100000211376_100011215472 [0,1,0,1,0,0|2,0,0]=4 8128 B13R1.335 CCC(CC)NC1CCCCC1C 269862a_100000199018_100000210921 [0,1,0,1,0,0|2,0,0]=4 8129 B13R1.335 CCC(CC)NC1CCCCC1C 270004a_100000199018_100000210921 [0,1,0,1,0,0|2,0,0]=4 8130 B13R1.335 CCC(CC)NC1CCCCC1C 270004a_100000211402_100000210860 [0,1,0,1,0,0|2,0,0]=4 8131 B13R1.335 CCC(CC)OC1CCCCC1C 7a_100000211207_100000210505 [0,1,0,1,0,0|2,0,0]=4 8132 B13R1.335 COC(CN1CCCCC1C)OC 2230a_100000211376_100000751394 [0,1,0,1,0,0|0,0,0]=2 8133 B13R1.335 COC(CN1CCCCC1C)OC 270004a_100000211376_100000752162 [0,1,0,1,0,0|0,0,0]=2 8134 B13R1.335 COC(CN1CCCCC1C)OC 34a_100000211376_100000211822 [0,1,0,1,0,0|0,0,0]=2 8135 B13R1.335 COC(CN1CCOC[C@@H]1C)OC 2230a_100009815349_100000751394 [0,1,0,1,0,0|1,0,0]=3 8136 B13R1.335 COC(CN1CCOC[C@@H]1C)OC 270004a_100009815349_100000752162 [0,1,0,1,0,0|1,0,0]=3 8137 B13R1.335 COC(CN1CCOC[C@@H]1C)OC 34a_100009815349_100000211822 [0,1,0,1,0,0|1,0,0]=3 8138 B13R1.371 CCCCCC1CCC(CC1)NC 270004a_106832991635_100000004394 [0,1,0,1,0,0|2,0,0]=4 8139 B13R1.371 CCCCCC1CCC(CC1)OC 34a_100000066488_200000210301 [0,1,0,1,0,0|1,0,0]=3 8140 B13R1.371 CCCCCC1CCC(CC1)OC 7a_100000066488_200000210301 [0,1,0,1,0,0|1,0,0]=3 8141 B13R1.371 CCCCCC1CCC(CC1)O[13CH3] 34a_100000066488_200025704644 [0,1,0,1,0,0|1,0,0]=3 8142 B13R1.371 CCCCCC1CCC(CC1)O[13CH3] 7a_100000066488_200025704644 [0,1,0,1,0,0|1,0,0]=3 8143 B13R1.371 CCCCCN1CCC(CC1)CC 2230a_100000754474_100000210326 [0,1,0,1,0,0|2,0,0]=4 8144 B13R1.371 CCCCCN1CCC(CC1)CC 269982a_100000754474_100000210215 [0,1,0,1,0,0|2,0,0]=4 8145 B13R1.371 CCCCCN1CCC(CC1)CC 34a_100000754474_100000718602 [0,1,0,1,0,0|2,0,0]=4 8146 B13R1.371 CCCCCN1CCC(CC1)OC 2230a_100000234800_100000210326 [0,1,0,1,0,0|1,0,0]=3 8147 B13R1.371 CCCCCN1CCC(CC1)OC 269982a_100000234800_100000210215 [0,1,0,1,0,0|1,0,0]=3 8148 B13R1.371 CCCCCN1CCC(CC1)OC 34a_100000234800_100000718602 [0,1,0,1,0,0|1,0,0]=3 8149 B13R1.371 CCCCCN1CCC(CC1)SC 2230a_100015202541_100000210326 [0,1,0,1,0,0|1,1,0]=4 8150 B13R1.371 CCCCCN1CCC(CC1)SC 269982a_100015202541_100000210215 [0,1,0,1,0,0|1,1,0]=4 8151 B13R1.371 CCCCCN1CCC(CC1)SC 34a_100015202541_100000718602 [0,1,0,1,0,0|1,1,0]=4 8152 B13R1.371 CCCCNC1CCC(CC1)CC 2230a_100011194317_100000210211 [0,1,0,1,0,0|2,0,0]=4 8153 B13R1.371 CCCCNC1CCC(CC1)CC 270004a_100000102301_100000210631 [0,1,0,1,0,0|2,0,0]=4 8154 B13R1.371 CCCCNC1CCC(CC1)CC 34a_100011194317_100000210210 [0,1,0,1,0,0|2,0,0]=4 8155 B13R1.371 CCCCNC1CCC(CC1)NC 270004a_100000102301_200016988011 [0,1,0,1,0,0|2,0,0]=4 8156 B13R1.371 CCCCNC1CCC(CC1)OC 270004a_100000102301_100000747084 [0,1,0,1,0,0|1,0,0]=3 8157 B13R1.371 CCCCNC1CCC(CC1)OC 34a_100015205214_100000210210 [0,1,0,1,0,0|1,0,0]=3 8158 B13R1.371 CCCCOC1CCC(CC1)CC 34a_100011215326_100000210210 [0,1,0,1,0,0|2,0,0]=4 8159 B13R1.371 CCCCOC1CCC(CC1)CC 7a_100011215326_100000210211 [0,1,0,1,0,0|2,0,0]=4 8160 B13R1.371 CCCCOC1CCC(CC1)OC 34a_100011581665_100000210210 [0,1,0,1,0,0|1,0,0]=3 8161 B13R1.371 CCCCOC1CCC(CC1)OC 7a_100011581665_100000210211 [0,1,0,1,0,0|1,0,0]=3 8162 B13R1.371 CCCCO[C@H]1CC[C@H](CC1)NC 34a_100020636401_100000210210 [0,1,0,1,0,0|2,0,0]=4 8163 B13R1.371 CCCOCC1CCC(CC1)OC 34a_100000210258_100013032858 [0,1,0,1,0,0|1,0,0]=3 8164 B13R1.371 CCCOC[C@H]1CC[C@@H](CC1)NC 34a_100009831571_100000210303 [0,1,0,1,0,0|2,0,0]=4 8165 B13R1.371 CCCSCC1CCC(CC1)OC 62a_100000210303_100013032858 [0,1,0,1,0,0|1,0,0]=3 8166 B13R1.371 CCCSCC1CCC(CC1)OC 62a_100013032858_100000210303 [0,1,0,1,0,0|1,0,0]=3 8167 B13R1.371 CCNCCC1CCC(CC1)OC 34a_100011998350_100000210202 [0,1,0,1,0,0|1,0,0]=3 8168 B13R1.371 CCOCCN1CCC(CC1)OC 2230a_100000234800_100011215890 [0,1,0,1,0,0|2,0,0]=4 8169 B13R1.371 CCOCCN1CCC(CC1)OC 269982a_100000234800_100011215890 [0,1,0,1,0,0|2,0,0]=4 8170 B13R1.371 CCOCCN1CCC(CC1)OC 34a_100000234800_100000210147 [0,1,0,1,0,0|2,0,0]=4 8171 B13R1.371 CCSCCN1CCC(CC1)OC 2230a_100000234800_100000757381 [0,1,0,1,0,0|2,0,0]=4 8172 B13R1.371 CCSCCN1CCC(CC1)OC 269982a_100000234800_100000757381 [0,1,0,1,0,0|2,0,0]=4 8173 B13R1.371 CCSCCN1CCC(CC1)OC 34a_100000234800_100000757381 [0,1,0,1,0,0|2,0,0]=4 8174 B13R1.371 COC1CCC(CC1)CCNCF 34a_100011998350_100015361967 [0,1,0,1,0,0|2,0,0]=4 8175 B13R1.371 COC1CCC(CC1)CNCCF 34a_100000724931_100013032858 [0,1,0,1,0,0|2,0,0]=4 8176 B13R1.371 COC1CCC(CC1)CNCCO 2230a_100016997473_100013032858 [0,1,0,1,0,0|2,0,0]=4 8177 B13R1.371 COC1CCC(CC1)CNCCO 34a_100016990907_100013032858 [0,1,0,1,0,0|2,0,0]=4 8178 B13R1.371 COC1CCC(CC1)COCCBr 34a_100000211926_100013032858 [0,1,0,1,0,0|2,0,0]=4 8179 B13R1.371 COC1CCC(CC1)COCCN 34a_100000210304_100013032858 [0,1,0,1,0,0|2,0,0]=4 8180 B13R1.371 COC1CCC(CC1)CSCCF 62a_100011217306_100013032858 [0,1,0,1,0,0|2,0,0]=4 8181 B13R1.371 COC1CCC(CC1)CSCCF 62a_100013032858_100011217306 [0,1,0,1,0,0|2,0,0]=4 8182 B13R1.371 COC1CCC(CC1)CSCCO 62a_100000211926_100013032858 [0,1,0,1,0,0|2,0,0]=4 8183 B13R1.371 COC1CCC(CC1)CSCCO 62a_100013032858_100000211926 [0,1,0,1,0,0|2,0,0]=4 8184 B13R1.371 COC1CCC(CC1)CSCSC 62a_100011218213_100013032858 [0,1,0,1,0,0|2,0,0]=4 8185 B13R1.371 COC1CCC(CC1)CSCSC 62a_100013032858_100011218213 [0,1,0,1,0,0|2,0,0]=4 8186 B13R1.371 COC1CCC(CC1)NCCCF 270004a_100015189416_100000747084 [0,1,0,1,0,0|2,0,0]=4 8187 B13R1.371 COC1CCC(CC1)NCCCF 34a_100015205214_100011934791 [0,1,0,1,0,0|2,0,0]=4 8188 B13R1.371 COC1CCC(CC1)NCCCO 270004a_100000182051_100000747084 [0,1,0,1,0,0|2,0,0]=4 8189 B13R1.371 COC1CCC(CC1)NCCCO 34a_100015205214_100000230001 [0,1,0,1,0,0|2,0,0]=4 8190 B13R1.371 COC1CCC(CC1)NCCSC 270004a_100020590264_100000747084 [0,1,0,1,0,0|2,0,0]=4 8191 B13R1.371 COC1CCC(CC1)NCCSC 34a_100015205214_100000212216 [0,1,0,1,0,0|2,0,0]=4 8192 B13R1.371 COC1CCC(CC1)OCCCF 34a_100011581665_100011934791 [0,1,0,1,0,0|2,0,0]=4 8193 B13R1.371 COC1CCC(CC1)OCCCF 7a_100011581665_100011934791 [0,1,0,1,0,0|2,0,0]=4 8194 B13R1.371 COC1CCC(CC1)OCCCO 34a_100011581665_100000230001 [0,1,0,1,0,0|2,0,0]=4 8195 B13R1.371 COC1CCC(CC1)OCCCO 7a_100011581665_100011215043 [0,1,0,1,0,0|2,0,0]=4 8196 B13R1.371 COC1CCC(CC1)OCCSC 34a_100011581665_100000212216 [0,1,0,1,0,0|2,0,0]=4 8197 B13R1.371 COC1CCC(CC1)OCCSC 7a_100011581665_100000212216 [0,1,0,1,0,0|2,0,0]=4 8198 B13R1.371 COC1CCN(CC1)CCCCF 2230a_100000234800_100000729493 [0,1,0,1,0,0|2,0,0]=4 8199 B13R1.371 COC1CCN(CC1)CCCCF 269982a_100000234800_100000729493 [0,1,0,1,0,0|2,0,0]=4 8200 B13R1.371 COC1CCN(CC1)CCCCF 34a_100000234800_100000729493 [0,1,0,1,0,0|2,0,0]=4 8201 B13R1.371 COC1CCN(CC1)CCCCO 2230a_100000234800_100000210776 [0,1,0,1,0,0|2,0,0]=4 8202 B13R1.371 COC1CCN(CC1)CCCCO 269982a_100000234800_100000210776 [0,1,0,1,0,0|2,0,0]=4 8203 B13R1.371 COC1CCN(CC1)CCCCO 34a_100000234800_100011216708 [0,1,0,1,0,0|2,0,0]=4 8204 B13R1.371 COCCCN1CCC(CC1)OC 2230a_100000234800_100000740836 [0,1,0,1,0,0|2,0,0]=4 8205 B13R1.371 COCCCN1CCC(CC1)OC 269982a_100000234800_100000740836 [0,1,0,1,0,0|2,0,0]=4 8206 B13R1.371 COCCCN1CCC(CC1)OC 34a_100000234800_100000740836 [0,1,0,1,0,0|2,0,0]=4 8207 B13R1.371 COCCNC1CCC(CC1)OC 270004a_100000209980_100000747084 [0,1,0,1,0,0|2,0,0]=4 8208 B13R1.371 COCCNC1CCC(CC1)OC 34a_100015205214_100011201679 [0,1,0,1,0,0|2,0,0]=4 8209 B13R1.371 COCCOC1CCC(CC1)OC 34a_100011581665_100011201679 [0,1,0,1,0,0|2,0,0]=4 8210 B13R1.371 COCCOC1CCC(CC1)OC 34a_200013344987_200000210301 [0,1,0,1,0,0|2,0,0]=4 8211 B13R1.371 COCCOC1CCC(CC1)OC 7a_100011581665_100000233755 [0,1,0,1,0,0|2,0,0]=4 8212 B13R1.371 COCCOC1CCC(CC1)OC 7a_200013344987_200000210301 [0,1,0,1,0,0|2,0,0]=4 8213 B13R1.371 COCCOC1CCC(CC1)O[13CH3] 34a_200013344987_200025704644 [0,1,0,1,0,0|2,0,0]=4 8214 B13R1.371 COCCOC1CCC(CC1)O[13CH3] 7a_200013344987_200025704644 [0,1,0,1,0,0|2,0,0]=4 8215 B13R1.371 COCSCC1CCC(CC1)OC 62a_100000766300_100013032858 [0,1,0,1,0,0|2,0,0]=4 8216 B13R1.371 COCSCC1CCC(CC1)OC 62a_100013032858_100000766300 [0,1,0,1,0,0|2,0,0]=4 8217 B13R1.415 CCC(CC)CNCC1CCCC1 2230a_100000737975_100011215472 [0,1,0,1,0,0|2,0,0]=4 8218 B13R1.415 CCC(CC)CNCC1CCCC1 2230a_100102946423_100000740388 [0,1,0,1,0,0|2,0,0]=4 8219 B13R1.415 CCC(CC)CNCC1CCCC1 269862a_100000737975_100000211137 [0,1,0,1,0,0|2,0,0]=4 8220 B13R1.415 CCC(CC)CNCC1CCCC1 269862a_100102946423_100000746403 [0,1,0,1,0,0|2,0,0]=4 8221 B13R1.415 CCC(CC)CNCC1CCCC1 270004a_100000737975_100000211137 [0,1,0,1,0,0|2,0,0]=4 8222 B13R1.415 CCC(CC)CNCC1CCCC1 34a_100000737975_100011215472 [0,1,0,1,0,0|2,0,0]=4 8223 B13R1.415 CCC(CC)COCC1CCCC1 34a_100000742336_100011215472 [0,1,0,1,0,0|2,0,0]=4 8224 B13R1.415 CCC(CC)COCC1CCCC1 7a_100000703878_100000740388 [0,1,0,1,0,0|2,0,0]=4 8225 B13R1.415 CCC(CC)COCC1CCCC1 7a_100000742336_100011215472 [0,1,0,1,0,0|2,0,0]=4 8226 B13R1.415 CCC(CC)CSCC1CCCC1 62a_100000740388_100011215472 [0,1,0,1,0,0|2,0,0]=4 8227 B13R1.415 CCC(CC)CSCC1CCCC1 62a_100011215472_100000740388 [0,1,0,1,0,0|2,0,0]=4 8228 B13R1.415 CCC(CC)NCCC1CCCC1 2230a_100000199018_100000760354 [0,1,0,1,0,0|2,0,0]=4 8229 B13R1.415 CCC(CC)NCCC1CCCC1 270004a_100000739158_100000210860 [0,1,0,1,0,0|2,0,0]=4 8230 B13R1.415 CCC(CC)OCCC1CCCC1 7a_100000688536_100000760354 [0,1,0,1,0,0|2,0,0]=4 8231 B13R1.415 CCC(CC)OCCC1CCCC1 7a_100000749090_100000210505 [0,1,0,1,0,0|2,0,0]=4 8232 B13R1.415 CCC(CC)SCCC1CCCC1 62a_100000210505_100000760354 [0,1,0,1,0,0|2,0,0]=4 8233 B13R1.415 CCC(CC)SCCC1CCCC1 62a_100000760354_100000210505 [0,1,0,1,0,0|2,0,0]=4 8234 B13R1.415 CCC(CNCC1CCCC1)OC 269862a_100000731041_100000746403 [0,1,0,1,0,0|1,0,0]=3 8235 B13R1.415 CCC(COCC1CCCC1)OC 34a_100011934954_100000740388 [0,1,0,1,0,0|1,0,0]=3 8236 B13R1.415 CCC(COCC1CCCC1)OC 7a_100011934954_100000740388 [0,1,0,1,0,0|1,0,0]=3 8237 B13R1.415 CCC(COCC1CCCO1)OC 7a_100011934954_100000203698 [0,1,0,1,0,0|2,0,0]=4 8238 B13R1.415 CCC(COCC1CCOC1)OC 34a_100011934954_100011261433 [0,1,0,1,0,0|2,0,0]=4 8239 B13R1.415 CCC(COCC1CCOC1)OC 7a_100011934954_100000702531 [0,1,0,1,0,0|2,0,0]=4 8240 B13R1.415 COC(C=NNC1CCCC1)OC 4a_100000737850_100000752162 [0,1,0,1,0,0|1,0,1]=4 8241 B13R1.415 COC(CCCN1CC=CC1)OC 269982a_100015195280_100000069011 [0,1,0,1,0,0|0,0,2]=4 8242 B13R1.415 COC(CCCN1CCCC1)OC 2230a_100000188435_100000069011 [0,1,0,1,0,0|0,0,0]=2 8243 B13R1.415 COC(CCCN1CCCC1)OC 269982a_100000188435_100000069011 [0,1,0,1,0,0|0,0,0]=2 8244 B13R1.415 COC(CCCN1CCSC1)OC 2230a_100011215254_100000069011 [0,1,0,1,0,0|1,0,0]=3 8245 B13R1.415 COC(CCCN1CCSC1)OC 269982a_100011215254_100000069011 [0,1,0,1,0,0|1,0,0]=3 8246 B13R1.415 COC(CCNC1CC=CC1)OC 2230a_100015188752_100009813347 [0,1,0,1,0,0|0,0,2]=4 8247 B13R1.415 COC(CCNC1CCCC1)OC 2230a_100000211070_100009813347 [0,1,0,1,0,0|0,0,0]=2 8248 B13R1.415 COC(CCNC1CCCC1)OC 34a_100000211070_100000139399 [0,1,0,1,0,0|0,0,0]=2 8249 B13R1.415 COC(CCN[C@@H]1CCOC1)OC 2230a_200015188469_100009813347 [0,1,0,1,0,0|1,0,0]=3 8250 B13R1.415 COC(CCN[C@H]1CCOC1)OC 2230a_100015188467_100009813347 [0,1,0,1,0,0|1,0,0]=3 8251 B13R1.415 COC(CCN[C@H]1CCOC1)OC 34a_100015188467_100000139399 [0,1,0,1,0,0|1,0,0]=3 8252 B13R1.415 COC(CCOC1CCCC1)OC 34a_100000210269_100000139399 [0,1,0,1,0,0|0,0,0]=2 8253 B13R1.415 COC(CCOC1CCCC1)OC 7a_100000210269_100009813347 [0,1,0,1,0,0|0,0,0]=2 8254 B13R1.415 COC(CCOC1CCCO1)OC 34a_100000085407_100000139399 [0,1,0,1,0,0|1,0,0]=3 8255 B13R1.415 COC(CCOC1CCSC1)OC 7a_100011232664_100009813347 [0,1,0,1,0,0|1,0,0]=3 8256 B13R1.415 COC(CCO[C@H]1CCOC1)OC 34a_100000717292_100000139399 [0,1,0,1,0,0|1,0,0]=3 8257 B13R1.415 COC(CCSC1CCCC1)OC 62a_100000139399_100000179811 [0,1,0,1,0,0|0,0,0]=2 8258 B13R1.415 COC(CCSC1CCCC1)OC 62a_100011217020_100000139399 [0,1,0,1,0,0|0,0,0]=2 8259 B13R1.415 COC(CCSC1CCOC1)OC 62a_100000139399_100000690089 [0,1,0,1,0,0|1,0,0]=3 8260 B13R1.415 COC(CNCC1CCCC1)OC 2230a_100000737975_100000751394 [0,1,0,1,0,0|0,0,0]=2 8261 B13R1.415 COC(CNCC1CCCC1)OC 270004a_100000737975_100000752162 [0,1,0,1,0,0|0,0,0]=2 8262 B13R1.415 COC(CNCC1CCCC1)OC 34a_100000737975_100000211822 [0,1,0,1,0,0|0,0,0]=2 8263 B13R1.415 COC(CNCC1CCOC1)OC 2230a_100000737293_100000751394 [0,1,0,1,0,0|1,0,0]=3 8264 B13R1.415 COC(CNCC1CCOC1)OC 270004a_100000737293_100000752162 [0,1,0,1,0,0|1,0,0]=3 8265 B13R1.415 COC(CNCC1CCOC1)OC 34a_100000737293_100000211822 [0,1,0,1,0,0|1,0,0]=3 8266 B13R1.415 COC(CNCC1OCCO1)OC 2230a_100000036311_100000751394 [0,1,0,1,0,0|2,0,0]=4 8267 B13R1.415 COC(CNCC1OCCO1)OC 270004a_100000036311_100000752162 [0,1,0,1,0,0|2,0,0]=4 8268 B13R1.415 COC(CNCC1OCCO1)OC 34a_100000036311_100000211822 [0,1,0,1,0,0|2,0,0]=4 8269 B13R1.415 COC(CNC[C@@H]1CCCO1)OC 2230a_100020590478_100000751394 [0,1,0,1,0,0|1,0,0]=3 8270 B13R1.415 COC(CNC[C@@H]1CCCO1)OC 270004a_100020590478_100000752162 [0,1,0,1,0,0|1,0,0]=3 8271 B13R1.415 COC(CNC[C@@H]1CCCO1)OC 34a_100020590478_100000211822 [0,1,0,1,0,0|1,0,0]=3 8272 B13R1.415 COC(COCC1CC=CC1)OC 34a_100000688395_100000211822 [0,1,0,1,0,0|0,0,2]=4 8273 B13R1.415 COC(COCC1CCCC1)OC 34a_100000742336_100000211822 [0,1,0,1,0,0|0,0,0]=2 8274 B13R1.415 COC(COCC1CCCC1)OC 34a_100011216393_100000740388 [0,1,0,1,0,0|0,0,0]=2 8275 B13R1.415 COC(COCC1CCCC1)OC 7a_100000742336_100000751394 [0,1,0,1,0,0|0,0,0]=2 8276 B13R1.415 COC(COCC1CCCO1)OC 34a_100000210270_100000211822 [0,1,0,1,0,0|1,0,0]=3 8277 B13R1.415 COC(COCC1CCCO1)OC 7a_100000210270_100000751394 [0,1,0,1,0,0|1,0,0]=3 8278 B13R1.415 COC(COCC1CCNC1)OC 34a_100000748654_100000211822 [0,1,0,1,0,0|1,0,0]=3 8279 B13R1.415 COC(COCC1CCOC1)OC 34a_100000740260_100000211822 [0,1,0,1,0,0|1,0,0]=3 8280 B13R1.415 COC(COCC1CCOC1)OC 34a_100011216393_100011261433 [0,1,0,1,0,0|1,0,0]=3 8281 B13R1.415 COC(COCC1COCO1)OC 34a_100011216627_100000211822 [0,1,0,1,0,0|2,0,0]=4 8282 B13R1.415 COC(COCC1OCCO1)OC 34a_100000087154_100000211822 [0,1,0,1,0,0|2,0,0]=4 8283 B13R1.415 COC(COCC1OCCO1)OC 34a_100011216393_100000755774 [0,1,0,1,0,0|2,0,0]=4 8284 B13R1.415 COC(COC[C@H]1CCCN1)OC 34a_100000745186_100000211822 [0,1,0,1,0,0|1,0,0]=3 8285 B13R1.415 COC(CSCC1CCCC1)OC 62a_100000740388_100000751394 [0,1,0,1,0,0|0,0,0]=2 8286 B13R1.415 COC(CSCC1CCCC1)OC 62a_100000751394_100000740388 [0,1,0,1,0,0|0,0,0]=2 8287 B13R1.415 COC(CSCC1CCCO1)OC 62a_100000203698_100000751394 [0,1,0,1,0,0|1,0,0]=3 8288 B13R1.415 COC(CSCC1CCCO1)OC 62a_100000751394_100000203698 [0,1,0,1,0,0|1,0,0]=3 8289 B13R1.415 COC(CSCC1CCOC1)OC 62a_100000702531_100000751394 [0,1,0,1,0,0|1,0,0]=3 8290 B13R1.415 COC(CSCC1CCOC1)OC 62a_100000751394_100000702531 [0,1,0,1,0,0|1,0,0]=3 8291 B13R1.415 COC(CSCC1OCCO1)OC 62a_100000751394_100000755774 [0,1,0,1,0,0|2,0,0]=4 8292 B13R1.415 COC(CSCC1OCCO1)OC 62a_100000755774_100000751394 [0,1,0,1,0,0|2,0,0]=4 8293 B13R1.417 CCC(CC)CNC1CCCCC1 2230a_100000182618_100011215472 [0,1,0,1,0,0|2,0,0]=4 8294 B13R1.417 CCC(CC)CNC1CCCCC1 269862a_100000182618_100000211137 [0,1,0,1,0,0|2,0,0]=4 8295 B13R1.417 CCC(CC)CNC1CCCCC1 270004a_100000182618_100000211137 [0,1,0,1,0,0|2,0,0]=4 8296 B13R1.417 CCC(CC)CNC1CCCCC1 270004a_100102946423_100000210434 [0,1,0,1,0,0|2,0,0]=4 8297 B13R1.417 CCC(CC)CNC1CCCCC1 34a_100000182618_100011215472 [0,1,0,1,0,0|2,0,0]=4 8298 B13R1.417 CCC(CC)COC1CCCCC1 34a_100000210231_100011215472 [0,1,0,1,0,0|2,0,0]=4 8299 B13R1.417 CCC(CC)COC1CCCCC1 7a_100000210231_100011215472 [0,1,0,1,0,0|2,0,0]=4 8300 B13R1.417 CCC(CC)COC1CCCCC1 7a_100000703878_100000210327 [0,1,0,1,0,0|2,0,0]=4 8301 B13R1.417 CCC(CC)CSC1CCCCC1 62a_100000210327_100011215472 [0,1,0,1,0,0|2,0,0]=4 8302 B13R1.417 CCC(CC)CSC1CCCCC1 62a_100011215472_100000210327 [0,1,0,1,0,0|2,0,0]=4 8303 B13R1.417 CCC(CC)NCC1CCCCC1 2230a_100000199018_100000211423 [0,1,0,1,0,0|2,0,0]=4 8304 B13R1.417 CCC(CC)NCC1CCCCC1 