0 B16R0.61 C#CCC(=O)CCCCCCCCCCCC 1458a_100011215791_100000184674 [0,0,1,0,0,0|1,0,2]=4 1 B16R0.61 C#CCC(=O)CCCCCCCCCCCC 1458a_100011220946_100000759014 [0,0,1,0,0,0|1,0,2]=4 2 B16R0.61 C#CCC(=O)NCCCCCCCCCCC 1626a_200011215754_100011220946 [0,0,1,0,0,0|1,0,2]=4 3 B16R0.61 C#CCC(=O)NCCCCCCCCCCC 527a_200011215754_100011220946 [0,0,1,0,0,0|1,0,2]=4 4 B16R0.61 C#CCCCCCCCCOCC(=O)OCC 34a_100000065265_100000188475 [0,0,1,0,0,0|1,0,2]=4 5 B16R0.61 C#CCCCCCCCCOCC(=O)OCC 7a_100000065265_100000188475 [0,0,1,0,0,0|1,0,2]=4 6 B16R0.61 C#CCCCCCCCOCCC(=O)OCC 34a_100000054614_100000765890 [0,0,1,0,0,0|1,0,2]=4 7 B16R0.61 C#CCCCCCCCOCCC(=O)OCC 7a_100000054614_100011206558 [0,0,1,0,0,0|1,0,2]=4 8 B16R0.61 C#CCCCCCCCOCOC(=O)CCC 34a_100000054614_100000034017 [0,0,1,0,0,0|1,0,2]=4 9 B16R0.61 C#CCCCCCCCSCCC(=O)OCC 62a_100000765890_100153394163 [0,0,1,0,0,0|1,0,2]=4 10 B16R0.61 C#CCCCCCCCSCCC(=O)OCC 62a_100153394163_100000765890 [0,0,1,0,0,0|1,0,2]=4 11 B16R0.61 C#CCCCCCCCSCOC(=O)CCC 62a_100153394163_100000034017 [0,0,1,0,0,0|1,0,2]=4 12 B16R0.61 C#CCCCCCCOCCCC(=O)OCC 34a_100011217361_100009991533 [0,0,1,0,0,0|1,0,2]=4 13 B16R0.61 C#CCCCCCCOCCCC(=O)OCC 7a_100011217361_100011215271 [0,0,1,0,0,0|1,0,2]=4 14 B16R0.61 C#CCCCCCCOCCCC(=O)OCC 7a_100012001163_100012276617 [0,0,1,0,0,0|1,0,2]=4 15 B16R0.61 C#CCCCCCCSCCCC(=O)OCC 62a_100009991533_100012276617 [0,0,1,0,0,0|1,0,2]=4 16 B16R0.61 C#CCCCCCCSCCCC(=O)OCC 62a_100012276617_100009991533 [0,0,1,0,0,0|1,0,2]=4 17 B16R0.61 C#CCCCCCOCCCCC(=O)OCC 34a_100000766912_100000750268 [0,0,1,0,0,0|1,0,2]=4 18 B16R0.61 C#CCCCCCOCCCCC(=O)OCC 7a_100000766912_100000750268 [0,0,1,0,0,0|1,0,2]=4 19 B16R0.61 C#CCCCCCSCCCCC(=O)OCC 62a_100000750268_100012094781 [0,0,1,0,0,0|1,0,2]=4 20 B16R0.61 C#CCCCCCSCCCCC(=O)OCC 62a_100012094781_100000750268 [0,0,1,0,0,0|1,0,2]=4 21 B16R0.61 C#CCCCCNCCCCCC(=O)OCC 2230a_100000706060_100000755133 [0,0,1,0,0,0|1,0,2]=4 22 B16R0.61 C#CCCCCNCCCCCC(=O)OCC 34a_100000706060_100000755133 [0,0,1,0,0,0|1,0,2]=4 23 B16R0.61 C#CCCCCOCCCCCC(=O)OCC 34a_100000766709_100000755133 [0,0,1,0,0,0|1,0,2]=4 24 B16R0.61 C#CCCCCOCCCCCC(=O)OCC 7a_100000766709_100000755133 [0,0,1,0,0,0|1,0,2]=4 25 B16R0.61 C#CCCCCOCCCCCC(=O)OCC 7a_100011214988_100010269958 [0,0,1,0,0,0|1,0,2]=4 26 B16R0.61 C#CCCCCSCCCCCC(=O)OCC 62a_100000755133_100010269958 [0,0,1,0,0,0|1,0,2]=4 27 B16R0.61 C#CCCCCSCCCCCC(=O)OCC 62a_100010269958_100000755133 [0,0,1,0,0,0|1,0,2]=4 28 B16R0.61 C#CCCCNCCCCCCC(=O)OCC 34a_100000718082_100009814379 [0,0,1,0,0,0|1,0,2]=4 29 B16R0.61 C#CCCCOCCCCCCC(=O)OCC 34a_100000215630_100009814379 [0,0,1,0,0,0|1,0,2]=4 30 B16R0.61 C#CCCCOCCCCCCC(=O)OCC 7a_100000215630_100009814379 [0,0,1,0,0,0|1,0,2]=4 31 B16R0.61 C#CCCCSCCCCCCC(=O)OCC 62a_100011215417_100009814379 [0,0,1,0,0,0|1,0,2]=4 32 B16R0.61 C#CCCNCCCCCCCC(=O)OCC 34a_100000755551_100009991516 [0,0,1,0,0,0|1,0,2]=4 33 B16R0.61 C#CCCOCCCCCCCC(=O)OCC 34a_100011215631_100009991516 [0,0,1,0,0,0|1,0,2]=4 34 B16R0.61 C#CCCSCCCCCCCC(=O)OCC 62a_100000688953_100009991516 [0,0,1,0,0,0|1,0,2]=4 35 B16R0.61 C#CCNCCCCCCCCC(=O)OCC 34a_100000212058_100010175975 [0,0,1,0,0,0|1,0,2]=4 36 B16R0.61 C#CCOCCCCCCCCC(=O)OCC 34a_100000210247_100010175975 [0,0,1,0,0,0|1,0,2]=4 37 B16R0.61 C#CCSCCCCCCCCC(=O)OCC 62a_100000038162_100010175975 [0,0,1,0,0,0|1,0,2]=4 38 B16R0.61 C/C=C/CCOCCCCCCC(=O)OCC 34a_100016278192_100009814379 [0,0,1,0,0,0|1,0,2]=4 39 B16R0.61 C/C=C/COCCCCCCCC(=O)OCC 34a_100016270725_100009991516 [0,0,1,0,0,0|1,0,2]=4 40 B16R0.61 C/C=C/CSCCCCCCCC(=O)OCC 62a_100102629194_100009991516 [0,0,1,0,0,0|1,0,2]=4 41 B16R0.61 C=CCC(=O)CCCCCCCCCCCC 1458a_100000210193_100000759014 [0,0,1,0,0,0|1,0,2]=4 42 B16R0.61 C=CCC(=O)CCCCCCCCCCCC 1458a_100011215791_100000210623 [0,0,1,0,0,0|1,0,2]=4 43 B16R0.61 C=CCC(=O)NCCCCCCCCCCC 11a_200011215754_100000210193 [0,0,1,0,0,0|1,0,2]=4 44 B16R0.61 C=CCC(=O)NCCCCCCCCCCC 1626a_200011215754_100000210193 [0,0,1,0,0,0|1,0,2]=4 45 B16R0.61 C=CCC(=O)NCCCCCCCCCCC 240690a_200011215754_100000210193 [0,0,1,0,0,0|1,0,2]=4 46 B16R0.61 C=CCC(=O)NCCCCCCCCCCC 527a_200011215754_100000210193 [0,0,1,0,0,0|1,0,2]=4 47 B16R0.61 C=CCCCCCCCCCCC(=O)CCC 1458a_100000211992_100011093070 [0,0,1,0,0,0|1,0,2]=4 48 B16R0.61 C=CCCCCCCCCCNC(=O)CCC 11a_100000081888_100000211992 [0,0,1,0,0,0|1,0,2]=4 49 B16R0.61 C=CCCCCCCCCCNC(=O)CCC 1626a_100000081888_100000211992 [0,0,1,0,0,0|1,0,2]=4 50 B16R0.61 C=CCCCCCCCCCNC(=O)CCC 240690a_100000081888_100000211992 [0,0,1,0,0,0|1,0,2]=4 51 B16R0.61 C=CCCCCCCCCCNC(=O)CCC 527a_100000081888_100000211992 [0,0,1,0,0,0|1,0,2]=4 52 B16R0.61 C=CCCCCCCCCOCC(=O)OCC 34a_100011215194_100000188475 [0,0,1,0,0,0|1,0,2]=4 53 B16R0.61 C=CCCCCCCCCOCC(=O)OCC 7a_100011215194_100000188475 [0,0,1,0,0,0|1,0,2]=4 54 B16R0.61 C=CCCCCCCCCSCC(=O)OCC 62a_100000188475_100011933949 [0,0,1,0,0,0|1,0,2]=4 55 B16R0.61 C=CCCCCCCCCSCC(=O)OCC 62a_100011933949_100000188475 [0,0,1,0,0,0|1,0,2]=4 56 B16R0.61 C=CCCCCCCCOCCC(=O)OCC 34a_100000730831_100000765890 [0,0,1,0,0,0|1,0,2]=4 57 B16R0.61 C=CCCCCCCCOCCC(=O)OCC 7a_100000730831_100011206558 [0,0,1,0,0,0|1,0,2]=4 58 B16R0.61 C=CCCCCCCCOCOC(=O)CCC 34a_100000730831_100000034017 [0,0,1,0,0,0|1,0,2]=4 59 B16R0.61 C=CCCCCCCCSCCC(=O)OCC 62a_100000765890_100012355270 [0,0,1,0,0,0|1,0,2]=4 60 B16R0.61 C=CCCCCCCCSCCC(=O)OCC 62a_100012355270_100000765890 [0,0,1,0,0,0|1,0,2]=4 61 B16R0.61 C=CCCCCCCCSCOC(=O)CCC 62a_100012355270_100000034017 [0,0,1,0,0,0|1,0,2]=4 62 B16R0.61 C=CCCCCCCOCCCC(=O)OCC 34a_200011216477_100009991533 [0,0,1,0,0,0|1,0,2]=4 63 B16R0.61 C=CCCCCCCOCCCC(=O)OCC 7a_100012001163_100011215473 [0,0,1,0,0,0|1,0,2]=4 64 B16R0.61 C=CCCCCCCOCCCC(=O)OCC 7a_200011216477_100011215271 [0,0,1,0,0,0|1,0,2]=4 65 B16R0.61 C=CCCCCCCSCCCC(=O)OCC 62a_100009991533_100011215473 [0,0,1,0,0,0|1,0,2]=4 66 B16R0.61 C=CCCCCCCSCCCC(=O)OCC 62a_100011215473_100009991533 [0,0,1,0,0,0|1,0,2]=4 67 B16R0.61 C=CCCCCCOCCCCC(=O)OCC 34a_100011216702_100000750268 [0,0,1,0,0,0|1,0,2]=4 68 B16R0.61 C=CCCCCCOCCCCC(=O)OCC 7a_100011216702_100000750268 [0,0,1,0,0,0|1,0,2]=4 69 B16R0.61 C=CCCCCCSCCCCC(=O)OCC 62a_100000700193_100000750268 [0,0,1,0,0,0|1,0,2]=4 70 B16R0.61 C=CCCCCCSCCCCC(=O)OCC 62a_100000750268_100000700193 [0,0,1,0,0,0|1,0,2]=4 71 B16R0.61 C=CCCCCNCCCCCC(=O)OCC 2230a_100000703577_100000755133 [0,0,1,0,0,0|1,0,2]=4 72 B16R0.61 C=CCCCCNCCCCCC(=O)OCC 34a_100000703577_100000755133 [0,0,1,0,0,0|1,0,2]=4 73 B16R0.61 C=CCCCCOCCCCCC(=O)OCC 34a_100000766645_100000755133 [0,0,1,0,0,0|1,0,2]=4 74 B16R0.61 C=CCCCCOCCCCCC(=O)OCC 7a_100000766645_100000755133 [0,0,1,0,0,0|1,0,2]=4 75 B16R0.61 C=CCCCCOCCCCCC(=O)OCC 7a_100011214988_100011215482 [0,0,1,0,0,0|1,0,2]=4 76 B16R0.61 C=CCCCCSCCCCCC(=O)OCC 62a_100000755133_100011215482 [0,0,1,0,0,0|1,0,2]=4 77 B16R0.61 C=CCCCCSCCCCCC(=O)OCC 62a_100011215482_100000755133 [0,0,1,0,0,0|1,0,2]=4 78 B16R0.61 C=CCCCNCCCCCCC(=O)OCC 2230a_100000700776_100009814379 [0,0,1,0,0,0|1,0,2]=4 79 B16R0.61 C=CCCCNCCCCCCC(=O)OCC 34a_100000700776_100009814379 [0,0,1,0,0,0|1,0,2]=4 80 B16R0.61 C=CCCCOCCCCCCC(=O)OCC 34a_100000758997_100009814379 [0,0,1,0,0,0|1,0,2]=4 81 B16R0.61 C=CCCCOCCCCCCC(=O)OCC 7a_100000758997_100009814379 [0,0,1,0,0,0|1,0,2]=4 82 B16R0.61 C=CCCCSCCCCCCC(=O)OCC 62a_100011713584_100009814379 [0,0,1,0,0,0|1,0,2]=4 83 B16R0.61 C=CCCNCCCCCCCC(=O)OCC 2230a_100015191253_100009991516 [0,0,1,0,0,0|1,0,2]=4 84 B16R0.61 C=CCCOCCCCCCCC(=O)OCC 34a_100011205117_100009991516 [0,0,1,0,0,0|1,0,2]=4 85 B16R0.61 C=CCCSCCCCCCCC(=O)OCC 62a_100000754431_100009991516 [0,0,1,0,0,0|1,0,2]=4 86 B16R0.61 C=CCNCCCCCCCCC(=O)OCC 2230a_100020586998_100010175975 [0,0,1,0,0,0|1,0,2]=4 87 B16R0.61 C=CCOCCCCCCCCC(=O)OCC 34a_200000210373_100010175975 [0,0,1,0,0,0|1,0,2]=4 88 B16R0.61 C=CCSCCCCCCCCC(=O)OCC 62a_100000210623_100010175975 [0,0,1,0,0,0|1,0,2]=4 89 B16R0.61 C=COC(=O)CNCCCCCCCCCC 2230a_100000684558_100000036128 [0,0,1,0,0,0|1,0,2]=4 90 B16R0.61 C=COC(=O)CNCCCCCCCCCC 34a_100000684558_100000036128 [0,0,1,0,0,0|1,0,2]=4 91 B16R0.61 C=COC(=O)COCCCCCCCCCC 34a_100000210711_100000036128 [0,0,1,0,0,0|1,0,2]=4 92 B16R0.61 C=COC(=O)CSCCCCCCCCCC 62a_100000036128_100000210320 [0,0,1,0,0,0|1,0,2]=4 93 B16R0.61 CC#CC(=O)CCCCCCCCCCCC 1458a_100000763181_100000759014 [0,0,1,0,0,0|1,0,1]=3 94 B16R0.61 CC#CC(=O)CCCCCCCCCCCO 1458a_100000763181_100009812471 [0,0,1,0,0,0|2,0,1]=4 95 B16R0.61 CC#CCCOCCCCCCC(=O)OCC 34a_100000750427_100009814379 [0,0,1,0,0,0|1,0,2]=4 96 B16R0.61 CC#CCNCCCCCCCC(=O)OCC 2230a_100000685387_100009991516 [0,0,1,0,0,0|1,0,2]=4 97 B16R0.61 CC#CCNCCCCCCCC(=O)OCC 34a_100000685387_100009991516 [0,0,1,0,0,0|1,0,2]=4 98 B16R0.61 CC#CCOCCCCCCCC(=O)OCC 34a_100000761923_100009991516 [0,0,1,0,0,0|1,0,2]=4 99 B16R0.61 CC#CCSCCCCCCCC(=O)OCC 62a_100000748600_100009991516 [0,0,1,0,0,0|1,0,2]=4 100 B16R0.61 CC/C=C/CCCOCCCCC(=O)OCC 34a_100016287902_100000750268 [0,0,1,0,0,0|1,0,2]=4 101 B16R0.61 CC/C=C/CCCOCCCCC(=O)OCC 7a_100016287902_100000750268 [0,0,1,0,0,0|1,0,2]=4 102 B16R0.61 CC/C=C\CCCCCOCCC(=O)OCC 34a_100016268722_100000765890 [0,0,1,0,0,0|1,0,2]=4 103 B16R0.61 CC/C=C\CCCCCOCCC(=O)OCC 7a_100016268722_100011206558 [0,0,1,0,0,0|1,0,2]=4 104 B16R0.61 CC/C=C\CCCCCOCOC(=O)CCC 34a_100016268722_100000034017 [0,0,1,0,0,0|1,0,2]=4 105 B16R0.61 CC/C=C\CCCCOCCCC(=O)OCC 34a_100016287862_100009991533 [0,0,1,0,0,0|1,0,2]=4 106 B16R0.61 CC/C=C\CCCCOCCCC(=O)OCC 7a_100016287862_100011215271 [0,0,1,0,0,0|1,0,2]=4 107 B16R0.61 CC/C=C\CCOCCCCCC(=O)OCC 34a_100016288707_100000755133 [0,0,1,0,0,0|1,0,2]=4 108 B16R0.61 CC/C=C\CCOCCCCCC(=O)OCC 7a_100011214988_100015370543 [0,0,1,0,0,0|1,0,2]=4 109 B16R0.61 CC/C=C\CCOCCCCCC(=O)OCC 7a_100016288707_100000755133 [0,0,1,0,0,0|1,0,2]=4 110 B16R0.61 CC/C=C\CCSCCCCCC(=O)OCC 62a_100000755133_100015370543 [0,0,1,0,0,0|1,0,2]=4 111 B16R0.61 CC/C=C\CCSCCCCCC(=O)OCC 62a_100015370543_100000755133 [0,0,1,0,0,0|1,0,2]=4 112 B16R0.61 CC/C=C\COCCCCCCC(=O)OCC 34a_100016268518_100009814379 [0,0,1,0,0,0|1,0,2]=4 113 B16R0.61 CC/C=C\CSCCCCCCC(=O)OCC 62a_100103147603_100009814379 [0,0,1,0,0,0|1,0,2]=4 114 B16R0.61 CC=CC(=O)CCCCCCCCCCCC 1458a_100000210699_100000759014 [0,0,1,0,0,0|1,0,1]=3 115 B16R0.61 CC=CC(=O)CCCCCCCCCCCO 1458a_100000210699_100009812471 [0,0,1,0,0,0|2,0,1]=4 116 B16R0.61 CC=CC(=O)NCCCCCCCCCCC 11a_200011215754_100000210699 [0,0,1,0,0,0|1,0,2]=4 117 B16R0.61 CC=CC(=O)NCCCCCCCCCCC 1626a_200011215754_100000210699 [0,0,1,0,0,0|1,0,2]=4 118 B16R0.61 CC=CC(=O)NCCCCCCCCCCC 240690a_200011215754_100000210699 [0,0,1,0,0,0|1,0,2]=4 119 B16R0.61 CC=CCCCOCCCCCC(=O)OCC 34a_100020645299_100000755133 [0,0,1,0,0,0|1,0,2]=4 120 B16R0.61 CC=CCSCCCCCCCC(=O)OCC 62a_100000070051_100009991516 [0,0,1,0,0,0|1,0,2]=4 121 B16R0.61 CCC#CCCCCCCSCC(=O)OCC 62a_100000188475_200000036426 [0,0,1,0,0,0|1,0,2]=4 122 B16R0.61 CCC#CCCCCCCSCC(=O)OCC 62a_200000036426_100000188475 [0,0,1,0,0,0|1,0,2]=4 123 B16R0.61 CCC#CCCOCCCCCC(=O)OCC 34a_100000036655_100000755133 [0,0,1,0,0,0|1,0,2]=4 124 B16R0.61 CCC#CCCOCCCCCC(=O)OCC 7a_100000036655_100000755133 [0,0,1,0,0,0|1,0,2]=4 125 B16R0.61 CCC#CCOCCCCCCC(=O)OCC 34a_100000032950_100009814379 [0,0,1,0,0,0|1,0,2]=4 126 B16R0.61 CCC#CCSCCCCCCC(=O)OCC 62a_100009813939_100009814379 [0,0,1,0,0,0|1,0,2]=4 127 B16R0.61 CCC/C=C/COCCCCCC(=O)OCC 34a_100016278788_100000755133 [0,0,1,0,0,0|1,0,2]=4 128 B16R0.61 CCC/C=C/COCCCCCC(=O)OCC 7a_100016278788_100000755133 [0,0,1,0,0,0|1,0,2]=4 129 B16R0.61 CCCC#CCCOCCCCC(=O)OCC 34a_100000042726_100000750268 [0,0,1,0,0,0|1,0,2]=4 130 B16R0.61 CCCC#CCCOCCCCC(=O)OCC 7a_100000042726_100000750268 [0,0,1,0,0,0|1,0,2]=4 131 B16R0.61 CCCC#CCOCCCCCC(=O)OCC 34a_100000034806_100000755133 [0,0,1,0,0,0|1,0,2]=4 132 B16R0.61 CCCC#CCOCCCCCC(=O)OCC 7a_100000034806_100000755133 [0,0,1,0,0,0|1,0,2]=4 133 B16R0.61 CCCC(=O)CCCCCCCCCCCO 1458a_100000211992_100009812471 [0,0,1,0,0,0|2,0,0]=3 134 B16R0.61 CCCC(=O)CNCCCCCCCCCO 2230a_100000078944_100000747444 [0,0,1,0,0,0|3,0,0]=4 135 B16R0.61 CCCC(=O)COCCCCCCCCCBr 7a_100009813782_100000747444 [0,0,1,0,0,0|3,0,0]=4 136 B16R0.61 CCCC(=O)COCCCCCCCCCCl 7a_100009868337_100000747444 [0,0,1,0,0,0|3,0,0]=4 137 B16R0.61 CCCC(=O)CSCCCCCCCCCO 62a_100000747444_100009813782 [0,0,1,0,0,0|3,0,0]=4 138 B16R0.61 CCCC(=O)CSCCCCCCCCCO 62a_100009813782_100000747444 [0,0,1,0,0,0|3,0,0]=4 139 B16R0.61 CCCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000211992 [0,0,1,0,0,0|2,0,0]=3 140 B16R0.61 CCCC(=O)OCNCCCCCCCCO 2230a_102515433106_100000034017 [0,0,1,0,0,0|2,0,0]=3 141 B16R0.61 CCCC(=O)OCNCCCCCCCCO 34a_102515433106_100000034017 [0,0,1,0,0,0|2,0,0]=3 142 B16R0.61 CCCC(=O)OCOCCCCCCCCBr 34a_100009813846_100000034017 [0,0,1,0,0,0|2,0,0]=3 143 B16R0.61 CCCC(=O)OCOCCCCCCCCCl 34a_100000033203_100000034017 [0,0,1,0,0,0|2,0,0]=3 144 B16R0.61 CCCC(=O)OCOCCCCCCCCN 34a_102515433106_100000034017 [0,0,1,0,0,0|2,0,0]=3 145 B16R0.61 CCCC(=O)OCOCCCCCNCCN 34a_103619048469_100000034017 [0,0,1,0,0,0|3,0,0]=4 146 B16R0.61 CCCC(=O)OCOCCCOCCCOC 34a_200011215475_100000034017 [0,0,1,0,0,0|3,0,0]=4 147 B16R0.61 CCCC(=O)OCSCCCCCCCCO 62a_100000033203_100000034017 [0,0,1,0,0,0|2,0,0]=3 148 B16R0.61 CCCC(C)OCCCCCCCCCCBr 34a_100009813290_100000766640 [0,0,1,0,0,0|2,0,1]=4 149 B16R0.61 CCCC(C)OCCCCCCCCCCBr 7a_100009813290_100000766640 [0,0,1,0,0,0|2,0,1]=4 150 B16R0.61 CCCC(C)OCCCCCCCCCCCl 34a_200000033068_100000766640 [0,0,1,0,0,0|2,0,1]=4 151 B16R0.61 CCCC(C)OCCCCCCCCCCCl 7a_200000033068_100000766640 [0,0,1,0,0,0|2,0,1]=4 152 B16R0.61 CCCC(C)OCCCCCCCCCCN 34a_100000066964_100000766640 [0,0,1,0,0,0|2,0,1]=4 153 B16R0.61 CCCC(C)OCCCCCCCCCCO 34a_100000764384_100009813290 [0,0,1,0,0,0|2,0,1]=4 154 B16R0.61 CCCC(C)OCCCCCCCCCCO 7a_100000764384_100009813290 [0,0,1,0,0,0|2,0,1]=4 155 B16R0.61 CCCC/C=C/CCCCOCC(=O)OCC 34a_200020645093_100000188475 [0,0,1,0,0,0|1,0,2]=4 156 B16R0.61 CCCC/C=C/CCCCOCC(=O)OCC 7a_200020645093_100000188475 [0,0,1,0,0,0|1,0,2]=4 157 B16R0.61 CCCC/C=C/COCCCCC(=O)OCC 34a_200016272032_100000750268 [0,0,1,0,0,0|1,0,2]=4 158 B16R0.61 CCCC/C=C/COCCCCC(=O)OCC 7a_200016272032_100000750268 [0,0,1,0,0,0|1,0,2]=4 159 B16R0.61 CCCC/C=C\CCOCCCC(=O)OCC 34a_200016286491_100009991533 [0,0,1,0,0,0|1,0,2]=4 160 B16R0.61 CCCC/C=C\CCOCCCC(=O)OCC 7a_200016286491_100011215271 [0,0,1,0,0,0|1,0,2]=4 161 B16R0.61 CCCCC#CCCCCCCC(=O)CCC 1458a_100000211992_200000043322 [0,0,1,0,0,0|1,0,2]=4 162 B16R0.61 CCCCC#CCCCCOCC(=O)OCC 34a_200000066234_100000188475 [0,0,1,0,0,0|1,0,2]=4 163 B16R0.61 CCCCC#CCCCCOCC(=O)OCC 7a_200000066234_100000188475 [0,0,1,0,0,0|1,0,2]=4 164 B16R0.61 CCCCC#CCCCSCCC(=O)OCC 62a_100000765890_200000047210 [0,0,1,0,0,0|1,0,2]=4 165 B16R0.61 CCCCC#CCCCSCCC(=O)OCC 62a_200000047210_100000765890 [0,0,1,0,0,0|1,0,2]=4 166 B16R0.61 CCCCC#CCCCSCOC(=O)CCC 62a_200000047210_100000034017 [0,0,1,0,0,0|1,0,2]=4 167 B16R0.61 CCCCC#CCCOCCCC(=O)OCC 34a_100000037610_100009991533 [0,0,1,0,0,0|1,0,2]=4 168 B16R0.61 CCCCC#CCCOCCCC(=O)OCC 7a_100000037610_100011215271 [0,0,1,0,0,0|1,0,2]=4 169 B16R0.61 CCCCC#CCOCCCCC(=O)OCC 34a_200000034558_100000750268 [0,0,1,0,0,0|1,0,2]=4 170 B16R0.61 CCCCC#CCOCCCCC(=O)OCC 7a_200000034558_100000750268 [0,0,1,0,0,0|1,0,2]=4 171 B16R0.61 CCCCC/C=C/COCCCC(=O)OCC 34a_100016258190_100009991533 [0,0,1,0,0,0|1,0,2]=4 172 B16R0.61 CCCCC/C=C/COCCCC(=O)OCC 7a_100016258190_100011215271 [0,0,1,0,0,0|1,0,2]=4 173 B16R0.61 CCCCC/C=C\CCCOCC(=O)OCC 34a_100020655193_100000188475 [0,0,1,0,0,0|1,0,2]=4 174 B16R0.61 CCCCC/C=C\CCCOCC(=O)OCC 7a_100020655193_100000188475 [0,0,1,0,0,0|1,0,2]=4 175 B16R0.61 CCCCC/C=C\CCOCCC(=O)OCC 34a_100016277358_100000765890 [0,0,1,0,0,0|1,0,2]=4 176 B16R0.61 CCCCC/C=C\CCOCCC(=O)OCC 7a_100016277358_100011206558 [0,0,1,0,0,0|1,0,2]=4 177 B16R0.61 CCCCC/C=C\CCOCOC(=O)CCC 34a_100016277358_100000034017 [0,0,1,0,0,0|1,0,2]=4 178 B16R0.61 CCCCCC#CCCOCCC(=O)OCC 34a_200000042877_100000765890 [0,0,1,0,0,0|1,0,2]=4 179 B16R0.61 CCCCCC#CCCOCCC(=O)OCC 7a_200000042877_100011206558 [0,0,1,0,0,0|1,0,2]=4 180 B16R0.61 CCCCCC#CCCOCOC(=O)CCC 34a_200000042877_100000034017 [0,0,1,0,0,0|1,0,2]=4 181 B16R0.61 CCCCCC#CCOCCCC(=O)OCC 34a_200000033628_100009991533 [0,0,1,0,0,0|1,0,2]=4 182 B16R0.61 CCCCCC#CCOCCCC(=O)OCC 7a_100012001163_100009816472 [0,0,1,0,0,0|1,0,2]=4 183 B16R0.61 CCCCCC#CCOCCCC(=O)OCC 7a_200000033628_100011215271 [0,0,1,0,0,0|1,0,2]=4 184 B16R0.61 CCCCCC#CCSCCCC(=O)OCC 62a_100009816472_100009991533 [0,0,1,0,0,0|1,0,2]=4 185 B16R0.61 CCCCCC#CCSCCCC(=O)OCC 62a_100009991533_100009816472 [0,0,1,0,0,0|1,0,2]=4 186 B16R0.61 CCCCCC/C=C/COCCC(=O)OCC 34a_200016276170_100000765890 [0,0,1,0,0,0|1,0,2]=4 187 B16R0.61 CCCCCC/C=C/COCCC(=O)OCC 7a_200016276170_100011206558 [0,0,1,0,0,0|1,0,2]=4 188 B16R0.61 CCCCCC/C=C/COCOC(=O)CCC 34a_200016276170_100000034017 [0,0,1,0,0,0|1,0,2]=4 189 B16R0.61 CCCCCCC#CCCOCC(=O)OCC 34a_200000033163_100000188475 [0,0,1,0,0,0|1,0,2]=4 190 B16R0.61 CCCCCCC#CCCOCC(=O)OCC 7a_200000033163_100000188475 [0,0,1,0,0,0|1,0,2]=4 191 B16R0.61 CCCCCCC#CCOCCC(=O)OCC 34a_200000037284_100000765890 [0,0,1,0,0,0|1,0,2]=4 192 B16R0.61 CCCCCCC#CCOCCC(=O)OCC 7a_200000037284_100011206558 [0,0,1,0,0,0|1,0,2]=4 193 B16R0.61 CCCCCCC#CCOCOC(=O)CCC 34a_200000037284_100000034017 [0,0,1,0,0,0|1,0,2]=4 194 B16R0.61 CCCCCCCC#CCOCC(=O)OCC 34a_200000061759_100000188475 [0,0,1,0,0,0|1,0,2]=4 195 B16R0.61 CCCCCCCC#CCOCC(=O)OCC 7a_200000061759_100000188475 [0,0,1,0,0,0|1,0,2]=4 196 B16R0.61 CCCCCCCCCC=NNC(=O)CCC 4a_100000189770_100000210895 [0,0,1,0,0,0|2,0,1]=4 197 B16R0.61 CCCCCCCCCCC=CC(=O)NCC 11a_100015525214_100015291182 [0,0,1,0,0,0|1,0,2]=4 198 B16R0.61 CCCCCCCCCCC=CC(=O)NCC 240690a_100015525214_100015291182 [0,0,1,0,0,0|1,0,2]=4 199 B16R0.61 CCCCCCCCCCCCC(=O)C=CBr 1458a_100016273825_100000759014 [0,0,1,0,0,0|2,0,1]=4 200 B16R0.61 CCCCCCCCCCCCC(=O)C=CCl 1458a_200016279998_100000759014 [0,0,1,0,0,0|2,0,1]=4 201 B16R0.61 CCCCCCCCCCCCC(=O)C=CI 1458a_100016256311_100000759014 [0,0,1,0,0,0|2,0,1]=4 202 B16R0.61 CCCCCCCCCCCCC(=O)CC#N 1458a_100011215791_100011214920 [0,0,1,0,0,0|2,0,1]=4 203 B16R0.61 CCCCCCCCCCCCC(=O)CC#N 1458a_100051588842_100000759014 [0,0,1,0,0,0|2,0,1]=4 204 B16R0.61 CCCCCCCCCCCCC(=O)CCC 1458a_100000211992_100000759014 [0,0,1,0,0,0|1,0,0]=2 205 B16R0.61 CCCCCCCCCCCCC(=O)CCC 1458a_100011215791_100000210303 [0,0,1,0,0,0|1,0,0]=2 206 B16R0.61 CCCCCCCCCCCCC(=O)CCF 1458a_100011215791_100011217306 [0,0,1,0,0,0|2,0,0]=3 207 B16R0.61 CCCCCCCCCCCCC(=O)CCO 1458a_100011215791_100000211926 [0,0,1,0,0,0|2,0,0]=3 208 B16R0.61 CCCCCCCCCCCCC(=O)CCO 1458a_100011216618_100000759014 [0,0,1,0,0,0|2,0,0]=3 209 B16R0.61 CCCCCCCCCCCCC(=O)COC 1458a_100000210968_100000759014 [0,0,1,0,0,0|2,0,0]=3 210 B16R0.61 CCCCCCCCCCCCC(=O)CSC 1458a_100000184570_100000759014 [0,0,1,0,0,0|2,0,0]=3 211 B16R0.61 CCCCCCCCCCCCC(=O)NCC 11a_100015525214_100011215791 [0,0,1,0,0,0|1,0,0]=2 212 B16R0.61 CCCCCCCCCCCCC(=O)NCC 240690a_100015525214_100011215791 [0,0,1,0,0,0|1,0,0]=2 213 B16R0.61 CCCCCCCCCCCCC(=O)NNC 22a_100016993582_100011215791 [0,0,1,0,0,0|2,0,0]=3 214 B16R0.61 CCCCCCCCCCCCC(C)NCC 2230a_100015525214_200011217028 [0,0,1,0,0,0|2,0,1]=4 215 B16R0.61 CCCCCCCCCCCCC(C)NCC 270004a_100015525214_100011219199 [0,0,1,0,0,0|2,0,1]=4 216 B16R0.61 CCCCCCCCCCCCC(C)OCC 34a_100121572206_200011217028 [0,0,1,0,0,0|1,0,1]=3 217 B16R0.61 CCCCCCCCCCCCC(C)OCC 34a_200011215752_100000210202 [0,0,1,0,0,0|1,0,1]=3 218 B16R0.61 CCCCCCCCCCCCC(C)OCC 7a_200011215752_100000210202 [0,0,1,0,0,0|1,0,1]=3 219 B16R0.61 CCCCCCCCCCCCC(C)OCF 34a_200011215752_100015361967 [0,0,1,0,0,0|2,0,1]=4 220 B16R0.61 CCCCCCCCCCCCC(C)OCF 7a_200011215752_100015361967 [0,0,1,0,0,0|2,0,1]=4 221 B16R0.61 CCCCCCCCCCCCN(C)CCC 2230a_100000227908_100000210303 [0,0,1,0,0,0|3,0,0]=4 222 B16R0.61 CCCCCCCCCCCCN(C)CCC 2230a_100000747261_100011215052 [0,0,1,0,0,0|3,0,0]=4 223 B16R0.61 CCCCCCCCCCCCN(C)CCC 269982a_100000227908_100000210303 [0,0,1,0,0,0|3,0,0]=4 224 B16R0.61 CCCCCCCCCCCCN(C)CCC 269982a_100000747261_100000759014 [0,0,1,0,0,0|3,0,0]=4 225 B16R0.61 CCCCCCCCCCCCN(C)CCC 270004a_100000747261_100011218549 [0,0,1,0,0,0|3,0,0]=4 226 B16R0.61 CCCCCCCCCCCNC(=O)CC#N 1626a_200011215754_100051588842 [0,0,1,0,0,0|2,0,1]=4 227 B16R0.61 CCCCCCCCCCCNC(=O)CC#N 240690a_200011215754_100051588842 [0,0,1,0,0,0|2,0,1]=4 228 B16R0.61 CCCCCCCCCCCNC(=O)CCC 11a_200011215754_100000211992 [0,0,1,0,0,0|1,0,0]=2 229 B16R0.61 CCCCCCCCCCCNC(=O)CCC 1626a_200011215754_100000211992 [0,0,1,0,0,0|1,0,0]=2 230 B16R0.61 CCCCCCCCCCCNC(=O)CCC 240690a_200011215754_100000211992 [0,0,1,0,0,0|1,0,0]=2 231 B16R0.61 CCCCCCCCCCCNC(=O)CCC 527a_200011215754_100000211992 [0,0,1,0,0,0|1,0,0]=2 232 B16R0.61 CCCCCCCCCCCNC(=O)CCO 240690a_200011215754_100011216618 [0,0,1,0,0,0|2,0,0]=3 233 B16R0.61 CCCCCCCCCCCNC(=O)COC 11a_200011215754_100000210968 [0,0,1,0,0,0|2,0,0]=3 234 B16R0.61 CCCCCCCCCCCNC(=O)COC 1626a_200011215754_100000210968 [0,0,1,0,0,0|2,0,0]=3 235 B16R0.61 CCCCCCCCCCCNC(=O)COC 240690a_200011215754_100000210968 [0,0,1,0,0,0|2,0,0]=3 236 B16R0.61 CCCCCCCCCCCNC(=O)COC 527a_200011215754_100000210968 [0,0,1,0,0,0|2,0,0]=3 237 B16R0.61 CCCCCCCCCCCNC(=O)CSC 11a_200011215754_100000184570 [0,0,1,0,0,0|2,0,0]=3 238 B16R0.61 CCCCCCCCCCCNC(=O)CSC 1626a_200011215754_100000184570 [0,0,1,0,0,0|2,0,0]=3 239 B16R0.61 CCCCCCCCCCCNC(=O)CSC 240690a_200011215754_100000184570 [0,0,1,0,0,0|2,0,0]=3 240 B16R0.61 CCCCCCCCCCCNC(=O)CSC 527a_200011215754_100000184570 [0,0,1,0,0,0|2,0,0]=3 241 B16R0.61 CCCCCCCCCCCNC(=O)NCC 2708a_100015525214_200011215754 [0,0,1,0,0,0|2,0,0]=3 242 B16R0.61 CCCCCCCCCCCNC(=O)NCC 2708a_200011215754_100015525214 [0,0,1,0,0,0|2,0,0]=3 243 B16R0.61 CCCCCCCCCCCNC(=O)NCC 273464a_100015525214_200011215754 [0,0,1,0,0,0|2,0,0]=3 244 B16R0.61 CCCCCCCCCCCNC(=O)NCC 273464a_200011215754_100015525214 [0,0,1,0,0,0|2,0,0]=3 245 B16R0.61 CCCCCCCCCCCNC(=O)NCC 512a_100015525214_200011215754 [0,0,1,0,0,0|2,0,0]=3 246 B16R0.61 CCCCCCCCCCCNC(=O)NCC 512a_200011215754_100015525214 [0,0,1,0,0,0|2,0,0]=3 247 B16R0.61 CCCCCCCCCCCNC(=O)NNC 273464a_200011215754_100016993582 [0,0,1,0,0,0|3,0,0]=4 248 B16R0.61 CCCCCCCCCCCNC(=O)NNC 512a_100016993582_200011215754 [0,0,1,0,0,0|3,0,0]=4 249 B16R0.61 CCCCCCCCCCCNC(=O)NNC 512a_200011215754_100016993582 [0,0,1,0,0,0|3,0,0]=4 250 B16R0.61 CCCCCCCCCCCNC(C)CCC 2230a_100000741246_100011215454 [0,0,1,0,0,0|2,0,1]=4 251 B16R0.61 CCCCCCCCCCCNC(C)CCC 2230a_200011215754_100000766640 [0,0,1,0,0,0|2,0,1]=4 252 B16R0.61 CCCCCCCCCCCNC(C)CCC 270004a_200011215754_100000211909 [0,0,1,0,0,0|2,0,1]=4 253 B16R0.61 CCCCCCCCCCCNC(C)CCC 34a_200011215754_100000766640 [0,0,1,0,0,0|2,0,1]=4 254 B16R0.61 CCCCCCCCCCCOC(C)CCBr 34a_100012276601_100011215454 [0,0,1,0,0,0|2,0,1]=4 255 B16R0.61 CCCCCCCCCCCOC(C)CCC 34a_100000210809_100000766640 [0,0,1,0,0,0|1,0,1]=3 256 B16R0.61 CCCCCCCCCCCOC(C)CCC 34a_100000764384_100011215454 [0,0,1,0,0,0|1,0,1]=3 257 B16R0.61 CCCCCCCCCCCOC(C)CCC 7a_100000210809_100000766640 [0,0,1,0,0,0|1,0,1]=3 258 B16R0.61 CCCCCCCCCCCOC(C)CCC 7a_100000764384_100011215454 [0,0,1,0,0,0|1,0,1]=3 259 B16R0.61 CCCCCCCCCCCOC(C)CCO 34a_100000210809_100009893172 [0,0,1,0,0,0|2,0,1]=4 260 B16R0.61 CCCCCCCCCCCOC(C)CCO 7a_100000210809_100009893172 [0,0,1,0,0,0|2,0,1]=4 261 B16R0.61 CCCCCCCCCCCOC(C)COC 34a_100000210809_100000765312 [0,0,1,0,0,0|2,0,1]=4 262 B16R0.61 CCCCCCCCCCCOC(C)COC 7a_100000210809_100000765312 [0,0,1,0,0,0|2,0,1]=4 263 B16R0.61 CCCCCCCCCCCO[C@H](C)COC 34a_100011934205_100011215454 [0,0,1,0,0,0|2,0,1]=4 264 B16R0.61 CCCCCCCCCCNCC(=O)CCC 2230a_100000684558_100000747444 [0,0,1,0,0,0|2,0,0]=3 265 B16R0.61 CCCCCCCCCCNCC(=O)NCC 2230a_100000684558_100000183381 [0,0,1,0,0,0|2,0,0]=3 266 B16R0.61 CCCCCCCCCCNCC(=O)NCC 2230a_100016988866_100000210320 [0,0,1,0,0,0|2,0,0]=3 267 B16R0.61 CCCCCCCCCCNCC(=O)NCC 34a_100000684558_100000183381 [0,0,1,0,0,0|2,0,0]=3 268 B16R0.61 CCCCCCCCCCNCC(=O)NCO 2230a_100000684558_100000185155 [0,0,1,0,0,0|3,0,0]=4 269 B16R0.61 CCCCCCCCCCNCC(=O)NCO 34a_100000684558_100000185155 [0,0,1,0,0,0|3,0,0]=4 270 B16R0.61 CCCCCCCCCCNCC(=O)OCC 2230a_100000684558_100000188475 [0,0,1,0,0,0|1,0,0]=2 271 B16R0.61 CCCCCCCCCCNCC(=O)OCC 34a_100000684558_100000188475 [0,0,1,0,0,0|1,0,0]=2 272 B16R0.61 CCCCCCCCCCOCC(=O)CCC 7a_100000210711_100000747444 [0,0,1,0,0,0|2,0,0]=3 273 B16R0.61 CCCCCCCCCCOCC(=O)NCC 34a_100000210711_100000183381 [0,0,1,0,0,0|2,0,0]=3 274 B16R0.61 CCCCCCCCCCOCC(=O)NCC 7a_100000210711_100000183381 [0,0,1,0,0,0|2,0,0]=3 275 B16R0.61 CCCCCCCCCCOCC(=O)NCO 34a_100000210711_100000185155 [0,0,1,0,0,0|3,0,0]=4 276 B16R0.61 CCCCCCCCCCOCC(=O)NCO 7a_100000210711_100000185155 [0,0,1,0,0,0|3,0,0]=4 277 B16R0.61 CCCCCCCCCCOCC(=O)OCC 34a_100000210711_100000188475 [0,0,1,0,0,0|1,0,0]=2 278 B16R0.61 CCCCCCCCCCOCC(=O)OCC 7a_100000210711_100000188475 [0,0,1,0,0,0|1,0,0]=2 279 B16R0.61 CCCCCCCCCCSCC(=O)CCC 62a_100000747444_100000210320 [0,0,1,0,0,0|2,0,0]=3 280 B16R0.61 CCCCCCCCCCSCC(=O)NCC 62a_100000183381_100000210320 [0,0,1,0,0,0|2,0,0]=3 281 B16R0.61 CCCCCCCCCCSCC(=O)NCO 62a_100000185155_100000210320 [0,0,1,0,0,0|3,0,0]=4 282 B16R0.61 CCCCCCCCCCSCC(=O)OCC 62a_100000188475_100000210320 [0,0,1,0,0,0|1,0,0]=2 283 B16R0.61 CCCCCCCCCNCCC(=O)NCC 2230a_100000212291_100000737597 [0,0,1,0,0,0|2,0,0]=3 284 B16R0.61 CCCCCCCCCNCCC(=O)NCC 34a_100025743525_100011214924 [0,0,1,0,0,0|2,0,0]=3 285 B16R0.61 CCCCCCCCCNCCC(=O)OCC 2230a_100000212291_100011206558 [0,0,1,0,0,0|1,0,0]=2 286 B16R0.61 CCCCCCCCCNCCC(=O)OCC 34a_100000212291_100000765890 [0,0,1,0,0,0|1,0,0]=2 287 B16R0.61 CCCCCCCCCNCOC(=O)CCC 2230a_100000212291_100000034017 [0,0,1,0,0,0|1,0,0]=2 288 B16R0.61 CCCCCCCCCNCOC(=O)CCC 34a_100000212291_100000034017 [0,0,1,0,0,0|1,0,0]=2 289 B16R0.61 CCCCCCCCCOCCC(=O)NCC 7a_100000210712_100000737597 [0,0,1,0,0,0|2,0,0]=3 290 B16R0.61 CCCCCCCCCOCCC(=O)OCC 34a_100000210712_100000765890 [0,0,1,0,0,0|1,0,0]=2 291 B16R0.61 CCCCCCCCCOCCC(=O)OCC 7a_100000210712_100011206558 [0,0,1,0,0,0|1,0,0]=2 292 B16R0.61 CCCCCCCCCOCOC(=O)CCC 34a_100000210712_100000034017 [0,0,1,0,0,0|1,0,0]=2 293 B16R0.61 CCCCCCCCCSCCC(=O)NCC 62a_100000737597_100000210670 [0,0,1,0,0,0|2,0,0]=3 294 B16R0.61 CCCCCCCCCSCCC(=O)OCC 62a_100000765890_100000210670 [0,0,1,0,0,0|1,0,0]=2 295 B16R0.61 CCCCCCCCNC/C=C/C(=O)OCC 2230a_100000229939_100016267167 [0,0,1,0,0,0|1,0,2]=4 296 B16R0.61 CCCCCCCCNC/C=C/C(=O)OCC 34a_100000229939_100016267167 [0,0,1,0,0,0|1,0,2]=4 297 B16R0.61 CCCCCCCCNCCCC(=O)OCC 2230a_100000229939_100009991533 [0,0,1,0,0,0|1,0,0]=2 298 B16R0.61 CCCCCCCCNCCCC(=O)OCC 34a_100000229939_100009991533 [0,0,1,0,0,0|1,0,0]=2 299 B16R0.61 CCCCCCCCOC/C=C/C(=O)OCC 34a_100000210232_100016267167 [0,0,1,0,0,0|1,0,2]=4 300 B16R0.61 CCCCCCCCOC/C=C/C(=O)OCC 7a_100000210232_100016267167 [0,0,1,0,0,0|1,0,2]=4 301 B16R0.61 CCCCCCCCOCCCC(=O)OCC 34a_100000210232_100009991533 [0,0,1,0,0,0|1,0,0]=2 302 B16R0.61 CCCCCCCCOCCCC(=O)OCC 7a_100000210232_100011215271 [0,0,1,0,0,0|1,0,0]=2 303 B16R0.61 CCCCCCCCOCCCC(=O)OCC 7a_100012001163_100000210759 [0,0,1,0,0,0|1,0,0]=2 304 B16R0.61 CCCCCCCCOCCNC(=O)OCC 34a_100000158857_100000210759 [0,0,1,0,0,0|2,0,0]=3 305 B16R0.61 CCCCCCCCOCCNC(=O)OCC 7a_100000210232_200011445536 [0,0,1,0,0,0|2,0,0]=3 306 B16R0.61 CCCCCCCCSC/C=C/C(=O)OCC 62a_100000210759_100016267167 [0,0,1,0,0,0|1,0,2]=4 307 B16R0.61 CCCCCCCCSC/C=C/C(=O)OCC 62a_100016267167_100000210317 [0,0,1,0,0,0|1,0,2]=4 308 B16R0.61 CCCCCCCCSCCCC(=O)OCC 62a_100000210759_100009991533 [0,0,1,0,0,0|1,0,0]=2 309 B16R0.61 CCCCCCCCSCCCC(=O)OCC 62a_100009991533_100000210317 [0,0,1,0,0,0|1,0,0]=2 310 B16R0.61 CCCCCCCCSCCNC(=O)OCC 62a_100000210759_200011445536 [0,0,1,0,0,0|2,0,0]=3 311 B16R0.61 CCCCCCCNCCCCC(=O)OCC 2230a_100000229938_100000750268 [0,0,1,0,0,0|1,0,0]=2 312 B16R0.61 CCCCCCCNCCOCC(=O)OCC 2230a_100000229938_100000088970 [0,0,1,0,0,0|2,0,0]=3 313 B16R0.61 CCCCCCCOCCCCC(=O)OCC 34a_100000210272_100000750268 [0,0,1,0,0,0|1,0,0]=2 314 B16R0.61 CCCCCCCOCCCCC(=O)OCC 7a_100000210272_100000750268 [0,0,1,0,0,0|1,0,0]=2 315 B16R0.61 CCCCCCCOCCOCC(=O)OCC 34a_100000210272_100000088970 [0,0,1,0,0,0|2,0,0]=3 316 B16R0.61 CCCCCCCOCCOCC(=O)OCC 7a_100000210272_100000088970 [0,0,1,0,0,0|2,0,0]=3 317 B16R0.61 CCCCCCCOCCSCC(=O)OCC 7a_200000230590_100000210614 [0,0,1,0,0,0|2,0,0]=3 318 B16R0.61 CCCCCCCSCCCCC(=O)OCC 62a_100000210614_100000750268 [0,0,1,0,0,0|1,0,0]=2 319 B16R0.61 CCCCCCCSCCCCC(=O)OCC 62a_100000750268_100000210316 [0,0,1,0,0,0|1,0,0]=2 320 B16R0.61 CCCCCCCSCCOCC(=O)OCC 62a_100000088970_100000210316 [0,0,1,0,0,0|2,0,0]=3 321 B16R0.61 CCCCCCCSCCOCC(=O)OCC 62a_100000210614_100000088970 [0,0,1,0,0,0|2,0,0]=3 322 B16R0.61 CCCCCCNCCCCCC(=O)OCC 2230a_100000210581_100000755133 [0,0,1,0,0,0|1,0,0]=2 323 B16R0.61 CCCCCCNCCCOCC(=O)OCC 2230a_100000210581_100009893628 [0,0,1,0,0,0|2,0,0]=3 324 B16R0.61 CCCCCCOCCCCCC(=O)OCC 34a_100000210259_100000755133 [0,0,1,0,0,0|1,0,0]=2 325 B16R0.61 CCCCCCOCCCCCC(=O)OCC 7a_100000210259_100000755133 [0,0,1,0,0,0|1,0,0]=2 326 B16R0.61 CCCCCCOCCCCCC(=O)OCC 7a_100011214988_100000210314 [0,0,1,0,0,0|1,0,0]=2 327 B16R0.61 CCCCCCOCCCOCC(=O)OCC 34a_100000210259_100009893628 [0,0,1,0,0,0|2,0,0]=3 328 B16R0.61 CCCCCCOCCCOCC(=O)OCC 7a_100000210259_100009893628 [0,0,1,0,0,0|2,0,0]=3 329 B16R0.61 CCCCCCOCCOCCC(=O)NCC 7a_100000691444_100000737597 [0,0,1,0,0,0|3,0,0]=4 330 B16R0.61 CCCCCCOCCOCCC(=O)OCC 34a_100000691444_100000765890 [0,0,1,0,0,0|2,0,0]=3 331 B16R0.61 CCCCCCOCCOCCC(=O)OCC 7a_100000691444_100011206558 [0,0,1,0,0,0|2,0,0]=3 332 B16R0.61 CCCCCCOCCOCOC(=O)CCC 34a_100000691444_100000034017 [0,0,1,0,0,0|2,0,0]=3 333 B16R0.61 CCCCCCSCCCCCC(=O)OCC 62a_100000210314_100000755133 [0,0,1,0,0,0|1,0,0]=2 334 B16R0.61 CCCCCCSCCCCCC(=O)OCC 62a_100000755133_100000210757 [0,0,1,0,0,0|1,0,0]=2 335 B16R0.61 CCCCCCSCCCOCC(=O)OCC 62a_100000210314_100009893628 [0,0,1,0,0,0|2,0,0]=3 336 B16R0.61 CCCCCCSCCCOCC(=O)OCC 62a_100009893628_100000210757 [0,0,1,0,0,0|2,0,0]=3 337 B16R0.61 CCCCCNCCCCCCC(=O)OCC 2230a_100000209983_100009814379 [0,0,1,0,0,0|1,0,0]=2 338 B16R0.61 CCCCCNCCOCCCC(=O)OCC 34a_100000224656_100009991533 [0,0,1,0,0,0|2,0,0]=3 339 B16R0.61 CCCCCNN=CCCCCC(=O)OCC 4a_100000694160_100012182868 [0,0,1,0,0,0|2,0,1]=4 340 B16R0.61 CCCCCOCCCCCCC(=O)OCC 34a_100000210253_100009814379 [0,0,1,0,0,0|1,0,0]=2 341 B16R0.61 CCCCCOCCCCCCC(=O)OCC 7a_100000210253_100009814379 [0,0,1,0,0,0|1,0,0]=2 342 B16R0.61 CCCCCOCCOCCCC(=O)OCC 34a_100011215259_100009991533 [0,0,1,0,0,0|2,0,0]=3 343 B16R0.61 CCCCCOCCOCCCC(=O)OCC 7a_100011215259_100011215271 [0,0,1,0,0,0|2,0,0]=3 344 B16R0.61 CCCCCOCCOCCNC(=O)OCC 7a_100011215259_200011445536 [0,0,1,0,0,0|3,0,0]=4 345 B16R0.61 CCCCCSCCCCCCC(=O)OCC 62a_100000210326_100009814379 [0,0,1,0,0,0|1,0,0]=2 346 B16R0.61 CCCCNCCCCCCCC(=O)OCC 2230a_100000102301_100009991516 [0,0,1,0,0,0|1,0,0]=2 347 B16R0.61 CCCCNCCCCCCCC(=O)OCC 7a_106832991798_100009991516 [0,0,1,0,0,0|1,0,0]=2 348 B16R0.61 CCCCNCCCCOCCC(=O)OCC 34a_200011216965_100000765890 [0,0,1,0,0,0|2,0,0]=3 349 B16R0.61 CCCCNCCCCOCOC(=O)CCC 34a_200011216965_100000034017 [0,0,1,0,0,0|2,0,0]=3 350 B16R0.61 CCCCNN=CCCCCCC(=O)OCC 4a_100025702795_100000085164 [0,0,1,0,0,0|2,0,1]=4 351 B16R0.61 CCCCOCCCCCCCC(=O)OCC 34a_100000210227_100009991516 [0,0,1,0,0,0|1,0,0]=2 352 B16R0.61 CCCCOCCCCCCCC(=O)OCC 7a_100000210227_100009991516 [0,0,1,0,0,0|1,0,0]=2 353 B16R0.61 CCCCOCCCCOCCC(=O)NCC 7a_200000760531_100000737597 [0,0,1,0,0,0|3,0,0]=4 354 B16R0.61 CCCCOCCCCOCCC(=O)OCC 34a_200000760531_100000765890 [0,0,1,0,0,0|2,0,0]=3 355 B16R0.61 CCCCOCCCCOCCC(=O)OCC 7a_200000760531_100011206558 [0,0,1,0,0,0|2,0,0]=3 356 B16R0.61 CCCCOCCCCOCOC(=O)CCC 34a_200000760531_100000034017 [0,0,1,0,0,0|2,0,0]=3 357 B16R0.61 CCCCOCCCNCCCC(=O)OCC 2230a_200000211371_100009991533 [0,0,1,0,0,0|2,0,0]=3 358 B16R0.61 CCCCOCCCNCCCC(=O)OCC 34a_200000211371_100009991533 [0,0,1,0,0,0|2,0,0]=3 359 B16R0.61 CCCCOCCCOCCCC(=O)OCC 34a_200011215613_100009991533 [0,0,1,0,0,0|2,0,0]=3 360 B16R0.61 CCCCOCCCOCCCC(=O)OCC 7a_200011215613_100011215271 [0,0,1,0,0,0|2,0,0]=3 361 B16R0.61 CCCCOCCCOCCNC(=O)OCC 7a_200011215613_200011445536 [0,0,1,0,0,0|3,0,0]=4 362 B16R0.61 CCCCOCCOCCCCC(=O)OCC 34a_100000210238_100000750268 [0,0,1,0,0,0|2,0,0]=3 363 B16R0.61 CCCCOCCOCCCCC(=O)OCC 7a_100000210238_100000750268 [0,0,1,0,0,0|2,0,0]=3 364 B16R0.61 CCCCOCCOCCOCC(=O)OCC 34a_100000210238_100000088970 [0,0,1,0,0,0|3,0,0]=4 365 B16R0.61 CCCCOCCOCCOCC(=O)OCC 34a_100011215186_100000188475 [0,0,1,0,0,0|3,0,0]=4 366 B16R0.61 CCCCOCCOCCOCC(=O)OCC 7a_100000210238_100000088970 [0,0,1,0,0,0|3,0,0]=4 367 B16R0.61 CCCCOCCOCCOCC(=O)OCC 7a_100011215186_100000188475 [0,0,1,0,0,0|3,0,0]=4 368 B16R0.61 CCCCOCCOCCSCC(=O)OCC 7a_200000230590_100000743108 [0,0,1,0,0,0|3,0,0]=4 369 B16R0.61 CCCCOCCSCCCCC(=O)OCC 62a_100000743108_100000750268 [0,0,1,0,0,0|2,0,0]=3 370 B16R0.61 CCCCOCCSCCCCC(=O)OCC 62a_100000750268_100000743108 [0,0,1,0,0,0|2,0,0]=3 371 B16R0.61 CCCCOCCSCCOCC(=O)OCC 62a_100000088970_100000743108 [0,0,1,0,0,0|3,0,0]=4 372 B16R0.61 CCCCOCCSCCOCC(=O)OCC 62a_100000743108_100000088970 [0,0,1,0,0,0|3,0,0]=4 373 B16R0.61 CCCCOCSCCCCCC(=O)OCC 62a_100000755133_100011995733 [0,0,1,0,0,0|2,0,0]=3 374 B16R0.61 CCCCOCSCCCCCC(=O)OCC 62a_100011995733_100000755133 [0,0,1,0,0,0|2,0,0]=3 375 B16R0.61 CCCCOCSCCCOCC(=O)OCC 62a_100009893628_100011995733 [0,0,1,0,0,0|3,0,0]=4 376 B16R0.61 CCCCOCSCCCOCC(=O)OCC 62a_100011995733_100009893628 [0,0,1,0,0,0|3,0,0]=4 377 B16R0.61 CCCCSCCCCCCCC(=O)OCC 62a_100000210211_100009991516 [0,0,1,0,0,0|1,0,0]=2 378 B16R0.61 CCCCSCCNCCCCC(=O)OCC 2230a_100025743550_100000750268 [0,0,1,0,0,0|2,0,0]=3 379 B16R0.61 CCCCSCCNCCOCC(=O)OCC 2230a_100025743550_100000088970 [0,0,1,0,0,0|3,0,0]=4 380 B16R0.61 CCCCSCCOCCCCC(=O)OCC 34a_200000230436_100000750268 [0,0,1,0,0,0|2,0,0]=3 381 B16R0.61 CCCCSCCOCCCCC(=O)OCC 7a_200000230436_100000750268 [0,0,1,0,0,0|2,0,0]=3 382 B16R0.61 CCCCSCCOCCOCC(=O)OCC 34a_200000230436_100000088970 [0,0,1,0,0,0|3,0,0]=4 383 B16R0.61 CCCCSCCOCCOCC(=O)OCC 7a_200000230436_100000088970 [0,0,1,0,0,0|3,0,0]=4 384 B16R0.61 CCCOCCCCCCCCC(=O)OCC 34a_100000210258_100010175975 [0,0,1,0,0,0|1,0,0]=2 385 B16R0.61 CCCOCCCNCCCCC(=O)OCC 2230a_100011217757_100000750268 [0,0,1,0,0,0|2,0,0]=3 386 B16R0.61 CCCOCCCNCCCCC(=O)OCC 34a_100011217757_100000750268 [0,0,1,0,0,0|2,0,0]=3 387 B16R0.61 CCCOCCCNCCOCC(=O)OCC 2230a_100011217757_100000088970 [0,0,1,0,0,0|3,0,0]=4 388 B16R0.61 CCCOCCCNCCOCC(=O)OCC 34a_100011217757_100000088970 [0,0,1,0,0,0|3,0,0]=4 389 B16R0.61 CCCOCCNCCCCCC(=O)OCC 2230a_100161115042_100000755133 [0,0,1,0,0,0|2,0,0]=3 390 B16R0.61 CCCOCCNCCCCCC(=O)OCC 34a_100161115042_100000755133 [0,0,1,0,0,0|2,0,0]=3 391 B16R0.61 CCCOCCNCCCOCC(=O)OCC 2230a_100161115042_100009893628 [0,0,1,0,0,0|3,0,0]=4 392 B16R0.61 CCCOCCNCCCOCC(=O)OCC 34a_100161115042_100009893628 [0,0,1,0,0,0|3,0,0]=4 393 B16R0.61 CCCOCCOCCCCCC(=O)OCC 34a_100000752267_100000755133 [0,0,1,0,0,0|2,0,0]=3 394 B16R0.61 CCCOCCOCCCCCC(=O)OCC 7a_100000752267_100000755133 [0,0,1,0,0,0|2,0,0]=3 395 B16R0.61 CCCOCCOCCCCCC(=O)OCC 7a_100011214988_100011215938 [0,0,1,0,0,0|2,0,0]=3 396 B16R0.61 CCCOCCOCCCOCC(=O)OCC 34a_100000752267_100009893628 [0,0,1,0,0,0|3,0,0]=4 397 B16R0.61 CCCOCCOCCCOCC(=O)OCC 7a_100000752267_100009893628 [0,0,1,0,0,0|3,0,0]=4 398 B16R0.61 CCCOCCOCCNCCC(=O)OCC 2230a_200011904461_100011206558 [0,0,1,0,0,0|3,0,0]=4 399 B16R0.61 CCCOCCOCCNCCC(=O)OCC 34a_200011904461_100000765890 [0,0,1,0,0,0|3,0,0]=4 400 B16R0.61 CCCOCCOCCNCOC(=O)CCC 2230a_200011904461_100000034017 [0,0,1,0,0,0|3,0,0]=4 401 B16R0.61 CCCOCCOCCNCOC(=O)CCC 34a_200011904461_100000034017 [0,0,1,0,0,0|3,0,0]=4 402 B16R0.61 CCCOCCOCCOCCC(=O)OCC 34a_100010737887_100000210303 [0,0,1,0,0,0|3,0,0]=4 403 B16R0.61 CCCOCCOCCOCCC(=O)OCC 7a_100010737887_100000210303 [0,0,1,0,0,0|3,0,0]=4 404 B16R0.61 CCCOCCSCCCCCC(=O)OCC 62a_100000755133_100011215938 [0,0,1,0,0,0|2,0,0]=3 405 B16R0.61 CCCOCCSCCCCCC(=O)OCC 62a_100011215938_100000755133 [0,0,1,0,0,0|2,0,0]=3 406 B16R0.61 CCCOCCSCCCOCC(=O)OCC 62a_100009893628_100011215938 [0,0,1,0,0,0|3,0,0]=4 407 B16R0.61 CCCOCCSCCCOCC(=O)OCC 62a_100011215938_100009893628 [0,0,1,0,0,0|3,0,0]=4 408 B16R0.61 CCCSCCCCCCCCC(=O)OCC 62a_100000210303_100010175975 [0,0,1,0,0,0|1,0,0]=2 409 B16R0.61 CCCSCCNCCCCCC(=O)OCC 2230a_100020603323_100000755133 [0,0,1,0,0,0|2,0,0]=3 410 B16R0.61 CCCSCCNCCCOCC(=O)OCC 2230a_100020603323_100009893628 [0,0,1,0,0,0|3,0,0]=4 411 B16R0.61 CCCSCCOCCCCCC(=O)OCC 34a_200000230433_100000755133 [0,0,1,0,0,0|2,0,0]=3 412 B16R0.61 CCCSCCOCCCCCC(=O)OCC 7a_200000230433_100000755133 [0,0,1,0,0,0|2,0,0]=3 413 B16R0.61 CCCSCCOCCCOCC(=O)OCC 34a_200000230433_100009893628 [0,0,1,0,0,0|3,0,0]=4 414 B16R0.61 CCCSCCOCCCOCC(=O)OCC 7a_200000230433_100009893628 [0,0,1,0,0,0|3,0,0]=4 415 B16R0.61 CCNC(=O)CCCCCCCCCCCO 240690a_100015525214_100000037981 [0,0,1,0,0,0|2,0,0]=3 416 B16R0.61 CCNC(=O)CCNCCCCCCCCO 2230a_102515433106_100000737597 [0,0,1,0,0,0|3,0,0]=4 417 B16R0.61 CCNC(=O)CCNCCCCCCCCO 34a_100025743525_100000033203 [0,0,1,0,0,0|3,0,0]=4 418 B16R0.61 CCNC(=O)CCOCCCCCCCCBr 7a_100009813846_100000737597 [0,0,1,0,0,0|3,0,0]=4 419 B16R0.61 CCNC(=O)CCOCCCCCCCCCl 7a_100000033203_100000737597 [0,0,1,0,0,0|3,0,0]=4 420 B16R0.61 CCNC(=O)CCSCCCCCCCCO 62a_100000033203_100000737597 [0,0,1,0,0,0|3,0,0]=4 421 B16R0.61 CCNC(=O)CCSCCCCCCCCO 62a_100000737597_100000033203 [0,0,1,0,0,0|3,0,0]=4 422 B16R0.61 CCNC(=O)CNCCCCCCCCCO 2230a_100000078944_100000183381 [0,0,1,0,0,0|3,0,0]=4 423 B16R0.61 CCNC(=O)CNCCCCCCCCCO 2230a_100016988866_100009813782 [0,0,1,0,0,0|3,0,0]=4 424 B16R0.61 CCNC(=O)CNCCCCCCCCCO 34a_100000078944_100000183381 [0,0,1,0,0,0|3,0,0]=4 425 B16R0.61 CCNC(=O)COCCCCCCCCCBr 34a_100009813782_100000183381 [0,0,1,0,0,0|3,0,0]=4 426 B16R0.61 CCNC(=O)COCCCCCCCCCBr 7a_100009813782_100000183381 [0,0,1,0,0,0|3,0,0]=4 427 B16R0.61 CCNC(=O)COCCCCCCCCCCl 34a_100009868337_100000183381 [0,0,1,0,0,0|3,0,0]=4 428 B16R0.61 CCNC(=O)COCCCCCCCCCCl 7a_100009868337_100000183381 [0,0,1,0,0,0|3,0,0]=4 429 B16R0.61 CCNC(=O)COCCCCCCCCCN 34a_100000078944_100000183381 [0,0,1,0,0,0|3,0,0]=4 430 B16R0.61 CCNC(=O)CSCCCCCCCCCO 62a_100000183381_100009813782 [0,0,1,0,0,0|3,0,0]=4 431 B16R0.61 CCNC(=O)CSCCCCCCCCCO 62a_100009813782_100000183381 [0,0,1,0,0,0|3,0,0]=4 432 B16R0.61 CCNC(=O)NCCCCCCCCCCO 2708a_100000066964_100015525214 [0,0,1,0,0,0|3,0,0]=4 433 B16R0.61 CCNC(=O)NCCCCCCCCCCO 2708a_100015525214_100000066964 [0,0,1,0,0,0|3,0,0]=4 434 B16R0.61 CCNC(=O)NCCCCCCCCCCO 273464a_100000066964_100015525214 [0,0,1,0,0,0|3,0,0]=4 435 B16R0.61 CCNC(=O)NCCCCCCCCCCO 273464a_100015525214_100000066964 [0,0,1,0,0,0|3,0,0]=4 436 B16R0.61 CCNC(=O)NCCCCCCCCCCO 512a_100000066964_100015525214 [0,0,1,0,0,0|3,0,0]=4 437 B16R0.61 CCNC(=O)NCCCCCCCCCCO 512a_100015525214_100000066964 [0,0,1,0,0,0|3,0,0]=4 438 B16R0.61 CCNCCCCCCCCCC(=O)OCC 2230a_100015525214_100009828014 [0,0,1,0,0,0|1,0,0]=2 439 B16R0.61 CCNN=CCCCCCCCC(=O)OCC 4a_100000756455_100102623289 [0,0,1,0,0,0|2,0,1]=4 440 B16R0.61 CCOC(=O)CCCCCCCCCCNC 2230a_106832991635_100009827693 [0,0,1,0,0,0|1,0,0]=2 441 B16R0.61 CCOC(=O)CCCCCCCCCCNC 34a_100102657272_100009827693 [0,0,1,0,0,0|1,0,0]=2 442 B16R0.61 CCOC(=O)CCCCCCCCCCNC 7a_106832991635_100009827693 [0,0,1,0,0,0|1,0,0]=2 443 B16R0.61 CCOC(=O)CCCCCCCCCCOC 34a_100138415774_100009827693 [0,0,1,0,0,0|1,0,0]=2 444 B16R0.61 CCOC(=O)CCCCCCCCCCSC 62a_200000210301_100009827693 [0,0,1,0,0,0|1,0,0]=2 445 B16R0.61 CCOC(=O)CCCCCCCCCCS[13CH3] 62a_200025704644_100009827693 [0,0,1,0,0,0|1,0,0]=2 446 B16R0.61 CCOC(=O)CCCCCCCCCSCC 62a_100000210202_100009828014 [0,0,1,0,0,0|1,0,0]=2 447 B16R0.61 CCOC(=O)CCCCCCCCCSCF 62a_100015361967_100009828014 [0,0,1,0,0,0|2,0,0]=3 448 B16R0.61 CCOC(=O)CCCCCCCCNCCF 34a_100000724931_100010175975 [0,0,1,0,0,0|2,0,0]=3 449 B16R0.61 CCOC(=O)CCCCCCCCNCCO 2230a_100016997473_100010175975 [0,0,1,0,0,0|2,0,0]=3 450 B16R0.61 CCOC(=O)CCCCCCCCNCCO 34a_100016990907_100010175975 [0,0,1,0,0,0|2,0,0]=3 451 B16R0.61 CCOC(=O)CCCCCCCCOCCBr 34a_100000211926_100010175975 [0,0,1,0,0,0|2,0,0]=3 452 B16R0.61 CCOC(=O)CCCCCCCCOCCN 34a_100000210304_100010175975 [0,0,1,0,0,0|2,0,0]=3 453 B16R0.61 CCOC(=O)CCCCCCCCSCC#N 62a_100011215382_100010175975 [0,0,1,0,0,0|2,0,1]=4 454 B16R0.61 CCOC(=O)CCCCCCCCSCC=O 62a_200015260668_100010175975 [0,0,1,0,0,0|2,0,1]=4 455 B16R0.61 CCOC(=O)CCCCCCCCSCCF 62a_100011217306_100010175975 [0,0,1,0,0,0|2,0,0]=3 456 B16R0.61 CCOC(=O)CCCCCCCCSCCO 62a_100000211926_100010175975 [0,0,1,0,0,0|2,0,0]=3 457 B16R0.61 CCOC(=O)CCCCCCCCSCOC 62a_100000766300_100010175975 [0,0,1,0,0,0|2,0,0]=3 458 B16R0.61 CCOC(=O)CCCCCCCCSCSC 62a_100011218213_100010175975 [0,0,1,0,0,0|2,0,0]=3 459 B16R0.61 CCOC(=O)CCCCCCCNCCCF 2230a_100015189416_100009991516 [0,0,1,0,0,0|2,0,0]=3 460 B16R0.61 CCOC(=O)CCCCCCCNCCCF 34a_100015189416_100009991516 [0,0,1,0,0,0|2,0,0]=3 461 B16R0.61 CCOC(=O)CCCCCCCNCCOC 2230a_100000209980_100009991516 [0,0,1,0,0,0|2,0,0]=3 462 B16R0.61 CCOC(=O)CCCCCCCNCCSC 2230a_100020590264_100009991516 [0,0,1,0,0,0|2,0,0]=3 463 B16R0.61 CCOC(=O)CCCCCCCOCCCBr 34a_100011217188_100009991516 [0,0,1,0,0,0|2,0,0]=3 464 B16R0.61 CCOC(=O)CCCCCCCOCCCCl 34a_100000230001_100009991516 [0,0,1,0,0,0|2,0,0]=3 465 B16R0.61 CCOC(=O)CCCCCCCOCCCF 34a_100000759539_100009991516 [0,0,1,0,0,0|2,0,0]=3 466 B16R0.61 CCOC(=O)CCCCCCCOCCCN 34a_100000182051_100009991516 [0,0,1,0,0,0|2,0,0]=3 467 B16R0.61 CCOC(=O)CCCCCCCOCCOC 34a_100000210237_100009991516 [0,0,1,0,0,0|2,0,0]=3 468 B16R0.61 CCOC(=O)CCCCCCCOCCON 34a_100000700252_100009991516 [0,0,1,0,0,0|3,0,0]=4 469 B16R0.61 CCOC(=O)CCCCCCCOCCSC 34a_100000230434_100009991516 [0,0,1,0,0,0|2,0,0]=3 470 B16R0.61 CCOC(=O)CCCCCCCOCCSC 7a_100000230434_100009991516 [0,0,1,0,0,0|2,0,0]=3 471 B16R0.61 CCOC(=O)CCCCCCCSCCC#N 62a_100011215226_100009991516 [0,0,1,0,0,0|2,0,1]=4 472 B16R0.61 CCOC(=O)CCCCCCCSCCCF 62a_100011934791_100009991516 [0,0,1,0,0,0|2,0,0]=3 473 B16R0.61 CCOC(=O)CCCCCCCSCCCO 62a_100011215043_100009991516 [0,0,1,0,0,0|2,0,0]=3 474 B16R0.61 CCOC(=O)CCCCCCCSCCOC 62a_100000233755_100009991516 [0,0,1,0,0,0|2,0,0]=3 475 B16R0.61 CCOC(=O)CCCCCCCSCCSC 62a_100000212216_100009991516 [0,0,1,0,0,0|2,0,0]=3 476 B16R0.61 CCOC(=O)CCCCCCNCCCCO 2230a_100000750430_100009814379 [0,0,1,0,0,0|2,0,0]=3 477 B16R0.61 CCOC(=O)CCCCCCNCCCCO 34a_100000750430_100009814379 [0,0,1,0,0,0|2,0,0]=3 478 B16R0.61 CCOC(=O)CCCCCCNCCCOC 34a_100150723488_100009814379 [0,0,1,0,0,0|2,0,0]=3 479 B16R0.61 CCOC(=O)CCCCCCNCCCSC 2230a_100000749238_100009814379 [0,0,1,0,0,0|2,0,0]=3 480 B16R0.61 CCOC(=O)CCCCCCNCCSCC 2230a_100000106463_100009814379 [0,0,1,0,0,0|2,0,0]=3 481 B16R0.61 CCOC(=O)CCCCCCOCCCCBr 34a_100011216708_100009814379 [0,0,1,0,0,0|2,0,0]=3 482 B16R0.61 CCOC(=O)CCCCCCOCCCCCl 34a_100000210776_100009814379 [0,0,1,0,0,0|2,0,0]=3 483 B16R0.61 CCOC(=O)CCCCCCOCCCCCl 7a_100000210776_100009814379 [0,0,1,0,0,0|2,0,0]=3 484 B16R0.61 CCOC(=O)CCCCCCOCCCCF 34a_100011995726_100009814379 [0,0,1,0,0,0|2,0,0]=3 485 B16R0.61 CCOC(=O)CCCCCCOCCCCF 7a_100011995726_100009814379 [0,0,1,0,0,0|2,0,0]=3 486 B16R0.61 CCOC(=O)CCCCCCOCCCCI 34a_200012148704_100009814379 [0,0,1,0,0,0|2,0,0]=3 487 B16R0.61 CCOC(=O)CCCCCCOCCCCN 34a_100000750430_100009814379 [0,0,1,0,0,0|2,0,0]=3 488 B16R0.61 CCOC(=O)CCCCCCOCCCNC 34a_100000213112_100009814379 [0,0,1,0,0,0|2,0,0]=3 489 B16R0.61 CCOC(=O)CCCCCCOCCCOC 34a_100000740835_100009814379 [0,0,1,0,0,0|2,0,0]=3 490 B16R0.61 CCOC(=O)CCCCCCOCCCSC 34a_100000690336_100009814379 [0,0,1,0,0,0|2,0,0]=3 491 B16R0.61 CCOC(=O)CCCCCCOCCCSC 7a_100000690336_100009814379 [0,0,1,0,0,0|2,0,0]=3 492 B16R0.61 CCOC(=O)CCCCCCOCCSCC 34a_100000212035_100009814379 [0,0,1,0,0,0|2,0,0]=3 493 B16R0.61 CCOC(=O)CCCCCCOCCSCC 7a_100000212035_100009814379 [0,0,1,0,0,0|2,0,0]=3 494 B16R0.61 CCOC(=O)CCCCCCSCCCC#N 62a_100000687738_100009814379 [0,0,1,0,0,0|2,0,1]=4 495 B16R0.61 CCOC(=O)CCCCCCSCCCC=O 62a_200011292268_100009814379 [0,0,1,0,0,0|2,0,1]=4 496 B16R0.61 CCOC(=O)CCCCCCSCCCCF 62a_100000729493_100009814379 [0,0,1,0,0,0|2,0,0]=3 497 B16R0.61 CCOC(=O)CCCCCCSCCCCO 62a_100000210776_100009814379 [0,0,1,0,0,0|2,0,0]=3 498 B16R0.61 CCOC(=O)CCCCCCSCCCOC 62a_100000709357_100009814379 [0,0,1,0,0,0|2,0,0]=3 499 B16R0.61 CCOC(=O)CCCCCCSCCSCC 62a_100000757381_100009814379 [0,0,1,0,0,0|2,0,0]=3 500 B16R0.61 CCOC(=O)CCCCCNCCCCCO 2230a_100000762737_100000755133 [0,0,1,0,0,0|2,0,0]=3 501 B16R0.61 CCOC(=O)CCCCCNCCCCCO 34a_100000762737_100000755133 [0,0,1,0,0,0|2,0,0]=3 502 B16R0.61 CCOC(=O)CCCCCNCCOCCO 2230a_100000211614_100000755133 [0,0,1,0,0,0|3,0,0]=4 503 B16R0.61 CCOC(=O)CCCCCNCCOCCO 34a_100000211614_100000755133 [0,0,1,0,0,0|3,0,0]=4 504 B16R0.61 CCOC(=O)CCCCCNCCSCCO 2230a_100011219999_100000755133 [0,0,1,0,0,0|3,0,0]=4 505 B16R0.61 CCOC(=O)CCCCCOCCCCC#N 7a_100011214988_100000211819 [0,0,1,0,0,0|2,0,1]=4 506 B16R0.61 CCOC(=O)CCCCCOCCCCC=O 7a_100011214988_100000139335 [0,0,1,0,0,0|2,0,1]=4 507 B16R0.61 CCOC(=O)CCCCCOCCCCCBr 34a_100000746331_100000755133 [0,0,1,0,0,0|2,0,0]=3 508 B16R0.61 CCOC(=O)CCCCCOCCCCCBr 7a_100000746331_100000755133 [0,0,1,0,0,0|2,0,0]=3 509 B16R0.61 CCOC(=O)CCCCCOCCCCCCl 34a_100000746330_100000755133 [0,0,1,0,0,0|2,0,0]=3 510 B16R0.61 CCOC(=O)CCCCCOCCCCCCl 7a_100000746330_100000755133 [0,0,1,0,0,0|2,0,0]=3 511 B16R0.61 CCOC(=O)CCCCCOCCCCCF 7a_100011214988_100000729378 [0,0,1,0,0,0|2,0,0]=3 512 B16R0.61 CCOC(=O)CCCCCOCCCCCI 34a_200012148887_100000755133 [0,0,1,0,0,0|2,0,0]=3 513 B16R0.61 CCOC(=O)CCCCCOCCCCCI 7a_200012148887_100000755133 [0,0,1,0,0,0|2,0,0]=3 514 B16R0.61 CCOC(=O)CCCCCOCCCCCN 34a_100000762737_100000755133 [0,0,1,0,0,0|2,0,0]=3 515 B16R0.61 CCOC(=O)CCCCCOCCCCCO 7a_100011214988_100000746330 [0,0,1,0,0,0|2,0,0]=3 516 B16R0.61 CCOC(=O)CCCCCOCCCCOC 34a_100000740925_100000755133 [0,0,1,0,0,0|2,0,0]=3 517 B16R0.61 CCOC(=O)CCCCCOCCCCOC 7a_100011214988_100000730899 [0,0,1,0,0,0|2,0,0]=3 518 B16R0.61 CCOC(=O)CCCCCOCCCCSC 34a_100011217163_100000755133 [0,0,1,0,0,0|2,0,0]=3 519 B16R0.61 CCOC(=O)CCCCCOCCCCSC 7a_100011217163_100000755133 [0,0,1,0,0,0|2,0,0]=3 520 B16R0.61 CCOC(=O)CCCCCOCCCSCC 34a_100011216438_100000755133 [0,0,1,0,0,0|2,0,0]=3 521 B16R0.61 CCOC(=O)CCCCCOCCCSCC 7a_100011216438_100000755133 [0,0,1,0,0,0|2,0,0]=3 522 B16R0.61 CCOC(=O)CCCCCOCCOCCBr 34a_100000692535_100000755133 [0,0,1,0,0,0|3,0,0]=4 523 B16R0.61 CCOC(=O)CCCCCOCCOCCBr 7a_100000692535_100000755133 [0,0,1,0,0,0|3,0,0]=4 524 B16R0.61 CCOC(=O)CCCCCOCCOCCCl 34a_100011215305_100000755133 [0,0,1,0,0,0|3,0,0]=4 525 B16R0.61 CCOC(=O)CCCCCOCCOCCCl 7a_100011215305_100000755133 [0,0,1,0,0,0|3,0,0]=4 526 B16R0.61 CCOC(=O)CCCCCOCCOCCF 34a_200015357709_100000755133 [0,0,1,0,0,0|3,0,0]=4 527 B16R0.61 CCOC(=O)CCCCCOCCOCCF 7a_200015357709_100000755133 [0,0,1,0,0,0|3,0,0]=4 528 B16R0.61 CCOC(=O)CCCCCOCCOCCI 34a_100012149058_100000755133 [0,0,1,0,0,0|3,0,0]=4 529 B16R0.61 CCOC(=O)CCCCCOCCOCCI 7a_100012149058_100000755133 [0,0,1,0,0,0|3,0,0]=4 530 B16R0.61 CCOC(=O)CCCCCOCCOCCN 34a_100000211614_100000755133 [0,0,1,0,0,0|3,0,0]=4 531 B16R0.61 CCOC(=O)CCCCCOCCOCCO 7a_100011214988_100011215305 [0,0,1,0,0,0|3,0,0]=4 532 B16R0.61 CCOC(=O)CCCCCSCCCCC#N 62a_100000755133_100000211819 [0,0,1,0,0,0|2,0,1]=4 533 B16R0.61 CCOC(=O)CCCCCSCCCCC#N 62a_100011219923_100000755133 [0,0,1,0,0,0|2,0,1]=4 534 B16R0.61 CCOC(=O)CCCCCSCCCCC=O 62a_100000139335_100000755133 [0,0,1,0,0,0|2,0,1]=4 535 B16R0.61 CCOC(=O)CCCCCSCCCCC=O 62a_100000755133_100000139335 [0,0,1,0,0,0|2,0,1]=4 536 B16R0.61 CCOC(=O)CCCCCSCCCCCF 62a_100000729378_100000755133 [0,0,1,0,0,0|2,0,0]=3 537 B16R0.61 CCOC(=O)CCCCCSCCCCCF 62a_100000755133_100000729378 [0,0,1,0,0,0|2,0,0]=3 538 B16R0.61 CCOC(=O)CCCCCSCCCCCO 62a_100000746330_100000755133 [0,0,1,0,0,0|2,0,0]=3 539 B16R0.61 CCOC(=O)CCCCCSCCCCCO 62a_100000755133_100000746330 [0,0,1,0,0,0|2,0,0]=3 540 B16R0.61 CCOC(=O)CCCCCSCCCCOC 62a_100000730899_100000755133 [0,0,1,0,0,0|2,0,0]=3 541 B16R0.61 CCOC(=O)CCCCCSCCCCOC 62a_100000755133_100000730899 [0,0,1,0,0,0|2,0,0]=3 542 B16R0.61 CCOC(=O)CCCCCSCCOCCO 62a_100000755133_100011215305 [0,0,1,0,0,0|3,0,0]=4 543 B16R0.61 CCOC(=O)CCCCCSCCOCCO 62a_100011215305_100000755133 [0,0,1,0,0,0|3,0,0]=4 544 B16R0.61 CCOC(=O)CCCCCSCOCCOC 62a_100000231047_100000755133 [0,0,1,0,0,0|3,0,0]=4 545 B16R0.61 CCOC(=O)CCCCCSCOCCOC 62a_100000755133_100000231047 [0,0,1,0,0,0|3,0,0]=4 546 B16R0.61 CCOC(=O)CCCCNCCCCCCO 2230a_100000686447_100000750268 [0,0,1,0,0,0|2,0,0]=3 547 B16R0.61 CCOC(=O)CCCCNCCCCCCO 34a_100000686447_100000750268 [0,0,1,0,0,0|2,0,0]=3 548 B16R0.61 CCOC(=O)CCCCNCCCCCOC 2230a_100000747528_100000750268 [0,0,1,0,0,0|2,0,0]=3 549 B16R0.61 CCOC(=O)CCCCNCCCCCOC 34a_100000747528_100000750268 [0,0,1,0,0,0|2,0,0]=3 550 B16R0.61 CCOC(=O)CCCCNCCOCCOC 2230a_100000745349_100000750268 [0,0,1,0,0,0|3,0,0]=4 551 B16R0.61 CCOC(=O)CCCCNCCOCCOC 34a_100000745349_100000750268 [0,0,1,0,0,0|3,0,0]=4 552 B16R0.61 CCOC(=O)CCCCOCCCCCCBr 34a_100011215345_100000750268 [0,0,1,0,0,0|2,0,0]=3 553 B16R0.61 CCOC(=O)CCCCOCCCCCCBr 7a_100011215345_100000750268 [0,0,1,0,0,0|2,0,0]=3 554 B16R0.61 CCOC(=O)CCCCOCCCCCCCl 34a_100000766143_100000750268 [0,0,1,0,0,0|2,0,0]=3 555 B16R0.61 CCOC(=O)CCCCOCCCCCCCl 7a_100000766143_100000750268 [0,0,1,0,0,0|2,0,0]=3 556 B16R0.61 CCOC(=O)CCCCOCCCCCCF 34a_100000732779_100000750268 [0,0,1,0,0,0|2,0,0]=3 557 B16R0.61 CCOC(=O)CCCCOCCCCCCF 7a_100000732779_100000750268 [0,0,1,0,0,0|2,0,0]=3 558 B16R0.61 CCOC(=O)CCCCOCCCCCCN 34a_100000686447_100000750268 [0,0,1,0,0,0|2,0,0]=3 559 B16R0.61 CCOC(=O)CCCCOCCCCCNC 34a_100000722520_100000750268 [0,0,1,0,0,0|2,0,0]=3 560 B16R0.61 CCOC(=O)CCCCOCCOCCNC 34a_100000228057_100000750268 [0,0,1,0,0,0|3,0,0]=4 561 B16R0.61 CCOC(=O)CCCCOCCOCCOC 34a_100011215163_100000750268 [0,0,1,0,0,0|3,0,0]=4 562 B16R0.61 CCOC(=O)CCCCOCCOCCOC 7a_100011215163_100000750268 [0,0,1,0,0,0|3,0,0]=4 563 B16R0.61 CCOC(=O)CCCCSCCCCCC#N 62a_100000750268_100009813376 [0,0,1,0,0,0|2,0,1]=4 564 B16R0.61 CCOC(=O)CCCCSCCCCCC#N 62a_100009813376_100000750268 [0,0,1,0,0,0|2,0,1]=4 565 B16R0.61 CCOC(=O)CCCCSCCCCCC=O 62a_100000139337_100000750268 [0,0,1,0,0,0|2,0,1]=4 566 B16R0.61 CCOC(=O)CCCCSCCCCCC=O 62a_100000750268_100000139337 [0,0,1,0,0,0|2,0,1]=4 567 B16R0.61 CCOC(=O)CCCCSCCCCCCF 62a_100000750268_100015922095 [0,0,1,0,0,0|2,0,0]=3 568 B16R0.61 CCOC(=O)CCCCSCCCCCCF 62a_100015922095_100000750268 [0,0,1,0,0,0|2,0,0]=3 569 B16R0.61 CCOC(=O)CCCCSCCCCCCO 62a_100000750268_100000766143 [0,0,1,0,0,0|2,0,0]=3 570 B16R0.61 CCOC(=O)CCCCSCCCCCCO 62a_100000766143_100000750268 [0,0,1,0,0,0|2,0,0]=3 571 B16R0.61 CCOC(=O)CCCCSCCOCCOC 62a_100000695917_100000750268 [0,0,1,0,0,0|3,0,0]=4 572 B16R0.61 CCOC(=O)CCCCSCCOCCOC 62a_100000750268_100000695917 [0,0,1,0,0,0|3,0,0]=4 573 B16R0.61 CCOC(=O)CCCNCCCCCCCO 2230a_100011996573_100009991533 [0,0,1,0,0,0|2,0,0]=3 574 B16R0.61 CCOC(=O)CCCNCCCCCCCO 34a_100011996573_100009991533 [0,0,1,0,0,0|2,0,0]=3 575 B16R0.61 CCOC(=O)CCCNCCCOCCCO 2230a_100011310245_100009991533 [0,0,1,0,0,0|3,0,0]=4 576 B16R0.61 CCOC(=O)CCCNCCCOCCCO 34a_100011310245_100009991533 [0,0,1,0,0,0|3,0,0]=4 577 B16R0.61 CCOC(=O)CCCNCCCOCCOC 2230a_100000206027_100009991533 [0,0,1,0,0,0|3,0,0]=4 578 B16R0.61 CCOC(=O)CCCNCCCOCCOC 34a_100000206027_100009991533 [0,0,1,0,0,0|3,0,0]=4 579 B16R0.61 CCOC(=O)CCCOCCCCCCC#N 7a_100012001163_100009813337 [0,0,1,0,0,0|2,0,1]=4 580 B16R0.61 CCOC(=O)CCCOCCCCCCCBr 34a_100000760002_100009991533 [0,0,1,0,0,0|2,0,0]=3 581 B16R0.61 CCOC(=O)CCCOCCCCCCCBr 7a_100000760002_100011215271 [0,0,1,0,0,0|2,0,0]=3 582 B16R0.61 CCOC(=O)CCCOCCCCCCCN 34a_100011996573_100009991533 [0,0,1,0,0,0|2,0,0]=3 583 B16R0.61 CCOC(=O)CCCOCCCCCCCO 7a_100012001163_100000760002 [0,0,1,0,0,0|2,0,0]=3 584 B16R0.61 CCOC(=O)CCCOCCCCCCOC 34a_200012092642_100009991533 [0,0,1,0,0,0|2,0,0]=3 585 B16R0.61 CCOC(=O)CCCOCCCCCCOC 7a_100012001163_100011998445 [0,0,1,0,0,0|2,0,0]=3 586 B16R0.61 CCOC(=O)CCCOCCCCCCOC 7a_200012092642_100011215271 [0,0,1,0,0,0|2,0,0]=3 587 B16R0.61 CCOC(=O)CCCOCCCOCCCN 34a_100011310245_100009991533 [0,0,1,0,0,0|3,0,0]=4 588 B16R0.61 CCOC(=O)CCCOCCCOCCOC 7a_100012001163_100011216529 [0,0,1,0,0,0|3,0,0]=4 589 B16R0.61 CCOC(=O)CCCSCCCCCCC#N 62a_100009813337_100009991533 [0,0,1,0,0,0|2,0,1]=4 590 B16R0.61 CCOC(=O)CCCSCCCCCCC#N 62a_100009991533_100009813337 [0,0,1,0,0,0|2,0,1]=4 591 B16R0.61 CCOC(=O)CCCSCCCCCCCO 62a_100000760002_100009991533 [0,0,1,0,0,0|2,0,0]=3 592 B16R0.61 CCOC(=O)CCCSCCCCCCCO 62a_100009991533_100000760002 [0,0,1,0,0,0|2,0,0]=3 593 B16R0.61 CCOC(=O)CCCSCCCCCCOC 62a_100009991533_100011998445 [0,0,1,0,0,0|2,0,0]=3 594 B16R0.61 CCOC(=O)CCCSCCCCCCOC 62a_100011998445_100009991533 [0,0,1,0,0,0|2,0,0]=3 595 B16R0.61 CCOC(=O)CCCSCCCOCCOC 62a_100009991533_100011216529 [0,0,1,0,0,0|3,0,0]=4 596 B16R0.61 CCOC(=O)CCCSCCCOCCOC 62a_100011216529_100009991533 [0,0,1,0,0,0|3,0,0]=4 597 B16R0.61 CCOC(=O)CCNCCCCCCCCO 2230a_102515433106_100011206558 [0,0,1,0,0,0|2,0,0]=3 598 B16R0.61 CCOC(=O)CCNCCCCCCCCO 34a_102515433106_100000765890 [0,0,1,0,0,0|2,0,0]=3 599 B16R0.61 CCOC(=O)CCOCCCCCCCCBr 34a_100009813846_100000765890 [0,0,1,0,0,0|2,0,0]=3 600 B16R0.61 CCOC(=O)CCOCCCCCCCCBr 7a_100009813846_100011206558 [0,0,1,0,0,0|2,0,0]=3 601 B16R0.61 CCOC(=O)CCOCCCCCCCCCl 34a_100000033203_100000765890 [0,0,1,0,0,0|2,0,0]=3 602 B16R0.61 CCOC(=O)CCOCCCCCCCCCl 7a_100000033203_100011206558 [0,0,1,0,0,0|2,0,0]=3 603 B16R0.61 CCOC(=O)CCOCCCCCCCCN 34a_102515433106_100000765890 [0,0,1,0,0,0|2,0,0]=3 604 B16R0.61 CCOC(=O)CCOCCCCCNCCN 34a_103619048469_100000765890 [0,0,1,0,0,0|3,0,0]=4 605 B16R0.61 CCOC(=O)CCOCCCOCCCOC 34a_200011215475_100000765890 [0,0,1,0,0,0|3,0,0]=4 606 B16R0.61 CCOC(=O)CCOCCCOCCCOC 7a_200011215475_100011206558 [0,0,1,0,0,0|3,0,0]=4 607 B16R0.61 CCOC(=O)CCSCCCCCCCCO 62a_100000033203_100000765890 [0,0,1,0,0,0|2,0,0]=3 608 B16R0.61 CCOC(=O)CCSCCCCCCCCO 62a_100000765890_100000033203 [0,0,1,0,0,0|2,0,0]=3 609 B16R0.61 CCOC(=O)CNCCCCCCCCCO 2230a_100000078944_100000188475 [0,0,1,0,0,0|2,0,0]=3 610 B16R0.61 CCOC(=O)CNCCCCCCCCCO 34a_100000078944_100000188475 [0,0,1,0,0,0|2,0,0]=3 611 B16R0.61 CCOC(=O)COCCCCCCCCCBr 34a_100009813782_100000188475 [0,0,1,0,0,0|2,0,0]=3 612 B16R0.61 CCOC(=O)COCCCCCCCCCBr 7a_100009813782_100000188475 [0,0,1,0,0,0|2,0,0]=3 613 B16R0.61 CCOC(=O)COCCCCCCCCCCl 34a_100009868337_100000188475 [0,0,1,0,0,0|2,0,0]=3 614 B16R0.61 CCOC(=O)COCCCCCCCCCCl 7a_100009868337_100000188475 [0,0,1,0,0,0|2,0,0]=3 615 B16R0.61 CCOC(=O)COCCCCCCCCCN 34a_100000078944_100000188475 [0,0,1,0,0,0|2,0,0]=3 616 B16R0.61 CCOC(=O)COCCCNCCCCCO 2230a_100000762737_100009893628 [0,0,1,0,0,0|3,0,0]=4 617 B16R0.61 CCOC(=O)COCCCNCCCCCO 34a_100000762737_100009893628 [0,0,1,0,0,0|3,0,0]=4 618 B16R0.61 CCOC(=O)COCCCOCCCCCBr 34a_100000746331_100009893628 [0,0,1,0,0,0|3,0,0]=4 619 B16R0.61 CCOC(=O)COCCCOCCCCCBr 7a_100000746331_100009893628 [0,0,1,0,0,0|3,0,0]=4 620 B16R0.61 CCOC(=O)COCCCOCCCCCCl 34a_100000746330_100009893628 [0,0,1,0,0,0|3,0,0]=4 621 B16R0.61 CCOC(=O)COCCCOCCCCCCl 7a_100000746330_100009893628 [0,0,1,0,0,0|3,0,0]=4 622 B16R0.61 CCOC(=O)COCCCOCCCCCI 34a_200012148887_100009893628 [0,0,1,0,0,0|3,0,0]=4 623 B16R0.61 CCOC(=O)COCCCOCCCCCI 7a_200012148887_100009893628 [0,0,1,0,0,0|3,0,0]=4 624 B16R0.61 CCOC(=O)COCCCOCCCCCN 34a_100000762737_100009893628 [0,0,1,0,0,0|3,0,0]=4 625 B16R0.61 CCOC(=O)COCCCOCCCCOC 34a_100000740925_100009893628 [0,0,1,0,0,0|3,0,0]=4 626 B16R0.61 CCOC(=O)COCCCOCCCCSC 34a_100011217163_100009893628 [0,0,1,0,0,0|3,0,0]=4 627 B16R0.61 CCOC(=O)COCCCOCCCCSC 7a_100011217163_100009893628 [0,0,1,0,0,0|3,0,0]=4 628 B16R0.61 CCOC(=O)COCCCOCCCSCC 34a_100011216438_100009893628 [0,0,1,0,0,0|3,0,0]=4 629 B16R0.61 CCOC(=O)COCCCOCCCSCC 7a_100011216438_100009893628 [0,0,1,0,0,0|3,0,0]=4 630 B16R0.61 CCOC(=O)COCCCSCCCCCF 62a_100000729378_100009893628 [0,0,1,0,0,0|3,0,0]=4 631 B16R0.61 CCOC(=O)COCCCSCCCCCF 62a_100009893628_100000729378 [0,0,1,0,0,0|3,0,0]=4 632 B16R0.61 CCOC(=O)COCCCSCCCCCO 62a_100000746330_100009893628 [0,0,1,0,0,0|3,0,0]=4 633 B16R0.61 CCOC(=O)COCCCSCCCCCO 62a_100009893628_100000746330 [0,0,1,0,0,0|3,0,0]=4 634 B16R0.61 CCOC(=O)COCCCSCCCCOC 62a_100000730899_100009893628 [0,0,1,0,0,0|3,0,0]=4 635 B16R0.61 CCOC(=O)COCCCSCCCCOC 62a_100009893628_100000730899 [0,0,1,0,0,0|3,0,0]=4 636 B16R0.61 CCOC(=O)COCCNCCCCCCO 2230a_100000686447_100000088970 [0,0,1,0,0,0|3,0,0]=4 637 B16R0.61 CCOC(=O)COCCNCCCCCCO 34a_100000686447_100000088970 [0,0,1,0,0,0|3,0,0]=4 638 B16R0.61 CCOC(=O)COCCNCCCCCOC 2230a_100000747528_100000088970 [0,0,1,0,0,0|3,0,0]=4 639 B16R0.61 CCOC(=O)COCCNCCCCCOC 34a_100000747528_100000088970 [0,0,1,0,0,0|3,0,0]=4 640 B16R0.61 CCOC(=O)COCCOCCCCCCBr 34a_100011215345_100000088970 [0,0,1,0,0,0|3,0,0]=4 641 B16R0.61 CCOC(=O)COCCOCCCCCCBr 7a_100011215345_100000088970 [0,0,1,0,0,0|3,0,0]=4 642 B16R0.61 CCOC(=O)COCCOCCCCCCCl 34a_100000766143_100000088970 [0,0,1,0,0,0|3,0,0]=4 643 B16R0.61 CCOC(=O)COCCOCCCCCCCl 7a_100000766143_100000088970 [0,0,1,0,0,0|3,0,0]=4 644 B16R0.61 CCOC(=O)COCCOCCCCCCF 34a_100000732779_100000088970 [0,0,1,0,0,0|3,0,0]=4 645 B16R0.61 CCOC(=O)COCCOCCCCCCF 7a_100000732779_100000088970 [0,0,1,0,0,0|3,0,0]=4 646 B16R0.61 CCOC(=O)COCCOCCCCCCN 34a_100000686447_100000088970 [0,0,1,0,0,0|3,0,0]=4 647 B16R0.61 CCOC(=O)COCCOCCCCCNC 34a_100000722520_100000088970 [0,0,1,0,0,0|3,0,0]=4 648 B16R0.61 CCOC(=O)COCCSCCCCCCF 62a_100000088970_100015922095 [0,0,1,0,0,0|3,0,0]=4 649 B16R0.61 CCOC(=O)COCCSCCCCCCF 62a_100015922095_100000088970 [0,0,1,0,0,0|3,0,0]=4 650 B16R0.61 CCOC(=O)COCCSCCCCCCO 62a_100000088970_100000766143 [0,0,1,0,0,0|3,0,0]=4 651 B16R0.61 CCOC(=O)COCCSCCCCCCO 62a_100000766143_100000088970 [0,0,1,0,0,0|3,0,0]=4 652 B16R0.61 CCOC(=O)CSCCCCCCCCCO 62a_100000188475_100009813782 [0,0,1,0,0,0|2,0,0]=3 653 B16R0.61 CCOC(=O)CSCCCCCCCCCO 62a_100009813782_100000188475 [0,0,1,0,0,0|2,0,0]=3 654 B16R0.61 CCOC(=O)CSCCOCCCCCCF 7a_200000230590_100015922095 [0,0,1,0,0,0|3,0,0]=4 655 B16R0.61 CCOC(=O)CSCCOCCCCCCO 7a_200000230590_100000766143 [0,0,1,0,0,0|3,0,0]=4 656 B16R0.61 CCOC(=O)NCCOCCCCCCCBr 7a_100000760002_200011445536 [0,0,1,0,0,0|3,0,0]=4 657 B16R0.61 CCOC(=O)NCCOCCCCCCCO 34a_100000158857_100000760002 [0,0,1,0,0,0|3,0,0]=4 658 B16R0.61 CCOC(=O)NCCOCCCCCCOC 34a_100000158857_100011998445 [0,0,1,0,0,0|3,0,0]=4 659 B16R0.61 CCOC(=O)NCCOCCCCCCOC 7a_200012092642_200011445536 [0,0,1,0,0,0|3,0,0]=4 660 B16R0.61 CCOC(=O)NCCSCCCCCCCO 62a_100000760002_200011445536 [0,0,1,0,0,0|3,0,0]=4 661 B16R0.61 CCOC(=O)NCCSCCCCCCOC 62a_100011998445_200011445536 [0,0,1,0,0,0|3,0,0]=4 662 B16R0.61 CCOC(=O)OCSCCCCCCCCO 62a_100000033203_100000075025 [0,0,1,0,0,0|3,0,0]=4 663 B16R0.61 CCOCCCCCCCCCC(=O)OCC 34a_100121572206_100009828014 [0,0,1,0,0,0|1,0,0]=2 664 B16R0.61 CCOCCCNCCCCCC(=O)OCC 2230a_100000210961_100000755133 [0,0,1,0,0,0|2,0,0]=3 