269862a_100000199018_100000211278 [0,1,0,1,0,0|2,0,0]=4 8305 B13R1.417 CCC(CC)NCC1CCCCC1 270004a_100000210473_100000210860 [0,1,0,1,0,0|2,0,0]=4 8306 B13R1.417 CCC(CC)OCC1CCCCC1 7a_100000212181_100000210505 [0,1,0,1,0,0|2,0,0]=4 8307 B13R1.417 CCC(CC)OCC1CCCCC1 7a_100000688536_100000211423 [0,1,0,1,0,0|2,0,0]=4 8308 B13R1.417 CCC(CC)SCC1CCCCC1 62a_100000210505_100000211423 [0,1,0,1,0,0|2,0,0]=4 8309 B13R1.417 CCC(CC)SCC1CCCCC1 62a_100000211423_100000210505 [0,1,0,1,0,0|2,0,0]=4 8310 B13R1.417 CCC(CNC1CCCCC1)OC 270004a_100000731041_100000210434 [0,1,0,1,0,0|1,0,0]=3 8311 B13R1.417 CCC(CNC1CCCOC1)OC 270004a_100000731041_100000753404 [0,1,0,1,0,0|2,0,0]=4 8312 B13R1.417 CCC(CNC1CCCSC1)OC 270004a_100000731041_100000057913 [0,1,0,1,0,0|2,0,0]=4 8313 B13R1.417 CCC(CNC1CCNCC1)OC 270004a_100000731041_100015192401 [0,1,0,1,0,0|2,0,0]=4 8314 B13R1.417 CCC(CNC1CCOCC1)OC 270004a_100000731041_100011217826 [0,1,0,1,0,0|2,0,0]=4 8315 B13R1.417 CCC(CNC1CCSCC1)OC 270004a_100000731041_100000203788 [0,1,0,1,0,0|2,0,0]=4 8316 B13R1.417 CCC(COC1CCCCC1)OC 34a_100011934954_100000210327 [0,1,0,1,0,0|1,0,0]=3 8317 B13R1.417 CCC(COC1CCCCC1)OC 7a_100011934954_100000210327 [0,1,0,1,0,0|1,0,0]=3 8318 B13R1.417 CCC(COC1CCCOC1)OC 34a_100011934954_100000693364 [0,1,0,1,0,0|2,0,0]=4 8319 B13R1.417 CCC(COC1CCCOC1)OC 7a_100011934954_100000693364 [0,1,0,1,0,0|2,0,0]=4 8320 B13R1.417 CCC(COC1CCOCC1)OC 7a_100011934954_100000686592 [0,1,0,1,0,0|2,0,0]=4 8321 B13R1.417 CCC(COC1CCSCC1)OC 34a_100011934954_100000069128 [0,1,0,1,0,0|2,0,0]=4 8322 B13R1.417 CCC(COC1CCSCC1)OC 7a_100011934954_100011500858 [0,1,0,1,0,0|2,0,0]=4 8323 B13R1.417 COC(CCN1CC=CCC1)OC 2230a_100000698166_100009813347 [0,1,0,1,0,0|0,0,2]=4 8324 B13R1.417 COC(CCN1CC=CCC1)OC 269982a_100000698166_100000139399 [0,1,0,1,0,0|0,0,2]=4 8325 B13R1.417 COC(CCN1CC=CCC1)OC 34a_100000698166_100000139399 [0,1,0,1,0,0|0,0,2]=4 8326 B13R1.417 COC(CCN1CCCOC1)OC 2230a_100000131196_100009813347 [0,1,0,1,0,0|1,0,0]=3 8327 B13R1.417 COC(CCN1CCCOC1)OC 269982a_100000131196_100000139399 [0,1,0,1,0,0|1,0,0]=3 8328 B13R1.417 COC(CCN1CCCOC1)OC 34a_100000131196_100000139399 [0,1,0,1,0,0|1,0,0]=3 8329 B13R1.417 COC(CCN1CCOCC1)OC 2230a_100015191051_100009813347 [0,1,0,1,0,0|1,0,0]=3 8330 B13R1.417 COC(CCN1CCOCC1)OC 269982a_100015191051_100000139399 [0,1,0,1,0,0|1,0,0]=3 8331 B13R1.417 COC(CCN1CCOCC1)OC 34a_100015191051_100000139399 [0,1,0,1,0,0|1,0,0]=3 8332 B13R1.417 COC(CCN1CCSCC1)OC 2230a_100000737611_100009813347 [0,1,0,1,0,0|1,0,0]=3 8333 B13R1.417 COC(CCN1CCSCC1)OC 269982a_100000737611_100000139399 [0,1,0,1,0,0|1,0,0]=3 8334 B13R1.417 COC(CNC1CCCCC1)OC 2230a_100000182618_100000751394 [0,1,0,1,0,0|0,0,0]=2 8335 B13R1.417 COC(CNC1CCCCC1)OC 270004a_100000182618_100000752162 [0,1,0,1,0,0|0,0,0]=2 8336 B13R1.417 COC(CNC1CCCCC1)OC 270004a_100000210479_100000210434 [0,1,0,1,0,0|0,0,0]=2 8337 B13R1.417 COC(CNC1CCCCC1)OC 34a_100000182618_100000211822 [0,1,0,1,0,0|0,0,0]=2 8338 B13R1.417 COC(CNC1CCCOC1)OC 2230a_100000719290_100000751394 [0,1,0,1,0,0|1,0,0]=3 8339 B13R1.417 COC(CNC1CCCOC1)OC 270004a_100000210479_100000753404 [0,1,0,1,0,0|1,0,0]=3 8340 B13R1.417 COC(CNC1CCCOC1)OC 270004a_100000719290_100000752162 [0,1,0,1,0,0|1,0,0]=3 8341 B13R1.417 COC(CNC1CCCOC1)OC 34a_100000719290_100000211822 [0,1,0,1,0,0|1,0,0]=3 8342 B13R1.417 COC(CNC1CCCSC1)OC 270004a_100000210479_100000057913 [0,1,0,1,0,0|1,0,0]=3 8343 B13R1.417 COC(CNC1CCNCC1)OC 270004a_100000210479_100015192401 [0,1,0,1,0,0|1,0,0]=3 8344 B13R1.417 COC(CNC1CCOCC1)OC 2230a_100000741149_100000751394 [0,1,0,1,0,0|1,0,0]=3 8345 B13R1.417 COC(CNC1CCOCC1)OC 270004a_100000210479_100011217826 [0,1,0,1,0,0|1,0,0]=3 8346 B13R1.417 COC(CNC1CCOCC1)OC 270004a_100000741149_100000752162 [0,1,0,1,0,0|1,0,0]=3 8347 B13R1.417 COC(CNC1CCOCC1)OC 34a_100000741149_100000211822 [0,1,0,1,0,0|1,0,0]=3 8348 B13R1.417 COC(CNC1CCSCC1)OC 2230a_100000748639_100000751394 [0,1,0,1,0,0|1,0,0]=3 8349 B13R1.417 COC(CNC1CCSCC1)OC 270004a_100000210479_100000203788 [0,1,0,1,0,0|1,0,0]=3 8350 B13R1.417 COC(CNC1CCSCC1)OC 270004a_100000748639_100000752162 [0,1,0,1,0,0|1,0,0]=3 8351 B13R1.417 COC(CNC1CCSCC1)OC 34a_100000748639_100000211822 [0,1,0,1,0,0|1,0,0]=3 8352 B13R1.417 COC(COC1C=CCCC1)OC 34a_100011215024_100000211822 [0,1,0,1,0,0|0,0,2]=4 8353 B13R1.417 COC(COC1CC=CCC1)OC 34a_100000073881_100000211822 [0,1,0,1,0,0|0,0,2]=4 8354 B13R1.417 COC(COC1CCCCC1)OC 34a_100000210231_100000211822 [0,1,0,1,0,0|0,0,0]=2 8355 B13R1.417 COC(COC1CCCCC1)OC 34a_100011216393_100000210327 [0,1,0,1,0,0|0,0,0]=2 8356 B13R1.417 COC(COC1CCCCC1)OC 7a_100000210231_100000751394 [0,1,0,1,0,0|0,0,0]=2 8357 B13R1.417 COC(COC1CCCCO1)OC 34a_100000033831_100000211822 [0,1,0,1,0,0|1,0,0]=3 8358 B13R1.417 COC(COC1CCCOC1)OC 34a_100000754041_100000211822 [0,1,0,1,0,0|1,0,0]=3 8359 B13R1.417 COC(COC1CCCOC1)OC 34a_100011216393_100000693364 [0,1,0,1,0,0|1,0,0]=3 8360 B13R1.417 COC(COC1CCCSC1)OC 7a_100015962668_100000751394 [0,1,0,1,0,0|1,0,0]=3 8361 B13R1.417 COC(COC1CCOCC1)OC 34a_100000744328_100000211822 [0,1,0,1,0,0|1,0,0]=3 8362 B13R1.417 COC(COC1CCSCC1)OC 34a_100000731022_100000211822 [0,1,0,1,0,0|1,0,0]=3 8363 B13R1.417 COC(COC1CCSCC1)OC 34a_100011216393_100000069128 [0,1,0,1,0,0|1,0,0]=3 8364 B13R1.417 COC(COC1CCSCC1)OC 7a_100000731022_100000751394 [0,1,0,1,0,0|1,0,0]=3 8365 B13R1.417 COC(CSC1C=CCCC1)OC 62a_100000751183_100000751394 [0,1,0,1,0,0|0,0,2]=4 8366 B13R1.417 COC(CSC1C=CCCC1)OC 62a_100000751394_100000751183 [0,1,0,1,0,0|0,0,2]=4 8367 B13R1.417 COC(CSC1CCCCC1)OC 62a_100000210327_100000751394 [0,1,0,1,0,0|0,0,0]=2 8368 B13R1.417 COC(CSC1CCCCC1)OC 62a_100000751394_100000210327 [0,1,0,1,0,0|0,0,0]=2 8369 B13R1.417 COC(CSC1CCCOC1)OC 62a_100000751394_100000693364 [0,1,0,1,0,0|1,0,0]=3 8370 B13R1.417 COC(CSC1CCOCC1)OC 62a_100000751394_100011324220 [0,1,0,1,0,0|1,0,0]=3 8371 B13R1.417 COC(CSC1CCSCC1)OC 62a_100000751394_100000069128 [0,1,0,1,0,0|1,0,0]=3 8372 B13R1.918 CCC(CC)N1CCCCCCC1 269982a_100000211400_100000210505 [0,1,0,1,0,0|2,0,0]=4 8373 B13R1.918 CCC(CC)N1CCCCCCC1 270004a_100000211400_100000210860 [0,1,0,1,0,0|2,0,0]=4 8374 B13R1.1001 CCC(CC)CN1CCCCCC1 2230a_100000185865_100011215472 [0,1,0,1,0,0|2,0,0]=4 8375 B13R1.1001 CCC(CC)CN1CCCCCC1 269982a_100000185865_100011215472 [0,1,0,1,0,0|2,0,0]=4 8376 B13R1.1001 CCC(CC)CN1CCCCCC1 270004a_100000185865_100000211137 [0,1,0,1,0,0|2,0,0]=4 8377 B13R1.1001 CCC(CC)CN1CCCCCC1 34a_100000185865_100011215472 [0,1,0,1,0,0|2,0,0]=4 8378 B13R1.1001 CCC(CC)NC1CCCCCC1 270004a_100000199018_100000210131 [0,1,0,1,0,0|2,0,0]=4 8379 B13R1.1001 CCC(CC)NC1CCCCCC1 270004a_100000210984_100000210860 [0,1,0,1,0,0|2,0,0]=4 8380 B13R1.1001 CCC(CC)OC1CCCCCC1 7a_100000210887_100000210505 [0,1,0,1,0,0|2,0,0]=4 8381 B13R1.1001 CCC(CC)SC1CCCCCC1 62a_100000210505_100011217769 [0,1,0,1,0,0|2,0,0]=4 8382 B13R1.1001 CCC(CC)SC1CCCCCC1 62a_100011217769_100000210505 [0,1,0,1,0,0|2,0,0]=4 8383 B13R1.1001 COC(CN1CCCCCC1)OC 2230a_100000185865_100000751394 [0,1,0,1,0,0|0,0,0]=2 8384 B13R1.1001 COC(CN1CCCCCC1)OC 270004a_100000185865_100000752162 [0,1,0,1,0,0|0,0,0]=2 8385 B13R1.1001 COC(CN1CCCCCC1)OC 34a_100000185865_100000211822 [0,1,0,1,0,0|0,0,0]=2 8386 B13R1.1001 COC(CN1CCCOCC1)OC 2230a_100000685342_100000751394 [0,1,0,1,0,0|1,0,0]=3 8387 B13R1.1001 COC(CN1CCCOCC1)OC 270004a_100000685342_100000752162 [0,1,0,1,0,0|1,0,0]=3 8388 B13R1.1001 COC(CN1CCCOCC1)OC 34a_100000685342_100000211822 [0,1,0,1,0,0|1,0,0]=3 8389 B13R1.1652 CCCCN1CCCC(CC1)CC 2230a_100000757272_100000210211 [0,1,0,1,0,0|2,0,0]=4 8390 B13R1.1652 CCCCN1CCCC(CC1)CC 269982a_100000757272_100000210211 [0,1,0,1,0,0|2,0,0]=4 8391 B13R1.1652 CCCCN1CCCC(CC1)CC 34a_100000757272_100000210210 [0,1,0,1,0,0|2,0,0]=4 8392 B13R1.1652 CCCCN1CCCC(CC1)OC 2230a_100016993962_100000210211 [0,1,0,1,0,0|1,0,0]=3 8393 B13R1.1652 CCCCN1CCCC(CC1)OC 269982a_100016993962_100000210211 [0,1,0,1,0,0|1,0,0]=3 8394 B13R1.1652 CCCCN1CCCC(CC1)OC 34a_100016993962_100000210210 [0,1,0,1,0,0|1,0,0]=3 8395 B13R1.1652 CCOCN1CCCC(CC1)OC 269982a_100016993962_100000739092 [0,1,0,1,0,0|2,0,0]=4 8396 B13R1.1652 COC1CCCN(CC1)CCCF 2230a_100016993962_100011934791 [0,1,0,1,0,0|2,0,0]=4 8397 B13R1.1652 COC1CCCN(CC1)CCCF 269982a_100016993962_100011934791 [0,1,0,1,0,0|2,0,0]=4 8398 B13R1.1652 COC1CCCN(CC1)CCCF 34a_100016993962_100011934791 [0,1,0,1,0,0|2,0,0]=4 8399 B13R1.1652 COC1CCCN(CC1)CCCO 2230a_100016993962_100000230001 [0,1,0,1,0,0|2,0,0]=4 8400 B13R1.1652 COC1CCCN(CC1)CCCO 269982a_100016993962_100011215043 [0,1,0,1,0,0|2,0,0]=4 8401 B13R1.1652 COC1CCCN(CC1)CCCO 34a_100016993962_100000230001 [0,1,0,1,0,0|2,0,0]=4 8402 B13R1.1652 COC1CCCN(CC1)CCSC 2230a_100016993962_100000751147 [0,1,0,1,0,0|2,0,0]=4 8403 B13R1.1652 COC1CCCN(CC1)CCSC 269982a_100016993962_100000212216 [0,1,0,1,0,0|2,0,0]=4 8404 B13R1.1652 COC1CCCN(CC1)CCSC 34a_100016993962_100000212216 [0,1,0,1,0,0|2,0,0]=4 8405 B13R1.1652 COCCN1CCCC(CC1)OC 2230a_100016993962_100011201679 [0,1,0,1,0,0|2,0,0]=4 8406 B13R1.1652 COCCN1CCCC(CC1)OC 269982a_100016993962_100000233755 [0,1,0,1,0,0|2,0,0]=4 8407 B13R1.1652 COCCN1CCCC(CC1)OC 34a_100016993962_100011201679 [0,1,0,1,0,0|2,0,0]=4 8408 B13R1.2802 CCC(CC)CN1CCCC1CC 2230a_100000754278_100011215472 [0,1,0,1,0,0|2,0,0]=4 8409 B13R1.2802 CCC(CC)CN1CCCC1CC 269982a_100000754278_100011215472 [0,1,0,1,0,0|2,0,0]=4 8410 B13R1.2802 CCC(CC)CN1CCCC1CC 270004a_100000754278_100000211137 [0,1,0,1,0,0|2,0,0]=4 8411 B13R1.2802 CCC(CC)CN1CCCC1CC 34a_100000754278_100011215472 [0,1,0,1,0,0|2,0,0]=4 8412 B13R1.2802 CCC(CC)NC1CCCC1CC 269862a_100000199018_100000749056 [0,1,0,1,0,0|2,0,0]=4 8413 B13R1.2802 CCC(CC)NC1CCCC1CC 270004a_100000199018_100000749056 [0,1,0,1,0,0|2,0,0]=4 8414 B13R1.2802 CCC1C=CCN1CC(OC)OC 2230a_100000730860_100000751394 [0,1,0,1,0,0|0,0,2]=4 8415 B13R1.2802 CCC1C=CCN1CC(OC)OC 34a_100000730860_100000211822 [0,1,0,1,0,0|0,0,2]=4 8416 B13R1.2802 CCC1CCCN1CC(OC)OC 2230a_100000754278_100000751394 [0,1,0,1,0,0|0,0,0]=2 8417 B13R1.2802 CCC1CCCN1CC(OC)OC 270004a_100000754278_100000752162 [0,1,0,1,0,0|0,0,0]=2 8418 B13R1.2802 CCC1CCCN1CC(OC)OC 34a_100000754278_100000211822 [0,1,0,1,0,0|0,0,0]=2 8419 B13R1.2802 COC(CN1CCCC1C#N)OC 2230a_100000701862_100000751394 [0,1,0,1,0,0|1,0,1]=4 8420 B13R1.2802 COC(CN1CCC[C@@H]1C#N)OC 2230a_106645074975_100000751394 [0,1,0,1,0,0|1,0,1]=4 8421 B13R1.2802 COC(CN1CCC[C@@H]1C#N)OC 270004a_106645074975_100000752162 [0,1,0,1,0,0|1,0,1]=4 8422 B13R1.2802 COC(CN1CCC[C@@H]1CO)OC 2230a_100000745186_100000751394 [0,1,0,1,0,0|1,0,0]=3 8423 B13R1.2802 COC(CN1CCC[C@@H]1CO)OC 270004a_100000745186_100000752162 [0,1,0,1,0,0|1,0,0]=3 8424 B13R1.2802 COC(CN1CCC[C@@H]1CO)OC 34a_100000745186_100000211822 [0,1,0,1,0,0|1,0,0]=3 8425 B13R1.2886 COCC1CCN1CC(OC)OC 2230a_100015195929_100000751394 [0,1,0,1,0,0|1,0,0]=3 8426 B13R1.2886 COCC1CCN1CC(OC)OC 270004a_100015195929_100000752162 [0,1,0,1,0,0|1,0,0]=3 8427 B13R1.2886 COCC1CCN1CC(OC)OC 34a_100015195929_100000211822 [0,1,0,1,0,0|1,0,0]=3 8428 B13R1.7838 CCC1(CO1)CNCCCCCO 34a_100000762737_200000139556 [0,1,0,1,0,0|2,0,0]=4 8429 B13R1.7838 CCC1(CO1)COCCCCCBr 34a_100000746331_200000139556 [0,1,0,1,0,0|2,0,0]=4 8430 B13R1.7838 CCC1(CO1)COCCCCCBr 7a_100000746331_200000139556 [0,1,0,1,0,0|2,0,0]=4 8431 B13R1.7838 CCC1(CO1)COCCCCCCl 34a_100000746330_200000139556 [0,1,0,1,0,0|2,0,0]=4 8432 B13R1.7838 CCC1(CO1)COCCCCCCl 7a_100000746330_200000139556 [0,1,0,1,0,0|2,0,0]=4 8433 B13R1.7838 CCC1(CO1)COCCCCCI 34a_200012148887_200000139556 [0,1,0,1,0,0|2,0,0]=4 8434 B13R1.7838 CCC1(CO1)COCCCCCI 7a_200012148887_200000139556 [0,1,0,1,0,0|2,0,0]=4 8435 B13R1.7838 CCC1(CO1)COCCCCCN 34a_100000762737_200000139556 [0,1,0,1,0,0|2,0,0]=4 8436 B13R1.7838 CCC1(CO1)COCCCCOC 34a_100000740925_200000139556 [0,1,0,1,0,0|2,0,0]=4 8437 B13R1.7838 CCC1(CO1)COCCCCSC 34a_100011217163_200000139556 [0,1,0,1,0,0|2,0,0]=4 8438 B13R1.7838 CCC1(CO1)COCCCCSC 7a_100011217163_200000139556 [0,1,0,1,0,0|2,0,0]=4 8439 B13R1.7838 CCC1(CO1)CSCCCCCF 62a_100000729378_200000139556 [0,1,0,1,0,0|2,0,0]=4 8440 B13R1.7838 CCC1(CO1)CSCCCCCF 62a_200000139556_100000729378 [0,1,0,1,0,0|2,0,0]=4 8441 B13R1.7838 CCC1(CO1)CSCCCCCO 62a_100000746330_200000139556 [0,1,0,1,0,0|2,0,0]=4 8442 B13R1.7838 CCC1(CO1)CSCCCCCO 62a_200000139556_100000746330 [0,1,0,1,0,0|2,0,0]=4 8443 B13R1.7838 CCC1(CO1)CSCCCCOC 62a_100000730899_200000139556 [0,1,0,1,0,0|2,0,0]=4 8444 B13R1.7838 CCC1(CO1)CSCCCCOC 62a_200000139556_100000730899 [0,1,0,1,0,0|2,0,0]=4 8445 B13R1.7838 CCCCCCCNC1(CC1)CC 2230a_100000732774_100000210681 [0,1,0,1,0,0|2,0,0]=4 8446 B13R1.7838 CCCCCCOCC1(CO1)CC 34a_100000210259_200000139556 [0,1,0,1,0,0|1,0,0]=3 8447 B13R1.7838 CCCCCCOCC1(CO1)CC 7a_100000210259_200000139556 [0,1,0,1,0,0|1,0,0]=3 8448 B13R1.7838 CCCCCCSCC1(CO1)CC 62a_100000210314_200000139556 [0,1,0,1,0,0|1,0,0]=3 8449 B13R1.7838 CCCCCCSCC1(CO1)CC 62a_200000139556_100000210757 [0,1,0,1,0,0|1,0,0]=3 8450 B13R1.7838 CCCCOCSCC1(CO1)CC 62a_100011995733_200000139556 [0,1,0,1,0,0|2,0,0]=4 8451 B13R1.7838 CCCCOCSCC1(CO1)CC 62a_200000139556_100011995733 [0,1,0,1,0,0|2,0,0]=4 8452 B13R1.7838 CCCOCCNCC1(CO1)CC 34a_100161115042_200000139556 [0,1,0,1,0,0|2,0,0]=4 8453 B13R1.7838 CCCOCCOCC1(CO1)CC 34a_100000752267_200000139556 [0,1,0,1,0,0|2,0,0]=4 8454 B13R1.7838 CCCOCCOCC1(CO1)CC 7a_100000752267_200000139556 [0,1,0,1,0,0|2,0,0]=4 8455 B13R1.7838 CCCOCCSCC1(CO1)CC 62a_100011215938_200000139556 [0,1,0,1,0,0|2,0,0]=4 8456 B13R1.7838 CCCOCCSCC1(CO1)CC 62a_200000139556_100011215938 [0,1,0,1,0,0|2,0,0]=4 8457 B13R1.7838 CCCSCCOCC1(CO1)CC 34a_200000230433_200000139556 [0,1,0,1,0,0|2,0,0]=4 8458 B13R1.7838 CCCSCCOCC1(CO1)CC 7a_200000230433_200000139556 [0,1,0,1,0,0|2,0,0]=4 8459 B13R1.7838 CCOCCCNCC1(CO1)CC 34a_100000210961_200000139556 [0,1,0,1,0,0|2,0,0]=4 8460 B13R1.7838 CCOCCCOCC1(CO1)CC 34a_100000757476_200000139556 [0,1,0,1,0,0|2,0,0]=4 8461 B13R1.7838 CCOCCCOCC1(CO1)CC 7a_100000757476_200000139556 [0,1,0,1,0,0|2,0,0]=4 8462 B13R1.7838 CCOCCCSCC1(CO1)CC 62a_100012232248_200000139556 [0,1,0,1,0,0|2,0,0]=4 8463 B13R1.7838 CCOCCCSCC1(CO1)CC 62a_200000139556_100012232248 [0,1,0,1,0,0|2,0,0]=4 8464 B13R1.7838 CCSCCCOCC1(CO1)CC 34a_100011216438_200000139556 [0,1,0,1,0,0|2,0,0]=4 8465 B13R1.7838 CCSCCCOCC1(CO1)CC 7a_100011216438_200000139556 [0,1,0,1,0,0|2,0,0]=4 8466 B13R1.48 CCCCCCC(=O)[C@@H]1CCCO1 1458a_100000686382_100000210757 [0,1,0,1,0,0|1,0,1]=4 8467 B13R1.48 CCCCCNC(C)C1CCCO1 2230a_100025754208_100000210326 [0,1,0,1,0,0|2,0,0]=4 8468 B13R1.48 CCCCCNC(C)C1CCCO1 34a_100025754208_100000718602 [0,1,0,1,0,0|2,0,0]=4 8469 B13R1.86 CCC(OC)C(=O)C1CCCCC1 1458a_100000747056_100000210327 [0,1,0,1,0,0|1,0,1]=4 8470 B13R1.86 COC(OC)C(=O)C1CCCCC1 1458a_100000046285_100000210327 [0,1,0,1,0,0|0,0,1]=3 8471 B13R1.86 COC(OC)C(=O)C1CCCOC1 1458a_100000046285_100000693364 [0,1,0,1,0,0|1,0,1]=4 8472 B13R1.86 COC(OC)C(=O)C1CCOCC1 1458a_100000046285_100011324220 [0,1,0,1,0,0|1,0,1]=4 8473 B13R1.86 COC(OC)C(C)N1CCCOC1 270004a_100000131196_100000211384 [0,1,0,1,0,0|2,0,0]=4 8474 B13R1.86 COC(OC)C(C)N1CCCOC1 34a_100000131196_100011222894 [0,1,0,1,0,0|2,0,0]=4 8475 B13R1.86 COC(OC)C(C)N1CCOCC1 270004a_100015191051_100000211384 [0,1,0,1,0,0|2,0,0]=4 8476 B13R1.86 COC(OC)C(C)N1CCOCC1 34a_100015191051_100011222894 [0,1,0,1,0,0|2,0,0]=4 8477 B13R1.86 COC(OC)C(C)N1CCSCC1 270004a_100000737611_100000211384 [0,1,0,1,0,0|2,0,0]=4 8478 B13R1.137 CCCCCCC1CCCC1NC 269862a_106832991636_100000189428 [0,1,0,1,0,0|2,0,0]=4 8479 B13R1.137 CCCCCCC1CCCC1NC 270004a_106832991635_100000189428 [0,1,0,1,0,0|2,0,0]=4 8480 