665 B16R0.61 CCOCCCNCCCCCC(=O)OCC 34a_100000210961_100000755133 [0,0,1,0,0,0|2,0,0]=3 666 B16R0.61 CCOCCCNCCCOCC(=O)OCC 2230a_100000210961_100009893628 [0,0,1,0,0,0|3,0,0]=4 667 B16R0.61 CCOCCCNCCCOCC(=O)OCC 34a_100000210961_100009893628 [0,0,1,0,0,0|3,0,0]=4 668 B16R0.61 CCOCCCOCCCCCC(=O)OCC 34a_100000757476_100000755133 [0,0,1,0,0,0|2,0,0]=3 669 B16R0.61 CCOCCCOCCCCCC(=O)OCC 7a_100000757476_100000755133 [0,0,1,0,0,0|2,0,0]=3 670 B16R0.61 CCOCCCOCCCCCC(=O)OCC 7a_100011214988_100012232248 [0,0,1,0,0,0|2,0,0]=3 671 B16R0.61 CCOCCCOCCCOCC(=O)OCC 34a_100000757476_100009893628 [0,0,1,0,0,0|3,0,0]=4 672 B16R0.61 CCOCCCOCCCOCC(=O)OCC 7a_100000757476_100009893628 [0,0,1,0,0,0|3,0,0]=4 673 B16R0.61 CCOCCCSCCCCCC(=O)OCC 62a_100000755133_100012232248 [0,0,1,0,0,0|2,0,0]=3 674 B16R0.61 CCOCCCSCCCCCC(=O)OCC 62a_100012232248_100000755133 [0,0,1,0,0,0|2,0,0]=3 675 B16R0.61 CCOCCCSCCCOCC(=O)OCC 62a_100009893628_100012232248 [0,0,1,0,0,0|3,0,0]=4 676 B16R0.61 CCOCCCSCCCOCC(=O)OCC 62a_100012232248_100009893628 [0,0,1,0,0,0|3,0,0]=4 677 B16R0.61 CCOCCNCCCCCCC(=O)OCC 2230a_102516460346_100009814379 [0,0,1,0,0,0|2,0,0]=3 678 B16R0.61 CCOCCNCCCCCCC(=O)OCC 34a_102516460346_100009814379 [0,0,1,0,0,0|2,0,0]=3 679 B16R0.61 CCOCCOCCCCCCC(=O)OCC 34a_100000210136_100009814379 [0,0,1,0,0,0|2,0,0]=3 680 B16R0.61 CCOCCOCCCCCCC(=O)OCC 7a_100000210136_100009814379 [0,0,1,0,0,0|2,0,0]=3 681 B16R0.61 CCOCCOCCNCCCC(=O)OCC 2230a_100102712874_100009991533 [0,0,1,0,0,0|3,0,0]=4 682 B16R0.61 CCOCCOCCNCCCC(=O)OCC 34a_100102712874_100009991533 [0,0,1,0,0,0|3,0,0]=4 683 B16R0.61 CCOCCOCCOCCCC(=O)OCC 34a_100000210240_100009991533 [0,0,1,0,0,0|3,0,0]=4 684 B16R0.61 CCOCCOCCOCCCC(=O)OCC 7a_100000210240_100011215271 [0,0,1,0,0,0|3,0,0]=4 685 B16R0.61 CCOCCOCCOCCCC(=O)OCC 7a_100012001163_100011211534 [0,0,1,0,0,0|3,0,0]=4 686 B16R0.61 CCOCCOCCSCCCC(=O)OCC 62a_100009991533_100011211534 [0,0,1,0,0,0|3,0,0]=4 687 B16R0.61 CCOCCOCCSCCCC(=O)OCC 62a_100011211534_100009991533 [0,0,1,0,0,0|3,0,0]=4 688 B16R0.61 CCOCCSCCCCCCC(=O)OCC 62a_100000210147_100009814379 [0,0,1,0,0,0|2,0,0]=3 689 B16R0.61 CCOCSCCCCCCCC(=O)OCC 62a_100000739092_100009991516 [0,0,1,0,0,0|2,0,0]=3 690 B16R0.61 CNNC(=O)CCCCCCCCCCCO 22a_100016993582_100000037981 [0,0,1,0,0,0|3,0,0]=4 691 B16R0.61 COCC(=O)CCCCCCCCCCCO 1458a_100000210968_100009812471 [0,0,1,0,0,0|3,0,0]=4 692 B16R0.61 COCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000210968 [0,0,1,0,0,0|3,0,0]=4 693 B16R0.61 CSCC(=O)CCCCCCCCCCCO 1458a_100000184570_100009812471 [0,0,1,0,0,0|3,0,0]=4 694 B16R0.61 CSCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000184570 [0,0,1,0,0,0|3,0,0]=4 695 B16R0.61 O=C(CCO)CCCCCCCCCCCO 1458a_100011216618_100009812471 [0,0,1,0,0,0|3,0,0]=4 696 B16R0.61 O=C(CCO)NCCCCCCCCCCO 240690a_100000066964_100011216618 [0,0,1,0,0,0|3,0,0]=4 697 B16R0.68 C#CCCCC(=O)CCCCCCCCCC 1458a_100000210375_100000731252 [0,0,1,0,0,0|1,0,2]=4 698 B16R0.68 C#CCCCC(=O)CCCCCCCCCC 1458a_100000690238_100000210319 [0,0,1,0,0,0|1,0,2]=4 699 B16R0.68 C#CCCCC(=O)NCCCCCCCCC 11a_100000212291_100000690238 [0,0,1,0,0,0|1,0,2]=4 700 B16R0.68 C#CCCCC(=O)NCCCCCCCCC 1626a_100000212291_100000690238 [0,0,1,0,0,0|1,0,2]=4 701 B16R0.68 C#CCCCC(=O)NCCCCCCCCC 240690a_100000212291_100000690238 [0,0,1,0,0,0|1,0,2]=4 702 B16R0.68 C#CCCCC(=O)NCCCCCCCCC 527a_100000212291_100000690238 [0,0,1,0,0,0|1,0,2]=4 703 B16R0.68 C#CCCCCCCCCC(=O)CCCCC 1458a_100000029693_100000210326 [0,0,1,0,0,0|1,0,2]=4 704 B16R0.68 C#CCCCCCCCCC(=O)NCCCC 11a_100000102301_100000029693 [0,0,1,0,0,0|1,0,2]=4 705 B16R0.68 C#CCCCCCCCCC(=O)NCCCC 1626a_100000102301_100000029693 [0,0,1,0,0,0|1,0,2]=4 706 B16R0.68 C#CCCCCCCCCC(=O)NCCCC 240690a_100000102301_100000029693 [0,0,1,0,0,0|1,0,2]=4 707 B16R0.68 C#CCCCCCCCCC(=O)NCCCC 527a_100000102301_100000029693 [0,0,1,0,0,0|1,0,2]=4 708 B16R0.68 C#CCCCCCCOCC(=O)OCCCC 34a_100011217361_100000211628 [0,0,1,0,0,0|1,0,2]=4 709 B16R0.68 C#CCCCCCCOCC(=O)OCCCC 7a_100011217361_100000211628 [0,0,1,0,0,0|1,0,2]=4 710 B16R0.68 C#CCCCCCCSCC(=O)OCCCC 62a_100000211628_100012276617 [0,0,1,0,0,0|1,0,2]=4 711 B16R0.68 C#CCCCCCCSCC(=O)OCCCC 62a_100012276617_100000211628 [0,0,1,0,0,0|1,0,2]=4 712 B16R0.68 C#CCCNC(=O)CCCCCCCCCC 11a_100000755551_100000210375 [0,0,1,0,0,0|1,0,2]=4 713 B16R0.68 C#CCCNC(=O)CCCCCCCCCC 1626a_100000755551_100000210375 [0,0,1,0,0,0|1,0,2]=4 714 B16R0.68 C#CCCNC(=O)CCCCCCCCCC 240690a_100000755551_100000210375 [0,0,1,0,0,0|1,0,2]=4 715 B16R0.68 C=CCCCC(=O)CCCCCCCCCC 1458a_100000210375_100000757094 [0,0,1,0,0,0|1,0,2]=4 716 B16R0.68 C=CCCCC(=O)CCCCCCCCCC 1458a_100000766728_100000210319 [0,0,1,0,0,0|1,0,2]=4 717 B16R0.68 C=CCCCC(=O)NCCCCCCCCC 11a_100000212291_100000766728 [0,0,1,0,0,0|1,0,2]=4 718 B16R0.68 C=CCCCC(=O)NCCCCCCCCC 1626a_100000212291_100000766728 [0,0,1,0,0,0|1,0,2]=4 719 B16R0.68 C=CCCCC(=O)NCCCCCCCCC 240690a_100000212291_100000766728 [0,0,1,0,0,0|1,0,2]=4 720 B16R0.68 C=CCCCC(=O)NCCCCCCCCC 527a_100000212291_100000766728 [0,0,1,0,0,0|1,0,2]=4 721 B16R0.68 C=CCCCCCCCCC(=O)CCCCC 1458a_100000211349_100000210326 [0,0,1,0,0,0|1,0,2]=4 722 B16R0.68 C=CCCCCCCCCC(=O)CCCCC 1458a_100000212188_100011933949 [0,0,1,0,0,0|1,0,2]=4 723 B16R0.68 C=CCCCCCCCCC(=O)NCCCC 11a_100000102301_100000211349 [0,0,1,0,0,0|1,0,2]=4 724 B16R0.68 C=CCCCCCCCCC(=O)NCCCC 1626a_100000102301_100000211349 [0,0,1,0,0,0|1,0,2]=4 725 B16R0.68 C=CCCCCCCCCC(=O)NCCCC 240690a_100000102301_100000211349 [0,0,1,0,0,0|1,0,2]=4 726 B16R0.68 C=CCCCCCCCCC(=O)NCCCC 527a_100000102301_100000211349 [0,0,1,0,0,0|1,0,2]=4 727 B16R0.68 C=CCCCCCCOCC(=O)OCCCC 34a_200011216477_100000211628 [0,0,1,0,0,0|1,0,2]=4 728 B16R0.68 C=CCCCCCCOCC(=O)OCCCC 7a_200011216477_100000211628 [0,0,1,0,0,0|1,0,2]=4 729 B16R0.68 C=CCCCCCCSCC(=O)OCCCC 62a_100000211628_100011215473 [0,0,1,0,0,0|1,0,2]=4 730 B16R0.68 C=CCCCCCCSCC(=O)OCCCC 62a_100011215473_100000211628 [0,0,1,0,0,0|1,0,2]=4 731 B16R0.68 C=CCCNC(=O)CCCCCCCCCC 11a_100015191253_100000210375 [0,0,1,0,0,0|1,0,2]=4 732 B16R0.68 C=CCCNC(=O)CCCCCCCCCC 1626a_100015191253_100000210375 [0,0,1,0,0,0|1,0,2]=4 733 B16R0.68 C=CCCNC(=O)CCCCCCCCCC 240690a_100015191253_100000210375 [0,0,1,0,0,0|1,0,2]=4 734 B16R0.68 CC#CCCCCCCCC(=O)CCCCC 1458a_100000066323_100000210326 [0,0,1,0,0,0|1,0,2]=4 735 B16R0.68 CC#CCCCCCCCC(=O)NCCCC 11a_100000102301_100000066323 [0,0,1,0,0,0|1,0,2]=4 736 B16R0.68 CC#CCCCCCCCC(=O)NCCCC 1626a_100000102301_100000066323 [0,0,1,0,0,0|1,0,2]=4 737 B16R0.68 CC#CCCCCCCCC(=O)NCCCC 240690a_100000102301_100000066323 [0,0,1,0,0,0|1,0,2]=4 738 B16R0.68 CC#CCCCCCCCC(=O)NCCCC 527a_100000102301_100000066323 [0,0,1,0,0,0|1,0,2]=4 739 B16R0.68 CC#CCNC(=O)CCCCCCCCCC 11a_100000685387_100000210375 [0,0,1,0,0,0|1,0,2]=4 740 B16R0.68 CC#CCNC(=O)CCCCCCCCCC 1626a_100000685387_100000210375 [0,0,1,0,0,0|1,0,2]=4 741 B16R0.68 CC/C=C/CC(=O)CCCCCCCCCC 1458a_100016274230_100000210319 [0,0,1,0,0,0|1,0,2]=4 742 B16R0.68 CC/C=C/CC(=O)NCCCCCCCCC 11a_100000212291_100016274230 [0,0,1,0,0,0|1,0,2]=4 743 B16R0.68 CC/C=C/CC(=O)NCCCCCCCCC 1626a_100000212291_100016274230 [0,0,1,0,0,0|1,0,2]=4 744 B16R0.68 CC/C=C/CC(=O)NCCCCCCCCC 240690a_100000212291_100016274230 [0,0,1,0,0,0|1,0,2]=4 745 B16R0.68 CC/C=C/CC(=O)NCCCCCCCCC 527a_100000212291_100016274230 [0,0,1,0,0,0|1,0,2]=4 746 B16R0.68 CC/C=C\CC(=O)CCCCCCCCCC 1458a_100000210375_100103147603 [0,0,1,0,0,0|1,0,2]=4 747 B16R0.68 CC/C=C\CCCCOCC(=O)OCCCC 34a_100016287862_100000211628 [0,0,1,0,0,0|1,0,2]=4 748 B16R0.68 CC/C=C\CCCCOCC(=O)OCCCC 7a_100016287862_100000211628 [0,0,1,0,0,0|1,0,2]=4 749 B16R0.68 CCC#CCC(=O)CCCCCCCCCC 1458a_100000210375_100009813939 [0,0,1,0,0,0|1,0,2]=4 750 B16R0.68 CCC#CCCCCCCC(=O)CCCCC 1458a_100000212188_200000036426 [0,0,1,0,0,0|1,0,2]=4 751 B16R0.68 CCCC#CC(=O)CCCCCCCCCC 1458a_200011218047_100000210319 [0,0,1,0,0,0|1,0,1]=3 752 B16R0.68 CCCC#CC(=O)CCCCCCCCCO 1458a_200011218047_100009813782 [0,0,1,0,0,0|2,0,1]=4 753 B16R0.68 CCCC#CC(=O)NCCCCCCCCC 240690a_100000212291_200011218047 [0,0,1,0,0,0|1,0,2]=4 754 B16R0.68 CCCC/C=C\CCOCC(=O)OCCCC 34a_200016286491_100000211628 [0,0,1,0,0,0|1,0,2]=4 755 B16R0.68 CCCC/C=C\CCOCC(=O)OCCCC 7a_200016286491_100000211628 [0,0,1,0,0,0|1,0,2]=4 756 B16R0.68 CCCC=CC(=O)CCCCCCCCCC 1458a_100000212230_100000210319 [0,0,1,0,0,0|1,0,1]=3 757 B16R0.68 CCCC=CC(=O)CCCCCCCCCO 1458a_100000212230_100009813782 [0,0,1,0,0,0|2,0,1]=4 758 B16R0.68 CCCC=CC(=O)NCCCCCCCCC 11a_100000212291_100000212230 [0,0,1,0,0,0|1,0,2]=4 759 B16R0.68 CCCC=CC(=O)NCCCCCCCCC 1626a_100000212291_100000212230 [0,0,1,0,0,0|1,0,2]=4 760 B16R0.68 CCCC=CC(=O)NCCCCCCCCC 240690a_100000212291_100000212230 [0,0,1,0,0,0|1,0,2]=4 761 B16R0.68 CCCCC#CCCOCC(=O)OCCCC 34a_100000037610_100000211628 [0,0,1,0,0,0|1,0,2]=4 762 B16R0.68 CCCCC#CCCOCC(=O)OCCCC 7a_100000037610_100000211628 [0,0,1,0,0,0|1,0,2]=4 763 B16R0.68 CCCCC/C=C/COCC(=O)OCCCC 34a_100016258190_100000211628 [0,0,1,0,0,0|1,0,2]=4 764 B16R0.68 CCCCC/C=C/COCC(=O)OCCCC 7a_100016258190_100000211628 [0,0,1,0,0,0|1,0,2]=4 765 B16R0.68 CCCCCC#CCOCC(=O)OCCCC 34a_200000033628_100000211628 [0,0,1,0,0,0|1,0,2]=4 766 B16R0.68 CCCCCC#CCOCC(=O)OCCCC 7a_200000033628_100000211628 [0,0,1,0,0,0|1,0,2]=4 767 B16R0.68 CCCCCC#CCSCC(=O)OCCCC 62a_100000211628_100009816472 [0,0,1,0,0,0|1,0,2]=4 768 B16R0.68 CCCCCC#CCSCC(=O)OCCCC 62a_100009816472_100000211628 [0,0,1,0,0,0|1,0,2]=4 769 B16R0.68 CCCCCC(=O)CCCCCCCCCF 1458a_200009909015_100000210326 [0,0,1,0,0,0|2,0,0]=3 770 B16R0.68 CCCCCC(=O)CCCCCCCCCO 1458a_100000212188_100009813782 [0,0,1,0,0,0|2,0,0]=3 771 B16R0.68 CCCCCC(=O)CNCCCCCCCO 2230a_100011996573_200012276598 [0,0,1,0,0,0|3,0,0]=4 772 B16R0.68 CCCCCC(=O)CNCCCCCCCO 34a_100011996573_200012276598 [0,0,1,0,0,0|3,0,0]=4 773 B16R0.68 CCCCCC(=O)CNCCCOCCCC 2230a_200000211371_200012276598 [0,0,1,0,0,0|3,0,0]=4 774 B16R0.68 CCCCCC(=O)CNCCCOCCCC 34a_200000211371_200012276598 [0,0,1,0,0,0|3,0,0]=4 775 B16R0.68 CCCCCC(=O)COCCCCCCCBr 34a_100000760002_200012276598 [0,0,1,0,0,0|3,0,0]=4 776 B16R0.68 CCCCCC(=O)COCCCCCCCBr 7a_100000760002_200012276598 [0,0,1,0,0,0|3,0,0]=4 777 B16R0.68 CCCCCC(=O)COCCCCCCCN 34a_100011996573_200012276598 [0,0,1,0,0,0|3,0,0]=4 778 B16R0.68 CCCCCC(=O)COCCCCCCOC 34a_200012092642_200012276598 [0,0,1,0,0,0|3,0,0]=4 779 B16R0.68 CCCCCC(=O)COCCCCCCOC 7a_200012092642_200012276598 [0,0,1,0,0,0|3,0,0]=4 780 B16R0.68 CCCCCC(=O)COCCCOCCCC 34a_200011215613_200012276598 [0,0,1,0,0,0|3,0,0]=4 781 B16R0.68 CCCCCC(=O)COCCCOCCCC 7a_200011215613_200012276598 [0,0,1,0,0,0|3,0,0]=4 782 B16R0.68 CCCCCC(=O)CSCCCCCCCO 62a_100000760002_200012276598 [0,0,1,0,0,0|3,0,0]=4 783 B16R0.68 CCCCCC(=O)CSCCCCCCCO 62a_200012276598_100000760002 [0,0,1,0,0,0|3,0,0]=4 784 B16R0.68 CCCCCC(=O)CSCCCCCCOC 62a_100011998445_200012276598 [0,0,1,0,0,0|3,0,0]=4 785 B16R0.68 CCCCCC(=O)CSCCCCCCOC 62a_200012276598_100011998445 [0,0,1,0,0,0|3,0,0]=4 786 B16R0.68 CCCCCC(=O)NCCCCCCCCO 240690a_102515433106_100000212188 [0,0,1,0,0,0|2,0,0]=3 787 B16R0.68 CCCCCC(=O)NCCOCCOCCC 11a_200011904461_100000212188 [0,0,1,0,0,0|3,0,0]=4 788 B16R0.68 CCCCCC(=O)NCCOCCOCCC 1626a_200011904461_100000212188 [0,0,1,0,0,0|3,0,0]=4 789 B16R0.68 CCCCCC(=O)NCCOCCOCCC 240690a_200011904461_100000212188 [0,0,1,0,0,0|3,0,0]=4 790 B16R0.68 CCCCCC(C)OCCCCCCCCBr 34a_100009813846_200011218191 [0,0,1,0,0,0|2,0,1]=4 791 B16R0.68 CCCCCC(C)OCCCCCCCCBr 7a_100009813846_200011218191 [0,0,1,0,0,0|2,0,1]=4 792 B16R0.68 CCCCCC(C)OCCCCCCCCCl 34a_100000033203_200011218191 [0,0,1,0,0,0|2,0,1]=4 793 B16R0.68 CCCCCC(C)OCCCCCCCCCl 7a_100000033203_200011218191 [0,0,1,0,0,0|2,0,1]=4 794 B16R0.68 CCCCCC(C)OCCCCCCCCN 34a_102515433106_200011218191 [0,0,1,0,0,0|2,0,1]=4 795 B16R0.68 CCCCCC(C)OCCCCCCCCO 34a_100011215632_100000033203 [0,0,1,0,0,0|2,0,1]=4 796 B16R0.68 CCCCCC(C)OCCCCCCCCO 7a_100011215632_100000033203 [0,0,1,0,0,0|2,0,1]=4 797 B16R0.68 CCCCCC(C)OCCCCNCCCC 34a_200011216965_200011218191 [0,0,1,0,0,0|2,0,1]=4 798 B16R0.68 CCCCCC(C)OCCCCOCCCC 34a_200000760531_200011218191 [0,0,1,0,0,0|2,0,1]=4 799 B16R0.68 CCCCCC(C)OCCCCOCCCC 7a_200000760531_200011218191 [0,0,1,0,0,0|2,0,1]=4 800 B16R0.68 CCCCCCCC=NNC(=O)CCCCC 4a_100000189784_100000210592 [0,0,1,0,0,0|2,0,1]=4 801 B16R0.68 CCCCCCCCC=CC(=O)CCCCC 1458a_100015345288_100000210326 [0,0,1,0,0,0|1,0,1]=3 802 B16R0.68 CCCCCCCCC=CC(=O)CCCCF 1458a_100015345288_100000729493 [0,0,1,0,0,0|2,0,1]=4 803 B16R0.68 CCCCCCCCC=CC(=O)CCCCO 1458a_100015345288_100000210776 [0,0,1,0,0,0|2,0,1]=4 804 B16R0.68 CCCCCCCCC=CC(=O)CCCOC 1458a_100015345288_100000740836 [0,0,1,0,0,0|2,0,1]=4 805 B16R0.68 CCCCCCCCC=CC(=O)CCOCC 1458a_100015345288_100011215890 [0,0,1,0,0,0|2,0,1]=4 806 B16R0.68 CCCCCCCCC=CC(=O)CCSCC 1458a_100015345288_100000757381 [0,0,1,0,0,0|2,0,1]=4 807 B16R0.68 CCCCCCCCC=CC(=O)NCCCC 11a_100000102301_100015345288 [0,0,1,0,0,0|1,0,2]=4 808 B16R0.68 CCCCCCCCC=CC(=O)NCCCC 1626a_100000102301_100015345288 [0,0,1,0,0,0|1,0,2]=4 809 B16R0.68 CCCCCCCCC=CC(=O)NCCCC 240690a_100000102301_100015345288 [0,0,1,0,0,0|1,0,2]=4 810 B16R0.68 CCCCCCCCCCC(=NNCCC)C 4a_100000740057_200011219864 [0,0,1,0,0,0|3,0,0]=4 811 B16R0.68 CCCCCCCCCCC(=O)C=CCOC 1458a_100016285016_100000210319 [0,0,1,0,0,0|2,0,1]=4 812 B16R0.68 CCCCCCCCCCC(=O)C=COCC 1458a_100016266692_100000210319 [0,0,1,0,0,0|2,0,1]=4 813 B16R0.68 CCCCCCCCCCC(=O)CCCC#N 1458a_100000075515_100000210319 [0,0,1,0,0,0|2,0,1]=4 814 B16R0.68 CCCCCCCCCCC(=O)CCCC#N 1458a_100000210375_100000211468 [0,0,1,0,0,0|2,0,1]=4 815 B16R0.68 CCCCCCCCCCC(=O)CCCCC 1458a_100000210375_100000210326 [0,0,1,0,0,0|1,0,0]=2 816 B16R0.68 CCCCCCCCCCC(=O)CCCCC 1458a_100000212188_100000210319 [0,0,1,0,0,0|1,0,0]=2 817 B16R0.68 CCCCCCCCCCC(=O)CCCCF 1458a_100000210375_100000729493 [0,0,1,0,0,0|2,0,0]=3 818 B16R0.68 CCCCCCCCCCC(=O)CCCCO 1458a_100000210375_100000210776 [0,0,1,0,0,0|2,0,0]=3 819 B16R0.68 CCCCCCCCCCC(=O)CCCCO 1458a_100000695505_100000210319 [0,0,1,0,0,0|2,0,0]=3 820 B16R0.68 CCCCCCCCCCC(=O)CCCOC 1458a_100000210375_100000740836 [0,0,1,0,0,0|2,0,0]=3 821 B16R0.68 CCCCCCCCCCC(=O)CCCOC 1458a_100000741012_100000210319 [0,0,1,0,0,0|2,0,0]=3 822 B16R0.68 CCCCCCCCCCC(=O)CCCSC 1458a_100000173376_100000210319 [0,0,1,0,0,0|2,0,0]=3 823 B16R0.68 CCCCCCCCCCC(=O)CCOCC 1458a_100000210375_100011215890 [0,0,1,0,0,0|2,0,0]=3 824 B16R0.68 CCCCCCCCCCC(=O)CCOCC 1458a_100000749530_100000210319 [0,0,1,0,0,0|2,0,0]=3 825 B16R0.68 CCCCCCCCCCC(=O)CCSCC 1458a_100000210375_100000757381 [0,0,1,0,0,0|2,0,0]=3 826 B16R0.68 CCCCCCCCCCC(=O)CCSCC 1458a_100000230768_100000210319 [0,0,1,0,0,0|2,0,0]=3 827 B16R0.68 CCCCCCCCCCC(=O)COCCC 1458a_100000745993_100000210319 [0,0,1,0,0,0|2,0,0]=3 828 B16R0.68 CCCCCCCCCCC(=O)COCCO 1458a_100000708028_100000210319 [0,0,1,0,0,0|3,0,0]=4 829 B16R0.68 CCCCCCCCCCC(=O)CSCCC 1458a_100000217233_100000210319 [0,0,1,0,0,0|2,0,0]=3 830 B16R0.68 CCCCCCCCCCC(=O)NCCC#N 11a_100000720768_100000210375 [0,0,1,0,0,0|2,0,1]=4 831 B16R0.68 CCCCCCCCCCC(=O)NCCC#N 1626a_100000720768_100000210375 [0,0,1,0,0,0|2,0,1]=4 832 B16R0.68 CCCCCCCCCCC(=O)NCCC#N 240690a_100000720768_100000210375 [0,0,1,0,0,0|2,0,1]=4 833 B16R0.68 CCCCCCCCCCC(=O)NCCCC 11a_100000102301_100000210375 [0,0,1,0,0,0|1,0,0]=2 834 B16R0.68 CCCCCCCCCCC(=O)NCCCC 1626a_100000102301_100000210375 [0,0,1,0,0,0|1,0,0]=2 835 B16R0.68 CCCCCCCCCCC(=O)NCCCC 240690a_100000102301_100000210375 [0,0,1,0,0,0|1,0,0]=2 836 B16R0.68 CCCCCCCCCCC(=O)NCCCF 11a_100015189416_100000210375 [0,0,1,0,0,0|2,0,0]=3 837 B16R0.68 CCCCCCCCCCC(=O)NCCCF 1626a_100015189416_100000210375 [0,0,1,0,0,0|2,0,0]=3 838 B16R0.68 CCCCCCCCCCC(=O)NCCCF 240690a_100015189416_100000210375 [0,0,1,0,0,0|2,0,0]=3 839 B16R0.68 CCCCCCCCCCC(=O)NCCCO 240690a_100000182051_100000210375 [0,0,1,0,0,0|2,0,0]=3 840 B16R0.68 CCCCCCCCCCC(=O)NCCOC 1626a_100000209980_100000210375 [0,0,1,0,0,0|2,0,0]=3 841 B16R0.68 CCCCCCCCCCC(=O)NCCOC 240690a_100000209980_100000210375 [0,0,1,0,0,0|2,0,0]=3 842 B16R0.68 CCCCCCCCCCC(=O)NCCSC 11a_100020590264_100000210375 [0,0,1,0,0,0|2,0,0]=3 843 B16R0.68 CCCCCCCCCCC(=O)NCCSC 1626a_100020590264_100000210375 [0,0,1,0,0,0|2,0,0]=3 844 B16R0.68 CCCCCCCCCCC(=O)NCCSC 240690a_100020590264_100000210375 [0,0,1,0,0,0|2,0,0]=3 845 B16R0.68 CCCCCCCCCCC(=O)NNCCC 22a_100000740057_100000210375 [0,0,1,0,0,0|2,0,0]=3 846 B16R0.68 CCCCCCCCCCC(=O)NNCCO 22a_100000210001_100000210375 [0,0,1,0,0,0|3,0,0]=4 847 B16R0.68 CCCCCCCCCCC(C)NCCCC 270004a_100000102301_200011219864 [0,0,1,0,0,0|2,0,1]=4 848 B16R0.68 CCCCCCCCCCC(C)OCCCC 34a_100011215000_100000210210 [0,0,1,0,0,0|1,0,1]=3 849 B16R0.68 CCCCCCCCCCC(C)OCCCC 7a_100011215000_100000210211 [0,0,1,0,0,0|1,0,1]=3 850 B16R0.68 CCCCCCCCCCC(C)OCCCF 34a_100011215000_100011934791 [0,0,1,0,0,0|2,0,1]=4 851 B16R0.68 CCCCCCCCCCC(C)OCCCF 7a_100011215000_100011934791 [0,0,1,0,0,0|2,0,1]=4 852 B16R0.68 CCCCCCCCCCC(C)OCCCO 34a_100011215000_100000230001 [0,0,1,0,0,0|2,0,1]=4 853 B16R0.68 CCCCCCCCCCC(C)OCCCO 7a_100011215000_100011215043 [0,0,1,0,0,0|2,0,1]=4 854 B16R0.68 CCCCCCCCCCC(C)OCCOC 34a_100011215000_100011201679 [0,0,1,0,0,0|2,0,1]=4 855 B16R0.68 CCCCCCCCCCC(C)OCCOC 7a_100011215000_100000233755 [0,0,1,0,0,0|2,0,1]=4 856 B16R0.68 CCCCCCCCCCC(C)OCCSC 34a_100011215000_100000212216 [0,0,1,0,0,0|2,0,1]=4 857 B16R0.68 CCCCCCCCCCC(C)OCCSC 7a_100011215000_100000212216 [0,0,1,0,0,0|2,0,1]=4 858 B16R0.68 CCCCCCCCCCN(C)CCCCC 2230a_100000207566_100000210326 [0,0,1,0,0,0|3,0,0]=4 859 B16R0.68 CCCCCCCCCCN(C)CCCCC 2230a_100000223495_100000210320 [0,0,1,0,0,0|3,0,0]=4 860 B16R0.68 CCCCCCCCCCN(C)CCCCC 269982a_100000207566_100000210215 [0,0,1,0,0,0|3,0,0]=4 861 B16R0.68 CCCCCCCCCCN(C)CCCCC 269982a_100000223495_100000210320 [0,0,1,0,0,0|3,0,0]=4 862 B16R0.68 CCCCCCCCCNC(=O)CCCC#N 11a_100000212291_100000075515 [0,0,1,0,0,0|2,0,1]=4 863 B16R0.68 CCCCCCCCCNC(=O)CCCC#N 1626a_100000212291_100000075515 [0,0,1,0,0,0|2,0,1]=4 864 B16R0.68 CCCCCCCCCNC(=O)CCCC#N 240690a_100000212291_100000075515 [0,0,1,0,0,0|2,0,1]=4 865 B16R0.68 CCCCCCCCCNC(=O)CCCC#N 527a_100000212291_100000075515 [0,0,1,0,0,0|2,0,1]=4 866 B16R0.68 CCCCCCCCCNC(=O)CCCCC 11a_100000212291_100000212188 [0,0,1,0,0,0|1,0,0]=2 867 B16R0.68 CCCCCCCCCNC(=O)CCCCC 1626a_100000212291_100000212188 [0,0,1,0,0,0|1,0,0]=2 868 B16R0.68 CCCCCCCCCNC(=O)CCCCC 240690a_100000212291_100000212188 [0,0,1,0,0,0|1,0,0]=2 869 B16R0.68 CCCCCCCCCNC(=O)CCCCC 527a_100000212291_100000212188 [0,0,1,0,0,0|1,0,0]=2 870 B16R0.68 CCCCCCCCCNC(=O)CCCCO 1626a_100000212291_100000695505 [0,0,1,0,0,0|2,0,0]=3 871 B16R0.68 CCCCCCCCCNC(=O)CCCOC 11a_100000212291_100000741012 [0,0,1,0,0,0|2,0,0]=3 872 B16R0.68 CCCCCCCCCNC(=O)CCCOC 1626a_100000212291_100000741012 [0,0,1,0,0,0|2,0,0]=3 873 B16R0.68 CCCCCCCCCNC(=O)CCCOC 240690a_100000212291_100000741012 [0,0,1,0,0,0|2,0,0]=3 874 B16R0.68 CCCCCCCCCNC(=O)CCCOC 527a_100000212291_100000741012 [0,0,1,0,0,0|2,0,0]=3 875 B16R0.68 CCCCCCCCCNC(=O)CCCSC 11a_100000212291_100000173376 [0,0,1,0,0,0|2,0,0]=3 876 B16R0.68 CCCCCCCCCNC(=O)CCCSC 1626a_100000212291_100000173376 [0,0,1,0,0,0|2,0,0]=3 877 B16R0.68 CCCCCCCCCNC(=O)CCCSC 240690a_100000212291_100000173376 [0,0,1,0,0,0|2,0,0]=3 878 B16R0.68 CCCCCCCCCNC(=O)CCCSC 527a_100000212291_100000173376 [0,0,1,0,0,0|2,0,0]=3 879 B16R0.68 CCCCCCCCCNC(=O)CCOCC 11a_100000212291_100000749530 [0,0,1,0,0,0|2,0,0]=3 880 B16R0.68 CCCCCCCCCNC(=O)CCOCC 1626a_100000212291_100000749530 [0,0,1,0,0,0|2,0,0]=3 881 B16R0.68 CCCCCCCCCNC(=O)CCOCC 240690a_100000212291_100000749530 [0,0,1,0,0,0|2,0,0]=3 882 B16R0.68 CCCCCCCCCNC(=O)CCOCC 527a_100000212291_100000749530 [0,0,1,0,0,0|2,0,0]=3 883 B16R0.68 CCCCCCCCCNC(=O)CCSCC 11a_100000212291_100000230768 [0,0,1,0,0,0|2,0,0]=3 884 B16R0.68 CCCCCCCCCNC(=O)CCSCC 1626a_100000212291_100000230768 [0,0,1,0,0,0|2,0,0]=3 885 B16R0.68 CCCCCCCCCNC(=O)CCSCC 240690a_100000212291_100000230768 [0,0,1,0,0,0|2,0,0]=3 886 B16R0.68 CCCCCCCCCNC(=O)CCSCC 527a_100000212291_100000230768 [0,0,1,0,0,0|2,0,0]=3 887 B16R0.68 CCCCCCCCCNC(=O)COCCC 11a_100000212291_100000745993 [0,0,1,0,0,0|2,0,0]=3 888 B16R0.68 CCCCCCCCCNC(=O)COCCC 1626a_100000212291_100000745993 [0,0,1,0,0,0|2,0,0]=3 889 B16R0.68 CCCCCCCCCNC(=O)COCCC 240690a_100000212291_100000745993 [0,0,1,0,0,0|2,0,0]=3 890 B16R0.68 CCCCCCCCCNC(=O)COCCC 527a_100000212291_100000745993 [0,0,1,0,0,0|2,0,0]=3 891 B16R0.68 CCCCCCCCCNC(=O)COCCO 1626a_100000212291_100000708028 [0,0,1,0,0,0|3,0,0]=4 892 B16R0.68 CCCCCCCCCNC(=O)COCCO 240690a_100000212291_100000708028 [0,0,1,0,0,0|3,0,0]=4 893 B16R0.68 CCCCCCCCCNC(=O)CSCCC 11a_100000212291_100000217233 [0,0,1,0,0,0|2,0,0]=3 894 B16R0.68 CCCCCCCCCNC(=O)CSCCC 1626a_100000212291_100000217233 [0,0,1,0,0,0|2,0,0]=3 895 B16R0.68 CCCCCCCCCNC(=O)CSCCC 240690a_100000212291_100000217233 [0,0,1,0,0,0|2,0,0]=3 896 B16R0.68 CCCCCCCCCNC(=O)CSCCC 527a_100000212291_100000217233 [0,0,1,0,0,0|2,0,0]=3 897 B16R0.68 CCCCCCCCCNC(=O)NCCCC 2708a_100000102301_100000212291 [0,0,1,0,0,0|2,0,0]=3 898 B16R0.68 CCCCCCCCCNC(=O)NCCCC 2708a_100000212291_100000102301 [0,0,1,0,0,0|2,0,0]=3 899 B16R0.68 CCCCCCCCCNC(=O)NCCCC 273464a_100000102301_100000212291 [0,0,1,0,0,0|2,0,0]=3 900 B16R0.68 CCCCCCCCCNC(=O)NCCCC 273464a_100000212291_100000102301 [0,0,1,0,0,0|2,0,0]=3 901 B16R0.68 CCCCCCCCCNC(=O)NCCCC 512a_100000102301_100000212291 [0,0,1,0,0,0|2,0,0]=3 902 B16R0.68 CCCCCCCCCNC(=O)NCCCC 512a_100000212291_100000102301 [0,0,1,0,0,0|2,0,0]=3 903 B16R0.68 CCCCCCCCCNC(=O)NCCCF 2708a_100000212291_100015189416 [0,0,1,0,0,0|3,0,0]=4 904 B16R0.68 CCCCCCCCCNC(=O)NCCCF 2708a_100015189416_100000212291 [0,0,1,0,0,0|3,0,0]=4 905 B16R0.68 CCCCCCCCCNC(=O)NCCCF 273464a_100000212291_100015189416 [0,0,1,0,0,0|3,0,0]=4 906 B16R0.68 CCCCCCCCCNC(=O)NCCCF 273464a_100015189416_100000212291 [0,0,1,0,0,0|3,0,0]=4 907 B16R0.68 CCCCCCCCCNC(=O)NCCCF 512a_100000212291_100015189416 [0,0,1,0,0,0|3,0,0]=4 908 B16R0.68 CCCCCCCCCNC(=O)NCCCF 512a_100015189416_100000212291 [0,0,1,0,0,0|3,0,0]=4 909 B16R0.68 CCCCCCCCCNC(=O)NCCCO 2708a_100000212291_100000182051 [0,0,1,0,0,0|3,0,0]=4 910 B16R0.68 CCCCCCCCCNC(=O)NCCCO 273464a_100000182051_100000212291 [0,0,1,0,0,0|3,0,0]=4 911 B16R0.68 CCCCCCCCCNC(=O)NCCCO 273464a_100000212291_100000182051 [0,0,1,0,0,0|3,0,0]=4 912 B16R0.68 CCCCCCCCCNC(=O)NCCCO 512a_100000212291_100000182051 [0,0,1,0,0,0|3,0,0]=4 913 B16R0.68 CCCCCCCCCNC(=O)NCCOC 2708a_100000212291_100000209980 [0,0,1,0,0,0|3,0,0]=4 914 B16R0.68 CCCCCCCCCNC(=O)NCCOC 273464a_100000209980_100000212291 [0,0,1,0,0,0|3,0,0]=4 915 B16R0.68 CCCCCCCCCNC(=O)NCCOC 273464a_100000212291_100000209980 [0,0,1,0,0,0|3,0,0]=4 916 B16R0.68 CCCCCCCCCNC(=O)NCCSC 2708a_100000212291_100020590264 [0,0,1,0,0,0|3,0,0]=4 917 B16R0.68 CCCCCCCCCNC(=O)NCCSC 2708a_100020590264_100000212291 [0,0,1,0,0,0|3,0,0]=4 918 B16R0.68 CCCCCCCCCNC(=O)NCCSC 273464a_100000212291_100020590264 [0,0,1,0,0,0|3,0,0]=4 919 B16R0.68 CCCCCCCCCNC(=O)NCCSC 273464a_100020590264_100000212291 [0,0,1,0,0,0|3,0,0]=4 920 B16R0.68 CCCCCCCCCNC(=O)NCCSC 512a_100000212291_100020590264 [0,0,1,0,0,0|3,0,0]=4 921 B16R0.68 CCCCCCCCCNC(=O)NCCSC 512a_100020590264_100000212291 [0,0,1,0,0,0|3,0,0]=4 922 B16R0.68 CCCCCCCCCNC(=O)NNCCC 273464a_100000212291_100000740057 [0,0,1,0,0,0|3,0,0]=4 923 B16R0.68 CCCCCCCCCNC(=O)NNCCC 512a_100000212291_100000740057 [0,0,1,0,0,0|3,0,0]=4 924 B16R0.68 CCCCCCCCCNC(=O)NNCCC 512a_100000740057_100000212291 [0,0,1,0,0,0|3,0,0]=4 925 B16R0.68 CCCCCCCCCNC(C)CCCCC 2230a_100000211957_100011214924 [0,0,1,0,0,0|2,0,1]=4 926 B16R0.68 CCCCCCCCCNC(C)CCCCC 2230a_100000212291_200011218191 [0,0,1,0,0,0|2,0,1]=4 927 B16R0.68 CCCCCCCCCNC(C)CCCCC 270004a_100000212291_100000211708 [0,0,1,0,0,0|2,0,1]=4 928 B16R0.68 CCCCCCCCCNC(C)CCCCC 34a_100000212291_200011218191 [0,0,1,0,0,0|2,0,1]=4 929 B16R0.68 CCCCCCCCCOC(C)CCCCC 34a_100000210712_200011218191 [0,0,1,0,0,0|1,0,1]=3 930 B16R0.68 CCCCCCCCCOC(C)CCCCC 34a_100011215632_100011214924 [0,0,1,0,0,0|1,0,1]=3 931 B16R0.68 CCCCCCCCCOC(C)CCCCC 7a_100000210712_200011218191 [0,0,1,0,0,0|1,0,1]=3 932 B16R0.68 CCCCCCCCCOC(C)CCCCC 7a_100011215632_100000210328 [0,0,1,0,0,0|1,0,1]=3 933 B16R0.68 CCCCCCCCCOC(C)CCCOC 34a_200011539412_100011214924 [0,0,1,0,0,0|2,0,1]=4 934 B16R0.68 CCCCCCCCCOC(C)CCCOC 7a_200011539412_100000210328 [0,0,1,0,0,0|2,0,1]=4 935 B16R0.68 CCCCCCCCNCC(=O)CCCCC 2230a_100000229939_200012276598 [0,0,1,0,0,0|2,0,0]=3 936 B16R0.68 CCCCCCCCNCC(=O)CCCCC 34a_100000229939_200012276598 [0,0,1,0,0,0|2,0,0]=3 937 B16R0.68 CCCCCCCCNCC(=O)NCCCC 2230a_100000229939_100000182744 [0,0,1,0,0,0|2,0,0]=3 938 B16R0.68 CCCCCCCCNCC(=O)NCCCC 34a_100000229939_100000182744 [0,0,1,0,0,0|2,0,0]=3 939 B16R0.68 CCCCCCCCNCC(=O)NCCOC 2230a_100000229939_100000183275 [0,0,1,0,0,0|3,0,0]=4 940 B16R0.68 CCCCCCCCNCC(=O)NCCOC 2230a_100000754632_100000210759 [0,0,1,0,0,0|3,0,0]=4 941 B16R0.68 CCCCCCCCNCC(=O)NCCOC 34a_100000229939_100000183275 [0,0,1,0,0,0|3,0,0]=4 942 B16R0.68 CCCCCCCCNCC(=O)OCCCC 2230a_100000229939_100000211628 [0,0,1,0,0,0|1,0,0]=2 943 B16R0.68 CCCCCCCCNCC(=O)OCCCC 34a_100000229939_100000211628 [0,0,1,0,0,0|1,0,0]=2 944 B16R0.68 CCCCCCCCNCC(=O)OCCOC 2230a_100000229939_200000040189 [0,0,1,0,0,0|2,0,0]=3 945 B16R0.68 CCCCCCCCNCC(=O)OCCOC 34a_100000229939_200000040189 [0,0,1,0,0,0|2,0,0]=3 946 B16R0.68 CCCCCCCCOCC(=O)CCCCC 1458a_100000759886_100000210326 [0,0,1,0,0,0|2,0,0]=3 947 B16R0.68 CCCCCCCCOCC(=O)CCCCC 34a_100000210232_200012276598 [0,0,1,0,0,0|2,0,0]=3 948 B16R0.68 CCCCCCCCOCC(=O)CCCCC 7a_100000210232_200012276598 [0,0,1,0,0,0|2,0,0]=3 949 B16R0.68 CCCCCCCCOCC(=O)CCCCF 1458a_100000759886_100000729493 [0,0,1,0,0,0|3,0,0]=4 950 B16R0.68 CCCCCCCCOCC(=O)CCCCO 1458a_100000759886_100000210776 [0,0,1,0,0,0|3,0,0]=4 951 B16R0.68 CCCCCCCCOCC(=O)CCCOC 1458a_100000759886_100000740836 [0,0,1,0,0,0|3,0,0]=4 952 B16R0.68 CCCCCCCCOCC(=O)CCOCC 1458a_100000759886_100011215890 [0,0,1,0,0,0|3,0,0]=4 953 B16R0.68 CCCCCCCCOCC(=O)CCSCC 1458a_100000759886_100000757381 [0,0,1,0,0,0|3,0,0]=4 954 B16R0.68 CCCCCCCCOCC(=O)NCCCC 11a_100000102301_100000759886 [0,0,1,0,0,0|2,0,0]=3 955 B16R0.68 CCCCCCCCOCC(=O)NCCCC 1626a_100000102301_100000759886 [0,0,1,0,0,0|2,0,0]=3 956 B16R0.68 CCCCCCCCOCC(=O)NCCCC 240690a_100000102301_100000759886 [0,0,1,0,0,0|2,0,0]=3 957 B16R0.68 CCCCCCCCOCC(=O)NCCCC 34a_100000210232_100000182744 [0,0,1,0,0,0|2,0,0]=3 958 B16R0.68 CCCCCCCCOCC(=O)NCCCC 527a_100000102301_100000759886 [0,0,1,0,0,0|2,0,0]=3 959 B16R0.68 CCCCCCCCOCC(=O)NCCCC 7a_100000210232_100000182744 [0,0,1,0,0,0|2,0,0]=3 960 B16R0.68 CCCCCCCCOCC(=O)NCCCF 11a_100015189416_100000759886 [0,0,1,0,0,0|3,0,0]=4 961 B16R0.68 CCCCCCCCOCC(=O)NCCCF 1626a_100015189416_100000759886 [0,0,1,0,0,0|3,0,0]=4 962 B16R0.68 CCCCCCCCOCC(=O)NCCCF 240690a_100015189416_100000759886 [0,0,1,0,0,0|3,0,0]=4 963 B16R0.68 CCCCCCCCOCC(=O)NCCCF 527a_100015189416_100000759886 [0,0,1,0,0,0|3,0,0]=4 964 B16R0.68 CCCCCCCCOCC(=O)NCCCO 240690a_100000182051_100000759886 [0,0,1,0,0,0|3,0,0]=4 965 B16R0.68 CCCCCCCCOCC(=O)NCCCO 527a_100000182051_100000759886 [0,0,1,0,0,0|3,0,0]=4 966 B16R0.68 CCCCCCCCOCC(=O)NCCOC 1626a_100000209980_100000759886 [0,0,1,0,0,0|3,0,0]=4 967 B16R0.68 CCCCCCCCOCC(=O)NCCOC 240690a_100000209980_100000759886 [0,0,1,0,0,0|3,0,0]=4 968 B16R0.68 CCCCCCCCOCC(=O)NCCOC 34a_100000210232_100000183275 [0,0,1,0,0,0|3,0,0]=4 969 B16R0.68 CCCCCCCCOCC(=O)NCCOC 527a_100000209980_100000759886 [0,0,1,0,0,0|3,0,0]=4 970 B16R0.68 CCCCCCCCOCC(=O)NCCOC 7a_100000210232_100000183275 [0,0,1,0,0,0|3,0,0]=4 971 B16R0.68 CCCCCCCCOCC(=O)NCCSC 11a_100020590264_100000759886 [0,0,1,0,0,0|3,0,0]=4 972 B16R0.68 CCCCCCCCOCC(=O)NCCSC 1626a_100020590264_100000759886 [0,0,1,0,0,0|3,0,0]=4 973 B16R0.68 CCCCCCCCOCC(=O)NCCSC 240690a_100020590264_100000759886 [0,0,1,0,0,0|3,0,0]=4 974 B16R0.68 CCCCCCCCOCC(=O)NCCSC 527a_100020590264_100000759886 [0,0,1,0,0,0|3,0,0]=4 975 B16R0.68 CCCCCCCCOCC(=O)NNCCC 22a_100000740057_100000759886 [0,0,1,0,0,0|3,0,0]=4 976 B16R0.68 CCCCCCCCOCC(=O)OCCCC 34a_100000210232_100000211628 [0,0,1,0,0,0|1,0,0]=2 977 B16R0.68 CCCCCCCCOCC(=O)OCCCC 7a_100000210232_100000211628 [0,0,1,0,0,0|1,0,0]=2 978 B16R0.68 CCCCCCCCOCC(=O)OCCOC 34a_100000210232_200000040189 [0,0,1,0,0,0|2,0,0]=3 979 B16R0.68 CCCCCCCCOCC(=O)OCCOC 7a_100000210232_200000040189 [0,0,1,0,0,0|2,0,0]=3 980 B16R0.68 CCCCCCCCSCC(=O)CCCCC 62a_100000210759_200012276598 [0,0,1,0,0,0|2,0,0]=3 981 B16R0.68 CCCCCCCCSCC(=O)CCCCC 62a_200012276598_100000210317 [0,0,1,0,0,0|2,0,0]=3 982 B16R0.68 CCCCCCCCSCC(=O)NCCCC 62a_100000182744_100000210317 [0,0,1,0,0,0|2,0,0]=3 983 B16R0.68 CCCCCCCCSCC(=O)NCCCC 62a_100000210759_100000182744 [0,0,1,0,0,0|2,0,0]=3 984 B16R0.68 CCCCCCCCSCC(=O)NCCOC 62a_100000183275_100000210317 [0,0,1,0,0,0|3,0,0]=4 985 B16R0.68 CCCCCCCCSCC(=O)NCCOC 62a_100000210759_100000183275 [0,0,1,0,0,0|3,0,0]=4 986 B16R0.68 CCCCCCCCSCC(=O)OCCCC 62a_100000210759_100000211628 [0,0,1,0,0,0|1,0,0]=2 987 B16R0.68 CCCCCCCCSCC(=O)OCCCC 62a_100000211628_100000210317 [0,0,1,0,0,0|1,0,0]=2 988 B16R0.68 CCCCCCCCSCC(=O)OCCOC 62a_100000210759_200000040189 [0,0,1,0,0,0|2,0,0]=3 989 B16R0.68 CCCCCCCCSCC(=O)OCCOC 62a_200000040189_100000210317 [0,0,1,0,0,0|2,0,0]=3 990 B16R0.68 CCCCCCOCCOC(C)CCCCC 34a_100000691444_200011218191 [0,0,1,0,0,0|2,0,1]=4 991 B16R0.68 CCCCCCOCCOC(C)CCCCC 7a_100000691444_200011218191 [0,0,1,0,0,0|2,0,1]=4 992 B16R0.68 CCCCCNCCOCC(=O)CCCCC 34a_100000224656_200012276598 [0,0,1,0,0,0|3,0,0]=4 993 B16R0.68 CCCCCNCCOCC(=O)NCCCC 34a_100000224656_100000182744 [0,0,1,0,0,0|3,0,0]=4 994 B16R0.68 CCCCCNCCOCC(=O)OCCCC 34a_100000224656_100000211628 [0,0,1,0,0,0|2,0,0]=3 995 B16R0.68 CCCCCNCCOCC(=O)OCCOC 34a_100000224656_200000040189 [0,0,1,0,0,0|3,0,0]=4 996 B16R0.68 CCCCCOCCOCC(=O)CCCCC 34a_100011215259_200012276598 [0,0,1,0,0,0|3,0,0]=4 997 B16R0.68 CCCCCOCCOCC(=O)CCCCC 7a_100011215259_200012276598 [0,0,1,0,0,0|3,0,0]=4 998 B16R0.68 CCCCCOCCOCC(=O)NCCCC 34a_100011215259_100000182744 [0,0,1,0,0,0|3,0,0]=4 999 B16R0.68 CCCCCOCCOCC(=O)NCCCC 7a_100011215259_100000182744 [0,0,1,0,0,0|3,0,0]=4 1000 B16R0.68 CCCCCOCCOCC(=O)OCCCC 34a_100011215259_100000211628 [0,0,1,0,0,0|2,0,0]=3 1001 B16R0.68 CCCCCOCCOCC(=O)OCCCC 7a_100011215259_100000211628 [0,0,1,0,0,0|2,0,0]=3 1002 B16R0.68 CCCCCOCCOCC(=O)OCCOC 34a_100011215259_200000040189 [0,0,1,0,0,0|3,0,0]=4 1003 B16R0.68 CCCCCOCCOCC(=O)OCCOC 7a_100011215259_200000040189 [0,0,1,0,0,0|3,0,0]=4 1004 B16R0.68 CCCCNC(=O)CCCCCCCCCF 11a_100000102301_200009909015 [0,0,1,0,0,0|2,0,0]=3 1005 B16R0.68 CCCCNC(=O)CCCCCCCCCF 240690a_100000102301_200009909015 [0,0,1,0,0,0|2,0,0]=3 1006 B16R0.68 CCCCNC(=O)CCCCCCCCCF 527a_100000102301_200009909015 [0,0,1,0,0,0|2,0,0]=3 1007 B16R0.68 CCCCNC(=O)CCCCCCCCCO 240690a_100000102301_100000032657 [0,0,1,0,0,0|2,0,0]=3 1008 B16R0.68 CCCCNC(=O)CNCCCCCCCO 2230a_100011996573_100000182744 [0,0,1,0,0,0|3,0,0]=4 1009 B16R0.68 CCCCNC(=O)CNCCCCCCCO 34a_100011996573_100000182744 [0,0,1,0,0,0|3,0,0]=4 1010 B16R0.68 CCCCNC(=O)CNCCCOCCCC 2230a_200000211371_100000182744 [0,0,1,0,0,0|3,0,0]=4 1011 B16R0.68 CCCCNC(=O)CNCCCOCCCC 34a_200000211371_100000182744 [0,0,1,0,0,0|3,0,0]=4 1012 B16R0.68 CCCCNC(=O)COCCCCCCCBr 34a_100000760002_100000182744 [0,0,1,0,0,0|3,0,0]=4 1013 B16R0.68 CCCCNC(=O)COCCCCCCCBr 7a_100000760002_100000182744 [0,0,1,0,0,0|3,0,0]=4 1014 B16R0.68 CCCCNC(=O)COCCCCCCCN 34a_100011996573_100000182744 [0,0,1,0,0,0|3,0,0]=4 1015 B16R0.68 CCCCNC(=O)COCCCCCCOC 34a_200012092642_100000182744 [0,0,1,0,0,0|3,0,0]=4 1016 B16R0.68 CCCCNC(=O)COCCCCCCOC 7a_200012092642_100000182744 [0,0,1,0,0,0|3,0,0]=4 1017 B16R0.68 CCCCNC(=O)COCCCOCCCC 34a_200011215613_100000182744 [0,0,1,0,0,0|3,0,0]=4 1018 B16R0.68 CCCCNC(=O)COCCCOCCCC 7a_200011215613_100000182744 [0,0,1,0,0,0|3,0,0]=4 1019 B16R0.68 CCCCNC(=O)CSCCCCCCCO 62a_100000182744_100000760002 [0,0,1,0,0,0|3,0,0]=4 1020 B16R0.68 CCCCNC(=O)CSCCCCCCCO 62a_100000760002_100000182744 [0,0,1,0,0,0|3,0,0]=4 1021 B16R0.68 CCCCNC(=O)CSCCCCCCOC 62a_100000182744_100011998445 [0,0,1,0,0,0|3,0,0]=4 1022 B16R0.68 CCCCNC(=O)CSCCCCCCOC 62a_100011998445_100000182744 [0,0,1,0,0,0|3,0,0]=4 1023 B16R0.68 CCCCNC(=O)NCCCCCCCCO 2708a_100000102301_102515433106 [0,0,1,0,0,0|3,0,0]=4 1024 B16R0.68 CCCCNC(=O)NCCCCCCCCO 2708a_102515433106_100000102301 [0,0,1,0,0,0|3,0,0]=4 1025 B16R0.68 CCCCNC(=O)NCCCCCCCCO 273464a_100000102301_102515433106 [0,0,1,0,0,0|3,0,0]=4 1026 B16R0.68 CCCCNC(=O)NCCCCCCCCO 273464a_102515433106_100000102301 [0,0,1,0,0,0|3,0,0]=4 1027 B16R0.68 CCCCNC(=O)NCCCCCCCCO 512a_100000102301_102515433106 [0,0,1,0,0,0|3,0,0]=4 1028 B16R0.68 CCCCNC(=O)NCCCCCCCCO 512a_102515433106_100000102301 [0,0,1,0,0,0|3,0,0]=4 1029 B16R0.68 CCCCOC(=O)CNCCCCCCCO 2230a_100011996573_100000211628 [0,0,1,0,0,0|2,0,0]=3 1030 B16R0.68 CCCCOC(=O)CNCCCCCCCO 34a_100011996573_100000211628 [0,0,1,0,0,0|2,0,0]=3 1031 B16R0.68 CCCCOC(=O)CNCCCOCCCO 2230a_100011310245_100000211628 [0,0,1,0,0,0|3,0,0]=4 1032 B16R0.68 CCCCOC(=O)CNCCCOCCCO 34a_100011310245_100000211628 [0,0,1,0,0,0|3,0,0]=4 1033 B16R0.68 CCCCOC(=O)CNCCCOCCOC 2230a_100000206027_100000211628 [0,0,1,0,0,0|3,0,0]=4 1034 B16R0.68 CCCCOC(=O)CNCCCOCCOC 34a_100000206027_100000211628 [0,0,1,0,0,0|3,0,0]=4 1035 B16R0.68 CCCCOC(=O)CNCCOCCOCC 2230a_100102712874_100000211628 [0,0,1,0,0,0|3,0,0]=4 1036 B16R0.68 CCCCOC(=O)CNCCOCCOCC 34a_100102712874_100000211628 [0,0,1,0,0,0|3,0,0]=4 1037 B16R0.68 CCCCOC(=O)COCCCCCCCBr 34a_100000760002_100000211628 [0,0,1,0,0,0|2,0,0]=3 1038 B16R0.68 CCCCOC(=O)COCCCCCCCBr 7a_100000760002_100000211628 [0,0,1,0,0,0|2,0,0]=3 1039 B16R0.68 CCCCOC(=O)COCCCCCCCN 34a_100011996573_100000211628 [0,0,1,0,0,0|2,0,0]=3 1040 B16R0.68 CCCCOC(=O)COCCCCCCOC 34a_200012092642_100000211628 [0,0,1,0,0,0|2,0,0]=3 1041 B16R0.68 CCCCOC(=O)COCCCCCCOC 7a_200012092642_100000211628 [0,0,1,0,0,0|2,0,0]=3 1042 B16R0.68 CCCCOC(=O)COCCCOCCCN 34a_100011310245_100000211628 [0,0,1,0,0,0|3,0,0]=4 1043 B16R0.68 CCCCOC(=O)COCCOCCOCC 34a_100000210240_100000211628 [0,0,1,0,0,0|3,0,0]=4 1044 B16R0.68 CCCCOC(=O)COCCOCCOCC 7a_100000210240_100000211628 [0,0,1,0,0,0|3,0,0]=4 1045 B16R0.68 CCCCOC(=O)CSCCCCCCC#N 62a_100000211628_100009813337 [0,0,1,0,0,0|2,0,1]=4 1046 B16R0.68 CCCCOC(=O)CSCCCCCCC#N 62a_100009813337_100000211628 [0,0,1,0,0,0|2,0,1]=4 1047 B16R0.68 CCCCOC(=O)CSCCCCCCCO 62a_100000211628_100000760002 [0,0,1,0,0,0|2,0,0]=3 1048 B16R0.68 CCCCOC(=O)CSCCCCCCCO 62a_100000760002_100000211628 [0,0,1,0,0,0|2,0,0]=3 1049 B16R0.68 CCCCOC(=O)CSCCCCCCOC 62a_100000211628_100011998445 [0,0,1,0,0,0|2,0,0]=3 1050 B16R0.68 CCCCOC(=O)CSCCCCCCOC 62a_100011998445_100000211628 [0,0,1,0,0,0|2,0,0]=3 1051 B16R0.68 CCCCOC(=O)CSCCCOCCOC 62a_100000211628_100011216529 [0,0,1,0,0,0|3,0,0]=4 1052 B16R0.68 CCCCOC(=O)CSCCCOCCOC 62a_100011216529_100000211628 [0,0,1,0,0,0|3,0,0]=4 1053 B16R0.68 CCCCOC(=O)CSCCOCCOCC 62a_100000211628_100011211534 [0,0,1,0,0,0|3,0,0]=4 1054 B16R0.68 CCCCOC(=O)CSCCOCCOCC 62a_100011211534_100000211628 [0,0,1,0,0,0|3,0,0]=4 1055 B16R0.68 CCCCOCCCNCC(=O)OCCCC 2230a_200000211371_100000211628 [0,0,1,0,0,0|2,0,0]=3 1056 B16R0.68 CCCCOCCCNCC(=O)OCCCC 34a_200000211371_100000211628 [0,0,1,0,0,0|2,0,0]=3 1057 B16R0.68 CCCCOCCCNCC(=O)OCCOC 2230a_200000211371_200000040189 [0,0,1,0,0,0|3,0,0]=4 1058 B16R0.68 CCCCOCCCNCC(=O)OCCOC 34a_200000211371_200000040189 [0,0,1,0,0,0|3,0,0]=4 1059 B16R0.68 CCCCOCCCOCC(=O)OCCCC 34a_200011215613_100000211628 [0,0,1,0,0,0|2,0,0]=3 1060 B16R0.68 CCCCOCCCOCC(=O)OCCCC 7a_200011215613_100000211628 [0,0,1,0,0,0|2,0,0]=3 1061 B16R0.68 CCCCOCCCOCC(=O)OCCOC 34a_200011215613_200000040189 [0,0,1,0,0,0|3,0,0]=4 1062 B16R0.68 CCCCOCCCOCC(=O)OCCOC 7a_200011215613_200000040189 [0,0,1,0,0,0|3,0,0]=4 1063 B16R0.68 CCCNNC(=O)CCCCCCCCCF 22a_100000740057_200009909015 [0,0,1,0,0,0|3,0,0]=4 1064 B16R0.68 CCCNNC(=O)CCCCCCCCCO 22a_100000740057_100000032657 [0,0,1,0,0,0|3,0,0]=4 1065 B16R0.68 CCCOCC(=O)CCCCCCCCCO 1458a_100000745993_100009813782 [0,0,1,0,0,0|3,0,0]=4 1066 B16R0.68 CCCOCC(=O)NCCCCCCCCO 240690a_102515433106_100000745993 [0,0,1,0,0,0|3,0,0]=4 1067 B16R0.68 CCCSCC(=O)CCCCCCCCCO 1458a_100000217233_100009813782 [0,0,1,0,0,0|3,0,0]=4 1068 B16R0.68 CCCSCC(=O)NCCCCCCCCO 240690a_102515433106_100000217233 [0,0,1,0,0,0|3,0,0]=4 1069 B16R0.68 CCOCCC(=O)CCCCCCCCCF 1458a_200009909015_100011215890 [0,0,1,0,0,0|3,0,0]=4 1070 B16R0.68 CCOCCC(=O)CCCCCCCCCO 1458a_100000749530_100009813782 [0,0,1,0,0,0|3,0,0]=4 1071 B16R0.68 CCOCCC(=O)NCCCCCCCCO 240690a_102515433106_100000749530 [0,0,1,0,0,0|3,0,0]=4 1072 B16R0.68 CCSCCC(=O)CCCCCCCCCF 1458a_200009909015_100000757381 [0,0,1,0,0,0|3,0,0]=4 1073 B16R0.68 CCSCCC(=O)CCCCCCCCCO 1458a_100000230768_100009813782 [0,0,1,0,0,0|3,0,0]=4 1074 B16R0.68 CCSCCC(=O)NCCCCCCCCO 240690a_102515433106_100000230768 [0,0,1,0,0,0|3,0,0]=4 1075 B16R0.68 COCCCC(=O)CCCCCCCCCF 1458a_200009909015_100000740836 [0,0,1,0,0,0|3,0,0]=4 1076 B16R0.68 COCCCC(=O)CCCCCCCCCO 1458a_100000741012_100009813782 [0,0,1,0,0,0|3,0,0]=4 1077 B16R0.68 COCCCC(=O)NCCCCCCCCO 240690a_102515433106_100000741012 [0,0,1,0,0,0|3,0,0]=4 1078 B16R0.68 COCCCCCCOCC(=O)OCCOC 34a_200012092642_200000040189 [0,0,1,0,0,0|3,0,0]=4 1079 B16R0.68 COCCCCCCOCC(=O)OCCOC 7a_200012092642_200000040189 [0,0,1,0,0,0|3,0,0]=4 1080 B16R0.68 COCCCCCCSCC(=O)OCCOC 62a_100011998445_200000040189 [0,0,1,0,0,0|3,0,0]=4 1081 B16R0.68 COCCCCCCSCC(=O)OCCOC 62a_200000040189_100011998445 [0,0,1,0,0,0|3,0,0]=4 1082 B16R0.68 COCCNC(=O)CCCCCCCCCF 240690a_100000209980_200009909015 [0,0,1,0,0,0|3,0,0]=4 1083 B16R0.68 COCCNC(=O)CCCCCCCCCF 527a_100000209980_200009909015 [0,0,1,0,0,0|3,0,0]=4 1084 B16R0.68 COCCNC(=O)CCCCCCCCCO 240690a_100000209980_100000032657 [0,0,1,0,0,0|3,0,0]=4 1085 B16R0.68 COCCOC(=O)CNCCCCCCCO 2230a_100011996573_200000040189 [0,0,1,0,0,0|3,0,0]=4 1086 B16R0.68 COCCOC(=O)CNCCCCCCCO 34a_100011996573_200000040189 [0,0,1,0,0,0|3,0,0]=4 1087 B16R0.68 COCCOC(=O)COCCCCCCCBr 34a_100000760002_200000040189 [0,0,1,0,0,0|3,0,0]=4 1088 B16R0.68 COCCOC(=O)COCCCCCCCBr 7a_100000760002_200000040189 [0,0,1,0,0,0|3,0,0]=4 1089 B16R0.68 COCCOC(=O)COCCCCCCCN 34a_100011996573_200000040189 [0,0,1,0,0,0|3,0,0]=4 1090 B16R0.68 COCCOC(=O)CSCCCCCCCO 62a_100000760002_200000040189 [0,0,1,0,0,0|3,0,0]=4 1091 B16R0.68 COCCOC(=O)CSCCCCCCCO 62a_200000040189_100000760002 [0,0,1,0,0,0|3,0,0]=4 1092 B16R0.68 CSCCCC(=O)CCCCCCCCCO 1458a_100000173376_100009813782 [0,0,1,0,0,0|3,0,0]=4 1093 B16R0.68 CSCCCC(=O)NCCCCCCCCO 240690a_102515433106_100000173376 [0,0,1,0,0,0|3,0,0]=4 1094 B16R0.68 CSCCNC(=O)CCCCCCCCCF 11a_100020590264_200009909015 [0,0,1,0,0,0|3,0,0]=4 1095 B16R0.68 CSCCNC(=O)CCCCCCCCCF 240690a_100020590264_200009909015 [0,0,1,0,0,0|3,0,0]=4 1096 B16R0.68 CSCCNC(=O)CCCCCCCCCF 527a_100020590264_200009909015 [0,0,1,0,0,0|3,0,0]=4 1097 B16R0.68 CSCCNC(=O)CCCCCCCCCO 240690a_100020590264_100000032657 [0,0,1,0,0,0|3,0,0]=4 1098 B16R0.68 O=C(CCCCCCCCCF)NCCCF 11a_100015189416_200009909015 [0,0,1,0,0,0|3,0,0]=4 1099 B16R0.68 O=C(CCCCCCCCCF)NCCCF 240690a_100015189416_200009909015 [0,0,1,0,0,0|3,0,0]=4 1100 B16R0.68 O=C(CCCCCCCCCF)NCCCF 527a_100015189416_200009909015 [0,0,1,0,0,0|3,0,0]=4 1101 B16R0.68 O=C(CCCCCCCCCF)NCCCO 240690a_100000182051_200009909015 [0,0,1,0,0,0|3,0,0]=4 1102 B16R0.68 O=C(CCCCCCCCCF)NCCCO 527a_100000182051_200009909015 [0,0,1,0,0,0|3,0,0]=4 