B13R1.409 CCC(OC)C(=O)CC1CCCC1 1458a_100000747056_100000740388 [0,1,0,1,0,0|1,0,1]=4 8481 B13R1.409 COC(OC)C(=O)CC1CCCC1 1458a_100000046285_100000740388 [0,1,0,1,0,0|0,0,1]=3 8482 B13R1.409 COC(OC)C(=O)CC1CCCO1 1458a_100000046285_100000203698 [0,1,0,1,0,0|1,0,1]=4 8483 B13R1.409 COC(OC)C(=O)CC1CCOC1 1458a_100000046285_100000702531 [0,1,0,1,0,0|1,0,1]=4 8484 B13R1.409 COC(OC)C(=O)NC1CCCC1 11a_100000211070_100000046285 [0,1,0,1,0,0|1,0,1]=4 8485 B13R1.409 COC(OC)C(=O)NC1CCCC1 240690a_100000211070_100000046285 [0,1,0,1,0,0|1,0,1]=4 8486 B13R1.409 COC(OC)C(=O)NC1CCCC1 527a_100000211070_100000046285 [0,1,0,1,0,0|1,0,1]=4 8487 B13R1.409 COC(OC)C(C)NC1CCCC1 270004a_100000211070_100000211384 [0,1,0,1,0,0|1,0,0]=3 8488 B13R1.409 COC(OC)C(C)NC1CCCC1 34a_100000211070_100011222894 [0,1,0,1,0,0|1,0,0]=3 8489 B13R1.409 COC(OC)C(C)N[C@@H]1CCOC1 270004a_200015188469_100000211384 [0,1,0,1,0,0|2,0,0]=4 8490 B13R1.409 COC(OC)C(C)N[C@H]1CCOC1 270004a_100015188467_100000211384 [0,1,0,1,0,0|2,0,0]=4 8491 B13R1.409 COC(OC)C(C)N[C@H]1CCOC1 34a_100015188467_100011222894 [0,1,0,1,0,0|2,0,0]=4 8492 B13R1.409 COC(OC)C(C)OC1CCCC1 34a_100000210269_100011222894 [0,1,0,1,0,0|1,0,0]=3 8493 B13R1.409 COC(OC)C(C)OC1CCCC1 34a_100000754440_100000179811 [0,1,0,1,0,0|1,0,0]=3 8494 B13R1.409 COC(OC)C(C)OC1CCCC1 7a_100000754440_100000179811 [0,1,0,1,0,0|1,0,0]=3 8495 B13R1.409 COC(OC)C(C)OC1CCCO1 34a_100000085407_100011222894 [0,1,0,1,0,0|2,0,0]=4 8496 B13R1.409 COC(OC)C(C)OC1CCOC1 34a_100000754440_100000690089 [0,1,0,1,0,0|2,0,0]=4 8497 B13R1.409 COC(OC)C(C)OC1CCOC1 7a_100000754440_100000731011 [0,1,0,1,0,0|2,0,0]=4 8498 B13R1.409 COC(OC)C(C)O[C@H]1CCOC1 34a_100000717292_100011222894 [0,1,0,1,0,0|2,0,0]=4 8499 B13R1.409 COC(OC)C(C)SC1CCCC1 62a_100011217020_100011222894 [0,1,0,1,0,0|1,0,0]=3 8500 B13R1.409 COC(OC)C(C)SC1CCCC1 62a_100011222894_100000179811 [0,1,0,1,0,0|1,0,0]=3 8501 B13R1.409 COC(OC)C(C)SC1CCOC1 62a_100011222894_100000690089 [0,1,0,1,0,0|2,0,0]=4 8502 B13R1.577 CCCCN1CC[C@H]([C@@H](C1)O)OC 2230a_200015396376_100000210211 [0,1,0,1,0,0|2,0,0]=4 8503 B13R1.577 CCCCN1CC[C@H]([C@@H](C1)O)OC 269982a_200015396376_100000210211 [0,1,0,1,0,0|2,0,0]=4 8504 B13R1.1397 COC(OC)C(C)OCC1CC1C 34a_100000744939_100011222894 [0,1,0,1,0,0|1,0,0]=3 8505 B13R1.1398 COC(OC)C(=O)NCC1CCC1 11a_100000738700_100000046285 [0,1,0,1,0,0|1,0,1]=4 8506 B13R1.1398 COC(OC)C(=O)NCC1CCC1 240690a_100000738700_100000046285 [0,1,0,1,0,0|1,0,1]=4 8507 B13R1.1398 COC(OC)C(=O)NCC1CCC1 527a_100000738700_100000046285 [0,1,0,1,0,0|1,0,1]=4 8508 B13R1.1398 COC(OC)C(C)NCC1CCC1 270004a_100000738700_100000211384 [0,1,0,1,0,0|1,0,0]=3 8509 B13R1.1398 COC(OC)C(C)NCC1CCC1 34a_100000738700_100011222894 [0,1,0,1,0,0|1,0,0]=3 8510 B13R1.1398 COC(OC)C(C)NCC1COC1 270004a_100015281925_100000211384 [0,1,0,1,0,0|2,0,0]=4 8511 B13R1.1398 COC(OC)C(C)NCC1COC1 34a_100015281925_100011222894 [0,1,0,1,0,0|2,0,0]=4 8512 B13R1.1398 COC(OC)C(C)NC[C@@H]1CCO1 270004a_100020831831_100000211384 [0,1,0,1,0,0|2,0,0]=4 8513 B13R1.1398 COC(OC)C(C)NC[C@@H]1CCO1 34a_100020831831_100011222894 [0,1,0,1,0,0|2,0,0]=4 8514 B13R1.1398 COC(OC)C(C)OCC1CCC1 34a_100000754440_100000763275 [0,1,0,1,0,0|1,0,0]=3 8515 B13R1.1398 COC(OC)C(C)OCC1CCC1 34a_100000760304_100011222894 [0,1,0,1,0,0|1,0,0]=3 8516 B13R1.1398 COC(OC)C(C)OCC1CCC1 7a_100000754440_100000763275 [0,1,0,1,0,0|1,0,0]=3 8517 B13R1.1398 COC(OC)C(C)OCC1CCO1 34a_100000039022_100011222894 [0,1,0,1,0,0|2,0,0]=4 8518 B13R1.1398 COC(OC)C(C)OCC1CCO1 34a_100000754440_100000103362 [0,1,0,1,0,0|2,0,0]=4 8519 B13R1.1398 COC(OC)C(C)OCC1CCO1 7a_100000754440_100000103362 [0,1,0,1,0,0|2,0,0]=4 8520 B13R1.1398 COC(OC)C(C)OCC1CNC1 34a_100016987283_100011222894 [0,1,0,1,0,0|2,0,0]=4 8521 B13R1.1398 COC(OC)C(C)OCC1COC1 34a_100000060846_100011222894 [0,1,0,1,0,0|2,0,0]=4 8522 B13R1.1398 COC(OC)C(C)OCC1COC1 34a_100000754440_100010264016 [0,1,0,1,0,0|2,0,0]=4 8523 B13R1.1398 COC(OC)C(C)OCC1COC1 7a_100000754440_100010264016 [0,1,0,1,0,0|2,0,0]=4 8524 B13R1.1398 COC(OC)C(C)SCC1CCC1 62a_100000763275_100011222894 [0,1,0,1,0,0|1,0,0]=3 8525 B13R1.1398 COC(OC)C(C)SCC1CCC1 62a_100011222894_100000763275 [0,1,0,1,0,0|1,0,0]=3 8526 B13R1.1398 COC(OC)C(C)SCC1CCO1 62a_100000103362_100011222894 [0,1,0,1,0,0|2,0,0]=4 8527 B13R1.1398 COC(OC)C(C)SCC1CCO1 62a_100011222894_100000103362 [0,1,0,1,0,0|2,0,0]=4 8528 B13R1.1398 COC(OC)C(C)SCC1COC1 62a_100010264016_100011222894 [0,1,0,1,0,0|2,0,0]=4 8529 B13R1.1398 COC(OC)C(C)SCC1COC1 62a_100011222894_100010264016 [0,1,0,1,0,0|2,0,0]=4 8530 B13R1.1399 COC(OC)C(=O)CCCC1CO1 1458a_100000046285_100000733510 [0,1,0,1,0,0|1,0,1]=4 8531 B13R1.1399 COC(OC)C(=O)NCCC1CC1 240690a_100000764129_100000046285 [0,1,0,1,0,0|1,0,1]=4 8532 B13R1.1399 COC(OC)C(=O)NCCC1CC1 527a_100000764129_100000046285 [0,1,0,1,0,0|1,0,1]=4 8533 B13R1.1399 COC(OC)C(C)NCCC1CC1 270004a_100000764129_100000211384 [0,1,0,1,0,0|1,0,0]=3 8534 B13R1.1399 COC(OC)C(C)NCCC1CC1 34a_100000764129_100011222894 [0,1,0,1,0,0|1,0,0]=3 8535 B13R1.1399 COC(OC)C(C)OCCC1CC1 34a_100000754188_100011222894 [0,1,0,1,0,0|1,0,0]=3 8536 B13R1.1399 COC(OC)C(C)OCCC1CC1 34a_100000754440_100000694398 [0,1,0,1,0,0|1,0,0]=3 8537 B13R1.1399 COC(OC)C(C)OCCC1CC1 7a_100000754440_100000764125 [0,1,0,1,0,0|1,0,0]=3 8538 B13R1.1399 COC(OC)C(C)OCCC1CO1 34a_100000754440_100000732470 [0,1,0,1,0,0|2,0,0]=4 8539 B13R1.1399 COC(OC)C(C)OCCC1CO1 7a_100000754440_100000732470 [0,1,0,1,0,0|2,0,0]=4 8540 B13R1.1399 COC(OC)C(C)OCC[C@@H]1CO1 34a_100009820653_100011222894 [0,1,0,1,0,0|2,0,0]=4 8541 B13R1.1399 COC(OC)C(C)SCCC1CC1 62a_100000764125_100011222894 [0,1,0,1,0,0|1,0,0]=3 8542 B13R1.1399 COC(OC)C(C)SCCC1CC1 62a_100011222894_100000764125 [0,1,0,1,0,0|1,0,0]=3 8543 B13R1.1399 COC(OC)C(C)SCCC1CO1 62a_100000732470_100011222894 [0,1,0,1,0,0|2,0,0]=4 8544 B13R1.1399 COC(OC)C(C)SCCC1CO1 62a_100011222894_100000732470 [0,1,0,1,0,0|2,0,0]=4 8545 B13R1.3072 COC(OC)C(=O)N1CCC[C@@H]1C 240690a_100020605311_100000046285 [0,1,0,1,0,0|1,0,1]=4 8546 B13R1.3072 COC(OC)C(=O)N1CCC[C@@H]1C 527a_100020605311_100000046285 [0,1,0,1,0,0|1,0,1]=4 8547 B13R1.3072 COC(OC)C(=O)N1CCC[C@H]1C 11a_100015189458_100000046285 [0,1,0,1,0,0|1,0,1]=4 8548 B13R1.3072 COC(OC)C(=O)N1CCC[C@H]1C 240690a_100015189458_100000046285 [0,1,0,1,0,0|1,0,1]=4 8549 B13R1.3072 COC(OC)C(=O)N1CCC[C@H]1C 527a_100015189458_100000046285 [0,1,0,1,0,0|1,0,1]=4 8550 B13R1.3072 COC(OC)C(C)N1CCC[C@@H]1C 270004a_100020605311_100000211384 [0,1,0,1,0,0|1,0,0]=3 8551 B13R1.3072 COC(OC)C(C)N1CCC[C@H]1C 270004a_100015189458_100000211384 [0,1,0,1,0,0|1,0,0]=3 8552 B13R1.3072 COC(OC)C(C)N1CCC[C@H]1C 34a_100015189458_100011222894 [0,1,0,1,0,0|1,0,0]=3 8553 B13R1.3072 COC(OC)C(C)N1CCSC1C 270004a_200011216479_100000211384 [0,1,0,1,0,0|2,0,0]=4 8554 B13R1.3072 COC(OC)C(C)N1CCSC1C 34a_200011216479_100011222894 [0,1,0,1,0,0|2,0,0]=4 8555 B13R1.6348 CCCCCCC(=O)C1(CC1)OC 1458a_100000137688_100000210757 [0,1,0,1,0,0|1,0,1]=4 8556 B13R1.28 BrCCCOCCC1OCCCO1 34a_100011217188_100000764188 [0,1,0,1,0,0|2,0,0]=4 8557 B13R1.28 CCCCCCCN1CCCOC1 2230a_100000131196_100000210681 [0,1,0,1,0,0|2,0,0]=4 8558 B13R1.28 CCCCCCCN1CCCOC1 269982a_100000131196_100000210681 [0,1,0,1,0,0|2,0,0]=4 8559 B13R1.28 CCCCCCCN1CCCOC1 34a_100000131196_100000210614 [0,1,0,1,0,0|2,0,0]=4 8560 B13R1.28 CCCCCCNC1CCCOC1 2230a_100000719290_100000210314 [0,1,0,1,0,0|2,0,0]=4 8561 B13R1.28 CCCCCCNC1CCCOC1 270004a_100000210581_100000753404 [0,1,0,1,0,0|2,0,0]=4 8562 B13R1.28 CCCCCCNC1CCCOC1 34a_100000719290_100000210314 [0,1,0,1,0,0|2,0,0]=4 8563 B13R1.28 CCCCCCOC1CCCCO1 34a_100000033831_100000210314 [0,1,0,1,0,0|2,0,0]=4 8564 B13R1.28 CCCCCCOC1CCCOC1 34a_100000210259_100000693364 [0,1,0,1,0,0|2,0,0]=4 8565 B13R1.28 CCCCCCOC1CCCOC1 34a_100000754041_100000210314 [0,1,0,1,0,0|2,0,0]=4 8566 B13R1.28 CCCCCCOC1CCCOC1 7a_100000210259_100000693364 [0,1,0,1,0,0|2,0,0]=4 8567 B13R1.28 CCCCCCSC1CCCOC1 62a_100000210314_100000693364 [0,1,0,1,0,0|2,0,0]=4 8568 B13R1.28 CCCCCNCC1CCCCO1 2230a_100000174945_100000210326 [0,1,0,1,0,0|2,0,0]=4 8569 B13R1.28 CCCCCNCC1CCCCO1 2230a_100000209983_100000211543 [0,1,0,1,0,0|2,0,0]=4 8570 B13R1.28 CCCCCNCC1CCCCO1 34a_100000174945_100000718602 [0,1,0,1,0,0|2,0,0]=4 8571 B13R1.28 CCCCCNCC1CCCOC1 2230a_100000209983_100000741521 [0,1,0,1,0,0|2,0,0]=4 8572 B13R1.28 CCCCCNCC1CCCOC1 2230a_100000720124_100000210326 [0,1,0,1,0,0|2,0,0]=4 8573 B13R1.28 CCCCCNCC1CCCOC1 34a_100000720124_100000718602 [0,1,0,1,0,0|2,0,0]=4 8574 B13R1.28 CCCCCNC[C@H]1COCCO1 2230a_100010981119_100000210326 [0,1,0,1,0,0|1,0,0]=3 8575 B13R1.28 CCCCCNC[C@H]1COCCO1 34a_100010981119_100000718602 [0,1,0,1,0,0|1,0,0]=3 8576 B13R1.28 CCCCCOCC1CCCCO1 34a_100000210253_100000211543 [0,1,0,1,0,0|2,0,0]=4 8577 B13R1.28 CCCCCOCC1CCCCO1 34a_100000211370_100000718602 [0,1,0,1,0,0|2,0,0]=4 8578 B13R1.28 CCCCCOCC1CCCCO1 7a_100000210253_100000211543 [0,1,0,1,0,0|2,0,0]=4 8579 B13R1.28 CCCCCOCC1CCCCO1 7a_100000211370_100000210326 [0,1,0,1,0,0|2,0,0]=4 8580 B13R1.28 CCCCCOCC1CCCOC1 34a_100000210253_100000741521 [0,1,0,1,0,0|2,0,0]=4 8581 B13R1.28 CCCCCOCC1CCCOC1 34a_100000741520_100000718602 [0,1,0,1,0,0|2,0,0]=4 8582 B13R1.28 CCCCCOCC1CCCOC1 7a_100000210253_100000741521 [0,1,0,1,0,0|2,0,0]=4 8583 B13R1.28 CCCCCOC[C@@H]1CNCCO1 34a_100015189573_100000718602 [0,1,0,1,0,0|2,0,0]=4 8584 B13R1.28 CCCCCOC[C@@H]1COCCN1 34a_100000717676_100000718602 [0,1,0,1,0,0|2,0,0]=4 8585 B13R1.28 CCCCCOC[C@H]1COCCO1 34a_100009875890_100000718602 [0,1,0,1,0,0|1,0,0]=3 8586 B13R1.28 CCCCCSCC1CCCCO1 62a_100000210326_100000211543 [0,1,0,1,0,0|2,0,0]=4 8587 B13R1.28 CCCCCSCC1CCCCO1 62a_100000211543_100000210326 [0,1,0,1,0,0|2,0,0]=4 8588 B13R1.28 CCCCCSCC1CCCOC1 62a_100000210326_100000741521 [0,1,0,1,0,0|2,0,0]=4 8589 B13R1.28 CCCCCSCC1CCCOC1 62a_100000741521_100000210326 [0,1,0,1,0,0|2,0,0]=4 8590 B13R1.28 CCCCNCCC1CCCCO1 2230a_100015183643_100000210211 [0,1,0,1,0,0|2,0,0]=4 8591 B13R1.28 CCCCNCCC1CCCCO1 34a_100015183643_100000210210 [0,1,0,1,0,0|2,0,0]=4 8592 B13R1.28 CCCCNCCC1OCCCO1 2230a_100000102301_100000764188 [0,1,0,1,0,0|1,0,0]=3 8593 B13R1.28 CCCCNCCC1OCCCO1 7a_106832991798_100000764188 [0,1,0,1,0,0|1,0,0]=3 8594 B13R1.28 CCCCOCCC1OCCCO1 34a_100000210227_100000764188 [0,1,0,1,0,0|1,0,0]=3 8595 B13R1.28 CCCCOCCC1OCCCO1 7a_100000210227_100000764188 [0,1,0,1,0,0|1,0,0]=3 8596 B13R1.28 CCCCSCCC1OCCCO1 62a_100000210211_100000764188 [0,1,0,1,0,0|1,0,0]=3 8597 B13R1.28 CCCCSCCC1OCCCO1 62a_100000764188_100000210210 [0,1,0,1,0,0|1,0,0]=3 8598 B13R1.28 CCOCCNC[C@H]1COCCO1 2230a_100010981119_100011215890 [0,1,0,1,0,0|2,0,0]=4 8599 B13R1.28 CCOCCNC[C@H]1COCCO1 34a_100010981119_100000210147 [0,1,0,1,0,0|2,0,0]=4 8600 B13R1.28 CCOCCOC[C@H]1COCCO1 34a_100009875890_100000210147 [0,1,0,1,0,0|2,0,0]=4 8601 B13R1.28 CCOCSCCC1OCCCO1 62a_100000739092_100000764188 [0,1,0,1,0,0|2,0,0]=4 8602 B13R1.28 CCOCSCCC1OCCCO1 62a_100000764188_100000739092 [0,1,0,1,0,0|2,0,0]=4 8603 B13R1.28 CCSCCNC[C@H]1COCCO1 2230a_100010981119_100000757381 [0,1,0,1,0,0|2,0,0]=4 8604 B13R1.28 CCSCCNC[C@H]1COCCO1 34a_100010981119_100000757381 [0,1,0,1,0,0|2,0,0]=4 8605 B13R1.28 CCSCCOC[C@H]1COCCO1 34a_100009875890_100000757381 [0,1,0,1,0,0|2,0,0]=4 8606 B13R1.28 COCCCNC[C@H]1COCCO1 2230a_100010981119_100000740836 [0,1,0,1,0,0|2,0,0]=4 8607 B13R1.28 COCCCNC[C@H]1COCCO1 34a_100010981119_100000740836 [0,1,0,1,0,0|2,0,0]=4 8608 B13R1.28 COCCCOC[C@H]1COCCO1 34a_100009875890_100000740836 [0,1,0,1,0,0|2,0,0]=4 8609 B13R1.28 COCCNCCC1OCCCO1 2230a_100000209980_100000764188 [0,1,0,1,0,0|2,0,0]=4 8610 B13R1.28 COCCOCCC1OCCCO1 34a_100000210237_100000764188 [0,1,0,1,0,0|2,0,0]=4 8611 B13R1.28 COCCSCCC1OCCCO1 62a_100000233755_100000764188 [0,1,0,1,0,0|2,0,0]=4 8612 B13R1.28 COCCSCCC1OCCCO1 62a_100000764188_100000233755 [0,1,0,1,0,0|2,0,0]=4 8613 B13R1.28 CSCCNCCC1OCCCO1 2230a_100020590264_100000764188 [0,1,0,1,0,0|2,0,0]=4 8614 B13R1.28 CSCCOCCC1OCCCO1 34a_100000230434_100000764188 [0,1,0,1,0,0|2,0,0]=4 8615 B13R1.28 CSCCOCCC1OCCCO1 7a_100000230434_100000764188 [0,1,0,1,0,0|2,0,0]=4 8616 B13R1.28 CSCCSCCC1OCCCO1 62a_100000212216_100000764188 [0,1,0,1,0,0|2,0,0]=4 8617 B13R1.28 CSCCSCCC1OCCCO1 62a_100000764188_100000751147 [0,1,0,1,0,0|2,0,0]=4 8618 B13R1.28 ClCCCOCCC1OCCCO1 34a_100000230001_100000764188 [0,1,0,1,0,0|2,0,0]=4 8619 B13R1.28 FCCCCNC[C@H]1COCCO1 2230a_100010981119_100000729493 [0,1,0,1,0,0|2,0,0]=4 8620 B13R1.28 FCCCCNC[C@H]1COCCO1 34a_100010981119_100000729493 [0,1,0,1,0,0|2,0,0]=4 8621 B13R1.28 FCCCCOC[C@H]1COCCO1 34a_100009875890_100000729493 [0,1,0,1,0,0|2,0,0]=4 8622 B13R1.28 FCCCNCCC1OCCCO1 2230a_100015189416_100000764188 [0,1,0,1,0,0|2,0,0]=4 8623 B13R1.28 FCCCNCCC1OCCCO1 34a_100015189416_100000764188 [0,1,0,1,0,0|2,0,0]=4 8624 B13R1.28 FCCCOCCC1OCCCO1 34a_100000759539_100000764188 [0,1,0,1,0,0|2,0,0]=4 8625 B13R1.28 FCCCSCCC1OCCCO1 62a_100000764188_100011934791 [0,1,0,1,0,0|2,0,0]=4 8626 B13R1.28 FCCCSCCC1OCCCO1 62a_100011934791_100000764188 [0,1,0,1,0,0|2,0,0]=4 8627 B13R1.28 NCCCOCCC1OCCCO1 34a_100000182051_100000764188 [0,1,0,1,0,0|2,0,0]=4 8628 B13R1.28 OCCCCNC[C@H]1COCCO1 2230a_100010981119_100000210776 [0,1,0,1,0,0|2,0,0]=4 8629 B13R1.28 OCCCCNC[C@H]1COCCO1 34a_100010981119_100011216708 [0,1,0,1,0,0|2,0,0]=4 8630 B13R1.28 OCCCCOC[C@H]1COCCO1 34a_100009875890_100011216708 [0,1,0,1,0,0|2,0,0]=4 8631 B13R1.28 OCCCSCCC1OCCCO1 62a_100000764188_100011215043 [0,1,0,1,0,0|2,0,0]=4 8632 B13R1.28 OCCCSCCC1OCCCO1 62a_100011215043_100000764188 [0,1,0,1,0,0|2,0,0]=4 8633 B13R1.77 CCCCC1CCC(CC1)NCC 2230a_100000745173_100000210202 [0,1,0,1,0,0|2,0,0]=4 8634 B13R1.77 CCCCC1CCC(CC1)NCC 34a_100000745173_100000210202 [0,1,0,1,0,0|2,0,0]=4 8635 B13R1.77 CCCCC1CCC(CC1)NCF 34a_100000745173_100015361967 [0,1,0,1,0,0|2,0,0]=4 8636 B13R1.77 CCCCC1CCC(CC1)OCC 34a_200000035503_100000210202 [0,1,0,1,0,0|1,0,0]=3 8637 B13R1.77 CCCCC1CCC(CC1)OCC 7a_200000035503_100000210202 [0,1,0,1,0,0|1,0,0]=3 8638 B13R1.77 CCCCC1CCC(CC1)OCF 34a_200000035503_100015361967 [0,1,0,1,0,0|1,0,0]=3 8639 B13R1.77 CCCCC1CCC(CC1)OCF 7a_200000035503_100015361967 [0,1,0,1,0,0|1,0,0]=3 8640 B13R1.77 CCCCC1CCN(CC1)COC 2230a_200016987432_100000766300 [0,1,0,1,0,0|2,0,0]=4 8641 B13R1.77 CCCCC1CCN(CC1)COC 269982a_200016987432_100000766300 [0,1,0,1,0,0|2,0,0]=4 8642 B13R1.77 CCCCN1CCC(CC1)COC 2230a_100000755097_100000210211 [0,1,0,1,0,0|2,0,0]=4 8643 B13R1.77 CCCCN1CCC(CC1)COC 269982a_100000755097_100000210211 [0,1,0,1,0,0|2,0,0]=4 8644 B13R1.77 CCCCN1CCC(CC1)COC 34a_100000755097_100000210210 [0,1,0,1,0,0|2,0,0]=4 8645 B13R1.77 CCCCN1CCC(CC1)OCC 2230a_100016990603_100000210211 [0,1,0,1,0,0|2,0,0]=4 8646 B13R1.77 CCCCN1CCC(CC1)OCC 269982a_100016990603_100000210211 [0,1,0,1,0,0|2,0,0]=4 8647 B13R1.77 CCCCN1CCC(CC1)OCC 34a_100016990603_100000210210 [0,1,0,1,0,0|2,0,0]=4 8648 B13R1.77 CCCNC1CCC(CC1)OCC 270004a_100020643023_100012183323 [0,1,0,1,0,0|2,0,0]=4 8649 B13R1.77 CCOCC1CCC(CC1)COC 34a_200010371891_100000210202 [0,1,0,1,0,0|2,0,0]=4 8650 B13R1.77 CCOCC1CCC(CC1)COC 7a_200010371891_100000210202 [0,1,0,1,0,0|2,0,0]=4 8651 B13R1.79 CCC(COC)NC1CCCCC1 270004a_100000182618_100000757811 [0,1,0,1,0,0|2,0,0]=4 8652 B13R1.79 CCC(COC)NC1CCCCC1 270004a_100000757820_100000210434 [0,1,0,1,0,0|2,0,0]=4 8653 B13R1.79 CCC(COC)OC1CCCCC1 7a_200011214946_100000210327 [0,1,0,1,0,0|2,0,0]=4 8654 B13R1.173 CCC(COC)N1CCCCC1C 270004a_100000211376_100000757811 [0,1,0,1,0,0|2,0,0]=4 8655 B13R1.175 CCOC(CC)CNCCC1CC1 2230a_100015183923_100000694398 [0,1,0,1,0,0|2,0,0]=4 8656 B13R1.175 CCOC(CC)CNCCC1CC1 34a_100015183923_100000694398 [0,1,0,1,0,0|2,0,0]=4 