1103 B16R0.68 O=C(CCCCCCCCCO)NCCCF 240690a_100015189416_100000032657 [0,0,1,0,0,0|3,0,0]=4 1104 B16R0.68 O=C(CCCCCCCCCO)NCCCO 240690a_100000182051_100000032657 [0,0,1,0,0,0|3,0,0]=4 1105 B16R0.68 O=C(CCCCF)CCCCCCCCCF 1458a_200009909015_100000729493 [0,0,1,0,0,0|3,0,0]=4 1106 B16R0.68 O=C(CCCCO)CCCCCCCCCF 1458a_200009909015_100000210776 [0,0,1,0,0,0|3,0,0]=4 1107 B16R0.68 O=C(CCCCO)CCCCCCCCCO 1458a_100000695505_100009813782 [0,0,1,0,0,0|3,0,0]=4 1108 B16R0.136 C#CCCCCCC(=O)CCCCCCCC 1458a_100000210188_100012094781 [0,0,1,0,0,0|1,0,2]=4 1109 B16R0.136 C#CCCCCCC(=O)CCCCCCCC 1458a_100000694772_100000210759 [0,0,1,0,0,0|1,0,2]=4 1110 B16R0.136 C#CCCCCCC(=O)NCCCCCCC 11a_100000229938_100000694772 [0,0,1,0,0,0|1,0,2]=4 1111 B16R0.136 C#CCCCCCC(=O)NCCCCCCC 1626a_100000229938_100000694772 [0,0,1,0,0,0|1,0,2]=4 1112 B16R0.136 C#CCCCCCC(=O)NCCCCCCC 240690a_100000229938_100000694772 [0,0,1,0,0,0|1,0,2]=4 1113 B16R0.136 C#CCCCCCC(=O)NCCCCCCC 527a_100000229938_100000694772 [0,0,1,0,0,0|1,0,2]=4 1114 B16R0.136 C#CCCCCCCC(=O)CCCCCCC 1458a_100000034748_100000210614 [0,0,1,0,0,0|1,0,2]=4 1115 B16R0.136 C#CCCCCCCC(=O)CCCCCCC 1458a_100000211969_100012276617 [0,0,1,0,0,0|1,0,2]=4 1116 B16R0.136 C#CCCCCCCC(=O)NCCCCCC 11a_100000210581_100000034748 [0,0,1,0,0,0|1,0,2]=4 1117 B16R0.136 C#CCCCCCCC(=O)NCCCCCC 1626a_100000210581_100000034748 [0,0,1,0,0,0|1,0,2]=4 1118 B16R0.136 C#CCCCCCCC(=O)NCCCCCC 240690a_100000210581_100000034748 [0,0,1,0,0,0|1,0,2]=4 1119 B16R0.136 C#CCCCCCCC(=O)NCCCCCC 527a_100000210581_100000034748 [0,0,1,0,0,0|1,0,2]=4 1120 B16R0.136 C#CCCCCNC(=O)CCCCCCCC 11a_100000706060_100000210188 [0,0,1,0,0,0|1,0,2]=4 1121 B16R0.136 C#CCCCCNC(=O)CCCCCCCC 1626a_100000706060_100000210188 [0,0,1,0,0,0|1,0,2]=4 1122 B16R0.136 C#CCCCCNC(=O)CCCCCCCC 240690a_100000706060_100000210188 [0,0,1,0,0,0|1,0,2]=4 1123 B16R0.136 C#CCCCCNC(=O)CCCCCCCC 527a_100000706060_100000210188 [0,0,1,0,0,0|1,0,2]=4 1124 B16R0.136 C#CCCCNCOC(=O)CCCCCCC 34a_100000718082_100009852258 [0,0,1,0,0,0|1,0,2]=4 1125 B16R0.136 C#CCCCOCOC(=O)CCCCCCC 34a_100000215630_100009852258 [0,0,1,0,0,0|1,0,2]=4 1126 B16R0.136 C#CCCCOCOC(=O)CCCCCCC 7a_100000215630_100009852258 [0,0,1,0,0,0|1,0,2]=4 1127 B16R0.136 C#CCCCSCOC(=O)CCCCCCC 62a_100011215417_100009852258 [0,0,1,0,0,0|1,0,2]=4 1128 B16R0.136 C/C=C/CCOCOC(=O)CCCCCCC 34a_100016278192_100009852258 [0,0,1,0,0,0|1,0,2]=4 1129 B16R0.136 C=CCCCCCC(=O)CCCCCCCC 1458a_100000210188_100000700193 [0,0,1,0,0,0|1,0,2]=4 1130 B16R0.136 C=CCCCCCC(=O)CCCCCCCC 1458a_100011934241_100000210759 [0,0,1,0,0,0|1,0,2]=4 1131 B16R0.136 C=CCCCCCC(=O)NCCCCCCC 11a_100000229938_100011934241 [0,0,1,0,0,0|1,0,2]=4 1132 B16R0.136 C=CCCCCCC(=O)NCCCCCCC 1626a_100000229938_100011934241 [0,0,1,0,0,0|1,0,2]=4 1133 B16R0.136 C=CCCCCCC(=O)NCCCCCCC 240690a_100000229938_100011934241 [0,0,1,0,0,0|1,0,2]=4 1134 B16R0.136 C=CCCCCCC(=O)NCCCCCCC 527a_100000229938_100011934241 [0,0,1,0,0,0|1,0,2]=4 1135 B16R0.136 C=CCCCCCCC(=O)CCCCCCC 1458a_100000211969_100011215473 [0,0,1,0,0,0|1,0,2]=4 1136 B16R0.136 C=CCCCCCCC(=O)CCCCCCC 1458a_100011809334_100000210614 [0,0,1,0,0,0|1,0,2]=4 1137 B16R0.136 C=CCCCCCCC(=O)NCCCCCC 11a_100000210581_100011809334 [0,0,1,0,0,0|1,0,2]=4 1138 B16R0.136 C=CCCCCCCC(=O)NCCCCCC 1626a_100000210581_100011809334 [0,0,1,0,0,0|1,0,2]=4 1139 B16R0.136 C=CCCCCCCC(=O)NCCCCCC 240690a_100000210581_100011809334 [0,0,1,0,0,0|1,0,2]=4 1140 B16R0.136 C=CCCCCCCC(=O)NCCCCCC 527a_100000210581_100011809334 [0,0,1,0,0,0|1,0,2]=4 1141 B16R0.136 C=CCCCCNC(=O)CCCCCCCC 11a_100000703577_100000210188 [0,0,1,0,0,0|1,0,2]=4 1142 B16R0.136 C=CCCCCNC(=O)CCCCCCCC 1626a_100000703577_100000210188 [0,0,1,0,0,0|1,0,2]=4 1143 B16R0.136 C=CCCCCNC(=O)CCCCCCCC 240690a_100000703577_100000210188 [0,0,1,0,0,0|1,0,2]=4 1144 B16R0.136 C=CCCCCNC(=O)CCCCCCCC 527a_100000703577_100000210188 [0,0,1,0,0,0|1,0,2]=4 1145 B16R0.136 C=CCCCNCOC(=O)CCCCCCC 2230a_100000700776_100009852258 [0,0,1,0,0,0|1,0,2]=4 1146 B16R0.136 C=CCCCNCOC(=O)CCCCCCC 34a_100000700776_100009852258 [0,0,1,0,0,0|1,0,2]=4 1147 B16R0.136 C=CCCCOCOC(=O)CCCCCCC 34a_100000758997_100009852258 [0,0,1,0,0,0|1,0,2]=4 1148 B16R0.136 C=CCCCOCOC(=O)CCCCCCC 7a_100000758997_100009852258 [0,0,1,0,0,0|1,0,2]=4 1149 B16R0.136 C=CCCCSCOC(=O)CCCCCCC 62a_100011713584_100009852258 [0,0,1,0,0,0|1,0,2]=4 1150 B16R0.136 CC#CCCOCOC(=O)CCCCCCC 34a_100000750427_100009852258 [0,0,1,0,0,0|1,0,2]=4 1151 B16R0.136 CC/C=C\COCOC(=O)CCCCCCC 34a_100016268518_100009852258 [0,0,1,0,0,0|1,0,2]=4 1152 B16R0.136 CC/C=C\CSCOC(=O)CCCCCCC 62a_100103147603_100009852258 [0,0,1,0,0,0|1,0,2]=4 1153 B16R0.136 CCC#CCOCOC(=O)CCCCCCC 34a_100000032950_100009852258 [0,0,1,0,0,0|1,0,2]=4 1154 B16R0.136 CCC#CCSCOC(=O)CCCCCCC 62a_100009813939_100009852258 [0,0,1,0,0,0|1,0,2]=4 1155 B16R0.136 CCCC/C=C/CC(=O)CCCCCCCC 1458a_200016282684_100000210759 [0,0,1,0,0,0|1,0,2]=4 1156 B16R0.136 CCCC/C=C/CC(=O)NCCCCCCC 11a_100000229938_200016282684 [0,0,1,0,0,0|1,0,2]=4 1157 B16R0.136 CCCC/C=C/CC(=O)NCCCCCCC 1626a_100000229938_200016282684 [0,0,1,0,0,0|1,0,2]=4 1158 B16R0.136 CCCC/C=C/CC(=O)NCCCCCCC 240690a_100000229938_200016282684 [0,0,1,0,0,0|1,0,2]=4 1159 B16R0.136 CCCC/C=C/CC(=O)NCCCCCCC 527a_100000229938_200016282684 [0,0,1,0,0,0|1,0,2]=4 1160 B16R0.136 CCCCC/C=C/CC(=O)CCCCCCC 1458a_100020675968_100000210614 [0,0,1,0,0,0|1,0,2]=4 1161 B16R0.136 CCCCC/C=C/CC(=O)NCCCCCC 11a_100000210581_100020675968 [0,0,1,0,0,0|1,0,2]=4 1162 B16R0.136 CCCCC/C=C/CC(=O)NCCCCCC 1626a_100000210581_100020675968 [0,0,1,0,0,0|1,0,2]=4 1163 B16R0.136 CCCCC/C=C/CC(=O)NCCCCCC 240690a_100000210581_100020675968 [0,0,1,0,0,0|1,0,2]=4 1164 B16R0.136 CCCCCC#CC(=O)CCCCCCCC 1458a_100011215388_100000210759 [0,0,1,0,0,0|1,0,1]=3 1165 B16R0.136 CCCCCC#CC(=O)CCCCCCCO 1458a_100011215388_100000760002 [0,0,1,0,0,0|2,0,1]=4 1166 B16R0.136 CCCCCC#CC(=O)CCCCCCOC 1458a_100011215388_100011998445 [0,0,1,0,0,0|2,0,1]=4 1167 B16R0.136 CCCCCC#CC(=O)NCCCCCCC 240690a_100000229938_100011215388 [0,0,1,0,0,0|1,0,2]=4 1168 B16R0.136 CCCCCC#CCC(=O)CCCCCCC 1458a_100000211969_100009816472 [0,0,1,0,0,0|1,0,2]=4 1169 B16R0.136 CCCCCC=CC(=O)CCCCCCCC 1458a_100016263427_100000210759 [0,0,1,0,0,0|1,0,1]=3 1170 B16R0.136 CCCCCC=CC(=O)CCCCCCCO 1458a_100016263427_100000760002 [0,0,1,0,0,0|2,0,1]=4 1171 B16R0.136 CCCCCC=CC(=O)CCCCCCOC 1458a_100016263427_100011998445 [0,0,1,0,0,0|2,0,1]=4 1172 B16R0.136 CCCCCC=CC(=O)NCCCCCCC 11a_100000229938_100016263427 [0,0,1,0,0,0|1,0,2]=4 1173 B16R0.136 CCCCCC=CC(=O)NCCCCCCC 1626a_100000229938_100016263427 [0,0,1,0,0,0|1,0,2]=4 1174 B16R0.136 CCCCCC=CC(=O)NCCCCCCC 240690a_100000229938_100016263427 [0,0,1,0,0,0|1,0,2]=4 1175 B16R0.136 CCCCCC=NNC(=O)CCCCCCC 4a_100000181853_100000737632 [0,0,1,0,0,0|2,0,1]=4 1176 B16R0.136 CCCCCCC=CC(=O)CCCCCCC 1458a_200015324643_100000210614 [0,0,1,0,0,0|1,0,1]=3 1177 B16R0.136 CCCCCCC=CC(=O)CCCCCCF 1458a_200015324643_100015922095 [0,0,1,0,0,0|2,0,1]=4 1178 B16R0.136 CCCCCCC=CC(=O)CCCCCCO 1458a_200015324643_100000766143 [0,0,1,0,0,0|2,0,1]=4 1179 B16R0.136 CCCCCCC=CC(=O)CCOCCCC 1458a_200015324643_100000743108 [0,0,1,0,0,0|2,0,1]=4 1180 B16R0.136 CCCCCCC=CC(=O)NCCCCCC 11a_100000210581_200015324643 [0,0,1,0,0,0|1,0,2]=4 1181 B16R0.136 CCCCCCC=CC(=O)NCCCCCC 1626a_100000210581_200015324643 [0,0,1,0,0,0|1,0,2]=4 1182 B16R0.136 CCCCCCC=CC(=O)NCCCCCC 240690a_100000210581_200015324643 [0,0,1,0,0,0|1,0,2]=4 1183 B16R0.136 CCCCCCCC(=O)CCCCCCC#N 1458a_100000211969_100009813337 [0,0,1,0,0,0|2,0,1]=4 1184 B16R0.136 CCCCCCCC(=O)CCCCCCCO 1458a_100000211969_100000760002 [0,0,1,0,0,0|2,0,0]=3 1185 B16R0.136 CCCCCCCC(=O)CCCCCCCO 1458a_100011219782_100000210614 [0,0,1,0,0,0|2,0,0]=3 1186 B16R0.136 CCCCCCCC(=O)CCCCCCOC 1458a_100000211969_100011998445 [0,0,1,0,0,0|2,0,0]=3 1187 B16R0.136 CCCCCCCC(=O)CCCOCCOC 1458a_100000211969_100011216529 [0,0,1,0,0,0|3,0,0]=4 1188 B16R0.136 CCCCCCCC(=O)CCOCCOCC 1458a_100000211969_100011211534 [0,0,1,0,0,0|3,0,0]=4 1189 B16R0.136 CCCCCCCC(=O)NCCCCCC#N 11a_100000061152_100000211969 [0,0,1,0,0,0|2,0,1]=4 1190 B16R0.136 CCCCCCCC(=O)NCCCCCC#N 1626a_100000061152_100000211969 [0,0,1,0,0,0|2,0,1]=4 1191 B16R0.136 CCCCCCCC(=O)NCCCCCC#N 240690a_100000061152_100000211969 [0,0,1,0,0,0|2,0,1]=4 1192 B16R0.136 CCCCCCCC(=O)NCCCCCC#N 527a_100000061152_100000211969 [0,0,1,0,0,0|2,0,1]=4 1193 B16R0.136 CCCCCCCC(=O)NCCCCCCO 240690a_100000686447_100000211969 [0,0,1,0,0,0|2,0,0]=3 1194 B16R0.136 CCCCCCCC(=O)NCCCCCCO 527a_100000686447_100000211969 [0,0,1,0,0,0|2,0,0]=3 1195 B16R0.136 CCCCCCCC(=O)NCCCCCOC 11a_100000747528_100000211969 [0,0,1,0,0,0|2,0,0]=3 1196 B16R0.136 CCCCCCCC(=O)NCCCCCOC 1626a_100000747528_100000211969 [0,0,1,0,0,0|2,0,0]=3 1197 B16R0.136 CCCCCCCC(=O)NCCCCCOC 240690a_100000747528_100000211969 [0,0,1,0,0,0|2,0,0]=3 1198 B16R0.136 CCCCCCCC(=O)NCCCCCOC 527a_100000747528_100000211969 [0,0,1,0,0,0|2,0,0]=3 1199 B16R0.136 CCCCCCCC(=O)NCCCOCCC 1626a_100011217757_100000211969 [0,0,1,0,0,0|2,0,0]=3 1200 B16R0.136 CCCCCCCC(=O)NCCCOCCC 240690a_100011217757_100000211969 [0,0,1,0,0,0|2,0,0]=3 1201 B16R0.136 CCCCCCCC(=O)NCCCOCCC 527a_100011217757_100000211969 [0,0,1,0,0,0|2,0,0]=3 1202 B16R0.136 CCCCCCCC(=O)NCCOCCOC 11a_100000745349_100000211969 [0,0,1,0,0,0|3,0,0]=4 1203 B16R0.136 CCCCCCCC(=O)NCCOCCOC 1626a_100000745349_100000211969 [0,0,1,0,0,0|3,0,0]=4 1204 B16R0.136 CCCCCCCC(=O)NCCOCCOC 240690a_100000745349_100000211969 [0,0,1,0,0,0|3,0,0]=4 1205 B16R0.136 CCCCCCCC(=O)NCCOCCOC 527a_100000745349_100000211969 [0,0,1,0,0,0|3,0,0]=4 1206 B16R0.136 CCCCCCCC(=O)NCCSCCCC 11a_100025743550_100000211969 [0,0,1,0,0,0|2,0,0]=3 1207 B16R0.136 CCCCCCCC(=O)NCCSCCCC 1626a_100025743550_100000211969 [0,0,1,0,0,0|2,0,0]=3 1208 B16R0.136 CCCCCCCC(=O)NCCSCCCC 240690a_100025743550_100000211969 [0,0,1,0,0,0|2,0,0]=3 1209 B16R0.136 CCCCCCCC(=O)NCCSCCCC 527a_100025743550_100000211969 [0,0,1,0,0,0|2,0,0]=3 1210 B16R0.136 CCCCCCCC(=O)OCNCCCCC 2230a_100000209983_100009852258 [0,0,1,0,0,0|1,0,0]=2 1211 B16R0.136 CCCCCCCC(=O)OCNCCCCO 2230a_100000750430_100009852258 [0,0,1,0,0,0|2,0,0]=3 1212 B16R0.136 CCCCCCCC(=O)OCNCCCCO 34a_100000750430_100009852258 [0,0,1,0,0,0|2,0,0]=3 1213 B16R0.136 CCCCCCCC(=O)OCNCCCOC 34a_100150723488_100009852258 [0,0,1,0,0,0|2,0,0]=3 1214 B16R0.136 CCCCCCCC(=O)OCNCCCSC 2230a_100000749238_100009852258 [0,0,1,0,0,0|2,0,0]=3 1215 B16R0.136 CCCCCCCC(=O)OCNCCOCC 2230a_102516460346_100009852258 [0,0,1,0,0,0|2,0,0]=3 1216 B16R0.136 CCCCCCCC(=O)OCNCCOCC 34a_102516460346_100009852258 [0,0,1,0,0,0|2,0,0]=3 1217 B16R0.136 CCCCCCCC(=O)OCNCCSCC 2230a_100000106463_100009852258 [0,0,1,0,0,0|2,0,0]=3 1218 B16R0.136 CCCCCCCC(=O)OCOCCCCBr 34a_100011216708_100009852258 [0,0,1,0,0,0|2,0,0]=3 1219 B16R0.136 CCCCCCCC(=O)OCOCCCCC 34a_100000210253_100009852258 [0,0,1,0,0,0|1,0,0]=2 1220 B16R0.136 CCCCCCCC(=O)OCOCCCCC 7a_100000210253_100009852258 [0,0,1,0,0,0|1,0,0]=2 1221 B16R0.136 CCCCCCCC(=O)OCOCCCCCl 34a_100000210776_100009852258 [0,0,1,0,0,0|2,0,0]=3 1222 B16R0.136 CCCCCCCC(=O)OCOCCCCCl 7a_100000210776_100009852258 [0,0,1,0,0,0|2,0,0]=3 1223 B16R0.136 CCCCCCCC(=O)OCOCCCCF 34a_100011995726_100009852258 [0,0,1,0,0,0|2,0,0]=3 1224 B16R0.136 CCCCCCCC(=O)OCOCCCCF 7a_100011995726_100009852258 [0,0,1,0,0,0|2,0,0]=3 1225 B16R0.136 CCCCCCCC(=O)OCOCCCCI 34a_200012148704_100009852258 [0,0,1,0,0,0|2,0,0]=3 1226 B16R0.136 CCCCCCCC(=O)OCOCCCCN 34a_100000750430_100009852258 [0,0,1,0,0,0|2,0,0]=3 1227 B16R0.136 CCCCCCCC(=O)OCOCCCNC 34a_100000213112_100009852258 [0,0,1,0,0,0|2,0,0]=3 1228 B16R0.136 CCCCCCCC(=O)OCOCCCOC 34a_100000740835_100009852258 [0,0,1,0,0,0|2,0,0]=3 1229 B16R0.136 CCCCCCCC(=O)OCOCCCSC 34a_100000690336_100009852258 [0,0,1,0,0,0|2,0,0]=3 1230 B16R0.136 CCCCCCCC(=O)OCOCCCSC 7a_100000690336_100009852258 [0,0,1,0,0,0|2,0,0]=3 1231 B16R0.136 CCCCCCCC(=O)OCOCCOCC 34a_100000210136_100009852258 [0,0,1,0,0,0|2,0,0]=3 1232 B16R0.136 CCCCCCCC(=O)OCOCCOCC 7a_100000210136_100009852258 [0,0,1,0,0,0|2,0,0]=3 1233 B16R0.136 CCCCCCCC(=O)OCOCCSCC 34a_100000212035_100009852258 [0,0,1,0,0,0|2,0,0]=3 1234 B16R0.136 CCCCCCCC(=O)OCOCCSCC 7a_100000212035_100009852258 [0,0,1,0,0,0|2,0,0]=3 1235 B16R0.136 CCCCCCCC(=O)OCSCCCC#N 62a_100000687738_100009852258 [0,0,1,0,0,0|2,0,1]=4 1236 B16R0.136 CCCCCCCC(=O)OCSCCCC=O 62a_200011292268_100009852258 [0,0,1,0,0,0|2,0,1]=4 1237 B16R0.136 CCCCCCCC(=O)OCSCCCCC 62a_100000210326_100009852258 [0,0,1,0,0,0|1,0,0]=2 1238 B16R0.136 CCCCCCCC(=O)OCSCCCCF 62a_100000729493_100009852258 [0,0,1,0,0,0|2,0,0]=3 1239 B16R0.136 CCCCCCCC(=O)OCSCCCCO 62a_100000210776_100009852258 [0,0,1,0,0,0|2,0,0]=3 1240 B16R0.136 CCCCCCCC(=O)OCSCCCOC 62a_100000709357_100009852258 [0,0,1,0,0,0|2,0,0]=3 1241 B16R0.136 CCCCCCCC(=O)OCSCCOCC 62a_100000210147_100009852258 [0,0,1,0,0,0|2,0,0]=3 1242 B16R0.136 CCCCCCCC(=O)OCSCCSCC 62a_100000757381_100009852258 [0,0,1,0,0,0|2,0,0]=3 1243 B16R0.136 CCCCCCCC(C)OCCCCCCBr 34a_100011215345_200011218727 [0,0,1,0,0,0|2,0,1]=4 1244 B16R0.136 CCCCCCCC(C)OCCCCCCBr 7a_100011215345_200011218727 [0,0,1,0,0,0|2,0,1]=4 1245 B16R0.136 CCCCCCCC(C)OCCCCCCCl 34a_100000766143_200011218727 [0,0,1,0,0,0|2,0,1]=4 1246 B16R0.136 CCCCCCCC(C)OCCCCCCCl 7a_100000766143_200011218727 [0,0,1,0,0,0|2,0,1]=4 1247 B16R0.136 CCCCCCCC(C)OCCCCCCF 34a_100000732779_200011218727 [0,0,1,0,0,0|2,0,1]=4 1248 B16R0.136 CCCCCCCC(C)OCCCCCCF 34a_200011215852_100015922095 [0,0,1,0,0,0|2,0,1]=4 1249 B16R0.136 CCCCCCCC(C)OCCCCCCF 7a_100000732779_200011218727 [0,0,1,0,0,0|2,0,1]=4 1250 B16R0.136 CCCCCCCC(C)OCCCCCCF 7a_200011215852_100015922095 [0,0,1,0,0,0|2,0,1]=4 1251 B16R0.136 CCCCCCCC(C)OCCCCCCN 34a_100000686447_200011218727 [0,0,1,0,0,0|2,0,1]=4 1252 B16R0.136 CCCCCCCC(C)OCCCCCCO 34a_200011215852_100000766143 [0,0,1,0,0,0|2,0,1]=4 1253 B16R0.136 CCCCCCCC(C)OCCCCCCO 7a_200011215852_100000766143 [0,0,1,0,0,0|2,0,1]=4 1254 B16R0.136 CCCCCCCC(C)OCCCCCNC 34a_100000722520_200011218727 [0,0,1,0,0,0|2,0,1]=4 1255 B16R0.136 CCCCCCCC(C)OCCOCCCC 34a_100000210238_200011218727 [0,0,1,0,0,0|2,0,1]=4 1256 B16R0.136 CCCCCCCC(C)OCCOCCCC 34a_200011215852_100000743108 [0,0,1,0,0,0|2,0,1]=4 1257 B16R0.136 CCCCCCCC(C)OCCOCCCC 7a_100000210238_200011218727 [0,0,1,0,0,0|2,0,1]=4 1258 B16R0.136 CCCCCCCC(C)OCCOCCCC 7a_200011215852_100000743108 [0,0,1,0,0,0|2,0,1]=4 1259 B16R0.136 CCCCCCCC(C)OCCSCCCC 34a_200000230436_200011218727 [0,0,1,0,0,0|2,0,1]=4 1260 B16R0.136 CCCCCCCC(C)OCCSCCCC 7a_200000230436_200011218727 [0,0,1,0,0,0|2,0,1]=4 1261 B16R0.136 CCCCCCCCC(=NNCCCCC)C 4a_100000694160_100011216694 [0,0,1,0,0,0|3,0,0]=4 1262 B16R0.136 CCCCCCCCC(=O)CCCCCC#N 1458a_100000210188_100009813376 [0,0,1,0,0,0|2,0,1]=4 1263 B16R0.136 CCCCCCCCC(=O)CCCCCCC 1458a_100000210188_100000210614 [0,0,1,0,0,0|1,0,0]=2 1264 B16R0.136 CCCCCCCCC(=O)CCCCCCC 1458a_100000211969_100000210759 [0,0,1,0,0,0|1,0,0]=2 1265 B16R0.136 CCCCCCCCC(=O)CCCCCCF 1458a_100000210188_100015922095 [0,0,1,0,0,0|2,0,0]=3 1266 B16R0.136 CCCCCCCCC(=O)CCCCCCO 1458a_100000210188_100000766143 [0,0,1,0,0,0|2,0,0]=3 1267 B16R0.136 CCCCCCCCC(=O)CCCCCCO 1458a_100011996774_100000210759 [0,0,1,0,0,0|2,0,0]=3 1268 B16R0.136 CCCCCCCCC(=O)CCCCCOC 1458a_100011935119_100000210759 [0,0,1,0,0,0|2,0,0]=3 1269 B16R0.136 CCCCCCCCC(=O)CCOCCCC 1458a_100000210188_100000743108 [0,0,1,0,0,0|2,0,0]=3 1270 B16R0.136 CCCCCCCCC(=O)CCOCCOC 1458a_100000210188_100000695917 [0,0,1,0,0,0|3,0,0]=4 1271 B16R0.136 CCCCCCCCC(=O)CCOCCOC 1458a_100000745395_100000210759 [0,0,1,0,0,0|3,0,0]=4 1272 B16R0.136 CCCCCCCCC(=O)NCCCCC#N 11a_100000751965_100000210188 [0,0,1,0,0,0|2,0,1]=4 1273 B16R0.136 CCCCCCCCC(=O)NCCCCC#N 1626a_100000751965_100000210188 [0,0,1,0,0,0|2,0,1]=4 1274 B16R0.136 CCCCCCCCC(=O)NCCCCC#N 240690a_100000751965_100000210188 [0,0,1,0,0,0|2,0,1]=4 1275 B16R0.136 CCCCCCCCC(=O)NCCCCC#N 527a_100000751965_100000210188 [0,0,1,0,0,0|2,0,1]=4 1276 B16R0.136 CCCCCCCCC(=O)NCCCCCC 11a_100000210581_100000210188 [0,0,1,0,0,0|1,0,0]=2 1277 B16R0.136 CCCCCCCCC(=O)NCCCCCC 1626a_100000210581_100000210188 [0,0,1,0,0,0|1,0,0]=2 1278 B16R0.136 CCCCCCCCC(=O)NCCCCCC 240690a_100000210581_100000210188 [0,0,1,0,0,0|1,0,0]=2 1279 B16R0.136 CCCCCCCCC(=O)NCCCCCC 527a_100000210581_100000210188 [0,0,1,0,0,0|1,0,0]=2 1280 B16R0.136 CCCCCCCCC(=O)NCCCCCO 240690a_100000762737_100000210188 [0,0,1,0,0,0|2,0,0]=3 1281 B16R0.136 CCCCCCCCC(=O)NCCCOCC 11a_100000210961_100000210188 [0,0,1,0,0,0|2,0,0]=3 1282 B16R0.136 CCCCCCCCC(=O)NCCCOCC 1626a_100000210961_100000210188 [0,0,1,0,0,0|2,0,0]=3 1283 B16R0.136 CCCCCCCCC(=O)NCCCOCC 240690a_100000210961_100000210188 [0,0,1,0,0,0|2,0,0]=3 1284 B16R0.136 CCCCCCCCC(=O)NCCCOCC 527a_100000210961_100000210188 [0,0,1,0,0,0|2,0,0]=3 1285 B16R0.136 CCCCCCCCC(=O)NCCOCCC 1626a_100161115042_100000210188 [0,0,1,0,0,0|2,0,0]=3 1286 B16R0.136 CCCCCCCCC(=O)NCCOCCC 240690a_100161115042_100000210188 [0,0,1,0,0,0|2,0,0]=3 1287 B16R0.136 CCCCCCCCC(=O)NCCOCCC 527a_100161115042_100000210188 [0,0,1,0,0,0|2,0,0]=3 1288 B16R0.136 CCCCCCCCC(=O)NCCOCCO 240690a_100000211614_100000210188 [0,0,1,0,0,0|3,0,0]=4 1289 B16R0.136 CCCCCCCCC(=O)NCCSCCC 11a_100020603323_100000210188 [0,0,1,0,0,0|2,0,0]=3 1290 B16R0.136 CCCCCCCCC(=O)NCCSCCC 240690a_100020603323_100000210188 [0,0,1,0,0,0|2,0,0]=3 1291 B16R0.136 CCCCCCCCC(=O)NCCSCCC 527a_100020603323_100000210188 [0,0,1,0,0,0|2,0,0]=3 1292 B16R0.136 CCCCCCCCC(=O)NCCSCCO 240690a_100011219999_100000210188 [0,0,1,0,0,0|3,0,0]=4 1293 B16R0.136 CCCCCCCCC(=O)NCCSCCO 527a_100011219999_100000210188 [0,0,1,0,0,0|3,0,0]=4 1294 B16R0.136 CCCCCCCCC(=O)NNCCCCC 22a_100000694160_100000210188 [0,0,1,0,0,0|2,0,0]=3 1295 B16R0.136 CCCCCCCCC(=O)NNCCCOC 22a_100025702787_100000210188 [0,0,1,0,0,0|3,0,0]=4 1296 B16R0.136 CCCCCCCCC(=O)NNCCOCC 22a_100000732670_100000210188 [0,0,1,0,0,0|3,0,0]=4 1297 B16R0.136 CCCCCCCCC(C)NCCCCCC 270004a_100000210581_100011216694 [0,0,1,0,0,0|2,0,1]=4 1298 B16R0.136 CCCCCCCCC(C)OCCCCCC 34a_100000210740_100000210314 [0,0,1,0,0,0|1,0,1]=3 1299 B16R0.136 CCCCCCCCC(C)OCCCCCC 7a_100000210740_100000210314 [0,0,1,0,0,0|1,0,1]=3 1300 B16R0.136 CCCCCCCCC(C)OCCCCCF 34a_100000210740_100000729378 [0,0,1,0,0,0|2,0,1]=4 1301 B16R0.136 CCCCCCCCC(C)OCCCCCF 7a_100000210740_100000729378 [0,0,1,0,0,0|2,0,1]=4 1302 B16R0.136 CCCCCCCCC(C)OCCCCCO 34a_100000210740_100000746330 [0,0,1,0,0,0|2,0,1]=4 1303 B16R0.136 CCCCCCCCC(C)OCCCCCO 7a_100000210740_100000746330 [0,0,1,0,0,0|2,0,1]=4 1304 B16R0.136 CCCCCCCCC(C)OCCCCOC 34a_100000210740_100000755781 [0,0,1,0,0,0|2,0,1]=4 1305 B16R0.136 CCCCCCCCC(C)OCCCCOC 7a_100000210740_100000730899 [0,0,1,0,0,0|2,0,1]=4 1306 B16R0.136 CCCCCCCCC(C)OCCCOCC 34a_100000210740_100012232248 [0,0,1,0,0,0|2,0,1]=4 1307 B16R0.136 CCCCCCCCC(C)OCCCOCC 7a_100000210740_100012232248 [0,0,1,0,0,0|2,0,1]=4 1308 B16R0.136 CCCCCCCCC(C)OCCOCCC 34a_100000210740_100011215938 [0,0,1,0,0,0|2,0,1]=4 1309 B16R0.136 CCCCCCCCC(C)OCCOCCC 7a_100000210740_100011215938 [0,0,1,0,0,0|2,0,1]=4 1310 B16R0.136 CCCCCCCCC(C)OCOCCCC 34a_100000210740_100011995733 [0,0,1,0,0,0|2,0,1]=4 1311 B16R0.136 CCCCCCCCN(C)CCCCCCC 2230a_100000207567_100000210681 [0,0,1,0,0,0|3,0,0]=4 1312 B16R0.136 CCCCCCCCN(C)CCCCCCC 2230a_100000228206_100000210759 [0,0,1,0,0,0|3,0,0]=4 1313 B16R0.136 CCCCCCCCN(C)CCCCCCC 2230a_200000271651_200000210301 [0,0,1,0,0,0|3,0,0]=4 1314 B16R0.136 CCCCCCCCN(C)CCCCCCC 269982a_100000207567_100000210681 [0,0,1,0,0,0|3,0,0]=4 1315 B16R0.136 CCCCCCCCN(C)CCCCCCC 269982a_100000228206_100000210759 [0,0,1,0,0,0|3,0,0]=4 1316 B16R0.136 CCCCCCCCN(C)CCCCCCC 269982a_200000271651_200000210301 [0,0,1,0,0,0|3,0,0]=4 1317 B16R0.136 CCCCCCCCN([13CH3])CCCCCCC 2230a_200000271651_200025704644 [0,0,1,0,0,0|3,0,0]=4 1318 B16R0.136 CCCCCCCCN([13CH3])CCCCCCC 269982a_200000271651_200025704644 [0,0,1,0,0,0|3,0,0]=4 1319 B16R0.136 CCCCCCCNC(=O)CCCCCCC 11a_100000229938_100000211969 [0,0,1,0,0,0|1,0,0]=2 1320 B16R0.136 CCCCCCCNC(=O)CCCCCCC 1626a_100000229938_100000211969 [0,0,1,0,0,0|1,0,0]=2 1321 B16R0.136 CCCCCCCNC(=O)CCCCCCC 240690a_100000229938_100000211969 [0,0,1,0,0,0|1,0,0]=2 1322 B16R0.136 CCCCCCCNC(=O)CCCCCCC 527a_100000229938_100000211969 [0,0,1,0,0,0|1,0,0]=2 1323 B16R0.136 CCCCCCCNC(=O)CCCCCCO 240690a_100000229938_100011996774 [0,0,1,0,0,0|2,0,0]=3 1324 B16R0.136 CCCCCCCNC(=O)CCCCCOC 11a_100000229938_100011935119 [0,0,1,0,0,0|2,0,0]=3 1325 B16R0.136 CCCCCCCNC(=O)CCCCCOC 1626a_100000229938_100011935119 [0,0,1,0,0,0|2,0,0]=3 1326 B16R0.136 CCCCCCCNC(=O)CCCCCOC 240690a_100000229938_100011935119 [0,0,1,0,0,0|2,0,0]=3 1327 B16R0.136 CCCCCCCNC(=O)CCCCCOC 527a_100000229938_100011935119 [0,0,1,0,0,0|2,0,0]=3 1328 B16R0.136 CCCCCCCNC(=O)CCOCCOC 11a_100000229938_100000745395 [0,0,1,0,0,0|3,0,0]=4 1329 B16R0.136 CCCCCCCNC(=O)CCOCCOC 1626a_100000229938_100000745395 [0,0,1,0,0,0|3,0,0]=4 1330 B16R0.136 CCCCCCCNC(=O)CCOCCOC 240690a_100000229938_100000745395 [0,0,1,0,0,0|3,0,0]=4 1331 B16R0.136 CCCCCCCNC(=O)CCOCCOC 527a_100000229938_100000745395 [0,0,1,0,0,0|3,0,0]=4 1332 B16R0.136 CCCCCCCNC(=O)NCCCCCC 2708a_100000210581_100000229938 [0,0,1,0,0,0|2,0,0]=3 1333 B16R0.136 CCCCCCCNC(=O)NCCCCCC 2708a_100000229938_100000210581 [0,0,1,0,0,0|2,0,0]=3 1334 B16R0.136 CCCCCCCNC(=O)NCCCCCC 273464a_100000210581_100000229938 [0,0,1,0,0,0|2,0,0]=3 1335 B16R0.136 CCCCCCCNC(=O)NCCCCCC 273464a_100000229938_100000210581 [0,0,1,0,0,0|2,0,0]=3 1336 B16R0.136 CCCCCCCNC(=O)NCCCCCC 512a_100000210581_100000229938 [0,0,1,0,0,0|2,0,0]=3 1337 B16R0.136 CCCCCCCNC(=O)NCCCCCC 512a_100000229938_100000210581 [0,0,1,0,0,0|2,0,0]=3 1338 B16R0.136 CCCCCCCNC(=O)NCCCCCO 2708a_100000229938_100000762737 [0,0,1,0,0,0|3,0,0]=4 1339 B16R0.136 CCCCCCCNC(=O)NCCCCCO 273464a_100000229938_100000762737 [0,0,1,0,0,0|3,0,0]=4 1340 B16R0.136 CCCCCCCNC(=O)NCCCCCO 273464a_100000762737_100000229938 [0,0,1,0,0,0|3,0,0]=4 1341 B16R0.136 CCCCCCCNC(=O)NCCCCCO 512a_100000229938_100000762737 [0,0,1,0,0,0|3,0,0]=4 1342 B16R0.136 CCCCCCCNC(=O)NCCCCCO 512a_100000762737_100000229938 [0,0,1,0,0,0|3,0,0]=4 1343 B16R0.136 CCCCCCCNC(=O)NCCCOCC 2708a_100000210961_100000229938 [0,0,1,0,0,0|3,0,0]=4 1344 B16R0.136 CCCCCCCNC(=O)NCCCOCC 2708a_100000229938_100000210961 [0,0,1,0,0,0|3,0,0]=4 1345 B16R0.136 CCCCCCCNC(=O)NCCCOCC 273464a_100000210961_100000229938 [0,0,1,0,0,0|3,0,0]=4 1346 B16R0.136 CCCCCCCNC(=O)NCCCOCC 273464a_100000229938_100000210961 [0,0,1,0,0,0|3,0,0]=4 1347 B16R0.136 CCCCCCCNC(=O)NCCCOCC 512a_100000210961_100000229938 [0,0,1,0,0,0|3,0,0]=4 1348 B16R0.136 CCCCCCCNC(=O)NCCCOCC 512a_100000229938_100000210961 [0,0,1,0,0,0|3,0,0]=4 1349 B16R0.136 CCCCCCCNC(=O)NCCOCCC 2708a_100000229938_100161115042 [0,0,1,0,0,0|3,0,0]=4 1350 B16R0.136 CCCCCCCNC(=O)NCCOCCC 2708a_100161115042_100000229938 [0,0,1,0,0,0|3,0,0]=4 1351 B16R0.136 CCCCCCCNC(=O)NCCOCCC 273464a_100000229938_100161115042 [0,0,1,0,0,0|3,0,0]=4 1352 B16R0.136 CCCCCCCNC(=O)NCCOCCC 273464a_100161115042_100000229938 [0,0,1,0,0,0|3,0,0]=4 1353 B16R0.136 CCCCCCCNC(=O)NCCOCCC 512a_100000229938_100161115042 [0,0,1,0,0,0|3,0,0]=4 1354 B16R0.136 CCCCCCCNC(=O)NCCOCCC 512a_100161115042_100000229938 [0,0,1,0,0,0|3,0,0]=4 1355 B16R0.136 CCCCCCCNC(=O)NCCSCCC 2708a_100000229938_100020603323 [0,0,1,0,0,0|3,0,0]=4 1356 B16R0.136 CCCCCCCNC(=O)NCCSCCC 2708a_100020603323_100000229938 [0,0,1,0,0,0|3,0,0]=4 1357 B16R0.136 CCCCCCCNC(=O)NCCSCCC 273464a_100000229938_100020603323 [0,0,1,0,0,0|3,0,0]=4 1358 B16R0.136 CCCCCCCNC(=O)NCCSCCC 273464a_100020603323_100000229938 [0,0,1,0,0,0|3,0,0]=4 1359 B16R0.136 CCCCCCCNC(=O)NCCSCCC 512a_100000229938_100020603323 [0,0,1,0,0,0|3,0,0]=4 1360 B16R0.136 CCCCCCCNC(=O)NCCSCCC 512a_100020603323_100000229938 [0,0,1,0,0,0|3,0,0]=4 1361 B16R0.136 CCCCCCCNC(=O)NNCCCCC 273464a_100000229938_100000694160 [0,0,1,0,0,0|3,0,0]=4 1362 B16R0.136 CCCCCCCNC(=O)NNCCCCC 512a_100000229938_100000694160 [0,0,1,0,0,0|3,0,0]=4 1363 B16R0.136 CCCCCCCNC(=O)NNCCCCC 512a_100000694160_100000229938 [0,0,1,0,0,0|3,0,0]=4 1364 B16R0.136 CCCCCCCNC(C)CCCCCCC 2230a_100000229938_200011218727 [0,0,1,0,0,0|2,0,1]=4 1365 B16R0.136 CCCCCCCNC(C)CCCCCCC 270004a_100000229938_100000210596 [0,0,1,0,0,0|2,0,1]=4 1366 B16R0.136 CCCCCCCOC(C)CCCCCCC 34a_100000210272_200011218727 [0,0,1,0,0,0|1,0,1]=3 1367 B16R0.136 CCCCCCCOC(C)CCCCCCC 34a_200011215852_100000210614 [0,0,1,0,0,0|1,0,1]=3 1368 B16R0.136 CCCCCCCOC(C)CCCCCCC 7a_100000210272_200011218727 [0,0,1,0,0,0|1,0,1]=3 1369 B16R0.136 CCCCCCCOC(C)CCCCCCC 7a_200011215852_100000210614 [0,0,1,0,0,0|1,0,1]=3 1370 B16R0.136 CCCCCCNC(=O)CCCCCCCO 240690a_100000210581_100011219782 [0,0,1,0,0,0|2,0,0]=3 1371 B16R0.136 CCCCCCNC(=O)CNCCCCCO 2230a_100000762737_100000230325 [0,0,1,0,0,0|3,0,0]=4 1372 B16R0.136 CCCCCCNC(=O)CNCCCCCO 34a_100000762737_100000230325 [0,0,1,0,0,0|3,0,0]=4 1373 B16R0.136 CCCCCCNC(=O)CNCCCOCC 2230a_100000210961_100000230325 [0,0,1,0,0,0|3,0,0]=4 1374 B16R0.136 CCCCCCNC(=O)CNCCCOCC 34a_100000210961_100000230325 [0,0,1,0,0,0|3,0,0]=4 1375 B16R0.136 CCCCCCNC(=O)CNCCOCCC 2230a_100161115042_100000230325 [0,0,1,0,0,0|3,0,0]=4 1376 B16R0.136 CCCCCCNC(=O)CNCCOCCC 34a_100161115042_100000230325 [0,0,1,0,0,0|3,0,0]=4 1377 B16R0.136 CCCCCCNC(=O)CNCCSCCC 2230a_100020603323_100000230325 [0,0,1,0,0,0|3,0,0]=4 1378 B16R0.136 CCCCCCNC(=O)COCCCCCBr 34a_100000746331_100000230325 [0,0,1,0,0,0|3,0,0]=4 1379 B16R0.136 CCCCCCNC(=O)COCCCCCBr 7a_100000746331_100000230325 [0,0,1,0,0,0|3,0,0]=4 1380 B16R0.136 CCCCCCNC(=O)COCCCCCC 34a_100000210259_100000230325 [0,0,1,0,0,0|2,0,0]=3 1381 B16R0.136 CCCCCCNC(=O)COCCCCCC 7a_100000210259_100000230325 [0,0,1,0,0,0|2,0,0]=3 1382 B16R0.136 CCCCCCNC(=O)COCCCCCCl 34a_100000746330_100000230325 [0,0,1,0,0,0|3,0,0]=4 1383 B16R0.136 CCCCCCNC(=O)COCCCCCCl 7a_100000746330_100000230325 [0,0,1,0,0,0|3,0,0]=4 1384 B16R0.136 CCCCCCNC(=O)COCCCCCI 34a_200012148887_100000230325 [0,0,1,0,0,0|3,0,0]=4 1385 B16R0.136 CCCCCCNC(=O)COCCCCCI 7a_200012148887_100000230325 [0,0,1,0,0,0|3,0,0]=4 1386 B16R0.136 CCCCCCNC(=O)COCCCCCN 34a_100000762737_100000230325 [0,0,1,0,0,0|3,0,0]=4 1387 B16R0.136 CCCCCCNC(=O)COCCCCOC 34a_100000740925_100000230325 [0,0,1,0,0,0|3,0,0]=4 1388 B16R0.136 CCCCCCNC(=O)COCCCCSC 34a_100011217163_100000230325 [0,0,1,0,0,0|3,0,0]=4 1389 B16R0.136 CCCCCCNC(=O)COCCCCSC 7a_100011217163_100000230325 [0,0,1,0,0,0|3,0,0]=4 1390 B16R0.136 CCCCCCNC(=O)COCCCOCC 34a_100000757476_100000230325 [0,0,1,0,0,0|3,0,0]=4 1391 B16R0.136 CCCCCCNC(=O)COCCCOCC 7a_100000757476_100000230325 [0,0,1,0,0,0|3,0,0]=4 1392 B16R0.136 CCCCCCNC(=O)COCCCSCC 34a_100011216438_100000230325 [0,0,1,0,0,0|3,0,0]=4 1393 B16R0.136 CCCCCCNC(=O)COCCCSCC 7a_100011216438_100000230325 [0,0,1,0,0,0|3,0,0]=4 1394 B16R0.136 CCCCCCNC(=O)COCCOCCC 34a_100000752267_100000230325 [0,0,1,0,0,0|3,0,0]=4 1395 B16R0.136 CCCCCCNC(=O)COCCOCCC 7a_100000752267_100000230325 [0,0,1,0,0,0|3,0,0]=4 1396 B16R0.136 CCCCCCNC(=O)COCCSCCC 34a_200000230433_100000230325 [0,0,1,0,0,0|3,0,0]=4 1397 B16R0.136 CCCCCCNC(=O)COCCSCCC 7a_200000230433_100000230325 [0,0,1,0,0,0|3,0,0]=4 1398 B16R0.136 CCCCCCNC(=O)CSCCCCCC 62a_100000230325_100000210757 [0,0,1,0,0,0|2,0,0]=3 1399 B16R0.136 CCCCCCNC(=O)CSCCCCCF 62a_100000230325_100000729378 [0,0,1,0,0,0|3,0,0]=4 1400 B16R0.136 CCCCCCNC(=O)CSCCCCCO 62a_100000230325_100000746330 [0,0,1,0,0,0|3,0,0]=4 1401 B16R0.136 CCCCCCNC(=O)CSCCCCOC 62a_100000230325_100000730899 [0,0,1,0,0,0|3,0,0]=4 1402 B16R0.136 CCCCCCNC(=O)CSCCCOCC 62a_100000230325_100012232248 [0,0,1,0,0,0|3,0,0]=4 1403 B16R0.136 CCCCCCNC(=O)CSCCOCCC 62a_100000230325_100011215938 [0,0,1,0,0,0|3,0,0]=4 1404 B16R0.136 CCCCCCNC(=O)CSCOCCCC 62a_100000230325_100011995733 [0,0,1,0,0,0|3,0,0]=4 1405 B16R0.136 CCCCCCNC(=O)NCCCCCCO 2708a_100000210581_100000686447 [0,0,1,0,0,0|3,0,0]=4 1406 B16R0.136 CCCCCCNC(=O)NCCCCCCO 273464a_100000210581_100000686447 [0,0,1,0,0,0|3,0,0]=4 1407 B16R0.136 CCCCCCNC(=O)NCCCCCCO 273464a_100000686447_100000210581 [0,0,1,0,0,0|3,0,0]=4 1408 B16R0.136 CCCCCCNC(=O)NCCCCCCO 512a_100000210581_100000686447 [0,0,1,0,0,0|3,0,0]=4 1409 B16R0.136 CCCCCCNC(=O)NCCCCCCO 512a_100000686447_100000210581 [0,0,1,0,0,0|3,0,0]=4 1410 B16R0.136 CCCCCCNC(=O)NCCCCCOC 2708a_100000210581_100000747528 [0,0,1,0,0,0|3,0,0]=4 1411 B16R0.136 CCCCCCNC(=O)NCCCCCOC 2708a_100000747528_100000210581 [0,0,1,0,0,0|3,0,0]=4 1412 B16R0.136 CCCCCCNC(=O)NCCCCCOC 273464a_100000210581_100000747528 [0,0,1,0,0,0|3,0,0]=4 1413 B16R0.136 CCCCCCNC(=O)NCCCCCOC 273464a_100000747528_100000210581 [0,0,1,0,0,0|3,0,0]=4 1414 B16R0.136 CCCCCCNC(=O)NCCCCCOC 512a_100000210581_100000747528 [0,0,1,0,0,0|3,0,0]=4 1415 B16R0.136 CCCCCCNC(=O)NCCCCCOC 512a_100000747528_100000210581 [0,0,1,0,0,0|3,0,0]=4 1416 B16R0.136 CCCCCCNC(=O)NCCCOCCC 2708a_100000210581_100011217757 [0,0,1,0,0,0|3,0,0]=4 1417 B16R0.136 CCCCCCNC(=O)NCCCOCCC 2708a_100011217757_100000210581 [0,0,1,0,0,0|3,0,0]=4 1418 B16R0.136 CCCCCCNC(=O)NCCCOCCC 273464a_100000210581_100011217757 [0,0,1,0,0,0|3,0,0]=4 1419 B16R0.136 CCCCCCNC(=O)NCCCOCCC 273464a_100011217757_100000210581 [0,0,1,0,0,0|3,0,0]=4 1420 B16R0.136 CCCCCCNC(=O)NCCCOCCC 512a_100000210581_100011217757 [0,0,1,0,0,0|3,0,0]=4 1421 B16R0.136 CCCCCCNC(=O)NCCCOCCC 512a_100011217757_100000210581 [0,0,1,0,0,0|3,0,0]=4 1422 B16R0.136 CCCCCCNC(=O)NCCSCCCC 2708a_100000210581_100025743550 [0,0,1,0,0,0|3,0,0]=4 1423 B16R0.136 CCCCCCNC(=O)NCCSCCCC 2708a_100025743550_100000210581 [0,0,1,0,0,0|3,0,0]=4 1424 B16R0.136 CCCCCCNC(=O)NCCSCCCC 273464a_100000210581_100025743550 [0,0,1,0,0,0|3,0,0]=4 1425 B16R0.136 CCCCCCNC(=O)NCCSCCCC 273464a_100025743550_100000210581 [0,0,1,0,0,0|3,0,0]=4 1426 B16R0.136 CCCCCCNC(=O)NCCSCCCC 512a_100000210581_100025743550 [0,0,1,0,0,0|3,0,0]=4 1427 B16R0.136 CCCCCCNC(=O)NCCSCCCC 512a_100025743550_100000210581 [0,0,1,0,0,0|3,0,0]=4 1428 B16R0.136 CCCCCCNCC(=O)NCCCCCC 2230a_100000210581_100000230325 [0,0,1,0,0,0|2,0,0]=3 1429 B16R0.136 CCCCCNNC(=O)CCCCCCCO 22a_100000694160_100011219782 [0,0,1,0,0,0|3,0,0]=4 1430 B16R0.136 CCCCOCCC(=O)CCCCCCCO 1458a_100011219782_100000743108 [0,0,1,0,0,0|3,0,0]=4 1431 B16R0.136 CCCCSCCNC(=O)CCCCCCO 240690a_100025743550_100011996774 [0,0,1,0,0,0|3,0,0]=4 1432 B16R0.136 CCCCSCCNC(=O)CCCCCOC 11a_100025743550_100011935119 [0,0,1,0,0,0|3,0,0]=4 1433 B16R0.136 CCCCSCCNC(=O)CCCCCOC 1626a_100025743550_100011935119 [0,0,1,0,0,0|3,0,0]=4 1434 B16R0.136 CCCCSCCNC(=O)CCCCCOC 240690a_100025743550_100011935119 [0,0,1,0,0,0|3,0,0]=4 1435 B16R0.136 CCCCSCCNC(=O)CCCCCOC 527a_100025743550_100011935119 [0,0,1,0,0,0|3,0,0]=4 1436 B16R0.136 CCCOCCCNC(=O)CCCCCCO 240690a_100011217757_100011996774 [0,0,1,0,0,0|3,0,0]=4 1437 B16R0.136 CCCOCCCNC(=O)CCCCCOC 1626a_100011217757_100011935119 [0,0,1,0,0,0|3,0,0]=4 1438 B16R0.136 CCCOCCCNC(=O)CCCCCOC 240690a_100011217757_100011935119 [0,0,1,0,0,0|3,0,0]=4 1439 B16R0.136 CCCOCCCNC(=O)CCCCCOC 527a_100011217757_100011935119 [0,0,1,0,0,0|3,0,0]=4 1440 B16R0.136 CCCOCCNC(=O)CCCCCCCO 240690a_100161115042_100011219782 [0,0,1,0,0,0|3,0,0]=4 1441 B16R0.136 CCCSCCNC(=O)CCCCCCCO 240690a_100020603323_100011219782 [0,0,1,0,0,0|3,0,0]=4 1442 B16R0.136 CCOCCCNC(=O)CCCCCCCO 240690a_100000210961_100011219782 [0,0,1,0,0,0|3,0,0]=4 1443 B16R0.136 COCCCCCC(=O)CCCCCCCO 1458a_100011935119_100000760002 [0,0,1,0,0,0|3,0,0]=4 1444 B16R0.136 COCCCCCC(=O)NCCCCCCO 240690a_100000686447_100011935119 [0,0,1,0,0,0|3,0,0]=4 1445 B16R0.136 COCCCCCC(=O)NCCCCCCO 527a_100000686447_100011935119 [0,0,1,0,0,0|3,0,0]=4 1446 B16R0.136 COCCCCCCC(=O)CCCCCCO 1458a_100011996774_100011998445 [0,0,1,0,0,0|3,0,0]=4 1447 B16R0.136 COCCCCCCC(=O)CCCCCOC 1458a_100011935119_100011998445 [0,0,1,0,0,0|3,0,0]=4 1448 B16R0.136 COCCCCCNC(=O)CCCCCCO 240690a_100000747528_100011996774 [0,0,1,0,0,0|3,0,0]=4 1449 B16R0.136 COCCCCCNC(=O)CCCCCOC 11a_100000747528_100011935119 [0,0,1,0,0,0|3,0,0]=4 1450 B16R0.136 COCCCCCNC(=O)CCCCCOC 1626a_100000747528_100011935119 [0,0,1,0,0,0|3,0,0]=4 1451 B16R0.136 COCCCCCNC(=O)CCCCCOC 240690a_100000747528_100011935119 [0,0,1,0,0,0|3,0,0]=4 1452 B16R0.136 COCCCCCNC(=O)CCCCCOC 527a_100000747528_100011935119 [0,0,1,0,0,0|3,0,0]=4 1453 B16R0.136 O=C(CCCCCCCO)NCCCCCO 240690a_100000762737_100011219782 [0,0,1,0,0,0|3,0,0]=4 1454 B16R0.136 O=C(CCCCCCF)CCCCCCCO 1458a_100011219782_100015922095 [0,0,1,0,0,0|3,0,0]=4 1455 B16R0.136 O=C(CCCCCCO)CCCCCCCO 1458a_100011219782_100000766143 [0,0,1,0,0,0|3,0,0]=4 1456 B16R0.136 O=C(CCCCCCO)CCCCCCCO 1458a_100011996774_100000760002 [0,0,1,0,0,0|3,0,0]=4 1457 B16R0.136 O=C(CCCCCCO)NCCCCCCO 240690a_100000686447_100011996774 [0,0,1,0,0,0|3,0,0]=4 1458 B16R0.221 C#CC(=O)CCCCCCCCCCCCC 1458a_100000211873_100000210684 [0,0,1,0,0,0|1,0,1]=3 1459 B16R0.221 C#CC(=O)CCCCCCCCCCCCO 1458a_100000211873_100009813331 [0,0,1,0,0,0|2,0,1]=4 1460 B16R0.221 C#CCCCCCCCCCOCC(=O)OC 34a_100000034437_100000747449 [0,0,1,0,0,0|1,0,2]=4 1461 B16R0.221 C#CCCCCCCCCCOCC(=O)OC 7a_100000034437_100000747449 [0,0,1,0,0,0|1,0,2]=4 1462 B16R0.221 C#CCCCCCCCCOCCC(=O)OC 34a_100000065265_100000742370 [0,0,1,0,0,0|1,0,2]=4 1463 B16R0.221 C#CCCCCCCCCOCCC(=O)OC 7a_100000065265_100000204255 [0,0,1,0,0,0|1,0,2]=4 1464 B16R0.221 C#CCCCCCCCOCCCC(=O)OC 34a_100000054614_100000742333 [0,0,1,0,0,0|1,0,2]=4 1465 B16R0.221 C#CCCCCCCCOCCCC(=O)OC 7a_100000054614_100011218270 [0,0,1,0,0,0|1,0,2]=4 1466 B16R0.221 C#CCCCCCCCOCCOC(=O)CC 7a_200000031056_100153394163 [0,0,1,0,0,0|1,0,2]=4 1467 B16R0.221 C#CCCCCCCCSCCCC(=O)OC 62a_100011218270_100153394163 [0,0,1,0,0,0|1,0,2]=4 1468 B16R0.221 C#CCCCCCCCSCCCC(=O)OC 62a_100153394163_100011218270 [0,0,1,0,0,0|1,0,2]=4 1469 B16R0.221 C#CCCCCCCOCCCCC(=O)OC 34a_100000059025_100012276617 [0,0,1,0,0,0|1,0,2]=4 1470 B16R0.221 C#CCCCCCCOCCCCC(=O)OC 34a_100011217361_100000204269 [0,0,1,0,0,0|1,0,2]=4 1471 B16R0.221 C#CCCCCCCOCCCCC(=O)OC 7a_100000059025_100012276617 [0,0,1,0,0,0|1,0,2]=4 1472 B16R0.221 C#CCCCCCCOCCCCC(=O)OC 7a_100011217361_100000204269 [0,0,1,0,0,0|1,0,2]=4 1473 B16R0.221 C#CCCCCCCSCCCCC(=O)OC 62a_100000204269_100012276617 [0,0,1,0,0,0|1,0,2]=4 1474 B16R0.221 C#CCCCCCCSCCCCC(=O)OC 62a_100012276617_100000204269 [0,0,1,0,0,0|1,0,2]=4 1475 B16R0.221 C#CCCCCCOCCCCCC(=O)OC 34a_100000074720_100012094781 [0,0,1,0,0,0|1,0,2]=4 1476 B16R0.221 C#CCCCCCOCCCCCC(=O)OC 34a_100000766912_100009816466 [0,0,1,0,0,0|1,0,2]=4 1477 B16R0.221 C#CCCCCCOCCCCCC(=O)OC 7a_100000074720_100012094781 [0,0,1,0,0,0|1,0,2]=4 1478 B16R0.221 C#CCCCCCOCCCCCC(=O)OC 7a_100000766912_100009816466 [0,0,1,0,0,0|1,0,2]=4 1479 B16R0.221 C#CCCCCCSCCCCCC(=O)OC 62a_100009816466_100012094781 [0,0,1,0,0,0|1,0,2]=4 1480 B16R0.221 C#CCCCCCSCCCCCC(=O)OC 62a_100012094781_100009816466 [0,0,1,0,0,0|1,0,2]=4 1481 B16R0.221 C#CCCCCNCCCCCCC(=O)OC 2230a_100000706060_100009815986 [0,0,1,0,0,0|1,0,2]=4 1482 B16R0.221 C#CCCCCNCCCCCCC(=O)OC 34a_100000706060_100009815986 [0,0,1,0,0,0|1,0,2]=4 1483 B16R0.221 C#CCCCCOCCCCCCC(=O)OC 34a_100000766709_100009815986 [0,0,1,0,0,0|1,0,2]=4 1484 B16R0.221 C#CCCCCOCCCCCCC(=O)OC 34a_100009863599_100010269958 [0,0,1,0,0,0|1,0,2]=4 1485 B16R0.221 C#CCCCCOCCCCCCC(=O)OC 7a_100000766709_100009815986 [0,0,1,0,0,0|1,0,2]=4 1486 B16R0.221 C#CCCCCOCCCCCCC(=O)OC 7a_100009863599_100010269958 [0,0,1,0,0,0|1,0,2]=4 1487 B16R0.221 C#CCCCCSCCCCCCC(=O)OC 62a_100009815986_100010269958 [0,0,1,0,0,0|1,0,2]=4 1488 B16R0.221 C#CCCCCSCCCCCCC(=O)OC 62a_100010269958_100009815986 [0,0,1,0,0,0|1,0,2]=4 1489 B16R0.221 C#CCCCNCCCCCCCC(=O)OC 34a_100000718082_100010004213 [0,0,1,0,0,0|1,0,2]=4 1490 B16R0.221 C#CCCCOCCCCCCCC(=O)OC 34a_100000215630_100010004213 [0,0,1,0,0,0|1,0,2]=4 1491 B16R0.221 C#CCCCOCCCCCCCC(=O)OC 34a_100011022521_100000695029 [0,0,1,0,0,0|1,0,2]=4 1492 B16R0.221 C#CCCCOCCCCCCCC(=O)OC 7a_100000215630_100010004213 [0,0,1,0,0,0|1,0,2]=4 1493 B16R0.221 C#CCCCOCCCCCCCC(=O)OC 7a_100011022521_100011215417 [0,0,1,0,0,0|1,0,2]=4 1494 B16R0.221 C#CCCCSCCCCCCCC(=O)OC 62a_100010004213_100011215417 [0,0,1,0,0,0|1,0,2]=4 1495 B16R0.221 C#CCCCSCCCCCCCC(=O)OC 62a_100011215417_100010004213 [0,0,1,0,0,0|1,0,2]=4 1496 B16R0.221 C#CCCNCCCCCCCCC(=O)OC 34a_100000755551_100010282707 [0,0,1,0,0,0|1,0,2]=4 1497 B16R0.221 C#CCCOCCCCCCCCC(=O)OC 34a_100000035544_100000688953 [0,0,1,0,0,0|1,0,2]=4 1498 B16R0.221 C#CCCOCCCCCCCCC(=O)OC 34a_100011215631_100010282707 [0,0,1,0,0,0|1,0,2]=4 1499 B16R0.221 C#CCCOCCCCCCCCC(=O)OC 7a_100000035544_100000688953 [0,0,1,0,0,0|1,0,2]=4 1500 B16R0.221 C#CCCSCCCCCCCCC(=O)OC 62a_100000688953_100010282707 [0,0,1,0,0,0|1,0,2]=4 1501 B16R0.221 C#CCCSCCCCCCCCC(=O)OC 62a_100010282707_100000688953 [0,0,1,0,0,0|1,0,2]=4 1502 B16R0.221 C#CCNCCCCCCCCCC(=O)OC 34a_100000212058_100009813843 [0,0,1,0,0,0|1,0,2]=4 1503 B16R0.221 C#CCOCCCCCCCCCC(=O)OC 34a_100000210247_100009813843 [0,0,1,0,0,0|1,0,2]=4 1504 B16R0.221 C#CCSCCCCCCCCCC(=O)OC 62a_100000038162_100009813843 [0,0,1,0,0,0|1,0,2]=4 1505 B16R0.221 C/C=C/CCOCCCCCCCC(=O)OC 34a_100016278192_100010004213 [0,0,1,0,0,0|1,0,2]=4 1506 B16R0.221 C/C=C/COCCCCCCCCC(=O)OC 34a_100000035544_100102629194 [0,0,1,0,0,0|1,0,2]=4 1507 B16R0.221 C/C=C/COCCCCCCCCC(=O)OC 34a_100016270725_100010282707 [0,0,1,0,0,0|1,0,2]=4 1508 B16R0.221 C/C=C/COCCCCCCCCC(=O)OC 7a_100000035544_100102629194 [0,0,1,0,0,0|1,0,2]=4 1509 B16R0.221 C/C=C/CSCCCCCCCCC(=O)OC 62a_100010282707_100102629194 [0,0,1,0,0,0|1,0,2]=4 1510 B16R0.221 C/C=C/CSCCCCCCCCC(=O)OC 62a_100102629194_100010282707 [0,0,1,0,0,0|1,0,2]=4 1511 B16R0.221 C=CC(=O)CCCCCCCCCCCCC 1458a_100000185746_100000210684 [0,0,1,0,0,0|1,0,1]=3 1512 B16R0.221 C=CC(=O)CCCCCCCCCCCCO 1458a_100000185746_100009813331 [0,0,1,0,0,0|2,0,1]=4 1513 B16R0.221 C=CC(=O)NCCCCCCCCCCCC 1626a_100000210451_100000185746 [0,0,1,0,0,0|1,0,2]=4 1514 B16R0.221 C=CC(=O)NCCCCCCCCCCCC 240690a_100000210451_200121576911 [0,0,1,0,0,0|1,0,2]=4 1515 B16R0.221 C=CC(=O)OCCCCCCNCCCCC 2230a_100000209983_100009894100 [0,0,1,0,0,0|1,0,2]=4 1516 B16R0.221 C=CC(=O)OCCCCCCOCCCCC 34a_100000210253_100009894100 [0,0,1,0,0,0|1,0,2]=4 1517 B16R0.221 C=CC(=O)OCCCCCCOCCCCC 7a_100000210253_100009894100 [0,0,1,0,0,0|1,0,2]=4 1518 B16R0.221 C=CC(=O)OCCCCCCSCCCCC 62a_100000210326_100009894100 [0,0,1,0,0,0|1,0,2]=4 1519 B16R0.221 C=CC(=O)OCCCCCCSCCCCC 62a_100009894100_100000210326 [0,0,1,0,0,0|1,0,2]=4 1520 B16R0.221 C=CC(=O)OCCCCCOCCCCCC 7a_200011023508_100000210314 [0,0,1,0,0,0|1,0,2]=4 1521 B16R0.221 C=CC(=O)OCCNCCCCCCCCC 2230a_100000212291_100009813456 [0,0,1,0,0,0|1,0,2]=4 1522 B16R0.221 C=CC(=O)OCCNCCCCCCCCC 34a_100000212291_100009813456 [0,0,1,0,0,0|1,0,2]=4 1523 B16R0.221 C=CC(=O)OCCOCCCCCCCCC 34a_100000210712_100009813456 [0,0,1,0,0,0|1,0,2]=4 1524 B16R0.221 C=CC(=O)OCCOCCCCCCCCC 7a_100000210712_100009813456 [0,0,1,0,0,0|1,0,2]=4 1525 B16R0.221 C=CC(=O)OCCSCCCCCCCCC 62a_100009813456_100000210670 [0,0,1,0,0,0|1,0,2]=4 1526 B16R0.221 C=CCCCCCCCCCCCC(=O)CC 1458a_100000210414_102130925996 [0,0,1,0,0,0|1,0,2]=4 1527 B16R0.221 C=CCCCCCCCCCNCC(=O)OC 2230a_100000081888_100000747449 [0,0,1,0,0,0|1,0,2]=4 1528 B16R0.221 C=CCCCCCCCCCNCC(=O)OC 34a_100000081888_100000747449 [0,0,1,0,0,0|1,0,2]=4 1529 B16R0.221 C=CCCCCCCCCCOCC(=O)OC 34a_100000038209_100000747449 [0,0,1,0,0,0|1,0,2]=4 1530 B16R0.221 C=CCCCCCCCCCOCC(=O)OC 7a_100000038209_100000747449 [0,0,1,0,0,0|1,0,2]=4 1531 B16R0.221 C=CCCCCCCCCCSCC(=O)OC 