8657 B13R1.181 CCOC(CC)CNCC1CCC1 2230a_100015183923_100000763275 [0,1,0,1,0,0|2,0,0]=4 8658 B13R1.181 CCOC(CC)CNCC1CCC1 269862a_100015183923_100000753134 [0,1,0,1,0,0|2,0,0]=4 8659 B13R1.181 CCOC(CC)CNCC1CCC1 34a_100015183923_100000763275 [0,1,0,1,0,0|2,0,0]=4 8660 B13R1.182 CCC1CCCN1C(CC)COC 270004a_100000754278_100000757811 [0,1,0,1,0,0|2,0,0]=4 8661 B13R1.184 CCC(COC)NC1CCCC1C 269862a_100000757820_100000752053 [0,1,0,1,0,0|2,0,0]=4 8662 B13R1.192 CCCCCCN1CCC1COC 2230a_100015195929_100000210314 [0,1,0,1,0,0|2,0,0]=4 8663 B13R1.192 CCCCCCN1CCC1COC 269982a_100015195929_100000210757 [0,1,0,1,0,0|2,0,0]=4 8664 B13R1.192 CCCCCCN1CCC1COC 34a_100015195929_100000210314 [0,1,0,1,0,0|2,0,0]=4 8665 B13R1.657 CCCCCN1CCC(C1)COC 2230a_100025706693_100000210326 [0,1,0,1,0,0|2,0,0]=4 8666 B13R1.657 CCCCCN1CCC(C1)COC 269982a_100025706693_100000210215 [0,1,0,1,0,0|2,0,0]=4 8667 B13R1.657 CCCCCN1CCC(C1)COC 34a_100025706693_100000718602 [0,1,0,1,0,0|2,0,0]=4 8668 B13R1.657 CCCCCN1CC[C@@H](C1)OCC 2230a_100011787710_100000210326 [0,1,0,1,0,0|2,0,0]=4 8669 B13R1.657 CCCCCN1CC[C@@H](C1)OCC 269982a_100011787710_100000210215 [0,1,0,1,0,0|2,0,0]=4 8670 B13R1.657 CCCCCN1CC[C@@H](C1)OCC 34a_100011787710_100000718602 [0,1,0,1,0,0|2,0,0]=4 8671 B13R1.666 CCCCCN1CCCC(C1)OC 2230a_100000695604_100000210326 [0,1,0,1,0,0|2,0,0]=4 8672 B13R1.666 CCCCCN1CCCC(C1)OC 269982a_100000695604_100000210215 [0,1,0,1,0,0|2,0,0]=4 8673 B13R1.666 CCCCCN1CCCC(C1)OC 34a_100000695604_100000718602 [0,1,0,1,0,0|2,0,0]=4 8674 B13R1.666 CCCCCN1CCOC(C1)CC 2230a_100000736320_100000210326 [0,1,0,1,0,0|2,0,0]=4 8675 B13R1.666 CCCCCN1CCOC(C1)CC 269982a_100000736320_100000210215 [0,1,0,1,0,0|2,0,0]=4 8676 B13R1.666 CCCCCN1CCOC(C1)CC 34a_100000736320_100000718602 [0,1,0,1,0,0|2,0,0]=4 8677 B13R1.694 CCC(COC)NCC1CCCC1 2230a_100000757820_100000740388 [0,1,0,1,0,0|2,0,0]=4 8678 B13R1.694 CCC(COC)NCC1CCCC1 269862a_100000757820_100000746403 [0,1,0,1,0,0|2,0,0]=4 8679 B13R1.694 CCC(COC)NCC1CCCC1 270004a_100000737975_100000757811 [0,1,0,1,0,0|2,0,0]=4 8680 B13R1.694 CCC(COC)OCC1CCCC1 7a_200011214946_100000740388 [0,1,0,1,0,0|2,0,0]=4 8681 B13R1.694 CCOC(CC)CNC1CCCC1 2230a_100015183923_100000179811 [0,1,0,1,0,0|2,0,0]=4 8682 B13R1.694 CCOC(CC)CNC1CCCC1 270004a_100015183923_100000210133 [0,1,0,1,0,0|2,0,0]=4 8683 B13R1.694 CCOC(CC)CNC1CCCC1 34a_100015183923_100000179811 [0,1,0,1,0,0|2,0,0]=4 8684 B13R1.3613 CCC(COC)N1CCCCCC1 270004a_100000185865_100000757811 [0,1,0,1,0,0|2,0,0]=4 8685 B13R1.3613 CCN(COC)C1CCCCCC1 2230a_114901603759_100000766300 [0,1,0,1,0,0|2,0,0]=4 8686 B13R1.3613 CCN(COC)C1CCCCCC1 269982a_114901603759_100000766300 [0,1,0,1,0,0|2,0,0]=4 8687 B13R1.5937 CCCCCCOC1(COC1)CC 7a_100010739965_100000210314 [0,1,0,1,0,0|2,0,0]=4 8688 B13R1.5937 CCCCCNCC1(COC1)CC 2230a_100000101356_100000210326 [0,1,0,1,0,0|2,0,0]=4 8689 B13R1.5937 CCCCCNCC1(COC1)CC 2230a_100000209983_200009907690 [0,1,0,1,0,0|2,0,0]=4 8690 B13R1.5937 CCCCCNCC1(COC1)CC 269862a_100000209983_100000687158 [0,1,0,1,0,0|2,0,0]=4 8691 B13R1.5937 CCCCCOCC1(COC1)CC 34a_100000210253_200009907690 [0,1,0,1,0,0|2,0,0]=4 8692 B13R1.5937 CCCCCOCC1(COC1)CC 7a_100000039901_100000210326 [0,1,0,1,0,0|2,0,0]=4 8693 B13R1.5937 CCCCCOCC1(COC1)CC 7a_100000210253_200009907690 [0,1,0,1,0,0|2,0,0]=4 8694 B13R1.5937 CCCCCSCC1(COC1)CC 62a_100000210326_200009907690 [0,1,0,1,0,0|2,0,0]=4 8695 B13R1.5937 CCCCCSCC1(COC1)CC 62a_200009907690_100000210326 [0,1,0,1,0,0|2,0,0]=4 8696 B13R1.5 CCC(=O)CC1CCC(CC1)OC 1458a_100000210414_100013032858 [0,1,0,1,0,0|1,0,1]=4 8697 B13R1.5 CCC(C)CN1CCC(CC1)OC 2230a_100000234800_100000748023 [0,1,0,1,0,0|2,0,0]=4 8698 B13R1.5 CCC(C)CN1CCC(CC1)OC 269982a_100000234800_100000748023 [0,1,0,1,0,0|2,0,0]=4 8699 B13R1.5 CCC(C)CN1CCC(CC1)OC 270004a_100000234800_100000243153 [0,1,0,1,0,0|2,0,0]=4 8700 B13R1.5 CCC(C)CN1CCC(CC1)OC 34a_100000234800_100000748023 [0,1,0,1,0,0|2,0,0]=4 8701 B13R1.5 CCC(C)NC1CCC(CC1)OC 270004a_100000209981_100000747084 [0,1,0,1,0,0|2,0,0]=4 8702 B13R1.5 CCC(C)NC1CCC(CC1)OC 34a_100015205214_100011215416 [0,1,0,1,0,0|2,0,0]=4 8703 B13R1.5 CCC(C)OC1CCC(CC1)OC 34a_100011581665_100011215416 [0,1,0,1,0,0|2,0,0]=4 8704 B13R1.5 CCC(C)OC1CCC(CC1)OC 7a_100011581665_100000758301 [0,1,0,1,0,0|2,0,0]=4 8705 B13R1.5 CCC(O)CN1CCC(CC1)OC 2230a_100000234800_100011218378 [0,1,0,1,0,0|2,0,0]=4 8706 B13R1.5 CCC(O)CN1CCC(CC1)OC 269982a_100000234800_100011218378 [0,1,0,1,0,0|2,0,0]=4 8707 B13R1.5 CCC(O)CN1CCC(CC1)OC 34a_100000234800_100011218378 [0,1,0,1,0,0|2,0,0]=4 8708 B13R1.5 CCN(C)CC1CCC(CC1)OC 2230a_100000225621_100013032858 [0,1,0,1,0,0|2,0,0]=4 8709 B13R1.5 CCN(C)CC1CCC(CC1)OC 269982a_100000225621_100013032858 [0,1,0,1,0,0|2,0,0]=4 8710 B13R1.5 CC[C@H](C)CN1CCC(CC1)OC 2230a_100000234800_100009816398 [0,1,0,1,0,0|2,0,0]=4 8711 B13R1.5 CC[C@H](C)CN1CCC(CC1)OC 269982a_100000234800_100009816398 [0,1,0,1,0,0|2,0,0]=4 8712 B13R1.5 CC[C@H](C)CN1CCC(CC1)OC 34a_100000234800_100009816398 [0,1,0,1,0,0|2,0,0]=4 8713 B13R1.62 COC(CN1CCC(C1)CO)OC 2230a_100000748654_100000751394 [0,1,0,1,0,0|2,0,0]=4 8714 B13R1.62 COC(CN1CCC(C1)CO)OC 270004a_100000748654_100000752162 [0,1,0,1,0,0|2,0,0]=4 8715 B13R1.62 COC(CN1CCC(C1)CO)OC 34a_100000748654_100000211822 [0,1,0,1,0,0|2,0,0]=4 8716 B13R1.62 COC(CN1CC[C@H](C1)OC)OC 2230a_100000766984_100000751394 [0,1,0,1,0,0|2,0,0]=4 8717 B13R1.62 COC(CN1CC[C@H](C1)OC)OC 270004a_100000766984_100000752162 [0,1,0,1,0,0|2,0,0]=4 8718 B13R1.145 C=C1CCN(CC1)CC(OC)OC 2230a_100000752442_100000751394 [0,1,0,1,0,0|1,0,1]=4 8719 B13R1.145 C=C1CCN(CC1)CC(OC)OC 270004a_100000752442_100000752162 [0,1,0,1,0,0|1,0,1]=4 8720 B13R1.145 C=C1CCN(CC1)CC(OC)OC 34a_100000752442_100000211822 [0,1,0,1,0,0|1,0,1]=4 8721 B13R1.145 COC(CN1CCC(CC1)C)OC 2230a_100000188429_100000751394 [0,1,0,1,0,0|1,0,0]=3 8722 B13R1.145 COC(CN1CCC(CC1)C)OC 270004a_100000188429_100000752162 [0,1,0,1,0,0|1,0,0]=3 8723 B13R1.145 COC(CN1CCC(CC1)C)OC 34a_100000188429_100000211822 [0,1,0,1,0,0|1,0,0]=3 8724 B13R1.145 COC(CN1CCC(CC1)F)OC 2230a_100015193889_100000751394 [0,1,0,1,0,0|1,0,0]=3 8725 B13R1.145 COC(CN1CCC(CC1)F)OC 270004a_100015193889_100000752162 [0,1,0,1,0,0|1,0,0]=3 8726 B13R1.145 COC(CN1CCC(CC1)F)OC 34a_100015193889_100000211822 [0,1,0,1,0,0|1,0,0]=3 8727 B13R1.145 COC(CN1CCC(CC1)O)OC 2230a_100025773856_100000751394 [0,1,0,1,0,0|1,0,0]=3 8728 B13R1.145 COC(CN1CCC(CC1)O)OC 270004a_100025773856_100000752162 [0,1,0,1,0,0|1,0,0]=3 8729 B13R1.145 COC(CN1CCN(CC1)C)OC 2230a_100000188432_100000751394 [0,1,0,1,0,0|2,0,0]=4 8730 B13R1.145 COC(CN1CCN(CC1)C)OC 269982a_100011935016_200000210301 [0,1,0,1,0,0|2,0,0]=4 8731 B13R1.145 COC(CN1CCN(CC1)C)OC 270004a_100000188432_100000752162 [0,1,0,1,0,0|2,0,0]=4 8732 B13R1.145 COC(CN1CCN(CC1)[13CH3])OC 269982a_100011935016_200025704644 [0,1,0,1,0,0|2,0,0]=4 8733 B13R1.145 COC(CN1CCS(=O)CC1)OC 2230a_100000752083_100000751394 [0,1,0,1,0,0|2,0,0]=4 8734 B13R1.145 COC(CN1CCS(=O)CC1)OC 270004a_100000752083_100000752162 [0,1,0,1,0,0|2,0,0]=4 8735 B13R1.536 CC(CF)OCCCC1OCCO1 34a_100016041109_100009861162 [0,1,0,1,0,0|2,0,0]=4 8736 B13R1.536 CC(CF)OCCCC1OCCO1 7a_100016041109_100000042513 [0,1,0,1,0,0|2,0,0]=4 8737 B13R1.536 CC(CN)COCCC1OCCO1 34a_100000744482_100000740749 [0,1,0,1,0,0|2,0,0]=4 8738 B13R1.536 CC(CN)OCCCC1OCCO1 34a_100000210904_100009861162 [0,1,0,1,0,0|2,0,0]=4 8739 B13R1.536 CC(CO)CCNCC1OCCO1 2230a_106354213184_100000755774 [0,1,0,1,0,0|2,0,0]=4 8740 B13R1.536 CC(CO)CCNCC1OCCO1 34a_106354213184_100000755774 [0,1,0,1,0,0|2,0,0]=4 8741 B13R1.536 CC(CO)CNCCC1OCCO1 34a_100000744482_100000740749 [0,1,0,1,0,0|2,0,0]=4 8742 B13R1.536 CC(CO)OCCCC1OCCO1 34a_100009871617_100012180447 [0,1,0,1,0,0|2,0,0]=4 8743 B13R1.536 CC(CO)OCCCC1OCCO1 7a_100009871617_100012180447 [0,1,0,1,0,0|2,0,0]=4 8744 B13R1.536 CC(CO)SCCCC1OCCO1 62a_100012180447_100000042513 [0,1,0,1,0,0|2,0,0]=4 8745 B13R1.536 CCC(=O)CCCCC1OCCO1 1458a_100000210414_100000034956 [0,1,0,1,0,0|0,0,1]=3 8746 B13R1.536 CCC(=O)COCCC1OCCO1 34a_100000725409_100000740749 [0,1,0,1,0,0|1,0,1]=4 8747 B13R1.536 CCC(=O)CSCCC1OCCO1 62a_100000747405_100000740749 [0,1,0,1,0,0|1,0,1]=4 8748 B13R1.536 CCC(C)CCNCC1CCCO1 2230a_100020591266_100000203698 [0,1,0,1,0,0|2,0,0]=4 8749 B13R1.536 CCC(C)CCNCC1OCCO1 2230a_100020591266_100000755774 [0,1,0,1,0,0|1,0,0]=3 8750 B13R1.536 CCC(C)CCOCC1CCCO1 7a_100011215188_100000203698 [0,1,0,1,0,0|2,0,0]=4 8751 B13R1.536 CCC(C)CCOCC1OCCO1 7a_100011215188_100000755774 [0,1,0,1,0,0|1,0,0]=3 8752 B13R1.536 CCC(C)CNCCC1OCCO1 2230a_100000034215_100000748023 [0,1,0,1,0,0|1,0,0]=3 8753 B13R1.536 CCC(C)CNCCC1OCCO1 2230a_100020588543_100000740749 [0,1,0,1,0,0|1,0,0]=3 8754 B13R1.536 CCC(C)CNCCC1OCCO1 270004a_100000034215_100000243153 [0,1,0,1,0,0|1,0,0]=3 8755 B13R1.536 CCC(C)CNCCC1OCCO1 34a_100000034215_100000748023 [0,1,0,1,0,0|1,0,0]=3 8756 B13R1.536 CCC(C)CSCCC1OCCO1 62a_100000748023_100000740749 [0,1,0,1,0,0|1,0,0]=3 8757 B13R1.536 CCC(C)NCCCC1OCCO1 2230a_100000209981_100000042513 [0,1,0,1,0,0|1,0,0]=3 8758 B13R1.536 CCC(C)OCCCC1OCCO1 34a_100009871617_100011215416 [0,1,0,1,0,0|1,0,0]=3 8759 B13R1.536 CCC(C)OCCCC1OCCO1 7a_100000210228_100000042513 [0,1,0,1,0,0|1,0,0]=3 8760 B13R1.536 CCC(C)OCCCC1OCCO1 7a_100009871617_100000758301 [0,1,0,1,0,0|1,0,0]=3 8761 B13R1.536 CCC(C)SCCCC1OCCO1 62a_100000758301_100000042513 [0,1,0,1,0,0|1,0,0]=3 8762 B13R1.536 CCC(O)CNCCC1OCCO1 2230a_100000034215_100011218378 [0,1,0,1,0,0|1,0,0]=3 8763 B13R1.536 CCC(O)CNCCC1OCCO1 2230a_100011218483_100000740749 [0,1,0,1,0,0|1,0,0]=3 8764 B13R1.536 CCC(O)CNCCC1OCCO1 34a_100000034215_100011218378 [0,1,0,1,0,0|1,0,0]=3 8765 B13R1.536 CCC(O)CSCCC1OCCO1 62a_100011218378_100000740749 [0,1,0,1,0,0|1,0,0]=3 8766 B13R1.536 CCN(C)CCCCC1OCCO1 2230a_100000225621_100000034956 [0,1,0,1,0,0|1,0,0]=3 8767 B13R1.536 CCN(C)CCCCC1OCCO1 269982a_100000225621_100000034956 [0,1,0,1,0,0|1,0,0]=3 8768 B13R1.536 CC[C@H](C)CNCCC1OCCO1 2230a_100000034215_100009816398 [0,1,0,1,0,0|1,0,0]=3 8769 B13R1.536 CC[C@H](C)CNCCC1OCCO1 34a_100000034215_100009816398 [0,1,0,1,0,0|1,0,0]=3 8770 B13R1.536 CC[C@H](C)COCCC1OCCO1 7a_100009816381_100000740749 [0,1,0,1,0,0|1,0,0]=3 8771 B13R1.536 CC[C@H](C)CSCCC1OCCO1 62a_100009816398_100000740749 [0,1,0,1,0,0|1,0,0]=3 8772 B13R1.536 COC(C)CCOCC1OCCO1 7a_100000764861_100000755774 [0,1,0,1,0,0|2,0,0]=4 8773 B13R1.536 COC(C)COCCC1OCCO1 34a_100000690652_100000740749 [0,1,0,1,0,0|2,0,0]=4 8774 B13R1.536 COC(C)SCCCC1OCCO1 62a_100009879195_100000042513 [0,1,0,1,0,0|2,0,0]=4 8775 B13R1.536 CO[C@H](C)CNCCC1OCCO1 2230a_100020591295_100000740749 [0,1,0,1,0,0|2,0,0]=4 8776 B13R1.536 C[C@@H](CO)CNCCC1OCCO1 2230a_100000034215_100000059175 [0,1,0,1,0,0|2,0,0]=4 8777 B13R1.536 C[C@@H](CO)CNCCC1OCCO1 34a_100000034215_100000059175 [0,1,0,1,0,0|2,0,0]=4 8778 B13R1.536 C[C@@H](CO)CSCCC1OCCO1 62a_100000059175_100000740749 [0,1,0,1,0,0|2,0,0]=4 8779 B13R1.536 C[C@H](CO)NCCCC1OCCO1 2230a_100000737577_100000042513 [0,1,0,1,0,0|2,0,0]=4 8780 B13R1.536 C[C@H](CO)SCCCC1OCCO1 62a_100016084084_100000042513 [0,1,0,1,0,0|2,0,0]=4 8781 B13R1.536 ClCC(Cl)COCCC1OCCO1 34a_100000033668_100000740749 [0,1,0,1,0,0|2,0,0]=4 8782 B13R1.536 NC[C@@H](F)COCCC1OCCO1 34a_100015665980_100000740749 [0,1,0,1,0,0|2,0,0]=4 8783 B13R1.536 O=C(CO)CCCCC1OCCO1 1458a_100000210174_100000034956 [0,1,0,1,0,0|1,0,1]=4 8784 B13R1.536 OCC(O)CNCCC1OCCO1 2230a_100000034215_100011219619 [0,1,0,1,0,0|2,0,0]=4 8785 B13R1.536 OCC(O)CNCCC1OCCO1 34a_100000034215_100011219619 [0,1,0,1,0,0|2,0,0]=4 8786 B13R1.536 OCC(O)CSCCC1OCCO1 62a_100011219619_100000740749 [0,1,0,1,0,0|2,0,0]=4 8787 B13R1.536 OC[C@@H](O)CNCCC1OCCO1 2230a_100020644852_100000740749 [0,1,0,1,0,0|2,0,0]=4 8788 B13R1.536 OC[C@H](F)CNCCC1OCCO1 34a_100015665980_100000740749 [0,1,0,1,0,0|2,0,0]=4 8789 B13R1.536 OC[C@H](O)CNCCC1OCCO1 2230a_100000034215_100009815848 [0,1,0,1,0,0|2,0,0]=4 8790 B13R1.536 OC[C@H](O)CNCCC1OCCO1 34a_100000034215_100009815848 [0,1,0,1,0,0|2,0,0]=4 8791 B13R1.536 OC[C@H](O)CSCCC1OCCO1 62a_100009815848_100000740749 [0,1,0,1,0,0|2,0,0]=4 8792 B13R1.536 O[C@@H](CF)CNCCC1OCCO1 2230a_100000034215_100015614560 [0,1,0,1,0,0|2,0,0]=4 8793 B13R1.536 O[C@@H](CF)CNCCC1OCCO1 34a_100000034215_100015614560 [0,1,0,1,0,0|2,0,0]=4 8794 B13R1.536 O[C@@H](CF)CSCCC1OCCO1 62a_100015614560_100000740749 [0,1,0,1,0,0|2,0,0]=4 8795 B13R1.936 COC(CCN1C[C@@H]([C@@H]1C)O)OC 2230a_206633788156_100009813347 [0,1,0,1,0,0|1,0,0]=3 8796 B13R1.936 COC(CCN1C[C@@H]([C@@H]1C)O)OC 269982a_206633788156_100000139399 [0,1,0,1,0,0|1,0,0]=3 8797 B13R1.944 COC(CCCNC1(CC1)C)OC 2230a_100000757604_100000069011 [0,1,0,1,0,0|1,0,0]=3 8798 B13R1.944 COC(CCCOC1(CC1)C)OC 7a_100011725673_100000069011 [0,1,0,1,0,0|1,0,0]=3 8799 B13R1.944 COC(CCNCC1(CC1)C)OC 2230a_100000766693_100009813347 [0,1,0,1,0,0|1,0,0]=3 8800 B13R1.944 COC(CCNCC1(CC1)O)OC 2230a_100011936951_100009813347 [0,1,0,1,0,0|1,0,0]=3 8801 B13R1.944 COC(CCOCC1(CC1)C)OC 7a_100000698024_100009813347 [0,1,0,1,0,0|1,0,0]=3 8802 B13R1.944 COC(CCOCC1(CC1)F)OC 34a_200000703853_100000139399 [0,1,0,1,0,0|1,0,0]=3 8803 B13R1.944 COC(CCOCC1(CC1)F)OC 7a_200000703853_100009813347 [0,1,0,1,0,0|1,0,0]=3 8804 B13R1.944 COC(CCSCC1(CO1)C)OC 62a_100000139399_100000760498 [0,1,0,1,0,0|2,0,0]=4 8805 B13R1.944 COC(CCSCC1(CO1)C)OC 62a_100000760498_100000139399 [0,1,0,1,0,0|2,0,0]=4 8806 B13R1.2171 CCC(C)N1CCCC(CC1)OC 2230a_100016993962_100000758301 [0,1,0,1,0,0|2,0,0]=4 8807 B13R1.2171 CCC(C)N1CCCC(CC1)OC 269982a_100016993962_100000758301 [0,1,0,1,0,0|2,0,0]=4 8808 B13R1.2171 CCC(C)N1CCCC(CC1)OC 34a_100016993962_100011215416 [0,1,0,1,0,0|2,0,0]=4 8809 B13R1.2330 CCC1CN(C1)CCC(OC)OC 2230a_100015205115_100009813347 [0,1,0,1,0,0|1,0,0]=3 8810 B13R1.2330 CCC1CN(C1)CCC(OC)OC 269982a_100015205115_100000139399 [0,1,0,1,0,0|1,0,0]=3 8811 B13R1.2330 CCN1CC(C1)NCC(OC)OC 2230a_200015199589_100000751394 [0,1,0,1,0,0|2,0,0]=4 8812 B13R1.2330 COC(CCN1CC(C1)CF)OC 269982a_100010363649_100000139399 [0,1,0,1,0,0|2,0,0]=4 8813 B13R1.2330 COC(CCN1CC(C1)CF)OC 34a_100010363649_100000139399 [0,1,0,1,0,0|2,0,0]=4 8814 B13R1.2330 COC(CCN1CC(C1)CO)OC 269982a_100016987283_100000139399 [0,1,0,1,0,0|2,0,0]=4 8815 B13R1.2330 COC(CCN1CC(C1)CO)OC 34a_100016987283_100000139399 [0,1,0,1,0,0|2,0,0]=4 8816 B13R1.2330 COC(CCN1CC(C1)SC)OC 269982a_100016990038_100000139399 [0,1,0,1,0,0|2,0,0]=4 8817 B13R1.2330 COC(CNC1CC(C1)CO)OC 270004a_100000095622_100000752162 [0,1,0,1,0,0|2,0,0]=4 8818 B13R1.2330 COC(CNC1CC(C1)CO)OC 270004a_100000210479_100000101936 [0,1,0,1,0,0|2,0,0]=4 8819 B13R1.2330 COC(CN[C@H]1C[C@@H](C1)OC)OC 2230a_100121570643_100000751394 [0,1,0,1,0,0|2,0,0]=4 8820 B13R1.2330 COC(CN[C@H]1C[C@@H](C1)OC)OC 270004a_100121570643_100000752162 [0,1,0,1,0,0|2,0,0]=4 8821 B13R1.2330 COC(CSC1CC(C1)CO)OC 62a_100000751394_100009874164 [0,1,0,1,0,0|2,0,0]=4 8822 B13R1.2330 COC(CSC1CC(C1)CO)OC 62a_100009874164_100000751394 [0,1,0,1,0,0|2,0,0]=4 8823 B13R1.2330 COC1CN(C1)CCC(OC)OC 269982a_100000755009_100000139399 [0,1,0,1,0,0|2,0,0]=4 8824 B13R1.5195 CCC(C)CCOCC1(CO1)CC 7a_100011215188_200000139556 [0,1,0,1,0,0|2,0,0]=4 8825 B13R1.153 CC(CCCCl)OCC1OCCO1 34a_200000718107_100000755774 [0,1,0,1,0,0|2,0,0]=4 8826 B13R1.153 CC(CCCCl)OCC1OCCO1 7a_200000718107_100000755774 [0,1,0,1,0,0|2,0,0]=4 8827 B13R1.153 CCCCC(=O)CCC1CCCO1 1458a_100011247709_100000210211 [0,1,0,1,0,0|1,0,1]=4 8828 B13R1.153 CCCCC(=O)CCC1OCCO1 1458a_100000082924_100000210211 [0,1,0,1,0,0|0,0,1]=3 8829 B13R1.153 CCCCC(=O)CCC1OCCO1 1458a_100000210183_100000740749 [0,1,0,1,0,0|0,0,1]=3 8830 B13R1.153 CCCCC(=O)NCC1OCCO1 11a_100000036311_100000210183 [0,1,0,1,0,0|1,0,1]=4 8831 B13R1.153 CCCCC(=O)NCC1OCCO1 1626a_100000036311_100000210183 [0,1,0,1,0,0|1,0,1]=4 8832 B13R1.153 CCCCC(=O)NCC1OCCO1 527a_100000036311_100000210183 [0,1,0,1,0,0|1,0,1]=4 8833 B13R1.153 CCCCC(C)NCC1CCCO1 2230a_100000126638_100000203698 [0,1,0,1,0,0|2,0,0]=4 8834 B13R1.153 CCCCC(C)NCC1OCCO1 2230a_100000036311_200011215066 [0,1,0,1,0,0|1,0,0]=3 8835 B13R1.153 CCCCC(C)NCC1OCCO1 2230a_100000126638_100000755774 [0,1,0,1,0,0|1,0,0]=3 8836 B13R1.153 CCCCC(C)NCC1OCCO1 270004a_100000036311_100000210087 [0,1,0,1,0,0|1,0,0]=3 8837 B13R1.153 CCCCC(C)NCC1OCCO1 34a_100000036311_200011215066 [0,1,0,1,0,0|1,0,0]=3 8838 B13R1.153 CCCCC(C)NC[C@@H]1CCCO1 2230a_100020590478_200011215066 [0,1,0,1,0,0|2,0,0]=4 8839 B13R1.153 CCCCC(C)NC[C@@H]1CCCO1 270004a_100020590478_100000210087 [0,1,0,1,0,0|2,0,0]=4 8840 B13R1.153 CCCCC(C)NC[C@@H]1CCCO1 34a_100020590478_200011215066 [0,1,0,1,0,0|2,0,0]=4 8841 B13R1.153 CCCCC(C)OCC1CCCO1 34a_100000210270_200011215066 [0,1,0,1,0,0|2,0,0]=4 8842 B13R1.153 CCCCC(C)OCC1CCCO1 7a_100000210270_200011215066 [0,1,0,1,0,0|2,0,0]=4 8843 B13R1.153 CCCCC(C)OCC1CCCO1 7a_100000687866_100000203698 [0,1,0,1,0,0|2,0,0]=4 8844 B13R1.153 CCCCC(C)OCC1OCCO1 34a_100000087154_200011215066 [0,1,0,1,0,0|1,0,0]=3 8845 B13R1.153 CCCCC(C)OCC1OCCO1 34a_100000687866_100000755774 [0,1,0,1,0,0|1,0,0]=3 8846 B13R1.153 CCCCC(C)OCC1OCCO1 7a_100000687866_100000755774 [0,1,0,1,0,0|1,0,0]=3 8847 B13R1.153 CCCCC(C)SCC1CCCO1 62a_100000203698_200011215066 [0,1,0,1,0,0|2,0,0]=4 8848 B13R1.153 CCCCC(C)SCC1CCCO1 62a_200011215066_100000203698 [0,1,0,1,0,0|2,0,0]=4 8849 B13R1.153 CCCCC(C)SCC1OCCO1 62a_100000755774_200011215066 [0,1,0,1,0,0|1,0,0]=3 8850 B13R1.153 CCCCC(C)SCC1OCCO1 62a_200011215066_100000755774 [0,1,0,1,0,0|1,0,0]=3 8851 B13R1.153 CCCCN(C)CCC1OCCO1 2230a_100000207549_100000740749 [0,1,0,1,0,0|1,0,0]=3 8852 B13R1.153 CCCCN(C)CCC1OCCO1 269982a_100000207549_100000740749 [0,1,0,1,0,0|1,0,0]=3 8853 B13R1.153 CCOCC(=O)CCC1OCCO1 1458a_100000211967_100000740749 [0,1,0,1,0,0|1,0,1]=4 8854 B13R1.153 CCOCC(C)OCC1OCCO1 34a_100000718985_100000755774 [0,1,0,1,0,0|2,0,0]=4 8855 B13R1.153 CCOCC(C)OCC1OCCO1 7a_100000718985_100000755774 [0,1,0,1,0,0|2,0,0]=4 8856 B13R1.153 CCSCC(=O)CCC1OCCO1 1458a_100000230394_100000740749 [0,1,0,1,0,0|1,0,1]=4 8857 B13R1.153 CCSCC(C)NCC1OCCO1 270004a_100000036311_200011216171 [0,1,0,1,0,0|2,0,0]=4 8858 B13R1.153 CN(CCCO)CCC1OCCO1 2230a_100000213112_100000740749 [0,1,0,1,0,0|2,0,0]=4 8859 B13R1.153 CN(CCCO)CCC1OCCO1 269982a_100000213112_100000740749 [0,1,0,1,0,0|2,0,0]=4 8860 B13R1.153 COCCC(=O)CCC1OCCO1 1458a_100000082924_100000233755 [0,1,0,1,0,0|1,0,1]=4 8861 B13R1.153 COCCC(=O)CCC1OCCO1 1458a_100000749529_100000740749 [0,1,0,1,0,0|1,0,1]=4 8862 B13R1.153 COCCC(C)NCC1OCCO1 270004a_100000036311_100000742357 [0,1,0,1,0,0|2,0,0]=4 8863 B13R1.153 COCCN(C)CCC1OCCO1 2230a_100000743101_100000740749 [0,1,0,1,0,0|2,0,0]=4 8864 B13R1.153 COCCN(C)CCC1OCCO1 269982a_100000743101_100000740749 [0,1,0,1,0,0|2,0,0]=4 8865 B13R1.153 CSCCC(=O)CCC1OCCO1 1458a_100000082924_100000751147 [0,1,0,1,0,0|1,0,1]=4 8866 B13R1.153 CSCCC(=O)CCC1OCCO1 1458a_100000174002_100000740749 [0,1,0,1,0,0|1,0,1]=4 8867 B13R1.153 CSCCC(C)NCC1OCCO1 270004a_100000036311_100011217047 [0,1,0,1,0,0|2,0,0]=4 8868 B13R1.153 CSCCN(C)CCC1OCCO1 2230a_100000686725_100000740749 [0,1,0,1,0,0|2,0,0]=4 8869 B13R1.153 CSCCN(C)CCC1OCCO1 269982a_100000686725_100000740749 [0,1,0,1,0,0|2,0,0]=4 8870 B13R1.153 O=C(CCCF)CCC1OCCO1 1458a_100000082924_100011934791 [0,1,0,1,0,0|1,0,1]=4 8871 B13R1.153 O=C(CCCO)CCC1OCCO1 1458a_100000082924_100011215043 [0,1,0,1,0,0|1,0,1]=4 8872 B13R1.679 CCCCC(C)N1CC[C@H](C1)OC 2230a_100000766984_200011215066 [0,1,0,1,0,0|2,0,0]=4 8873 B13R1.679 CCCCC(C)N1CC[C@H](C1)OC 269982a_100000766984_200011215066 [0,1,0,1,0,0|2,0,0]=4 8874 B13R1.679 CCCCC(C)N1CC[C@H](C1)OC 270004a_100000766984_100000210087 [0,1,0,1,0,0|2,0,0]=4 8875 B13R1.935 COC(CNC1(CCOC1)C)OC 2230a_100000693475_100000751394 [0,1,0,1,0,0|2,0,0]=4 8876 B13R1.935 COC(CNC1(CCOC1)C)OC 270004a_100000693475_100000752162 [0,1,0,1,0,0|2,0,0]=4 8877 B13R1.935 COC(COC1(CCCC1)C)OC 34a_100000751722_100000211822 [0,1,0,1,0,0|1,0,0]=3 8878 B13R1.935 COC(COC1(CCCC1)C)OC 7a_100000751722_100000751394 [0,1,0,1,0,0|1,0,0]=3 8879 B13R1.1401 CCC(CNC(C)C1CCC1)OC 269862a_100000731041_100000760154 [0,1,0,1,0,0|2,0,0]=4 8880 B13R1.1401 COC(CCC(=O)C1CCC1)OC 1458a_100000209988_100000139399 [0,1,0,1,0,0|0,0,1]=3 8881 B13R1.1401 COC(CCC(=O)C1CCC1)OC 1458a_200000082759_100000749161 [0,1,0,1,0,0|0,0,1]=3 8882 B13R1.1401 COC(CCC(=O)C1CCO1)OC 1458a_100000089072_100000139399 [0,1,0,1,0,0|1,0,1]=4 8883 B13R1.1401 COC(CCC(=O)C1COC1)OC 1458a_100000758290_100000139399 [0,1,0,1,0,0|1,0,1]=4 8884 B13R1.1401 COC(CCC(=O)C1COC1)OC 1458a_200000082759_100000687716 [0,1,0,1,0,0|1,0,1]=4 8885 B13R1.1401 COC(CCC(=O)N1CCC1)OC 11a_100000754969_200000082759 [0,1,0,1,0,0|1,0,1]=4 8886 B13R1.1401 COC(CCC(=O)N1CCC1)OC 240690a_100000754969_200000082759 [0,1,0,1,0,0|1,0,1]=4 8887 B13R1.1401 COC(CCC(=O)N1CCC1)OC 527a_100000754969_200000082759 [0,1,0,1,0,0|1,0,1]=4 8888 B13R1.1401 COC(CCN(C)C1CCC1)OC 2230a_100000758072_100009813347 [0,1,0,1,0,0|1,0,0]=3 8889 B13R1.1401 COC(CCN(C)C1CCC1)OC 269982a_100000758072_100000139399 [0,1,0,1,0,0|1,0,0]=3 8890 B13R1.1401 COC(CCN(C)C1CCC1)OC 34a_100000758072_100000139399 [0,1,0,1,0,0|1,0,0]=3 8891 B13R1.1401 COC(CCN(C)C1COC1)OC 2230a_100102693430_100009813347 [0,1,0,1,0,0|2,0,0]=4 8892 B13R1.1401 COC(CCN(C)C1COC1)OC 269982a_100102693430_100000139399 [0,1,0,1,0,0|2,0,0]=4 8893 B13R1.1401 COC(CNC(=O)C1CCC1)OC 11a_100000210479_100000209988 [0,1,0,1,0,0|1,0,1]=4 8894 B13R1.1401 COC(CNC(=O)C1CCC1)OC 1626a_100000210479_100000209988 [0,1,0,1,0,0|1,0,1]=4 8895 B13R1.1401 COC(CNC(=O)C1CCC1)OC 240690a_100000210479_100000209988 [0,1,0,1,0,0|1,0,1]=4 8896 B13R1.1401 COC(CNC(=O)C1CCC1)OC 527a_100000210479_100000209988 [0,1,0,1,0,0|1,0,1]=4 8897 B13R1.1401 COC(CNC(C)C1CCC1)OC 2230a_100016994624_100000751394 [0,1,0,1,0,0|1,0,0]=3 8898 B13R1.1401 COC(CNC(C)C1CCC1)OC 270004a_100016994624_100000752162 [0,1,0,1,0,0|1,0,0]=3 8899 B13R1.1401 COC(CNC(C)C1CCC1)OC 34a_100016994624_100000211822 [0,1,0,1,0,0|1,0,0]=3 8900 B13R1.1401 COC(COC(C)C1CCC1)OC 34a_100000766398_100000211822 [0,1,0,1,0,0|1,0,0]=3 8901 B13R1.1401 COC(COC(C)C1CCC1)OC 7a_100000766398_100000751394 [0,1,0,1,0,0|1,0,0]=3 8902 B13R1.1403 CCC(CNC(C)CC1CC1)OC 270004a_100000731041_200000686933 [0,1,0,1,0,0|2,0,0]=4 8903 B13R1.1403 COC(CCC(=O)CC1CC1)OC 1458a_100000738066_100000139399 [0,1,0,1,0,0|0,0,1]=3 8904 B13R1.1403 COC(CCC(=O)CC1CC1)OC 1458a_200000082759_100000742324 [0,1,0,1,0,0|0,0,1]=3 8905 B13R1.1403 COC(CCC(=O)CC1CO1)OC 1458a_200000082759_100011216344 [0,1,0,1,0,0|1,0,1]=4 8906 B13R1.1403 COC(CCC(=O)CC1CS1)OC 1458a_200000082759_100000031435 [0,1,0,1,0,0|1,0,1]=4 8907 B13R1.1403 COC(CCC(=O)C[C@@H]1CO1)OC 1458a_200000082759_100000745022 [0,1,0,1,0,0|1,0,1]=4 8908 B13R1.1403 COC(CCC(=O)NC1CC1)OC 1626a_100000212008_200000082759 [0,1,0,1,0,0|1,0,1]=4 8909 B13R1.1403 COC(CCC(=O)NC1CC1)OC 240690a_100000212008_200000082759 [0,1,0,1,0,0|1,0,1]=4 8910 B13R1.1403 COC(CCC(=O)NC1CC1)OC 527a_100000212008_200000082759 [0,1,0,1,0,0|1,0,1]=4 8911 B13R1.1403 COC(CCN(C)CC1CC1)OC 2230a_100000741881_100009813347 [0,1,0,1,0,0|1,0,0]=3 8912 B13R1.1403 COC(CCN(C)CC1CC1)OC 269982a_100000741881_100000139399 [0,1,0,1,0,0|1,0,0]=3 8913 B13R1.1403 COC(CNC(=O)CC1CC1)OC 11a_100000210479_100000738066 [0,1,0,1,0,0|1,0,1]=4 8914 B13R1.1403 COC(CNC(=O)CC1CC1)OC 1626a_100000210479_100000738066 [0,1,0,1,0,0|1,0,1]=4 8915 B13R1.1403 COC(CNC(=O)CC1CC1)OC 240690a_100000210479_100000738066 [0,1,0,1,0,0|1,0,1]=4 8916 B13R1.1403 COC(CNC(=O)CC1CC1)OC 527a_100000210479_100000738066 [0,1,0,1,0,0|1,0,1]=4 8917 B13R1.1403 COC(CNC(C)CC1CC1)OC 270004a_100000210479_200000686933 [0,1,0,1,0,0|1,0,0]=3 8918 B13R1.1635 CCCCN1CCC(C1)(OC)OC 2230a_100025715670_100000210211 [0,1,0,1,0,0|1,0,0]=3 8919 B13R1.1635 CCCCN1CCC(C1)(OC)OC 269982a_100025715670_100000210211 [0,1,0,1,0,0|1,0,0]=3 8920 B13R1.1635 CCOCN1CCC(C1)(OC)OC 269982a_100025715670_100000739092 [0,1,0,1,0,0|2,0,0]=4 8921 B13R1.1635 COC1(CCN(C1)CCCF)OC 2230a_100025715670_100011934791 [0,1,0,1,0,0|2,0,0]=4 8922 B13R1.1635 COC1(CCN(C1)CCCF)OC 269982a_100025715670_100011934791 [0,1,0,1,0,0|2,0,0]=4 8923 B13R1.1635 COC1(CCN(C1)CCCO)OC 2230a_100025715670_100000230001 [0,1,0,1,0,0|2,0,0]=4 8924 B13R1.1635 COC1(CCN(C1)CCCO)OC 269982a_100025715670_100011215043 [0,1,0,1,0,0|2,0,0]=4 8925 B13R1.1635 COC1(CCN(C1)CCSC)OC 2230a_100025715670_100000751147 [0,1,0,1,0,0|2,0,0]=4 8926 B13R1.1635 COC1(CCN(C1)CCSC)OC 269982a_100025715670_100000212216 [0,1,0,1,0,0|2,0,0]=4 8927 B13R1.1635 COCCN1CCC(C1)(OC)OC 2230a_100025715670_100011201679 [0,1,0,1,0,0|2,0,0]=4 8928 B13R1.1635 COCCN1CCC(C1)(OC)OC 269982a_100025715670_100000233755 [0,1,0,1,0,0|2,0,0]=4 8929 B13R1.4365 COC(CCC(=O)C1CC1C)OC 1458a_100000211227_100000139399 [0,1,0,1,0,0|0,0,1]=3 8930 B13R1.4365 COC(CCC(=O)[C@@H]1C[C@@H]1F)OC 1458a_100015396687_100000139399 [0,1,0,1,0,0|1,0,1]=4 8931 B13R1.4365 COC(CNC(=O)C1CC1C)OC 11a_100000210479_100000211227 [0,1,0,1,0,0|1,0,1]=4 8932 B13R1.4365 COC(CNC(=O)C1CC1C)OC 1626a_100000210479_100000211227 [0,1,0,1,0,0|1,0,1]=4 8933 B13R1.4365 COC(CNC(=O)C1CC1C)OC 527a_100000210479_100000211227 [0,1,0,1,0,0|1,0,1]=4 8934 B13R1.5498 CCCCC(C)OCC1(CO1)CC 34a_100000687866_200000139556 [0,1,0,1,0,0|2,0,0]=4 8935 B13R1.5498 CCCCC(C)OCC1(CO1)CC 7a_100000687866_200000139556 [0,1,0,1,0,0|2,0,0]=4 8936 B13R1.5498 CCCCC(C)SCC1(CO1)CC 62a_200000139556_200011215066 [0,1,0,1,0,0|2,0,0]=4 8937 B13R1.5498 CCCCC(C)SCC1(CO1)CC 62a_200011215066_200000139556 [0,1,0,1,0,0|2,0,0]=4 8938 B13R1.7521 COC(CN1C(CCC1C)C)OC 2230a_100000687148_100000751394 [0,1,0,1,0,0|1,0,0]=3 8939 B13R1.7521 COC(CN1C(CCC1C)C)OC 34a_100000687148_100000211822 [0,1,0,1,0,0|1,0,0]=3 8940 B13R1.65 COC(CC(=O)C1CCCC1)OC 1458a_100000082724_100000179811 [0,1,0,1,0,0|0,0,1]=3 8941 B13R1.65 COC(CC(=O)C1CCCC1)OC 1458a_100000210718_100000751394 [0,1,0,1,0,0|0,0,1]=3 8942 B13R1.65 COC(CC(=O)C1CCCS1)OC 1458a_100012002731_100000751394 [0,1,0,1,0,0|1,0,1]=4 8943 B13R1.65 COC(CC(=O)C1CCOC1)OC 1458a_100000082724_100000690089 [0,1,0,1,0,0|1,0,1]=4 8944 B13R1.65 COC(CC(=O)C1CCOC1)OC 1458a_100011219752_100000751394 [0,1,0,1,0,0|1,0,1]=4 8945 B13R1.65 COC(CC(=O)N1CCCC1)OC 240690a_100000188435_100000082724 [0,1,0,1,0,0|1,0,1]=4 8946 B13R1.65 COC(CC(=O)N1CCCC1)OC 527a_100000188435_100000082724 [0,1,0,1,0,0|1,0,1]=4 8947 B13R1.65 COC(CC(=O)[C@@H]1CCCO1)OC 1458a_100000686382_100000751394 [0,1,0,1,0,0|1,0,1]=4 8948 B13R1.65 COC(CC(C)N1CCCC1)OC 270004a_100000188435_100000210484 [0,1,0,1,0,0|1,0,0]=3 8949 B13R1.65 COC(CC(C)N1CCSC1)OC 270004a_100011215254_100000210484 [0,1,0,1,0,0|2,0,0]=4 8950 B13R1.65 COC(CN(C)C1CCCC1)OC 2230a_100000207505_100000751394 [0,1,0,1,0,0|1,0,0]=3 8951 B13R1.65 COC(CN(C)C1CCCC1)OC 269982a_100000225562_100000179811 [0,1,0,1,0,0|1,0,0]=3 8952 B13R1.65 COC(CN(C)C1CCCC1)OC 270004a_100000207505_100000752162 [0,1,0,1,0,0|1,0,0]=3 8953 B13R1.65 COC(CN(C)C1CCCC1)OC 270004a_100000225562_100000210133 [0,1,0,1,0,0|1,0,0]=3 8954 B13R1.65 COC(CN(C)C1CCCC1)OC 34a_100000207505_100000211822 [0,1,0,1,0,0|1,0,0]=3 8955 B13R1.65 COC(CN(C)C1CCOC1)OC 2230a_100016988252_100000751394 [0,1,0,1,0,0|2,0,0]=4 8956 B13R1.65 COC(CN(C)C1CCOC1)OC 269982a_100000225562_100000731011 [0,1,0,1,0,0|2,0,0]=4 8957 B13R1.65 COC(CN(C)C1CCOC1)OC 270004a_100000225562_100000752484 [0,1,0,1,0,0|2,0,0]=4 8958 B13R1.65 COC(CN(C)C1CCOC1)OC 270004a_100016988252_100000752162 [0,1,0,1,0,0|2,0,0]=4 8959 B13R1.65 COC(CN(C)C1CCOC1)OC 34a_100016988252_100000211822 [0,1,0,1,0,0|2,0,0]=4 8960 B13R1.65 COC(CN(C)C1CCSC1)OC 270004a_100000225562_100000212027 [0,1,0,1,0,0|2,0,0]=4 8961 B13R1.156 CCCCCC(=O)CC1CCCO1 1458a_100000212188_100000203698 [0,1,0,1,0,0|1,0,1]=4 8962 B13R1.156 CCCCCC(=O)CC1OCCO1 1458a_100000212188_100000755774 [0,1,0,1,0,0|0,0,1]=3 8963 B13R1.156 CCCCCC(C)OC1CCCO1 34a_100000085407_200011218191 [0,1,0,1,0,0|2,0,0]=4 8964 B13R1.156 CCCCCN(C)CC1CCCO1 2230a_100000223495_100000203698 [0,1,0,1,0,0|2,0,0]=4 8965 B13R1.156 CCCCCN(C)CC1CCCO1 2230a_100102946541_100000210326 [0,1,0,1,0,0|2,0,0]=4 8966 B13R1.156 CCCCCN(C)CC1CCCO1 269982a_100000223495_100000183445 [0,1,0,1,0,0|2,0,0]=4 8967 B13R1.156 CCCCCN(C)CC1CCCO1 269982a_100102946541_100000210215 [0,1,0,1,0,0|2,0,0]=4 8968 B13R1.156 CCCCCN(C)CC1CCCO1 34a_100102946541_100000718602 [0,1,0,1,0,0|2,0,0]=4 8969 B13R1.156 CCCCCN(C)CC1OCCO1 2230a_100000223495_100000755774 [0,1,0,1,0,0|1,0,0]=3 8970 B13R1.156 CCCCCN(C)CC1OCCO1 2230a_200000032744_100000210326 [0,1,0,1,0,0|1,0,0]=3 8971 B13R1.156 CCCCCN(C)CC1OCCO1 269982a_100000223495_100000755774 [0,1,0,1,0,0|1,0,0]=3 8972 B13R1.156 CCCCCN(C)CC1OCCO1 269982a_200000032744_100000210215 [0,1,0,1,0,0|1,0,0]=3 8973 B13R1.156 CCCCCN(C)CC1OCCO1 34a_200000032744_100000718602 [0,1,0,1,0,0|1,0,0]=3 8974 B13R1.156 CCCOCC(=O)CC1OCCO1 1458a_100000745993_100000755774 [0,1,0,1,0,0|1,0,1]=4 8975 B13R1.156 CCCSCC(=O)CC1OCCO1 1458a_100000217233_100000755774 [0,1,0,1,0,0|1,0,1]=4 8976 B13R1.156 CCOCCC(=O)CC1OCCO1 1458a_100000749530_100000755774 [0,1,0,1,0,0|1,0,1]=4 8977 B13R1.156 CCOCCN(C)CC1OCCO1 2230a_200000032744_100011215890 [0,1,0,1,0,0|2,0,0]=4 8978 B13R1.156 CCOCCN(C)CC1OCCO1 269982a_200000032744_100011215890 [0,1,0,1,0,0|2,0,0]=4 8979 B13R1.156 CCOCCN(C)CC1OCCO1 34a_200000032744_100000210147 [0,1,0,1,0,0|2,0,0]=4 8980 B13R1.156 CCSCCC(=O)CC1OCCO1 1458a_100000230768_100000755774 [0,1,0,1,0,0|1,0,1]=4 8981 B13R1.156 CCSCCN(C)CC1OCCO1 2230a_200000032744_100000757381 [0,1,0,1,0,0|2,0,0]=4 8982 B13R1.156 CCSCCN(C)CC1OCCO1 269982a_200000032744_100000757381 [0,1,0,1,0,0|2,0,0]=4 8983 B13R1.156 CCSCCN(C)CC1OCCO1 34a_200000032744_100000757381 [0,1,0,1,0,0|2,0,0]=4 8984 B13R1.156 CN(CCCCF)CC1OCCO1 2230a_200000032744_100000729493 [0,1,0,1,0,0|2,0,0]=4 8985 B13R1.156 CN(CCCCF)CC1OCCO1 269982a_200000032744_100000729493 [0,1,0,1,0,0|2,0,0]=4 8986 B13R1.156 CN(CCCCF)CC1OCCO1 34a_200000032744_100000729493 [0,1,0,1,0,0|2,0,0]=4 8987 B13R1.156 CN(CCCCO)CC1OCCO1 2230a_100000717598_100000755774 [0,1,0,1,0,0|2,0,0]=4 8988 B13R1.156 CN(CCCCO)CC1OCCO1 2230a_200000032744_100000210776 [0,1,0,1,0,0|2,0,0]=4 8989 B13R1.156 CN(CCCCO)CC1OCCO1 269982a_100000717598_100000755774 [0,1,0,1,0,0|2,0,0]=4 8990 B13R1.156 CN(CCCCO)CC1OCCO1 269982a_200000032744_100000210776 [0,1,0,1,0,0|2,0,0]=4 8991 B13R1.156 CN(CCCCO)CC1OCCO1 34a_200000032744_100011216708 [0,1,0,1,0,0|2,0,0]=4 8992 B13R1.156 COCCCC(=O)CC1OCCO1 1458a_100000741012_100000755774 [0,1,0,1,0,0|1,0,1]=4 8993 B13R1.156 COCCCN(C)CC1OCCO1 2230a_100000224831_100000755774 [0,1,0,1,0,0|2,0,0]=4 8994 B13R1.156 COCCCN(C)CC1OCCO1 2230a_200000032744_100000740836 [0,1,0,1,0,0|2,0,0]=4 8995 B13R1.156 COCCCN(C)CC1OCCO1 269982a_100000224831_100000755774 [0,1,0,1,0,0|2,0,0]=4 8996 B13R1.156 COCCCN(C)CC1OCCO1 269982a_200000032744_100000740836 [0,1,0,1,0,0|2,0,0]=4 8997 B13R1.156 COCCCN(C)CC1OCCO1 34a_200000032744_100000740836 [0,1,0,1,0,0|2,0,0]=4 8998 B13R1.156 CSCCCC(=O)CC1OCCO1 1458a_100000173376_100000755774 [0,1,0,1,0,0|1,0,1]=4 8999 B13R1.156 O=C(CCCCO)CC1OCCO1 1458a_100000695505_100000755774 [0,1,0,1,0,0|1,0,1]=4 9000 B13R1.234 CCOC1CN(C1)CC(OC)OC 270004a_100000732654_100000752162 [0,1,0,1,0,0|2,0,0]=4 9001 B13R1.234 CCOC1CN(C1)CC(OC)OC 34a_100000732654_100000211822 [0,1,0,1,0,0|2,0,0]=4 9002 B13R1.234 COCC1CN(C1)CC(OC)OC 2230a_100016993750_100000751394 [0,1,0,1,0,0|2,0,0]=4 9003 B13R1.234 COCC1CN(C1)CC(OC)OC 270004a_100016993750_100000752162 [0,1,0,1,0,0|2,0,0]=4 9004 B13R1.234 COCC1CN(C1)CC(OC)OC 34a_100016993750_100000211822 [0,1,0,1,0,0|2,0,0]=4 9005 B13R1.2074 CCC1CC1C(=O)CC(OC)OC 1458a_200011661523_100000751394 [0,1,0,1,0,0|0,0,1]=3 9006 B13R1.2961 COC(CC(=O)CC1CCC1)OC 1458a_100000082724_100000763275 [0,1,0,1,0,0|0,0,1]=3 9007 B13R1.2961 COC(CC(=O)CC1CCC1)OC 1458a_100000763092_100000751394 [0,1,0,1,0,0|0,0,1]=3 9008 B13R1.2961 COC(CC(=O)CC1CCO1)OC 1458a_100000082724_100000103362 [0,1,0,1,0,0|1,0,1]=4 9009 B13R1.2961 COC(CC(=O)CC1COC1)OC 1458a_100000082724_100010264016 [0,1,0,1,0,0|1,0,1]=4 9010 B13R1.2961 COC(CC(=O)CC1COC1)OC 1458a_100000687760_100000751394 [0,1,0,1,0,0|1,0,1]=4 9011 B13R1.2961 COC(CC(=O)NC1CCC1)OC 11a_100000749019_100000082724 [0,1,0,1,0,0|1,0,1]=4 9012 B13R1.2961 COC(CC(=O)NC1CCC1)OC 1626a_100000749019_100000082724 [0,1,0,1,0,0|1,0,1]=4 9013 B13R1.2961 COC(CC(=O)NC1CCC1)OC 240690a_100000749019_100000082724 [0,1,0,1,0,0|1,0,1]=4 9014 B13R1.2961 COC(CC(=O)NC1CCC1)OC 527a_100000749019_100000082724 [0,1,0,1,0,0|1,0,1]=4 9015 B13R1.2961 COC(CC(C)NC1COC1)OC 270004a_100016991112_100000210484 [0,1,0,1,0,0|2,0,0]=4 9016 B13R1.2961 COC(CC(C)NC1CSC1)OC 270004a_100016994217_100000210484 [0,1,0,1,0,0|2,0,0]=4 9017 B13R1.2961 COC(CC(C)OC1COC1)OC 7a_100011018202_100009818527 [0,1,0,1,0,0|2,0,0]=4 9018 B13R1.2961 COC(CN(C)CC1CCC1)OC 2230a_200000750244_100000751394 [0,1,0,1,0,0|1,0,0]=3 9019 B13R1.2961 COC(CN(C)CC1CCC1)OC 269982a_100000225562_100000763275 [0,1,0,1,0,0|1,0,0]=3 9020 B13R1.2961 COC(CN(C)CC1CCC1)OC 270004a_200000750244_100000752162 [0,1,0,1,0,0|1,0,0]=3 9021 B13R1.2961 COC(CN(C)CC1CCC1)OC 34a_200000750244_100000211822 [0,1,0,1,0,0|1,0,0]=3 9022 B13R1.2961 COC(CN(C)CC1CCO1)OC 269982a_100000225562_100000103362 [0,1,0,1,0,0|2,0,0]=4 9023 B13R1.2961 COC(CN(C)CC1COC1)OC 269982a_100000225562_100010264016 [0,1,0,1,0,0|2,0,0]=4 9024 B13R1.2962 COC(CC(=O)CCC1CC1)OC 1458a_100000082724_100000694398 [0,1,0,1,0,0|0,0,1]=3 9025 B13R1.2962 COC(CC(=O)CCC1CC1)OC 1458a_100000756386_100000751394 [0,1,0,1,0,0|0,0,1]=3 9026 B13R1.2962 COC(CC(=O)CCC1CO1)OC 1458a_100000082724_100000732470 [0,1,0,1,0,0|1,0,1]=4 9027 B13R1.2962 COC(CC(=O)NCC1CC1)OC 11a_100000735609_100000082724 [0,1,0,1,0,0|1,0,1]=4 9028 B13R1.2962 COC(CC(=O)NCC1CC1)OC 1626a_100000735609_100000082724 [0,1,0,1,0,0|1,0,1]=4 9029 B13R1.2962 COC(CC(=O)NCC1CC1)OC 240690a_100000735609_100000082724 [0,1,0,1,0,0|1,0,1]=4 9030 B13R1.2962 COC(CC(=O)NCC1CC1)OC 527a_100000735609_100000082724 [0,1,0,1,0,0|1,0,1]=4 9031 B13R1.2962 COC(CC(C)NCC1CC1)OC 270004a_100000735609_100000210484 [0,1,0,1,0,0|1,0,0]=3 9032 B13R1.2962 COC(CC(C)OCC1CC1)OC 7a_100011018202_100000742324 [0,1,0,1,0,0|1,0,0]=3 9033 B13R1.2962 COC(CC(C)OCC1CO1)OC 7a_100011018202_102125554688 [0,1,0,1,0,0|2,0,0]=4 9034 B13R1.2962 COC(CC(C)OCC1CS1)OC 7a_100011018202_100000031435 [0,1,0,1,0,0|2,0,0]=4 9035 B13R1.2962 COC(CC(C)OC[C@@H]1CO1)OC 7a_100011018202_100000745022 [0,1,0,1,0,0|2,0,0]=4 9036 B13R1.2962 COC(CN(C)CCC1CC1)OC 269982a_100000225562_100000694398 [0,1,0,1,0,0|1,0,0]=3 9037 B13R1.2962 COC(CN(C)CCC1CO1)OC 269982a_100000225562_100000732470 [0,1,0,1,0,0|2,0,0]=4 9038 B13R1.2963 COC(CC(=O)N1CCC1C)OC 11a_100000755817_100000082724 [0,1,0,1,0,0|1,0,1]=4 9039 B13R1.2963 COC(CC(=O)N1CCC1C)OC 240690a_100000755817_100000082724 [0,1,0,1,0,0|1,0,1]=4 9040 B13R1.2963 COC(CC(=O)N1CCC1C)OC 527a_100000755817_100000082724 [0,1,0,1,0,0|1,0,1]=4 9041 B13R1.5835 CCCCCC(=O)CC1(CO1)CC 1458a_100000212188_200000139556 [0,1,0,1,0,0|1,0,1]=4 9042 B13R1.5835 CCCCCN(C)CC1(CO1)CC 269982a_100000223495_200000139556 [0,1,0,1,0,0|2,0,0]=4 9043 B13R1.8943 CCCOCC1CC(C1)(OC)OC 34a_100000210258_100010742979 [0,1,0,1,0,0|1,0,0]=3 9044 B13R1.8943 CCCSCC1CC(C1)(OC)OC 62a_100000210303_100010742979 [0,1,0,1,0,0|1,0,0]=3 9045 B13R1.8943 CCCSCC1CC(C1)(OC)OC 62a_100010742979_100000210303 [0,1,0,1,0,0|1,0,0]=3 9046 B13R1.8943 COC1(CC(C1)CNCCF)OC 34a_100000724931_100010742979 [0,1,0,1,0,0|2,0,0]=4 9047 B13R1.8943 COC1(CC(C1)CNCCO)OC 2230a_100016997473_100010742979 [0,1,0,1,0,0|2,0,0]=4 9048 B13R1.8943 COC1(CC(C1)CNCCO)OC 34a_100016990907_100010742979 [0,1,0,1,0,0|2,0,0]=4 9049 B13R1.8943 COC1(CC(C1)COCCBr)OC 34a_100000211926_100010742979 [0,1,0,1,0,0|2,0,0]=4 9050 B13R1.8943 COC1(CC(C1)COCCN)OC 34a_100000210304_100010742979 [0,1,0,1,0,0|2,0,0]=4 9051 B13R1.8943 COC1(CC(C1)CSCCF)OC 62a_100010742979_100011217306 [0,1,0,1,0,0|2,0,0]=4 9052 B13R1.8943 COC1(CC(C1)CSCCF)OC 62a_100011217306_100010742979 [0,1,0,1,0,0|2,0,0]=4 9053 B13R1.8943 COC1(CC(C1)CSCCO)OC 62a_100000211926_100010742979 [0,1,0,1,0,0|2,0,0]=4 9054 B13R1.8943 COC1(CC(C1)CSCCO)OC 62a_100010742979_100000211926 [0,1,0,1,0,0|2,0,0]=4 9055 B13R1.8943 COC1(CC(C1)CSCSC)OC 62a_100010742979_100011218213 [0,1,0,1,0,0|2,0,0]=4 9056 B13R1.8943 COC1(CC(C1)CSCSC)OC 62a_100011218213_100010742979 [0,1,0,1,0,0|2,0,0]=4 9057 B13R1.8943 COCSCC1CC(C1)(OC)OC 62a_100000766300_100010742979 [0,1,0,1,0,0|2,0,0]=4 9058 B13R1.8943 COCSCC1CC(C1)(OC)OC 62a_100010742979_100000766300 [0,1,0,1,0,0|2,0,0]=4 9059 B13R1.74 CCCCC1CCC(CC1)C(=O)C 1458a_100000183790_200000210301 [0,1,0,1,0,0|2,0,0]=4 9060 B13R1.74 CCCCC1CCC(CC1)C(=O)[13CH3] 1458a_100000183790_200025704644 [0,1,0,1,0,0|2,0,0]=4 9061 B13R1.404 CC(CCBr)OCCC1OCCO1 34a_100012276601_100000740749 [0,1,0,1,0,0|2,0,0]=4 9062 B13R1.404 CC(CCN)COCC1OCCO1 34a_106354213184_100000755774 [0,1,0,1,0,0|2,0,0]=4 9063 B13R1.404 CC(CCO)NCCC1OCCO1 2230a_100000034215_100009893172 [0,1,0,1,0,0|2,0,0]=4 9064 B13R1.404 CC(CCO)NCCC1OCCO1 34a_100000034215_100009893172 [0,1,0,1,0,0|2,0,0]=4 9065 B13R1.404 CC(CCO)SCCC1OCCO1 62a_100009893172_100000740749 [0,1,0,1,0,0|2,0,0]=4 9066 B13R1.404 CCCC(=O)CCCC1OCCO1 1458a_100000211992_100000042513 [0,1,0,1,0,0|0,0,1]=3 9067 B13R1.404 CCCC(=O)CNCC1OCCO1 2230a_100000036311_100000747444 [0,1,0,1,0,0|1,0,1]=4 9068 B13R1.404 CCCC(=O)CSCC1OCCO1 62a_100000747444_100000755774 [0,1,0,1,0,0|1,0,1]=4 9069 B13R1.404 CCCC(=O)CSCC1OCCO1 62a_100000755774_100000747444 [0,1,0,1,0,0|1,0,1]=4 9070 B13R1.404 CCCC(=O)NCCC1OCCO1 11a_100000034215_100000211992 [0,1,0,1,0,0|1,0,1]=4 9071 B13R1.404 CCCC(=O)NCCC1OCCO1 1626a_100000034215_100000211992 [0,1,0,1,0,0|1,0,1]=4 9072 B13R1.404 CCCC(=O)NCCC1OCCO1 240690a_100000034215_100000211992 [0,1,0,1,0,0|1,0,1]=4 9073 B13R1.404 CCCC(=O)NCCC1OCCO1 527a_100000034215_100000211992 [0,1,0,1,0,0|1,0,1]=4 9074 B13R1.404 CCCC(C)CNCC1OCCO1 2230a_100000036311_100011216630 [0,1,0,1,0,0|1,0,0]=3 9075 B13R1.404 CCCC(C)CNCC1OCCO1 270004a_100000036311_100000243154 [0,1,0,1,0,0|1,0,0]=3 9076 B13R1.404 CCCC(C)CNCC1OCCO1 34a_100000036311_100011216630 [0,1,0,1,0,0|1,0,0]=3 9077 B13R1.404 CCCC(C)CNC[C@@H]1CCCO1 2230a_100020590478_100011216630 [0,1,0,1,0,0|2,0,0]=4 9078 B13R1.404 CCCC(C)CNC[C@@H]1CCCO1 270004a_100020590478_100000243154 [0,1,0,1,0,0|2,0,0]=4 9079 B13R1.404 CCCC(C)CNC[C@@H]1CCCO1 34a_100020590478_100011216630 [0,1,0,1,0,0|2,0,0]=4 9080 B13R1.404 CCCC(C)COCC1CCCO1 34a_100000210270_100011216630 [0,1,0,1,0,0|2,0,0]=4 9081 B13R1.404 CCCC(C)COCC1CCCO1 7a_100000210270_100011216630 [0,1,0,1,0,0|2,0,0]=4 9082 B13R1.404 CCCC(C)COCC1CCCO1 7a_100000688023_100000203698 [0,1,0,1,0,0|2,0,0]=4 9083 B13R1.404 CCCC(C)COCC1OCCO1 34a_100000087154_100011216630 [0,1,0,1,0,0|1,0,0]=3 9084 B13R1.404 CCCC(C)COCC1OCCO1 34a_100000688023_100000755774 [0,1,0,1,0,0|1,0,0]=3 9085 B13R1.404 CCCC(C)COCC1OCCO1 7a_100000688023_100000755774 [0,1,0,1,0,0|1,0,0]=3 9086 B13R1.404 CCCC(C)CSCC1CCCO1 62a_100000203698_100011216630 [0,1,0,1,0,0|2,0,0]=4 9087 B13R1.404 CCCC(C)CSCC1CCCO1 62a_100011216630_100000203698 [0,1,0,1,0,0|2,0,0]=4 9088 B13R1.404 CCCC(C)CSCC1OCCO1 62a_100000755774_100011216630 [0,1,0,1,0,0|1,0,0]=3 9089 B13R1.404 CCCC(C)CSCC1OCCO1 62a_100011216630_100000755774 [0,1,0,1,0,0|1,0,0]=3 9090 B13R1.404 CCCC(C)NCCC1OCCO1 2230a_100000034215_100000766640 [0,1,0,1,0,0|1,0,0]=3 9091 B13R1.404 CCCC(C)NCCC1OCCO1 2230a_100000741246_100000740749 [0,1,0,1,0,0|1,0,0]=3 9092 B13R1.404 CCCC(C)NCCC1OCCO1 270004a_100000034215_100000211909 [0,1,0,1,0,0|1,0,0]=3 9093 B13R1.404 CCCC(C)NCCC1OCCO1 34a_100000034215_100000766640 [0,1,0,1,0,0|1,0,0]=3 9094 B13R1.404 CCCC(C)OCCC1OCCO1 34a_100000764384_100000740749 [0,1,0,1,0,0|1,0,0]=3 9095 B13R1.404 CCCC(C)OCCC1OCCO1 7a_100000764384_100000740749 [0,1,0,1,0,0|1,0,0]=3 9096 B13R1.404 CCCC(C)SCCC1OCCO1 62a_100000766640_100000740749 [0,1,0,1,0,0|1,0,0]=3 9097 B13R1.404 CCCN(C)CCCC1CCCO1 2230a_100011698863_100000210303 [0,1,0,1,0,0|2,0,0]=4 9098 B13R1.404 CCCN(C)CCCC1CCCO1 269982a_100011698863_100000210303 [0,1,0,1,0,0|2,0,0]=4 9099 B13R1.404 CCCN(C)CCCC1CCCO1 34a_100011698863_100000210303 [0,1,0,1,0,0|2,0,0]=4 9100 B13R1.404 CCCN(C)CCCC1OCCO1 2230a_100000747261_100000042513 [0,1,0,1,0,0|1,0,0]=3 9101 B13R1.404 CCCN(C)CCCC1OCCO1 269982a_100000747261_100000042513 [0,1,0,1,0,0|1,0,0]=3 9102 B13R1.404 CCC[C@H](N)COCC1OCCO1 34a_100000732646_100000755774 [0,1,0,1,0,0|1,0,0]=3 9103 B13R1.404 CN(CCO)CCCC1OCCO1 2230a_100000210263_100000042513 [0,1,0,1,0,0|2,0,0]=4 9104 B13R1.404 CN(CCO)CCCC1OCCO1 269982a_100000210263_100000042513 [0,1,0,1,0,0|2,0,0]=4 9105 B13R1.404 COCC(=O)CCCC1OCCO1 1458a_100000210968_100000042513 [0,1,0,1,0,0|1,0,1]=4 9106 B13R1.404 COCC(C)NCCC1OCCO1 2230a_100000034215_100000765312 [0,1,0,1,0,0|2,0,0]=4 9107 B13R1.404 COCC(C)NCCC1OCCO1 270004a_100000034215_100000749346 [0,1,0,1,0,0|2,0,0]=4 9108 B13R1.404 COCC(C)NCCC1OCCO1 34a_100000034215_100000765312 [0,1,0,1,0,0|2,0,0]=4 9109 B13R1.404 COCC(C)SCCC1OCCO1 62a_100000765312_100000740749 [0,1,0,1,0,0|2,0,0]=4 9110 B13R1.404 COCC(N)COCC1OCCO1 34a_100000724102_100000755774 [0,1,0,1,0,0|2,0,0]=4 9111 B13R1.404 COCC(O)CNCC1OCCO1 2230a_100000756049_100000755774 [0,1,0,1,0,0|2,0,0]=4 9112 B13R1.404 COCC(O)CNCC1OCCO1 34a_100000036311_100011215053 [0,1,0,1,0,0|2,0,0]=4 9113 B13R1.404 COCC(O)CNCC1OCCO1 34a_100000756049_100000755774 [0,1,0,1,0,0|2,0,0]=4 9114 B13R1.404 COCC(O)COCC1OCCO1 34a_100000087154_100011215053 [0,1,0,1,0,0|2,0,0]=4 9115 B13R1.404 COCC(O)CSCC1OCCO1 62a_100000755774_100011215053 [0,1,0,1,0,0|2,0,0]=4 9116 B13R1.404 COCC(O)CSCC1OCCO1 62a_100011215053_100000755774 [0,1,0,1,0,0|2,0,0]=4 9117 B13R1.404 COC[C@@H](C)NCCC1OCCO1 2230a_100000764878_100000740749 [0,1,0,1,0,0|2,0,0]=4 9118 B13R1.404 COC[C@@H](C)OCCC1OCCO1 34a_100011934205_100000740749 [0,1,0,1,0,0|2,0,0]=4 9119 B13R1.404 CSCC(=O)CCCC1OCCO1 1458a_100000184570_100000042513 [0,1,0,1,0,0|1,0,1]=4 9120 B13R1.404 CSCC(C)NCCC1OCCO1 270004a_100000034215_100011216314 [0,1,0,1,0,0|2,0,0]=4 9121 B13R1.404 C[C@H](CCO)NCCC1OCCO1 2230a_100000706166_100000740749 [0,1,0,1,0,0|2,0,0]=4 9122 B13R1.404 C[C@H](CCO)NCCC1OCCO1 34a_100000706166_100000740749 [0,1,0,1,0,0|2,0,0]=4 9123 B13R1.404 O=C(CCO)CCCC1OCCO1 1458a_100011216618_100000042513 [0,1,0,1,0,0|1,0,1]=4 9124 B13R1.452 CCCC(=O)C1CCC(CC1)OC 1458a_100011215563_100000210303 [0,1,0,1,0,0|1,0,1]=4 9125 B13R1.452 CCCC(C)N1CCC(CC1)OC 2230a_100000234800_100000766640 [0,1,0,1,0,0|2,0,0]=4 9126 B13R1.452 CCCC(C)N1CCC(CC1)OC 269982a_100000234800_100000766640 [0,1,0,1,0,0|2,0,0]=4 9127 B13R1.452 CCCC(C)N1CCC(CC1)OC 270004a_100000234800_100000211909 [0,1,0,1,0,0|2,0,0]=4 9128 B13R1.452 CCCC(C)N1CCC(CC1)OC 34a_100000234800_100000766640 [0,1,0,1,0,0|2,0,0]=4 9129 B13R1.452 CCCN(C)C1CCC(CC1)OC 270004a_100000747261_100000747084 [0,1,0,1,0,0|2,0,0]=4 9130 B13R1.689 CCCC(C)CN1CC[C@H](C1)OC 2230a_100000766984_100011216630 [0,1,0,1,0,0|2,0,0]=4 9131 B13R1.689 CCCC(C)CN1CC[C@H](C1)OC 269982a_100000766984_100011216630 [0,1,0,1,0,0|2,0,0]=4 9132 B13R1.689 CCCC(C)CN1CC[C@H](C1)OC 270004a_100000766984_100000243154 [0,1,0,1,0,0|2,0,0]=4 9133 B13R1.947 COC(CCCC(=O)C1CC1)OC 1458a_100000210395_100000069011 [0,1,0,1,0,0|0,0,1]=3 9134 B13R1.947 COC(CCCC(=O)C1CO1)OC 1458a_100000701028_100000069011 [0,1,0,1,0,0|1,0,1]=4 9135 B13R1.947 COC(CCCN(C)C1CC1)OC 2230a_100000226674_100000069011 [0,1,0,1,0,0|1,0,0]=3 9136 B13R1.947 COC(CCCN(C)C1CC1)OC 269982a_100000226674_100000069011 [0,1,0,1,0,0|1,0,0]=3 9137 B13R1.947 COC(CCNC(C)C1CC1)OC 2230a_100000700016_100009813347 [0,1,0,1,0,0|1,0,0]=3 9138 B13R1.947 COC(CCNC(C)C1CC1)OC 34a_100000700016_100000139399 [0,1,0,1,0,0|1,0,0]=3 9139 B13R1.947 COC(CCOC(C)C1CC1)OC 34a_100000744524_100000139399 [0,1,0,1,0,0|1,0,0]=3 9140 B13R1.947 COC(CCOC(C)C1CC1)OC 7a_100000744524_100009813347 [0,1,0,1,0,0|1,0,0]=3 9141 B13R1.947 COC(CNCC(O)C1CC1)OC 2230a_100000751198_100000751394 [0,1,0,1,0,0|1,0,0]=3 9142 B13R1.947 COC(CNCC(O)C1CC1)OC 270004a_100000751198_100000752162 [0,1,0,1,0,0|1,0,0]=3 9143 B13R1.947 COC(CNCC(O)C1CC1)OC 34a_100000751198_100000211822 [0,1,0,1,0,0|1,0,0]=3 9144 B13R1.947 COC(COCC(=O)C1CC1)OC 34a_100000686663_100000211822 [0,1,0,1,0,0|1,0,1]=4 9145 B13R1.947 COC(COCC(=O)C1CC1)OC 34a_100011216393_100000746382 [0,1,0,1,0,0|1,0,1]=4 9146 B13R1.947 COC(COC[C@H](N)C1CC1)OC 34a_100020623730_100000211822 [0,1,0,1,0,0|1,0,0]=3 9147 B13R1.947 COC(CSCC(=O)C1CC1)OC 62a_100000746382_100000751394 [0,1,0,1,0,0|1,0,1]=4 9148 B13R1.947 COC(CSCC(=O)C1CC1)OC 62a_100000751394_100000746382 [0,1,0,1,0,0|1,0,1]=4 9149 B13R1.5525 CCCC(C)COCC1(CO1)CC 34a_100000688023_200000139556 [0,1,0,1,0,0|2,0,0]=4 9150 B13R1.5525 CCCC(C)COCC1(CO1)CC 7a_100000688023_200000139556 [0,1,0,1,0,0|2,0,0]=4 9151 B13R1.5525 CCCC(C)CSCC1(CO1)CC 62a_100011216630_200000139556 [0,1,0,1,0,0|2,0,0]=4 9152 B13R1.5525 CCCC(C)CSCC1(CO1)CC 62a_200000139556_100011216630 [0,1,0,1,0,0|2,0,0]=4 9153 B13R1.5525 CCC[C@H](N)COCC1(CO1)CC 34a_100000732646_200000139556 [0,1,0,1,0,0|2,0,0]=4 9154 B13R1.7519 CCC(COCC1(CCC1)C)OC 34a_100011934954_100000726658 [0,1,0,1,0,0|2,0,0]=4 9155 B13R1.7519 CCC(COCC1(CCC1)C)OC 7a_100011934954_100000726658 [0,1,0,1,0,0|2,0,0]=4 9156 B13R1.7519 COC(CCNC1(CCC1)C)OC 2230a_100000692455_100009813347 [0,1,0,1,0,0|1,0,0]=3 9157 B13R1.7519 COC(CCNC1(CCC1)C)OC 34a_100000692455_100000139399 [0,1,0,1,0,0|1,0,0]=3 9158 B13R1.7519 COC(CCNC1(COC1)C)OC 2230a_100000732644_100009813347 [0,1,0,1,0,0|2,0,0]=4 9159 B13R1.7519 COC(CCOC1(CCC1)C)OC 34a_100000759064_100000139399 [0,1,0,1,0,0|1,0,0]=3 9160 B13R1.7519 COC(CCOC1(CCC1)C)OC 7a_100000759064_100009813347 [0,1,0,1,0,0|1,0,0]=3 9161 B13R1.7519 COC(CCOC1(CSC1)C)OC 7a_100016018533_100009813347 [0,1,0,1,0,0|2,0,0]=4 9162 B13R1.7519 COC(CNCC1(CCC1)C)OC 2230a_100000706607_100000751394 [0,1,0,1,0,0|1,0,0]=3 9163 B13R1.7519 COC(CNCC1(CCC1)C)OC 270004a_100000706607_100000752162 [0,1,0,1,0,0|1,0,0]=3 9164 B13R1.7519 COC(CNCC1(CCC1)O)OC 2230a_100000752638_100000751394 [0,1,0,1,0,0|1,0,0]=3 9165 B13R1.7519 COC(CNCC1(CCC1)O)OC 270004a_100000752638_100000752162 [0,1,0,1,0,0|1,0,0]=3 9166 B13R1.7519 COC(CNCC1(COC1)C)OC 2230a_100020631278_100000751394 [0,1,0,1,0,0|2,0,0]=4 9167 B13R1.7519 COC(CNCC1(COC1)C)OC 270004a_100020631278_100000752162 [0,1,0,1,0,0|2,0,0]=4 9168 B13R1.7519 COC(CNCC1(COC1)O)OC 2230a_100010264505_100000751394 [0,1,0,1,0,0|2,0,0]=4 9169 B13R1.7519 COC(CNCC1(COC1)O)OC 270004a_100010264505_100000752162 [0,1,0,1,0,0|2,0,0]=4 9170 B13R1.7519 COC(COCC1(CCC1)C)OC 34a_100011216393_100000726658 [0,1,0,1,0,0|1,0,0]=3 9171 B13R1.7519 COC(COCC1(COC1)C)OC 34a_100011216393_100009817586 [0,1,0,1,0,0|2,0,0]=4 9172 B13R1.7519 COC(COCC1(CSC1)C)OC 34a_100000732658_100000211822 [0,1,0,1,0,0|2,0,0]=4 9173 B13R1.7519 COC(COCC1(CSC1)C)OC 7a_100000732658_100000751394 [0,1,0,1,0,0|2,0,0]=4 9174 B13R1.7519 COC(CSCC1(CCC1)C)OC 62a_100000726658_100000751394 [0,1,0,1,0,0|1,0,0]=3 9175 B13R1.7519 COC(CSCC1(CCC1)C)OC 62a_100000751394_100000726658 [0,1,0,1,0,0|1,0,0]=3 9176 B13R1.7519 COC(CSCC1(COC1)C)OC 62a_100000751394_100009817586 [0,1,0,1,0,0|2,0,0]=4 9177 B13R1.7519 COC(CSCC1(COC1)C)OC 62a_100009817586_100000751394 [0,1,0,1,0,0|2,0,0]=4 9178 B13R1.2436 CC1(OCCO1)CCCNCCF 34a_100000724931_100000037737 [0,1,0,1,0,0|2,0,0]=4 9179 B13R1.2436 CC1(OCCO1)CCCNCCO 2230a_100016997473_100000037737 [0,1,0,1,0,0|2,0,0]=4 9180 B13R1.2436 CC1(OCCO1)CCCNCCO 34a_100016990907_100000037737 [0,1,0,1,0,0|2,0,0]=4 9181 B13R1.2436 CC1(OCCO1)CCCOCCBr 34a_100000211926_100000037737 [0,1,0,1,0,0|2,0,0]=4 9182 B13R1.2436 CC1(OCCO1)CCCOCCN 34a_100000210304_100000037737 [0,1,0,1,0,0|2,0,0]=4 9183 B13R1.2436 CC1(OCCO1)CCCSCCF 62a_100000037737_100011217306 [0,1,0,1,0,0|2,0,0]=4 9184 B13R1.2436 CC1(OCCO1)CCCSCCF 62a_100011217306_100000037737 [0,1,0,1,0,0|2,0,0]=4 9185 B13R1.2436 CC1(OCCO1)CCCSCCO 62a_100000037737_100000211926 [0,1,0,1,0,0|2,0,0]=4 9186 B13R1.2436 CC1(OCCO1)CCCSCCO 62a_100000211926_100000037737 [0,1,0,1,0,0|2,0,0]=4 9187 B13R1.2436 CC1(OCCO1)CCNCCCF 2230a_100000073055_100011934791 [0,1,0,1,0,0|2,0,0]=4 9188 B13R1.2436 CC1(OCCO1)CCNCCCF 2230a_100015189416_100000758764 [0,1,0,1,0,0|2,0,0]=4 9189 B13R1.2436 CC1(OCCO1)CCNCCCF 34a_100015189416_100000758764 [0,1,0,1,0,0|2,0,0]=4 9190 B13R1.2436 CC1(OCCO1)CCNCCCO 2230a_100000073055_100000230001 [0,1,0,1,0,0|2,0,0]=4 9191 B13R1.2436 CC1(OCCO1)CCOCCCBr 34a_100011217188_100000758764 [0,1,0,1,0,0|2,0,0]=4 9192 B13R1.2436 CC1(OCCO1)CCOCCCCl 34a_100000230001_100000758764 [0,1,0,1,0,0|2,0,0]=4 9193 B13R1.2436 CC1(OCCO1)CCOCCCF 34a_100000759539_100000758764 [0,1,0,1,0,0|2,0,0]=4 9194 B13R1.2436 CC1(OCCO1)CCOCCCF 7a_100009861814_100011934791 [0,1,0,1,0,0|2,0,0]=4 9195 B13R1.2436 CC1(OCCO1)CCOCCCN 34a_100000182051_100000758764 [0,1,0,1,0,0|2,0,0]=4 9196 B13R1.2436 CC1(OCCO1)CCOCCCO 7a_100009861814_100011215043 [0,1,0,1,0,0|2,0,0]=4 9197 B13R1.2436 CC1(OCCO1)CCSCCCF 62a_100000758764_100011934791 [0,1,0,1,0,0|2,0,0]=4 9198 B13R1.2436 CC1(OCCO1)CCSCCCF 62a_100011934791_100000758764 [0,1,0,1,0,0|2,0,0]=4 9199 B13R1.2436 CC1(OCCO1)CCSCCCO 62a_100000758764_100011215043 [0,1,0,1,0,0|2,0,0]=4 9200 B13R1.2436 CC1(OCCO1)CCSCCCO 62a_100011215043_100000758764 [0,1,0,1,0,0|2,0,0]=4 9201 B13R1.2436 CC1(OCCO1)CNCCCCF 2230a_100000691740_100000729493 [0,1,0,1,0,0|2,0,0]=4 9202 B13R1.2436 CC1(OCCO1)CNCCCCO 2230a_100000691740_100000210776 [0,1,0,1,0,0|2,0,0]=4 9203 B13R1.2436 CC1(OCCO1)CSCCCCF 62a_100000729493_100009818610 [0,1,0,1,0,0|2,0,0]=4 9204 B13R1.2436 CC1(OCCO1)CSCCCCF 62a_100009818610_100000729493 [0,1,0,1,0,0|2,0,0]=4 9205 B13R1.2436 CC1(OCCO1)CSCCCCO 62a_100000210776_100009818610 [0,1,0,1,0,0|2,0,0]=4 9206 B13R1.2436 CC1(OCCO1)CSCCCCO 62a_100009818610_100000210776 [0,1,0,1,0,0|2,0,0]=4 9207 B13R1.2436 CCCCCNCC1(OCCO1)C 2230a_100000691740_100000210326 [0,1,0,1,0,0|1,0,0]=3 9208 B13R1.2436 CCCCCSCC1(OCCO1)C 62a_100000210326_100009818610 [0,1,0,1,0,0|1,0,0]=3 9209 B13R1.2436 CCCCCSCC1(OCCO1)C 62a_100009818610_100000210326 [0,1,0,1,0,0|1,0,0]=3 9210 B13R1.2436 CCCCNCCC1(OCCO1)C 2230a_100000073055_100000210211 [0,1,0,1,0,0|1,0,0]=3 9211 B13R1.2436 CCCCNCCC1(OCCO1)C 2230a_100000102301_100000758764 [0,1,0,1,0,0|1,0,0]=3 9212 B13R1.2436 CCCCNCCC1(OCCO1)C 7a_106832991798_100000758764 [0,1,0,1,0,0|1,0,0]=3 9213 B13R1.2436 CCCCOCCC1(OCCO1)C 34a_100000210227_100000758764 [0,1,0,1,0,0|1,0,0]=3 9214 B13R1.2436 CCCCOCCC1(OCCO1)C 7a_100000210227_100000758764 [0,1,0,1,0,0|1,0,0]=3 9215 B13R1.2436 CCCCOCCC1(OCCO1)C 7a_100009861814_100000210211 [0,1,0,1,0,0|1,0,0]=3 9216 B13R1.2436 CCCCSCCC1(OCCO1)C 62a_100000210211_100000758764 [0,1,0,1,0,0|1,0,0]=3 9217 B13R1.2436 CCCCSCCC1(OCCO1)C 62a_100000758764_100000210210 [0,1,0,1,0,0|1,0,0]=3 9218 B13R1.2436 CCCOCCCC1(OCCO1)C 34a_100000210258_100000037737 [0,1,0,1,0,0|1,0,0]=3 9219 B13R1.2436 CCCSCCCC1(OCCO1)C 62a_100000037737_100000210303 [0,1,0,1,0,0|1,0,0]=3 9220 B13R1.2436 CCCSCCCC1(OCCO1)C 62a_100000210303_100000037737 [0,1,0,1,0,0|1,0,0]=3 9221 B13R1.2436 CCOCCNCC1(OCCO1)C 2230a_100000691740_100011215890 [0,1,0,1,0,0|2,0,0]=4 9222 B13R1.2436 CCOCCSCC1(OCCO1)C 62a_100000210147_100009818610 [0,1,0,1,0,0|2,0,0]=4 9223 B13R1.2436 CCOCCSCC1(OCCO1)C 62a_100009818610_100011215890 [0,1,0,1,0,0|2,0,0]=4 9224 B13R1.2436 CCOCSCCC1(OCCO1)C 62a_100000739092_100000758764 [0,1,0,1,0,0|2,0,0]=4 9225 B13R1.2436 CCOCSCCC1(OCCO1)C 62a_100000758764_100000739092 [0,1,0,1,0,0|2,0,0]=4 9226 B13R1.2436 CCSCCNCC1(OCCO1)C 2230a_100000691740_100000757381 [0,1,0,1,0,0|2,0,0]=4 9227 B13R1.2436 CCSCCSCC1(OCCO1)C 62a_100000757381_100009818610 [0,1,0,1,0,0|2,0,0]=4 9228 B13R1.2436 CCSCCSCC1(OCCO1)C 62a_100009818610_100000757381 [0,1,0,1,0,0|2,0,0]=4 9229 B13R1.2436 COCCCNCC1(OCCO1)C 2230a_100000691740_100000740836 [0,1,0,1,0,0|2,0,0]=4 9230 B13R1.2436 COCCCSCC1(OCCO1)C 62a_100000709357_100009818610 [0,1,0,1,0,0|2,0,0]=4 9231 B13R1.2436 COCCCSCC1(OCCO1)C 62a_100009818610_100000709357 [0,1,0,1,0,0|2,0,0]=4 9232 B13R1.2436 COCCNCCC1(OCCO1)C 2230a_100000073055_100011201679 [0,1,0,1,0,0|2,0,0]=4 9233 B13R1.2436 COCCNCCC1(OCCO1)C 2230a_100000209980_100000758764 [0,1,0,1,0,0|2,0,0]=4 9234 B13R1.2436 COCCOCCC1(OCCO1)C 34a_100000210237_100000758764 [0,1,0,1,0,0|2,0,0]=4 9235 B13R1.2436 COCCOCCC1(OCCO1)C 7a_100009861814_100000233755 [0,1,0,1,0,0|2,0,0]=4 9236 B13R1.2436 COCCSCCC1(OCCO1)C 62a_100000233755_100000758764 [0,1,0,1,0,0|2,0,0]=4 9237 B13R1.2436 COCCSCCC1(OCCO1)C 62a_100000758764_100000233755 [0,1,0,1,0,0|2,0,0]=4 9238 B13R1.2436 COCSCCCC1(OCCO1)C 62a_100000037737_100000766300 [0,1,0,1,0,0|2,0,0]=4 9239 B13R1.2436 COCSCCCC1(OCCO1)C 62a_100000766300_100000037737 [0,1,0,1,0,0|2,0,0]=4 9240 B13R1.2436 CSCCNCCC1(OCCO1)C 2230a_100000073055_100000751147 [0,1,0,1,0,0|2,0,0]=4 9241 B13R1.2436 CSCCNCCC1(OCCO1)C 2230a_100020590264_100000758764 [0,1,0,1,0,0|2,0,0]=4 9242 B13R1.2436 CSCCOCCC1(OCCO1)C 34a_100000230434_100000758764 [0,1,0,1,0,0|2,0,0]=4 9243 B13R1.2436 CSCCOCCC1(OCCO1)C 7a_100000230434_100000758764 [0,1,0,1,0,0|2,0,0]=4 9244 B13R1.2436 CSCCOCCC1(OCCO1)C 7a_100009861814_100000212216 [0,1,0,1,0,0|2,0,0]=4 9245 B13R1.2436 CSCCSCCC1(OCCO1)C 62a_100000212216_100000758764 [0,1,0,1,0,0|2,0,0]=4 9246 B13R1.2436 CSCCSCCC1(OCCO1)C 62a_100000758764_100000751147 [0,1,0,1,0,0|2,0,0]=4 9247 B13R1.2436 CSCSCCCC1(OCCO1)C 62a_100000037737_100011218213 [0,1,0,1,0,0|2,0,0]=4 9248 B13R1.2436 CSCSCCCC1(OCCO1)C 62a_100011218213_100000037737 [0,1,0,1,0,0|2,0,0]=4 9249 B13R1.2712 COC(C)(CNC1CCCC1)OC 2230a_100000211070_100000064154 [0,1,0,1,0,0|1,0,0]=3 9250 B13R1.2712 COC(C)(CNC1CCCC1)OC 2230a_100000732740_100000179811 [0,1,0,1,0,0|1,0,0]=3 9251 B13R1.2712 COC(C)(CNC1CCCC1)OC 34a_100000211070_100000766008 [0,1,0,1,0,0|1,0,0]=3 9252 B13R1.2712 COC(C)(CNC1CCOC1)OC 2230a_100000732740_100000731011 [0,1,0,1,0,0|2,0,0]=4 9253 B13R1.2712 COC(C)(CN[C@@H]1CCOC1)OC 2230a_200015188469_100000064154 [0,1,0,1,0,0|2,0,0]=4 9254 B13R1.2712 COC(C)(CN[C@H]1CCOC1)OC 2230a_100015188467_100000064154 [0,1,0,1,0,0|2,0,0]=4 9255 B13R1.2712 COC(C)(CN[C@H]1CCOC1)OC 34a_100015188467_100000766008 [0,1,0,1,0,0|2,0,0]=4 9256 B13R1.2712 COC(C)(COC1CCCC1)OC 34a_100000210269_100000766008 [0,1,0,1,0,0|1,0,0]=3 9257 B13R1.2712 COC(C)(COC1CCCO1)OC 34a_100000085407_100000766008 [0,1,0,1,0,0|2,0,0]=4 9258 B13R1.2712 COC(C)(CO[C@H]1CCOC1)OC 34a_100000717292_100000766008 [0,1,0,1,0,0|2,0,0]=4 9259 B13R1.2712 COC(C)(CSC1CCCC1)OC 62a_100000766008_100000179811 [0,1,0,1,0,0|1,0,0]=3 9260 B13R1.2712 COC(C)(CSC1CCCC1)OC 62a_100011217020_100000766008 [0,1,0,1,0,0|1,0,0]=3 9261 B13R1.2712 COC(C)(CSC1CCOC1)OC 62a_100000766008_100000690089 [0,1,0,1,0,0|2,0,0]=4 9262 B13R1.2712 COP(=O)(COC1CCCC1)OC 34a_100000101693_100000179811 [0,1,0,1,0,0|2,0,0]=4 9263 B13R1.2712 CO[Si](C)(CSC1CCCC1)OC 62a_100000067953_100000179811 [0,1,0,1,0,0|1,1,0]=4 9264 B13R1.2712 CO[Si](C)(CSC1CCCC1)OC 62a_100011217020_100000067953 [0,1,0,1,0,0|1,1,0]=4 9265 B13R1.2713 COC(C)(CNCCC1CC1)OC 2230a_100000732740_100000694398 [0,1,0,1,0,0|1,0,0]=3 9266 B13R1.2713 COC(C)(CNCCC1CC1)OC 34a_100000764129_100000766008 [0,1,0,1,0,0|1,0,0]=3 9267 B13R1.2713 COC(C)(CNCCC1CO1)OC 2230a_100000732740_100000732470 [0,1,0,1,0,0|2,0,0]=4 9268 B13R1.2713 COC(C)(COCCC1CC1)OC 34a_100000754188_100000766008 [0,1,0,1,0,0|1,0,0]=3 9269 B13R1.2713 COC(C)(COCC[C@@H]1CO1)OC 34a_100009820653_100000766008 [0,1,0,1,0,0|2,0,0]=4 9270 B13R1.2713 COC(C)(CSCCC1CC1)OC 62a_100000764125_100000766008 [0,1,0,1,0,0|1,0,0]=3 9271 B13R1.2713 COC(C)(CSCCC1CC1)OC 62a_100000766008_100000764125 [0,1,0,1,0,0|1,0,0]=3 9272 B13R1.2713 COC(C)(CSCCC1CO1)OC 62a_100000732470_100000766008 [0,1,0,1,0,0|2,0,0]=4 9273 B13R1.2713 COC(C)(CSCCC1CO1)OC 62a_100000766008_100000732470 [0,1,0,1,0,0|2,0,0]=4 9274 B13R1.2713 COP(=O)(CCOCC1CC1)OC 34a_200000043213_100000742324 [0,1,0,1,0,0|2,0,0]=4 9275 B13R1.2713 COP(=O)(COCCC1CC1)OC 34a_100000101693_100000694398 [0,1,0,1,0,0|2,0,0]=4 9276 B13R1.2713 CO[Si](C)(CCCNC1CC1)OC 34a_100000212008_100000031653 [0,1,0,1,0,0|1,1,0]=4 9277 B13R1.2713 CO[Si](C)(CCCSC1CC1)OC 62a_100000031653_100000211595 [0,1,0,1,0,0|1,1,0]=4 9278 B13R1.2713 CO[Si](C)(CSCCC1CC1)OC 62a_100000067953_100000764125 [0,1,0,1,0,0|1,1,0]=4 9279 B13R1.2713 CO[Si](C)(CSCCC1CC1)OC 62a_100000764125_100000067953 [0,1,0,1,0,0|1,1,0]=4 9280 B13R1.2718 COC(C)(CNCC1CCC1)OC 2230a_100000732740_100000763275 [0,1,0,1,0,0|1,0,0]=3 9281 B13R1.2718 COC(C)(CNCC1CCC1)OC 2230a_100000738700_100000064154 [0,1,0,1,0,0|1,0,0]=3 9282 B13R1.2718 COC(C)(CNCC1CCC1)OC 269862a_100000732740_100000753134 [0,1,0,1,0,0|1,0,0]=3 9283 B13R1.2718 COC(C)(CNCC1CCC1)OC 34a_100000738700_100000766008 [0,1,0,1,0,0|1,0,0]=3 9284 B13R1.2718 COC(C)(CNCC1CCO1)OC 2230a_100000732740_100000103362 [0,1,0,1,0,0|2,0,0]=4 9285 B13R1.2718 COC(C)(CNCC1COC1)OC 2230a_100000732740_100010264016 [0,1,0,1,0,0|2,0,0]=4 9286 B13R1.2718 COC(C)(CNCC1COC1)OC 2230a_100015281925_100000064154 [0,1,0,1,0,0|2,0,0]=4 9287 B13R1.2718 COC(C)(CNCC1COC1)OC 34a_100015281925_100000766008 [0,1,0,1,0,0|2,0,0]=4 9288 B13R1.2718 COC(C)(CNC[C@@H]1CCO1)OC 2230a_100020831831_100000064154 [0,1,0,1,0,0|2,0,0]=4 9289 B13R1.2718 COC(C)(CNC[C@@H]1CCO1)OC 34a_100020831831_100000766008 [0,1,0,1,0,0|2,0,0]=4 9290 B13R1.2718 COC(C)(COCC1CCC1)OC 34a_100000760304_100000766008 [0,1,0,1,0,0|1,0,0]=3 9291 B13R1.2718 COC(C)(COCC1CCO1)OC 34a_100000039022_100000766008 [0,1,0,1,0,0|2,0,0]=4 9292 B13R1.2718 COC(C)(COCC1CNC1)OC 34a_100016987283_100000766008 [0,1,0,1,0,0|2,0,0]=4 9293 B13R1.2718 COC(C)(COCC1COC1)OC 34a_100000060846_100000766008 [0,1,0,1,0,0|2,0,0]=4 9294 B13R1.2718 COC(C)(CSCC1CCC1)OC 62a_100000763275_100000766008 [0,1,0,1,0,0|1,0,0]=3 9295 B13R1.2718 COC(C)(CSCC1CCC1)OC 62a_100000766008_100000763275 [0,1,0,1,0,0|1,0,0]=3 9296 B13R1.2718 COC(C)(CSCC1CCO1)OC 62a_100000103362_100000766008 [0,1,0,1,0,0|2,0,0]=4 9297 B13R1.2718 COC(C)(CSCC1CCO1)OC 62a_100000766008_100000103362 [0,1,0,1,0,0|2,0,0]=4 9298 B13R1.2718 COC(C)(CSCC1COC1)OC 62a_100000766008_100010264016 [0,1,0,1,0,0|2,0,0]=4 9299 B13R1.2718 COC(C)(CSCC1COC1)OC 62a_100010264016_100000766008 [0,1,0,1,0,0|2,0,0]=4 9300 B13R1.2718 COP(=O)(CCOC1CCC1)OC 34a_200000043213_100000749161 [0,1,0,1,0,0|2,0,0]=4 9301 B13R1.2718 COP(=O)(COCC1CCC1)OC 34a_100000101693_100000763275 [0,1,0,1,0,0|2,0,0]=4 9302 B13R1.2718 CO[Si](C)(CCCN1CCC1)OC 269982a_100000754969_100000031653 [0,1,0,1,0,0|1,1,0]=4 9303 B13R1.2718 CO[Si](C)(CSCC1CCC1)OC 62a_100000067953_100000763275 [0,1,0,1,0,0|1,1,0]=4 9304 B13R1.2718 CO[Si](C)(CSCC1CCC1)OC 62a_100000763275_100000067953 [0,1,0,1,0,0|1,1,0]=4 9305 B13R1.2720 COC(C)(CN1CCC[C@@H]1C)OC 2230a_100020605311_100000064154 [0,1,0,1,0,0|1,0,0]=3 9306 B13R1.2720 COC(C)(CN1CCC[C@@H]1C)OC 269982a_100020605311_100000766008 [0,1,0,1,0,0|1,0,0]=3 9307 B13R1.2720 COC(C)(CN1CCC[C@H]1C)OC 2230a_100015189458_100000064154 [0,1,0,1,0,0|1,0,0]=3 9308 B13R1.2720 COC(C)(CN1CCC[C@H]1C)OC 269982a_100015189458_100000766008 [0,1,0,1,0,0|1,0,0]=3 9309 B13R1.2720 COC(C)(CN1CCC[C@H]1C)OC 34a_100015189458_100000766008 [0,1,0,1,0,0|1,0,0]=3 9310 B13R1.2720 COC(C)(CN1CCSC1C)OC 2230a_200011216479_100000064154 [0,1,0,1,0,0|2,0,0]=4 9311 B13R1.2720 COC(C)(CN1CCSC1C)OC 269982a_200011216479_100000766008 [0,1,0,1,0,0|2,0,0]=4 9312 B13R1.2720 COC(C)(CN1CCSC1C)OC 34a_200011216479_100000766008 [0,1,0,1,0,0|2,0,0]=4 9313 B13R1.2720 CO[Si](C)(CN1CCC[C@@H]1C)OC 269982a_100020605311_100000067953 [0,1,0,1,0,0|1,1,0]=4 9314 B13R1.2720 CO[Si](C)(CN1CCC[C@H]1C)OC 269982a_100015189458_100000067953 [0,1,0,1,0,0|1,1,0]=4 9315 B13R1.2985 CCCCN1CCC(CC1)(C)OC 2230a_100000733821_100000210211 [0,1,0,1,0,0|2,0,0]=4 9316 B13R1.2985 CCCCN1CCC(CC1)(C)OC 269982a_100000733821_100000210211 [0,1,0,1,0,0|2,0,0]=4 9317 B13R1.3080 COC(C)(CN1CCCOC1)OC 2230a_100000131196_100000064154 [0,1,0,1,0,0|2,0,0]=4 9318 B13R1.3080 COC(C)(CN1CCCOC1)OC 269982a_100000131196_100000766008 [0,1,0,1,0,0|2,0,0]=4 9319 B13R1.3080 COC(C)(CN1CCCOC1)OC 34a_100000131196_100000766008 [0,1,0,1,0,0|2,0,0]=4 9320 B13R1.3080 COC(C)(CN1CCOCC1)OC 2230a_100015191051_100000064154 [0,1,0,1,0,0|2,0,0]=4 9321 B13R1.3080 COC(C)(CN1CCOCC1)OC 269982a_100015191051_100000766008 [0,1,0,1,0,0|2,0,0]=4 9322 B13R1.3080 COC(C)(CN1CCOCC1)OC 34a_100015191051_100000766008 [0,1,0,1,0,0|2,0,0]=4 9323 B13R1.3080 COC(C)(CN1CCSCC1)OC 2230a_100000737611_100000064154 [0,1,0,1,0,0|2,0,0]=4 9324 B13R1.3080 COC(C)(CN1CCSCC1)OC 269982a_100000737611_100000766008 [0,1,0,1,0,0|2,0,0]=4 9325 B13R1.5704 COC(C)(COCC1CC1C)OC 34a_100000744939_100000766008 [0,1,0,1,0,0|1,0,0]=3 9326 B13R2.5 CNC1COCCC12OCCO2 2230a_200016993997_200000210301 [0,0,0,2,0,0|2,0,0]=4 9327 B13R2.5 [13CH3]NC1COCCC12OCCO2 2230a_200016993997_200025704644 [0,0,0,2,0,0|2,0,0]=4 9328 B13R2.29 CC1SCCN1CC2OCCO2 2230a_200011216479_100000755774 [0,0,0,2,0,0|2,0,0]=4 9329 B13R2.29 CC1SCCN1CC2OCCO2 269982a_200011216479_100000755774 [0,0,0,2,0,0|2,0,0]=4 9330 B13R2.29 CC1SCCN1CC2OCCO2 34a_200011216479_100000755774 [0,0,0,2,0,0|2,0,0]=4 9331 B13R2.29 C[C@@H]1CCCN1CC2CCCO2 2230a_100015189458_100000203698 [0,0,0,2,0,0|2,0,0]=4 9332 B13R2.29 C[C@@H]1CCCN1CC2CCCO2 269982a_100015189458_100000183445 [0,0,0,2,0,0|2,0,0]=4 9333 B13R2.29 C[C@@H]1CCCN1CC2OCCO2 2230a_100015189458_100000755774 [0,0,0,2,0,0|1,0,0]=3 9334 B13R2.29 C[C@@H]1CCCN1CC2OCCO2 269982a_100015189458_100000755774 [0,0,0,2,0,0|1,0,0]=3 9335 B13R2.29 C[C@@H]1CCCN1CC2OCCO2 34a_100015189458_100000755774 [0,0,0,2,0,0|1,0,0]=3 9336 B13R2.29 C[C@H]1CCCN1CC2CCCO2 2230a_100020605311_100000203698 [0,0,0,2,0,0|2,0,0]=4 9337 B13R2.29 C[C@H]1CCCN1CC2CCCO2 269982a_100020605311_100000183445 [0,0,0,2,0,0|2,0,0]=4 9338 B13R2.29 C[C@H]1CCCN1CC2OCCO2 2230a_100020605311_100000755774 [0,0,0,2,0,0|1,0,0]=3 9339 B13R2.29 C[C@H]1CCCN1CC2OCCO2 269982a_100020605311_100000755774 [0,0,0,2,0,0|1,0,0]=3 9340 B13R2.64 C1CCC(CC1)OC2CCCO2 34a_100000085407_100000210327 [0,0,0,2,0,0|2,0,0]=4 9341 B13R2.64 C1CN(CCO1)CC2OCCO2 2230a_100015191051_100000755774 [0,0,0,2,0,0|2,0,0]=4 9342 B13R2.64 C1CN(CCO1)CC2OCCO2 269982a_100015191051_100000755774 [0,0,0,2,0,0|2,0,0]=4 9343 B13R2.64 C1CN(CCO1)CC2OCCO2 34a_100015191051_100000755774 [0,0,0,2,0,0|2,0,0]=4 9344 B13R2.64 C1COC(O1)CN2CCSCC2 2230a_100000737611_100000755774 [0,0,0,2,0,0|2,0,0]=4 9345 B13R2.64 C1COC(O1)CN2CCSCC2 269982a_100000737611_100000755774 [0,0,0,2,0,0|2,0,0]=4 9346 B13R2.64 C1COCN(C1)CC2OCCO2 2230a_100000131196_100000755774 [0,0,0,2,0,0|2,0,0]=4 9347 B13R2.64 C1COCN(C1)CC2OCCO2 269982a_100000131196_100000755774 [0,0,0,2,0,0|2,0,0]=4 9348 B13R2.64 C1COCN(C1)CC2OCCO2 34a_100000131196_100000755774 [0,0,0,2,0,0|2,0,0]=4 9349 B13R2.158 CC1CCN1CCC2OCCO2 269982a_100000755817_100000740749 [0,0,0,2,0,0|1,0,0]=3 9350 B13R2.158 CC1CCN1CCC2OCCO2 34a_100000755817_100000740749 [0,0,0,2,0,0|1,0,0]=3 9351 B13R2.183 C1CC(CO1)NCC2OCCO2 2230a_100000036311_100000731011 [0,0,0,2,0,0|2,0,0]=4 9352 B13R2.183 C1CC(CO1)NCC2OCCO2 270004a_100000036311_100000752484 [0,0,0,2,0,0|2,0,0]=4 9353 B13R2.183 C1CC(CO1)NCC2OCCO2 34a_100000036311_100000690089 [0,0,0,2,0,0|2,0,0]=4 9354 B13R2.183 C1CC(CO1)OCC2OCCO2 34a_100000087154_100000690089 [0,0,0,2,0,0|2,0,0]=4 9355 B13R2.183 C1CC(CO1)SCC2OCCO2 62a_100000755774_100000690089 [0,0,0,2,0,0|2,0,0]=4 9356 B13R2.183 C1CCC(C1)COC2CCCO2 34a_100000085407_100000740388 [0,0,0,2,0,0|2,0,0]=4 9357 B13R2.183 C1CCC(C1)NCC2CCCO2 2230a_100000211070_100000203698 [0,0,0,2,0,0|2,0,0]=4 9358 B13R2.183 C1CCC(C1)NCC2OCCO2 2230a_100000036311_100000179811 [0,0,0,2,0,0|1,0,0]=3 9359 B13R2.183 C1CCC(C1)NCC2OCCO2 2230a_100000211070_100000755774 [0,0,0,2,0,0|1,0,0]=3 9360 B13R2.183 C1CCC(C1)NCC2OCCO2 270004a_100000036311_100000210133 [0,0,0,2,0,0|1,0,0]=3 9361 B13R2.183 C1CCC(C1)NCC2OCCO2 34a_100000036311_100000179811 [0,0,0,2,0,0|1,0,0]=3 9362 B13R2.183 C1CCC(C1)NCC2OCCO2 34a_100000211070_100000755774 [0,0,0,2,0,0|1,0,0]=3 9363 B13R2.183 C1CCC(C1)NC[C@@H]2CCCO2 2230a_100020590478_100000179811 [0,0,0,2,0,0|2,0,0]=4 9364 B13R2.183 C1CCC(C1)NC[C@@H]2CCCO2 270004a_100020590478_100000210133 [0,0,0,2,0,0|2,0,0]=4 9365 B13R2.183 C1CCC(C1)NC[C@@H]2CCCO2 34a_100020590478_100000179811 [0,0,0,2,0,0|2,0,0]=4 9366 B13R2.183 C1CCC(C1)OCC2CCCO2 34a_100000210270_100000179811 [0,0,0,2,0,0|2,0,0]=4 9367 B13R2.183 C1CCC(C1)OCC2CCCO2 7a_100000210269_100000203698 [0,0,0,2,0,0|2,0,0]=4 9368 B13R2.183 C1CCC(C1)OCC2CCCO2 7a_100000210270_100000179811 [0,0,0,2,0,0|2,0,0]=4 9369 B13R2.183 C1CCC(C1)OCC2OCCO2 34a_100000087154_100000179811 [0,0,0,2,0,0|1,0,0]=3 9370 B13R2.183 C1CCC(C1)OCC2OCCO2 34a_100000210269_100000755774 [0,0,0,2,0,0|1,0,0]=3 9371 B13R2.183 C1CCC(C1)OCC2OCCO2 7a_100000210269_100000755774 [0,0,0,2,0,0|1,0,0]=3 9372 B13R2.183 C1CCC(C1)SCC2OCCO2 62a_100000755774_100000179811 [0,0,0,2,0,0|1,0,0]=3 9373 B13R2.183 C1CCC(C1)SCC2OCCO2 62a_100011217020_100000755774 [0,0,0,2,0,0|1,0,0]=3 9374 B13R2.183 C1CCN(C1)CCC2OCCO2 2230a_100000188435_100000740749 [0,0,0,2,0,0|1,0,0]=3 9375 B13R2.183 C1CCN(C1)CCC2OCCO2 269982a_100000188435_100000740749 [0,0,0,2,0,0|1,0,0]=3 9376 B13R2.183 C1COC(C1)CSC2CCCC2 62a_100000203698_100000179811 [0,0,0,2,0,0|2,0,0]=4 9377 B13R2.183 C1COC(C1)CSC2CCCC2 62a_100011217020_100000203698 [0,0,0,2,0,0|2,0,0]=4 9378 B13R2.183 C1COC(C1)OCC2OCCO2 34a_100000085407_100000755774 [0,0,0,2,0,0|2,0,0]=4 9379 B13R2.183 C1COC(O1)CCN2CCSC2 2230a_100011215254_100000740749 [0,0,0,2,0,0|2,0,0]=4 9380 B13R2.183 C1COC(O1)CCN2CCSC2 269982a_100011215254_100000740749 [0,0,0,2,0,0|2,0,0]=4 9381 B13R2.183 C1COC(O1)CNC2CCSC2 270004a_100000036311_100000212027 [0,0,0,2,0,0|2,0,0]=4 9382 B13R2.183 C1COC(O1)COC2CCSC2 7a_100011232664_100000755774 [0,0,0,2,0,0|2,0,0]=4 9383 B13R2.183 C1C[C@@H](CO1)NCC2OCCO2 2230a_100015188467_100000755774 [0,0,0,2,0,0|2,0,0]=4 9384 B13R2.183 C1C[C@@H](CO1)NCC2OCCO2 34a_100015188467_100000755774 [0,0,0,2,0,0|2,0,0]=4 9385 B13R2.183 C1C[C@@H](CO1)OCC2OCCO2 34a_100000717292_100000755774 [0,0,0,2,0,0|2,0,0]=4 9386 B13R2.183 C1C[C@H](CO1)NCC2OCCO2 2230a_200015188469_100000755774 [0,0,0,2,0,0|2,0,0]=4 9387 B13R2.196 CC1CC1COCC2CCCO2 7a_100000744939_100000203698 [0,0,0,2,0,0|2,0,0]=4 9388 B13R2.196 CC1CC1COCC2OCCO2 34a_100000744939_100000755774 [0,0,0,2,0,0|1,0,0]=3 9389 B13R2.196 CC1CC1COCC2OCCO2 7a_100000744939_100000755774 [0,0,0,2,0,0|1,0,0]=3 9390 B13R2.196 F[C@@H]1C[C@H]1NCCC2OCCO2 2230a_100025746932_100000740749 [0,0,0,2,0,0|2,0,0]=4 9391 B13R2.196 F[C@@H]1C[C@H]1NCCC2OCCO2 34a_100025746932_100000740749 [0,0,0,2,0,0|2,0,0]=4 9392 B13R2.196 F[C@H]1C[C@H]1NCCC2OCCO2 2230a_100015190264_100000740749 [0,0,0,2,0,0|2,0,0]=4 9393 B13R2.2380 C(CC1CC1)NCC2OCCO2 2230a_100000036311_100000694398 [0,0,0,2,0,0|1,0,0]=3 9394 B13R2.2380 C(CC1CC1)NCC2OCCO2 34a_100000036311_100000694398 [0,0,0,2,0,0|1,0,0]=3 9395 B13R2.2380 C(CC1CC1)NCC2OCCO2 34a_100000764129_100000755774 [0,0,0,2,0,0|1,0,0]=3 9396 B13R2.2380 C(CC1CC1)OCC2OCCO2 34a_100000087154_100000694398 [0,0,0,2,0,0|1,0,0]=3 9397 B13R2.2380 C(CC1CC1)OCC2OCCO2 34a_100000754188_100000755774 [0,0,0,2,0,0|1,0,0]=3 9398 B13R2.2380 C(CC1CC1)OCC2OCCO2 7a_100000754188_100000755774 [0,0,0,2,0,0|1,0,0]=3 9399 B13R2.2380 C(CC1CO1)NCC2OCCO2 2230a_100000036311_100000732470 [0,0,0,2,0,0|2,0,0]=4 9400 B13R2.2380 C(CC1CO1)NCC2OCCO2 34a_100000036311_100000732470 [0,0,0,2,0,0|2,0,0]=4 9401 B13R2.2380 C(CC1CO1)OCC2OCCO2 34a_100000087154_100000732470 [0,0,0,2,0,0|2,0,0]=4 9402 B13R2.2380 C(CC1OCCO1)NCC2CC2 2230a_100000034215_100000742324 [0,0,0,2,0,0|1,0,0]=3 9403 B13R2.2380 C(CC1OCCO1)NCC2CC2 2230a_100000735609_100000740749 [0,0,0,2,0,0|1,0,0]=3 9404 B13R2.2380 C(CC1OCCO1)NCC2CC2 34a_100000034215_100000742324 [0,0,0,2,0,0|1,0,0]=3 9405 B13R2.2380 C(CC1OCCO1)NCC2CC2 34a_100000735609_100000740749 [0,0,0,2,0,0|1,0,0]=3 9406 B13R2.2380 C(CC1OCCO1)NCC2CO2 2230a_100000034215_100011216344 [0,0,0,2,0,0|2,0,0]=4 9407 B13R2.2380 C(CC1OCCO1)NCC2CO2 34a_100000034215_102125554688 [0,0,0,2,0,0|2,0,0]=4 9408 B13R2.2380 C(CC1OCCO1)OCC2CC2 34a_100000211283_100000740749 [0,0,0,2,0,0|1,0,0]=3 9409 B13R2.2380 C(CC1OCCO1)OC[C@@H]2CO2 34a_100000757423_100000740749 [0,0,0,2,0,0|2,0,0]=4 9410 B13R2.2380 C(CNC1CC1)CC2OCCO2 34a_100000212008_100009861162 [0,0,0,2,0,0|1,0,0]=3 9411 B13R2.2380 C(COC1CC1)CC2OCCO2 34a_100009871617_100000211595 [0,0,0,2,0,0|1,0,0]=3 9412 B13R2.2380 C(C[C@@H]1CO1)OCC2OCCO2 34a_100009820653_100000755774 [0,0,0,2,0,0|2,0,0]=4 9413 B13R2.2380 C1COC(C1)COCCC2CC2 34a_100000210270_100000694398 [0,0,0,2,0,0|2,0,0]=4 9414 B13R2.2380 C1COC(C1)COCCC2CC2 7a_100000210270_100000764125 [0,0,0,2,0,0|2,0,0]=4 9415 B13R2.2380 C1COC(C1)COCCC2CC2 7a_100000754188_100000203698 [0,0,0,2,0,0|2,0,0]=4 9416 B13R2.2380 C1COC(C1)CSCCC2CC2 62a_100000203698_100000764125 [0,0,0,2,0,0|2,0,0]=4 9417 B13R2.2380 C1COC(C1)CSCCC2CC2 62a_100000764125_100000203698 [0,0,0,2,0,0|2,0,0]=4 9418 B13R2.2380 C1COC(O1)CCSCC2CC2 62a_100000756562_100000740749 [0,0,0,2,0,0|1,0,0]=3 9419 B13R2.2380 C1COC(O1)CCSCC2CO2 62a_102125554688_100000740749 [0,0,0,2,0,0|2,0,0]=4 9420 B13R2.2380 C1COC(O1)CCSCC2CS2 62a_100000031435_100000740749 [0,0,0,2,0,0|2,0,0]=4 9421 B13R2.2380 C1COC(O1)CCSC[C@@H]2CO2 62a_100000745022_100000740749 [0,0,0,2,0,0|2,0,0]=4 9422 B13R2.2380 C1COC(O1)CSCCC2CC2 62a_100000755774_100000764125 [0,0,0,2,0,0|1,0,0]=3 9423 B13R2.2380 C1COC(O1)CSCCC2CC2 62a_100000764125_100000755774 [0,0,0,2,0,0|1,0,0]=3 9424 B13R2.2380 C1COC(O1)CSCCC2CO2 62a_100000732470_100000755774 [0,0,0,2,0,0|2,0,0]=4 9425 B13R2.2380 C1COC(O1)CSCCC2CO2 62a_100000755774_100000732470 [0,0,0,2,0,0|2,0,0]=4 9426 B13R2.2380 C1CO[C@@H](C1)CNCCC2CC2 2230a_100020590478_100000694398 [0,0,0,2,0,0|2,0,0]=4 9427 B13R2.2380 C1CO[C@@H](C1)CNCCC2CC2 34a_100020590478_100000694398 [0,0,0,2,0,0|2,0,0]=4 9428 B13R2.2381 C(CC1OCCO1)CN2CCC2 269982a_100000754969_100000042513 [0,0,0,2,0,0|1,0,0]=3 9429 B13R2.2381 C(CC1OCCO1)NC2COC2 2230a_100016991112_100000740749 [0,0,0,2,0,0|2,0,0]=4 9430 B13R2.2381 C(CC1OCCO1)NC2COC2 34a_100000034215_100009818527 [0,0,0,2,0,0|2,0,0]=4 9431 B13R2.2381 C(CC1OCCO1)OC2CSC2 7a_100000072292_100000740749 [0,0,0,2,0,0|2,0,0]=4 9432 B13R2.2381 C1CC(C1)CNCC2CCCO2 2230a_100000738700_100000203698 [0,0,0,2,0,0|2,0,0]=4 9433 B13R2.2381 C1CC(C1)CNCC2OCCO2 2230a_100000036311_100000763275 [0,0,0,2,0,0|1,0,0]=3 9434 B13R2.2381 C1CC(C1)CNCC2OCCO2 2230a_100000738700_100000755774 [0,0,0,2,0,0|1,0,0]=3 9435 B13R2.2381 C1CC(C1)CNCC2OCCO2 34a_100000036311_100000763275 [0,0,0,2,0,0|1,0,0]=3 9436 B13R2.2381 C1CC(C1)CNCC2OCCO2 34a_100000738700_100000755774 [0,0,0,2,0,0|1,0,0]=3 9437 B13R2.2381 C1CC(C1)CNC[C@@H]2CCCO2 2230a_100020590478_100000763275 [0,0,0,2,0,0|2,0,0]=4 9438 B13R2.2381 C1CC(C1)CNC[C@@H]2CCCO2 269862a_100020590478_100000753134 [0,0,0,2,0,0|2,0,0]=4 9439 B13R2.2381 C1CC(C1)CNC[C@@H]2CCCO2 34a_100020590478_100000763275 [0,0,0,2,0,0|2,0,0]=4 9440 B13R2.2381 C1CC(C1)COCC2CCCO2 34a_100000210270_100000763275 [0,0,0,2,0,0|2,0,0]=4 9441 B13R2.2381 C1CC(C1)COCC2CCCO2 7a_100000210270_100000763275 [0,0,0,2,0,0|2,0,0]=4 9442 B13R2.2381 C1CC(C1)COCC2OCCO2 34a_100000087154_100000763275 [0,0,0,2,0,0|1,0,0]=3 9443 B13R2.2381 C1CC(C1)COCC2OCCO2 34a_100000760304_100000755774 [0,0,0,2,0,0|1,0,0]=3 9444 B13R2.2381 C1CC(C1)CSCC2CCCO2 62a_100000203698_100000763275 [0,0,0,2,0,0|2,0,0]=4 9445 B13R2.2381 C1CC(C1)CSCC2CCCO2 62a_100000763275_100000203698 [0,0,0,2,0,0|2,0,0]=4 9446 B13R2.2381 C1CC(C1)CSCC2OCCO2 62a_100000755774_100000763275 [0,0,0,2,0,0|1,0,0]=3 9447 B13R2.2381 C1CC(C1)CSCC2OCCO2 62a_100000763275_100000755774 [0,0,0,2,0,0|1,0,0]=3 9448 B13R2.2381 C1CC(C1)NCCC2OCCO2 2230a_100000749019_100000740749 [0,0,0,2,0,0|1,0,0]=3 9449 B13R2.2381 C1CC(C1)NCCC2OCCO2 270004a_100000034215_100000241760 [0,0,0,2,0,0|1,0,0]=3 9450 B13R2.2381 C1CC(C1)NCCC2OCCO2 34a_100000034215_100000749161 [0,0,0,2,0,0|1,0,0]=3 9451 B13R2.2381 C1CC(C1)NCCC2OCCO2 34a_100000749019_100000740749 [0,0,0,2,0,0|1,0,0]=3 9452 B13R2.2381 C1CC(C1)OCCC2OCCO2 34a_100000748187_100000740749 [0,0,0,2,0,0|1,0,0]=3 9453 B13R2.2381 C1CC(O1)CNCC2OCCO2 2230a_100000036311_100000103362 [0,0,0,2,0,0|2,0,0]=4 9454 B13R2.2381 C1CC(O1)CNCC2OCCO2 34a_100000036311_100000103362 [0,0,0,2,0,0|2,0,0]=4 9455 B13R2.2381 C1CC(O1)COCC2OCCO2 34a_100000039022_100000755774 [0,0,0,2,0,0|2,0,0]=4 9456 B13R2.2381 C1CC(O1)COCC2OCCO2 34a_100000087154_100000103362 [0,0,0,2,0,0|2,0,0]=4 9457 B13R2.2381 C1CC(O1)CSCC2OCCO2 62a_100000103362_100000755774 [0,0,0,2,0,0|2,0,0]=4 9458 B13R2.2381 C1CC(O1)CSCC2OCCO2 62a_100000755774_100000103362 [0,0,0,2,0,0|2,0,0]=4 9459 B13R2.2381 C1COC(O1)CNCC2COC2 2230a_100000036311_100010264016 [0,0,0,2,0,0|2,0,0]=4 9460 B13R2.2381 C1COC(O1)CNCC2COC2 2230a_100015281925_100000755774 [0,0,0,2,0,0|2,0,0]=4 9461 B13R2.2381 C1COC(O1)CNCC2COC2 34a_100000036311_100010264016 [0,0,0,2,0,0|2,0,0]=4 9462 B13R2.2381 C1COC(O1)CNCC2COC2 34a_100015281925_100000755774 [0,0,0,2,0,0|2,0,0]=4 9463 B13R2.2381 C1COC(O1)CNC[C@@H]2CCO2 2230a_100020831831_100000755774 [0,0,0,2,0,0|2,0,0]=4 9464 B13R2.2381 C1COC(O1)CNC[C@@H]2CCO2 34a_100020831831_100000755774 [0,0,0,2,0,0|2,0,0]=4 9465 B13R2.2381 C1COC(O1)COCC2CNC2 34a_100016987283_100000755774 [0,0,0,2,0,0|2,0,0]=4 9466 B13R2.2381 C1COC(O1)COCC2COC2 34a_100000060846_100000755774 [0,0,0,2,0,0|2,0,0]=4 9467 B13R2.2381 C1COC(O1)COCC2COC2 34a_100000087154_100010264016 [0,0,0,2,0,0|2,0,0]=4 9468 B13R2.2381 C1COC(O1)CSCC2COC2 62a_100000755774_100010264016 [0,0,0,2,0,0|2,0,0]=4 9469 B13R2.2381 C1COC(O1)CSCC2COC2 62a_100010264016_100000755774 [0,0,0,2,0,0|2,0,0]=4 9470 B13R2.2520 CCCCCN1C[C@H]2C[C@@H]1CO2 2230a_100016995552_100000210326 [0,0,0,2,0,0|2,0,0]=4 9471 B13R2.2520 CCCCCN1C[C@H]2C[C@@H]1CO2 269982a_100016995552_100000210215 [0,0,0,2,0,0|2,0,0]=4 9472 B13R2.2520 CCCCCN1C[C@H]2C[C@@H]1CO2 34a_100016995552_100000718602 [0,0,0,2,0,0|2,0,0]=4 9473 B13R2.57 CNC1CCC2CCCCC2C1 270004a_106832991635_100000211418 [0,0,0,2,0,0|2,0,0]=4 9474 B13R2.57 COC1CCC2CCCCC2C1 34a_100000211317_200000210301 [0,0,0,2,0,0|1,0,0]=3 9475 B13R2.57 COC1CCC2CCCCC2C1 7a_100000211317_200000210301 [0,0,0,2,0,0|1,0,0]=3 9476 B13R2.57 [13CH3]OC1CCC2CCCCC2C1 34a_100000211317_200025704644 [0,0,0,2,0,0|1,0,0]=3 9477 B13R2.57 [13CH3]OC1CCC2CCCCC2C1 7a_100000211317_200025704644 [0,0,0,2,0,0|1,0,0]=3 9478 B13R2.184 COC1CCC(CC1)NC2CC2 34a_100015205214_100000211595 [0,0,0,2,0,0|2,0,0]=4 9479 B13R2.184 COC1CCC(CC1)OC2CC2 34a_100011581665_100000211595 [0,0,0,2,0,0|2,0,0]=4 9480 B13R2.184 COC1CCN(CC1)CC2CC2 2230a_100000234800_100000742324 [0,0,0,2,0,0|2,0,0]=4 9481 B13R2.184 COC1CCN(CC1)CC2CC2 269982a_100000234800_100000756562 [0,0,0,2,0,0|2,0,0]=4 9482 B13R2.184 COC1CCN(CC1)CC2CC2 34a_100000234800_100000742324 [0,0,0,2,0,0|2,0,0]=4 9483 B13R2.185 COC1CCN(CC1)C2CCC2 269982a_100000234800_100000749161 [0,0,0,2,0,0|2,0,0]=4 9484 B13R2.185 COC1CCN(CC1)C2CCC2 270004a_100000234800_100000241760 [0,0,0,2,0,0|2,0,0]=4 9485 B13R2.185 COC1CCN(CC1)C2CCC2 34a_100000234800_100000749161 [0,0,0,2,0,0|2,0,0]=4 9486 B13R2.5500 COC(CN1CC2CC2C1)OC 2230a_100000741873_100000751394 [0,0,0,2,0,0|1,0,0]=3 9487 B13R2.5500 COC(CN1CC2CC2C1)OC 270004a_100000741873_100000752162 [0,0,0,2,0,0|1,0,0]=3 9488 B13R2.5500 COC(CN1CC2CC2C1)OC 34a_100000741873_100000211822 [0,0,0,2,0,0|1,0,0]=3 9489 B13R2.1613 CNC1CCCC2C1CCCC2 269862a_106832991636_100000032293 [0,0,0,2,0,0|2,0,0]=4 9490 B13R2.1613 COC1CCCC2C1CCCC2 34a_100000042559_200000210301 [0,0,0,2,0,0|1,0,0]=3 9491 B13R2.1613 COC1CCCC2C1CCCC2 7a_100000042559_200000210301 [0,0,0,2,0,0|1,0,0]=3 9492 B13R2.1613 [13CH3]OC1CCCC2C1CCCC2 34a_100000042559_200025704644 [0,0,0,2,0,0|1,0,0]=3 9493 B13R2.1613 [13CH3]OC1CCCC2C1CCCC2 7a_100000042559_200025704644 [0,0,0,2,0,0|1,0,0]=3 9494 B13R2.2465 CO[C@@H]1CCN(C1)CCC2CC2 2230a_100000766984_100000694398 [0,0,0,2,0,0|2,0,0]=4 9495 B13R2.2465 CO[C@@H]1CCN(C1)CCC2CC2 269982a_100000766984_100000694398 [0,0,0,2,0,0|2,0,0]=4 9496 B13R2.7386 COC1CCCN(CC1)C2CC2 269982a_100016993962_100000211595 [0,0,0,2,0,0|2,0,0]=4 9497 B13R2.7386 COC1CCCN(CC1)C2CC2 34a_100016993962_100000211595 [0,0,0,2,0,0|2,0,0]=4 9498 B13R2.8658 CCC1(CO1)CNCCC2CC2 34a_100000764129_200000139556 [0,0,0,2,0,0|2,0,0]=4 9499 B13R2.8658 CCC1(CO1)COCCC2CC2 34a_100000754188_200000139556 [0,0,0,2,0,0|2,0,0]=4 9500 B13R2.8658 CCC1(CO1)COCCC2CC2 7a_100000754188_200000139556 [0,0,0,2,0,0|2,0,0]=4 9501 B13R2.8658 CCC1(CO1)CSCCC2CC2 62a_100000764125_200000139556 [0,0,0,2,0,0|2,0,0]=4 9502 B13R2.8658 CCC1(CO1)CSCCC2CC2 62a_200000139556_100000764125 [0,0,0,2,0,0|2,0,0]=4 9503 B13R2.2468 CO[C@@H]1CCN(C1)CC2CCC2 2230a_100000766984_100000763275 [0,0,0,2,0,0|2,0,0]=4 9504 B13R2.2468 CO[C@@H]1CCN(C1)CC2CCC2 269982a_100000766984_100000763275 [0,0,0,2,0,0|2,0,0]=4 9505 B13R2.8672 CCC1(CO1)CNCC2CCC2 34a_100000738700_200000139556 [0,0,0,2,0,0|2,0,0]=4 9506 B13R2.8672 CCC1(CO1)COCC2CCC2 34a_100000760304_200000139556 [0,0,0,2,0,0|2,0,0]=4 9507 B13R2.8672 CCC1(CO1)CSCC2CCC2 62a_100000763275_200000139556 [0,0,0,2,0,0|2,0,0]=4 9508 B13R2.8672 CCC1(CO1)CSCC2CCC2 62a_200000139556_100000763275 [0,0,0,2,0,0|2,0,0]=4 9509 B13R2.2555 CCC1(CO1)CN2CCC[C@@H]2C 269982a_100020605311_200000139556 [0,0,0,2,0,0|2,0,0]=4 9510 B13R2.2555 CCC1(CO1)CN2CCC[C@H]2C 269982a_100015189458_200000139556 [0,0,0,2,0,0|2,0,0]=4 9511 B13R2.2555 CCC1(CO1)CN2CCC[C@H]2C 34a_100015189458_200000139556 [0,0,0,2,0,0|2,0,0]=4 9512 B13R2.4 CO[C@@H]1CCN(C1)C2CCCC2 2230a_100000766984_100000179811 [0,0,0,2,0,0|2,0,0]=4 9513 B13R2.4 CO[C@@H]1CCN(C1)C2CCCC2 269982a_100000766984_100000179811 [0,0,0,2,0,0|2,0,0]=4 9514 B13R2.4 CO[C@@H]1CCN(C1)C2CCCC2 270004a_100000766984_100000210133 [0,0,0,2,0,0|2,0,0]=4 9515 B13R2.2585 CCC1(CO1)CNC2CCCC2 34a_100000211070_200000139556 [0,0,0,2,0,0|2,0,0]=4 9516 B13R2.2585 CCC1(CO1)COC2CCCC2 34a_100000210269_200000139556 [0,0,0,2,0,0|2,0,0]=4 9517 B13R2.2585 CCC1(CO1)COC2CCCC2 7a_100000210269_200000139556 [0,0,0,2,0,0|2,0,0]=4 9518 B13R2.2585 CCC1(CO1)CSC2CCCC2 62a_100011217020_200000139556 [0,0,0,2,0,0|2,0,0]=4 9519 B13R2.2585 CCC1(CO1)CSC2CCCC2 62a_200000139556_100000179811 [0,0,0,2,0,0|2,0,0]=4 9520 B13R2.2553 CCC1(CO1)COCC2CC2C 34a_100000744939_200000139556 [0,0,0,2,0,0|2,0,0]=4 9521 B13R2.2553 CCC1(CO1)COCC2CC2C 7a_100000744939_200000139556 [0,0,0,2,0,0|2,0,0]=4