62a_100000747449_100009814027 [0,0,1,0,0,0|1,0,2]=4 1532 B16R0.221 C=CCCCCCCCCCSCC(=O)OC 62a_100009814027_100000747449 [0,0,1,0,0,0|1,0,2]=4 1533 B16R0.221 C=CCCCCCCCCOCCC(=O)OC 34a_100011215194_100000742370 [0,0,1,0,0,0|1,0,2]=4 1534 B16R0.221 C=CCCCCCCCCOCCC(=O)OC 7a_100011215194_100000204255 [0,0,1,0,0,0|1,0,2]=4 1535 B16R0.221 C=CCCCCCCCCSCCC(=O)OC 62a_100000204255_100011933949 [0,0,1,0,0,0|1,0,2]=4 1536 B16R0.221 C=CCCCCCCCCSCCC(=O)OC 62a_100011933949_100000204255 [0,0,1,0,0,0|1,0,2]=4 1537 B16R0.221 C=CCCCCCCCOCCCC(=O)OC 34a_100000730831_100000742333 [0,0,1,0,0,0|1,0,2]=4 1538 B16R0.221 C=CCCCCCCCOCCCC(=O)OC 7a_100000730831_100011218270 [0,0,1,0,0,0|1,0,2]=4 1539 B16R0.221 C=CCCCCCCCOCCOC(=O)CC 7a_200000031056_100012355270 [0,0,1,0,0,0|1,0,2]=4 1540 B16R0.221 C=CCCCCCCCSCCCC(=O)OC 62a_100011218270_100012355270 [0,0,1,0,0,0|1,0,2]=4 1541 B16R0.221 C=CCCCCCCCSCCCC(=O)OC 62a_100012355270_100011218270 [0,0,1,0,0,0|1,0,2]=4 1542 B16R0.221 C=CCCCCCCOCCCCC(=O)OC 34a_100000059025_100011215473 [0,0,1,0,0,0|1,0,2]=4 1543 B16R0.221 C=CCCCCCCOCCCCC(=O)OC 34a_200011216477_100000204269 [0,0,1,0,0,0|1,0,2]=4 1544 B16R0.221 C=CCCCCCCOCCCCC(=O)OC 7a_100000059025_100011215473 [0,0,1,0,0,0|1,0,2]=4 1545 B16R0.221 C=CCCCCCCOCCCCC(=O)OC 7a_200011216477_100000204269 [0,0,1,0,0,0|1,0,2]=4 1546 B16R0.221 C=CCCCCCCSCCCCC(=O)OC 62a_100000204269_100011215473 [0,0,1,0,0,0|1,0,2]=4 1547 B16R0.221 C=CCCCCCCSCCCCC(=O)OC 62a_100011215473_100000204269 [0,0,1,0,0,0|1,0,2]=4 1548 B16R0.221 C=CCCCCCOCCCCCC(=O)OC 34a_100000074720_100000700193 [0,0,1,0,0,0|1,0,2]=4 1549 B16R0.221 C=CCCCCCOCCCCCC(=O)OC 34a_100011216702_100009816466 [0,0,1,0,0,0|1,0,2]=4 1550 B16R0.221 C=CCCCCCOCCCCCC(=O)OC 7a_100000074720_100000700193 [0,0,1,0,0,0|1,0,2]=4 1551 B16R0.221 C=CCCCCCOCCCCCC(=O)OC 7a_100011216702_100009816466 [0,0,1,0,0,0|1,0,2]=4 1552 B16R0.221 C=CCCCCCSCCCCCC(=O)OC 62a_100000700193_100009816466 [0,0,1,0,0,0|1,0,2]=4 1553 B16R0.221 C=CCCCCCSCCCCCC(=O)OC 62a_100009816466_100000700193 [0,0,1,0,0,0|1,0,2]=4 1554 B16R0.221 C=CCCCCNCCCCCCC(=O)OC 2230a_100000703577_100009815986 [0,0,1,0,0,0|1,0,2]=4 1555 B16R0.221 C=CCCCCNCCCCCCC(=O)OC 34a_100000703577_100009815986 [0,0,1,0,0,0|1,0,2]=4 1556 B16R0.221 C=CCCCCOCCCCCCC(=O)OC 34a_100000766645_100009815986 [0,0,1,0,0,0|1,0,2]=4 1557 B16R0.221 C=CCCCCOCCCCCCC(=O)OC 34a_100009863599_100011215482 [0,0,1,0,0,0|1,0,2]=4 1558 B16R0.221 C=CCCCCOCCCCCCC(=O)OC 7a_100000766645_100009815986 [0,0,1,0,0,0|1,0,2]=4 1559 B16R0.221 C=CCCCCOCCCCCCC(=O)OC 7a_100009863599_100011215482 [0,0,1,0,0,0|1,0,2]=4 1560 B16R0.221 C=CCCCCSCCCCCCC(=O)OC 62a_100009815986_100011215482 [0,0,1,0,0,0|1,0,2]=4 1561 B16R0.221 C=CCCCCSCCCCCCC(=O)OC 62a_100011215482_100009815986 [0,0,1,0,0,0|1,0,2]=4 1562 B16R0.221 C=CCCCNCCCCCCCC(=O)OC 2230a_100000700776_100010004213 [0,0,1,0,0,0|1,0,2]=4 1563 B16R0.221 C=CCCCNCCCCCCCC(=O)OC 34a_100000700776_100010004213 [0,0,1,0,0,0|1,0,2]=4 1564 B16R0.221 C=CCCCOCCCCCCCC(=O)OC 34a_100000758997_100010004213 [0,0,1,0,0,0|1,0,2]=4 1565 B16R0.221 C=CCCCOCCCCCCCC(=O)OC 34a_100011022521_100000757094 [0,0,1,0,0,0|1,0,2]=4 1566 B16R0.221 C=CCCCOCCCCCCCC(=O)OC 7a_100000758997_100010004213 [0,0,1,0,0,0|1,0,2]=4 1567 B16R0.221 C=CCCCOCCCCCCCC(=O)OC 7a_100011022521_100000757094 [0,0,1,0,0,0|1,0,2]=4 1568 B16R0.221 C=CCCCSCCCCCCCC(=O)OC 62a_100010004213_100000757094 [0,0,1,0,0,0|1,0,2]=4 1569 B16R0.221 C=CCCCSCCCCCCCC(=O)OC 62a_100011713584_100010004213 [0,0,1,0,0,0|1,0,2]=4 1570 B16R0.221 C=CCCNCCCCCCCCC(=O)OC 2230a_100015191253_100010282707 [0,0,1,0,0,0|1,0,2]=4 1571 B16R0.221 C=CCCOCCCCCCCCC(=O)OC 34a_100000035544_100000754431 [0,0,1,0,0,0|1,0,2]=4 1572 B16R0.221 C=CCCOCCCCCCCCC(=O)OC 34a_100011205117_100010282707 [0,0,1,0,0,0|1,0,2]=4 1573 B16R0.221 C=CCCOCCCCCCCCC(=O)OC 7a_100000035544_100000754431 [0,0,1,0,0,0|1,0,2]=4 1574 B16R0.221 C=CCCSCCCCCCCCC(=O)OC 62a_100000754431_100010282707 [0,0,1,0,0,0|1,0,2]=4 1575 B16R0.221 C=CCCSCCCCCCCCC(=O)OC 62a_100010282707_100000754431 [0,0,1,0,0,0|1,0,2]=4 1576 B16R0.221 C=CCNCCCCCCCCCC(=O)OC 2230a_100020586998_100009813843 [0,0,1,0,0,0|1,0,2]=4 1577 B16R0.221 C=CCOCCCCCCCCCC(=O)OC 34a_200000210373_100009813843 [0,0,1,0,0,0|1,0,2]=4 1578 B16R0.221 C=CCSCCCCCCCCCC(=O)OC 62a_100000210623_100009813843 [0,0,1,0,0,0|1,0,2]=4 1579 B16R0.221 CC#CCCOCCCCCCCC(=O)OC 34a_100000750427_100010004213 [0,0,1,0,0,0|1,0,2]=4 1580 B16R0.221 CC#CCNCCCCCCCCC(=O)OC 2230a_100000685387_100010282707 [0,0,1,0,0,0|1,0,2]=4 1581 B16R0.221 CC#CCNCCCCCCCCC(=O)OC 34a_100000685387_100010282707 [0,0,1,0,0,0|1,0,2]=4 1582 B16R0.221 CC#CCOCCCCCCCCC(=O)OC 34a_100000035544_100000748600 [0,0,1,0,0,0|1,0,2]=4 1583 B16R0.221 CC#CCOCCCCCCCCC(=O)OC 34a_100000761923_100010282707 [0,0,1,0,0,0|1,0,2]=4 1584 B16R0.221 CC#CCOCCCCCCCCC(=O)OC 7a_100000035544_100000748600 [0,0,1,0,0,0|1,0,2]=4 1585 B16R0.221 CC#CCSCCCCCCCCC(=O)OC 62a_100000748600_100010282707 [0,0,1,0,0,0|1,0,2]=4 1586 B16R0.221 CC#CCSCCCCCCCCC(=O)OC 62a_100010282707_100000748600 [0,0,1,0,0,0|1,0,2]=4 1587 B16R0.221 CC/C=C/CCCOCCCCCC(=O)OC 34a_100016287902_100009816466 [0,0,1,0,0,0|1,0,2]=4 1588 B16R0.221 CC/C=C/CCCOCCCCCC(=O)OC 7a_100016287902_100009816466 [0,0,1,0,0,0|1,0,2]=4 1589 B16R0.221 CC/C=C\CCCCCOCCCC(=O)OC 34a_100016268722_100000742333 [0,0,1,0,0,0|1,0,2]=4 1590 B16R0.221 CC/C=C\CCCCCOCCCC(=O)OC 7a_100016268722_100011218270 [0,0,1,0,0,0|1,0,2]=4 1591 B16R0.221 CC/C=C\CCCCOCCCCC(=O)OC 34a_100016287862_100000204269 [0,0,1,0,0,0|1,0,2]=4 1592 B16R0.221 CC/C=C\CCCCOCCCCC(=O)OC 7a_100016287862_100000204269 [0,0,1,0,0,0|1,0,2]=4 1593 B16R0.221 CC/C=C\CCOCCCCCCC(=O)OC 34a_100009863599_100015370543 [0,0,1,0,0,0|1,0,2]=4 1594 B16R0.221 CC/C=C\CCOCCCCCCC(=O)OC 34a_100016288707_100009815986 [0,0,1,0,0,0|1,0,2]=4 1595 B16R0.221 CC/C=C\CCOCCCCCCC(=O)OC 7a_100009863599_100015370543 [0,0,1,0,0,0|1,0,2]=4 1596 B16R0.221 CC/C=C\CCOCCCCCCC(=O)OC 7a_100016288707_100009815986 [0,0,1,0,0,0|1,0,2]=4 1597 B16R0.221 CC/C=C\CCSCCCCCCC(=O)OC 62a_100009815986_100015370543 [0,0,1,0,0,0|1,0,2]=4 1598 B16R0.221 CC/C=C\CCSCCCCCCC(=O)OC 62a_100015370543_100009815986 [0,0,1,0,0,0|1,0,2]=4 1599 B16R0.221 CC/C=C\COCCCCCCCC(=O)OC 34a_100011022521_100103147603 [0,0,1,0,0,0|1,0,2]=4 1600 B16R0.221 CC/C=C\COCCCCCCCC(=O)OC 34a_100016268518_100010004213 [0,0,1,0,0,0|1,0,2]=4 1601 B16R0.221 CC/C=C\COCCCCCCCC(=O)OC 7a_100011022521_100103147603 [0,0,1,0,0,0|1,0,2]=4 1602 B16R0.221 CC/C=C\CSCCCCCCCC(=O)OC 62a_100010004213_100103147603 [0,0,1,0,0,0|1,0,2]=4 1603 B16R0.221 CC/C=C\CSCCCCCCCC(=O)OC 62a_100103147603_100010004213 [0,0,1,0,0,0|1,0,2]=4 1604 B16R0.221 CC=CCCCOCCCCCCC(=O)OC 34a_100020645299_100009815986 [0,0,1,0,0,0|1,0,2]=4 1605 B16R0.221 CC=CCOCCCCCCCCC(=O)OC 34a_100000035544_100000070051 [0,0,1,0,0,0|1,0,2]=4 1606 B16R0.221 CC=CCOCCCCCCCCC(=O)OC 7a_100000035544_100000070051 [0,0,1,0,0,0|1,0,2]=4 1607 B16R0.221 CC=CCSCCCCCCCCC(=O)OC 62a_100000070051_100010282707 [0,0,1,0,0,0|1,0,2]=4 1608 B16R0.221 CC=CCSCCCCCCCCC(=O)OC 62a_100010282707_100000070051 [0,0,1,0,0,0|1,0,2]=4 1609 B16R0.221 CCC#CCCCCCCSCCC(=O)OC 62a_100000204255_200000036426 [0,0,1,0,0,0|1,0,2]=4 1610 B16R0.221 CCC#CCCCCCCSCCC(=O)OC 62a_200000036426_100000204255 [0,0,1,0,0,0|1,0,2]=4 1611 B16R0.221 CCC#CCCOCCCCCCC(=O)OC 34a_100000036655_100009815986 [0,0,1,0,0,0|1,0,2]=4 1612 B16R0.221 CCC#CCCOCCCCCCC(=O)OC 7a_100000036655_100009815986 [0,0,1,0,0,0|1,0,2]=4 1613 B16R0.221 CCC#CCOCCCCCCCC(=O)OC 34a_100000032950_100010004213 [0,0,1,0,0,0|1,0,2]=4 1614 B16R0.221 CCC#CCOCCCCCCCC(=O)OC 34a_100011022521_100009813939 [0,0,1,0,0,0|1,0,2]=4 1615 B16R0.221 CCC#CCOCCCCCCCC(=O)OC 7a_100011022521_100009813939 [0,0,1,0,0,0|1,0,2]=4 1616 B16R0.221 CCC#CCSCCCCCCCC(=O)OC 62a_100009813939_100010004213 [0,0,1,0,0,0|1,0,2]=4 1617 B16R0.221 CCC#CCSCCCCCCCC(=O)OC 62a_100010004213_100009813939 [0,0,1,0,0,0|1,0,2]=4 1618 B16R0.221 CCC(=O)CCCCCCCCCCCCO 1458a_100000210414_100009813331 [0,0,1,0,0,0|2,0,0]=3 1619 B16R0.221 CCC(=O)CCCCCCOCCCCCO 1458a_100000210414_200132310570 [0,0,1,0,0,0|3,0,0]=4 1620 B16R0.221 CCC(=O)COCCCCCCCCCCBr 7a_100009813290_100000747405 [0,0,1,0,0,0|3,0,0]=4 1621 B16R0.221 CCC(=O)COCCCCCCCCCCCl 7a_200000033068_100000747405 [0,0,1,0,0,0|3,0,0]=4 1622 B16R0.221 CCC(=O)COCCCCCCCCCCO 34a_100000725409_100009813290 [0,0,1,0,0,0|3,0,0]=4 1623 B16R0.221 CCC(=O)CSCCCCCCCCCCO 62a_100000747405_200000033068 [0,0,1,0,0,0|3,0,0]=4 1624 B16R0.221 CCC(=O)CSCCCCCCCCCCO 62a_100009813290_100000747405 [0,0,1,0,0,0|3,0,0]=4 1625 B16R0.221 CCC(=O)NCCNCCCCCCCCO 34a_100132302217_100000033203 [0,0,1,0,0,0|3,0,0]=4 1626 B16R0.221 CCC(=O)NCCOCCCCCCCCO 34a_200000158885_100000033203 [0,0,1,0,0,0|3,0,0]=4 1627 B16R0.221 CCC(=O)NCCOCCCCCCCCO 7a_200000158885_100000033203 [0,0,1,0,0,0|3,0,0]=4 1628 B16R0.221 CCC(=O)OCCOCCCCCCCCO 7a_200000031056_100000033203 [0,0,1,0,0,0|2,0,0]=3 1629 B16R0.221 CCC(C)OCCCCCCCCCCCBr 34a_100009812471_100011215416 [0,0,1,0,0,0|2,0,1]=4 1630 B16R0.221 CCC(C)OCCCCCCCCCCCBr 7a_100009812471_100000758301 [0,0,1,0,0,0|2,0,1]=4 1631 B16R0.221 CCC(C)OCCCCCCCCCCCO 7a_100000210228_100009812471 [0,0,1,0,0,0|2,0,1]=4 1632 B16R0.221 CCC/C=C/COCCCCCCC(=O)OC 34a_100016278788_100009815986 [0,0,1,0,0,0|1,0,2]=4 1633 B16R0.221 CCC/C=C/COCCCCCCC(=O)OC 7a_100016278788_100009815986 [0,0,1,0,0,0|1,0,2]=4 1634 B16R0.221 CCCC#CCCOCCCCCC(=O)OC 34a_100000042726_100009816466 [0,0,1,0,0,0|1,0,2]=4 1635 B16R0.221 CCCC#CCCOCCCCCC(=O)OC 7a_100000042726_100009816466 [0,0,1,0,0,0|1,0,2]=4 1636 B16R0.221 CCCC#CCOCCCCCCC(=O)OC 34a_100000034806_100009815986 [0,0,1,0,0,0|1,0,2]=4 1637 B16R0.221 CCCC#CCOCCCCCCC(=O)OC 7a_100000034806_100009815986 [0,0,1,0,0,0|1,0,2]=4 1638 B16R0.221 CCCC/C=C/CCCCOCCC(=O)OC 34a_200020645093_100000742370 [0,0,1,0,0,0|1,0,2]=4 1639 B16R0.221 CCCC/C=C/CCCCOCCC(=O)OC 7a_200020645093_100000204255 [0,0,1,0,0,0|1,0,2]=4 1640 B16R0.221 CCCC/C=C/COCCCCCC(=O)OC 34a_200016272032_100009816466 [0,0,1,0,0,0|1,0,2]=4 1641 B16R0.221 CCCC/C=C/COCCCCCC(=O)OC 7a_200016272032_100009816466 [0,0,1,0,0,0|1,0,2]=4 1642 B16R0.221 CCCC/C=C\CCOCCCCC(=O)OC 34a_200016286491_100000204269 [0,0,1,0,0,0|1,0,2]=4 1643 B16R0.221 CCCC/C=C\CCOCCCCC(=O)OC 7a_200016286491_100000204269 [0,0,1,0,0,0|1,0,2]=4 1644 B16R0.221 CCCCC#CCCCCOCCC(=O)OC 34a_200000066234_100000742370 [0,0,1,0,0,0|1,0,2]=4 1645 B16R0.221 CCCCC#CCCCCOCCC(=O)OC 7a_200000066234_100000204255 [0,0,1,0,0,0|1,0,2]=4 1646 B16R0.221 CCCCC#CCCCOCCOC(=O)CC 7a_200000031056_200000047210 [0,0,1,0,0,0|1,0,2]=4 1647 B16R0.221 CCCCC#CCCCSCCCC(=O)OC 62a_100011218270_200000047210 [0,0,1,0,0,0|1,0,2]=4 1648 B16R0.221 CCCCC#CCCCSCCCC(=O)OC 62a_200000047210_100011218270 [0,0,1,0,0,0|1,0,2]=4 1649 B16R0.221 CCCCC#CCCOCCCCC(=O)OC 34a_100000037610_100000204269 [0,0,1,0,0,0|1,0,2]=4 1650 B16R0.221 CCCCC#CCCOCCCCC(=O)OC 7a_100000037610_100000204269 [0,0,1,0,0,0|1,0,2]=4 1651 B16R0.221 CCCCC#CCOCCCCCC(=O)OC 34a_200000034558_100009816466 [0,0,1,0,0,0|1,0,2]=4 1652 B16R0.221 CCCCC#CCOCCCCCC(=O)OC 7a_200000034558_100009816466 [0,0,1,0,0,0|1,0,2]=4 1653 B16R0.221 CCCCC/C=C/COCCCCC(=O)OC 34a_100016258190_100000204269 [0,0,1,0,0,0|1,0,2]=4 1654 B16R0.221 CCCCC/C=C/COCCCCC(=O)OC 7a_100016258190_100000204269 [0,0,1,0,0,0|1,0,2]=4 1655 B16R0.221 CCCCC/C=C\CCCOCCC(=O)OC 34a_100020655193_100000742370 [0,0,1,0,0,0|1,0,2]=4 1656 B16R0.221 CCCCC/C=C\CCCOCCC(=O)OC 7a_100020655193_100000204255 [0,0,1,0,0,0|1,0,2]=4 1657 B16R0.221 CCCCC/C=C\CCOCCCC(=O)OC 34a_100016277358_100000742333 [0,0,1,0,0,0|1,0,2]=4 1658 B16R0.221 CCCCC/C=C\CCOCCCC(=O)OC 7a_100016277358_100011218270 [0,0,1,0,0,0|1,0,2]=4 1659 B16R0.221 CCCCCC#CCCOCCCC(=O)OC 34a_200000042877_100000742333 [0,0,1,0,0,0|1,0,2]=4 1660 B16R0.221 CCCCCC#CCCOCCCC(=O)OC 7a_200000042877_100011218270 [0,0,1,0,0,0|1,0,2]=4 1661 B16R0.221 CCCCCC#CCOCCCCC(=O)OC 34a_100000059025_100009816472 [0,0,1,0,0,0|1,0,2]=4 1662 B16R0.221 CCCCCC#CCOCCCCC(=O)OC 34a_200000033628_100000204269 [0,0,1,0,0,0|1,0,2]=4 1663 B16R0.221 CCCCCC#CCOCCCCC(=O)OC 7a_100000059025_100009816472 [0,0,1,0,0,0|1,0,2]=4 1664 B16R0.221 CCCCCC#CCOCCCCC(=O)OC 7a_200000033628_100000204269 [0,0,1,0,0,0|1,0,2]=4 1665 B16R0.221 CCCCCC#CCSCCCCC(=O)OC 62a_100000204269_100009816472 [0,0,1,0,0,0|1,0,2]=4 1666 B16R0.221 CCCCCC#CCSCCCCC(=O)OC 62a_100009816472_100000204269 [0,0,1,0,0,0|1,0,2]=4 1667 B16R0.221 CCCCCC/C=C/COCCCC(=O)OC 34a_200016276170_100000742333 [0,0,1,0,0,0|1,0,2]=4 1668 B16R0.221 CCCCCC/C=C/COCCCC(=O)OC 7a_200016276170_100011218270 [0,0,1,0,0,0|1,0,2]=4 1669 B16R0.221 CCCCCCC#CCCOCCC(=O)OC 34a_200000033163_100000742370 [0,0,1,0,0,0|1,0,2]=4 1670 B16R0.221 CCCCCCC#CCCOCCC(=O)OC 7a_200000033163_100000204255 [0,0,1,0,0,0|1,0,2]=4 1671 B16R0.221 CCCCCCC#CCOCCCC(=O)OC 34a_200000037284_100000742333 [0,0,1,0,0,0|1,0,2]=4 1672 B16R0.221 CCCCCCC#CCOCCCC(=O)OC 7a_200000037284_100011218270 [0,0,1,0,0,0|1,0,2]=4 1673 B16R0.221 CCCCCCCC#CCOCCC(=O)OC 34a_200000061759_100000742370 [0,0,1,0,0,0|1,0,2]=4 1674 B16R0.221 CCCCCCCC#CCOCCC(=O)OC 7a_200000061759_100000204255 [0,0,1,0,0,0|1,0,2]=4 1675 B16R0.221 CCCCCCCC/C=C/COCC(=O)OC 34a_200020667288_100000747449 [0,0,1,0,0,0|1,0,2]=4 1676 B16R0.221 CCCCCCCC/C=C/COCC(=O)OC 7a_200020667288_100000747449 [0,0,1,0,0,0|1,0,2]=4 1677 B16R0.221 CCCCCCCCCCC=NNC(=O)CC 4a_100000183195_100011218819 [0,0,1,0,0,0|2,0,1]=4 1678 B16R0.221 CCCCCCCCCCCCCC(=O)CC 1458a_100000210414_100000210684 [0,0,1,0,0,0|1,0,0]=2 1679 B16R0.221 CCCCCCCCCCCCCC(=O)CC 1458a_100000756256_100000210202 [0,0,1,0,0,0|1,0,0]=2 1680 B16R0.221 CCCCCCCCCCCCCC(=O)CF 1458a_100000756256_100015361967 [0,0,1,0,0,0|2,0,0]=3 1681 B16R0.221 CCCCCCCCCCCCCC(=O)CO 1458a_100000210174_100000210684 [0,0,1,0,0,0|2,0,0]=3 1682 B16R0.221 CCCCCCCCCCCCCC(=O)NC 11a_106832991635_100000756256 [0,0,1,0,0,0|1,0,0]=2 1683 B16R0.221 CCCCCCCCCCCCCC(=O)NC 1626a_100102657272_100000756256 [0,0,1,0,0,0|1,0,0]=2 1684 B16R0.221 CCCCCCCCCCCCCC(=O)NC 240690a_100102657272_100000756256 [0,0,1,0,0,0|1,0,0]=2 1685 B16R0.221 CCCCCCCCCCCCCC(C)NC 270004a_106832991635_100011216122 [0,0,1,0,0,0|2,0,1]=4 1686 B16R0.221 CCCCCCCCCCCCCN(C)CC 2230a_100000225621_100000210684 [0,0,1,0,0,0|3,0,0]=4 1687 B16R0.221 CCCCCCCCCCCCCN(C)CC 269982a_100000225621_100000210684 [0,0,1,0,0,0|3,0,0]=4 1688 B16R0.221 CCCCCCCCCCCCNC(=O)CC 11a_100000210451_100000210414 [0,0,1,0,0,0|1,0,0]=2 1689 B16R0.221 CCCCCCCCCCCCNC(=O)CC 1626a_100000210451_100000210414 [0,0,1,0,0,0|1,0,0]=2 1690 B16R0.221 CCCCCCCCCCCCNC(=O)CC 240690a_100000210451_100000210414 [0,0,1,0,0,0|1,0,0]=2 1691 B16R0.221 CCCCCCCCCCCCNC(=O)CC 527a_100000210451_100000210414 [0,0,1,0,0,0|1,0,0]=2 1692 B16R0.221 CCCCCCCCCCCCNC(=O)CO 240690a_100000210451_100000210174 [0,0,1,0,0,0|2,0,0]=3 1693 B16R0.221 CCCCCCCCCCCCNC(=O)CO 527a_100000210451_100000210174 [0,0,1,0,0,0|2,0,0]=3 1694 B16R0.221 CCCCCCCCCCCCNC(=O)NC 2708a_100000210451_106832991635 [0,0,1,0,0,0|2,0,0]=3 1695 B16R0.221 CCCCCCCCCCCCNC(=O)NC 2708a_100102657272_100000210451 [0,0,1,0,0,0|2,0,0]=3 1696 B16R0.221 CCCCCCCCCCCCNC(=O)NC 273464a_100000210451_100102657272 [0,0,1,0,0,0|2,0,0]=3 1697 B16R0.221 CCCCCCCCCCCCNC(=O)NC 273464a_100102657272_100000210451 [0,0,1,0,0,0|2,0,0]=3 1698 B16R0.221 CCCCCCCCCCCCNC(=O)NC 512a_100000210451_100102657272 [0,0,1,0,0,0|2,0,0]=3 1699 B16R0.221 CCCCCCCCCCCCNC(=O)NC 512a_106832991638_100000210451 [0,0,1,0,0,0|2,0,0]=3 1700 B16R0.221 CCCCCCCCCCCCNC(C)CC 2230a_100000209981_100011215052 [0,0,1,0,0,0|2,0,1]=4 1701 B16R0.221 CCCCCCCCCCCCNC(C)CC 2230a_100000210451_100000758301 [0,0,1,0,0,0|2,0,1]=4 1702 B16R0.221 CCCCCCCCCCCCNC(C)CC 270004a_100000209981_100011218549 [0,0,1,0,0,0|2,0,1]=4 1703 B16R0.221 CCCCCCCCCCCCNC(C)CC 34a_100000210451_100011215416 [0,0,1,0,0,0|2,0,1]=4 1704 B16R0.221 CCCCCCCCCCCCOC(C)CC 34a_100000210810_100011215416 [0,0,1,0,0,0|1,0,1]=3 1705 B16R0.221 CCCCCCCCCCCCOC(C)CC 7a_100000210228_100000759014 [0,0,1,0,0,0|1,0,1]=3 1706 B16R0.221 CCCCCCCCCCCCOC(C)CC 7a_100000210810_100000758301 [0,0,1,0,0,0|1,0,1]=3 1707 B16R0.221 CCCCCCCCCCCCOC(C)CF 34a_100016041109_100000759014 [0,0,1,0,0,0|2,0,1]=4 1708 B16R0.221 CCCCCCCCCCCCOC(C)CF 7a_100016041109_100000759014 [0,0,1,0,0,0|2,0,1]=4 1709 B16R0.221 CCCCCCCCCCCCOC(C)CN 34a_100000210904_100000759014 [0,0,1,0,0,0|2,0,1]=4 1710 B16R0.221 CCCCCCCCCCCCOC(C)CO 34a_100000210810_100012180447 [0,0,1,0,0,0|2,0,1]=4 1711 B16R0.221 CCCCCCCCCCCCOC(C)CO 7a_100000210810_100012180447 [0,0,1,0,0,0|2,0,1]=4 1712 B16R0.221 CCCCCCCCCCCCSC(C)OC 62a_100009879195_100000759014 [0,0,1,0,0,0|2,0,1]=4 1713 B16R0.221 CCCCCCCCCCCNCC(=O)NC 2230a_100000693194_100011215454 [0,0,1,0,0,0|2,0,0]=3 1714 B16R0.221 CCCCCCCCCCCNCC(=O)NC 2230a_200011215754_100000183359 [0,0,1,0,0,0|2,0,0]=3 1715 B16R0.221 CCCCCCCCCCCNCC(=O)NC 34a_200011215754_100000183359 [0,0,1,0,0,0|2,0,0]=3 1716 B16R0.221 CCCCCCCCCCCNCC(=O)OC 2230a_200011215754_100000747449 [0,0,1,0,0,0|1,0,0]=2 1717 B16R0.221 CCCCCCCCCCCNCC(=O)OC 34a_200011215754_100000747449 [0,0,1,0,0,0|1,0,0]=2 1718 B16R0.221 CCCCCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100011215454 [0,0,1,0,0,0|2,0,1]=4 1719 B16R0.221 CCCCCCCCCCCOCC(=O)CC 34a_100000725409_100011215454 [0,0,1,0,0,0|2,0,0]=3 1720 B16R0.221 CCCCCCCCCCCOCC(=O)CC 7a_100000210809_100000747405 [0,0,1,0,0,0|2,0,0]=3 1721 B16R0.221 CCCCCCCCCCCOCC(=O)NC 34a_100000210809_100000183359 [0,0,1,0,0,0|2,0,0]=3 1722 B16R0.221 CCCCCCCCCCCOCC(=O)NC 34a_100000750040_100011215454 [0,0,1,0,0,0|2,0,0]=3 1723 B16R0.221 CCCCCCCCCCCOCC(=O)NC 7a_100000210809_100000183359 [0,0,1,0,0,0|2,0,0]=3 1724 B16R0.221 CCCCCCCCCCCOCC(=O)OC 34a_100000210809_100000747449 [0,0,1,0,0,0|1,0,0]=2 1725 B16R0.221 CCCCCCCCCCCOCC(=O)OC 7a_100000210809_100000747449 [0,0,1,0,0,0|1,0,0]=2 1726 B16R0.221 CCCCCCCCCCCOCC(C)OC 34a_100000690652_100011215454 [0,0,1,0,0,0|2,0,1]=4 1727 B16R0.221 CCCCCCCCCCCSCC(=O)CC 62a_100000747405_100011215454 [0,0,1,0,0,0|2,0,0]=3 1728 B16R0.221 CCCCCCCCCCCSCC(=O)NC 62a_100000183359_100011215454 [0,0,1,0,0,0|2,0,0]=3 1729 B16R0.221 CCCCCCCCCCCSCC(=O)OC 62a_100000747449_100011215454 [0,0,1,0,0,0|1,0,0]=2 1730 B16R0.221 CCCCCCCCCCNCCC(=O)NC 2230a_100000684558_100000737683 [0,0,1,0,0,0|2,0,0]=3 1731 B16R0.221 CCCCCCCCCCNCCC(=O)NC 2230a_100000738227_100000210320 [0,0,1,0,0,0|2,0,0]=3 1732 B16R0.221 CCCCCCCCCCNCCC(=O)NC 34a_100000684558_100012179268 [0,0,1,0,0,0|2,0,0]=3 1733 B16R0.221 CCCCCCCCCCNCCC(=O)NC 34a_100000738227_100000210320 [0,0,1,0,0,0|2,0,0]=3 1734 B16R0.221 CCCCCCCCCCNCCC(=O)OC 2230a_100000684558_100000204255 [0,0,1,0,0,0|1,0,0]=2 1735 B16R0.221 CCCCCCCCCCNCCC(=O)OC 34a_100000684558_100000742370 [0,0,1,0,0,0|1,0,0]=2 1736 B16R0.221 CCCCCCCCCCOCCC(=O)NC 34a_100000210711_100012179268 [0,0,1,0,0,0|2,0,0]=3 1737 B16R0.221 CCCCCCCCCCOCCC(=O)NC 34a_100000754576_100000210320 [0,0,1,0,0,0|2,0,0]=3 1738 B16R0.221 CCCCCCCCCCOCCC(=O)NC 7a_100000210711_100000737683 [0,0,1,0,0,0|2,0,0]=3 1739 B16R0.221 CCCCCCCCCCOCCC(=O)OC 34a_100000210711_100000742370 [0,0,1,0,0,0|1,0,0]=2 1740 B16R0.221 CCCCCCCCCCOCCC(=O)OC 7a_100000210711_100000204255 [0,0,1,0,0,0|1,0,0]=2 1741 B16R0.221 CCCCCCCCCCOCCC(C)OC 7a_100000764861_100000210320 [0,0,1,0,0,0|2,0,1]=4 1742 B16R0.221 CCCCCCCCCCSCCC(=O)NC 62a_100000737683_100000210320 [0,0,1,0,0,0|2,0,0]=3 1743 B16R0.221 CCCCCCCCCCSCCC(=O)OC 62a_100000204255_100000210320 [0,0,1,0,0,0|1,0,0]=2 1744 B16R0.221 CCCCCCCCCNC/C=C/C(=O)OC 2230a_100000212291_100000742655 [0,0,1,0,0,0|1,0,2]=4 1745 B16R0.221 CCCCCCCCCNC/C=C/C(=O)OC 34a_100000212291_100000742655 [0,0,1,0,0,0|1,0,2]=4 1746 B16R0.221 CCCCCCCCCNCCCC(=O)NC 2230a_100000212291_100000741757 [0,0,1,0,0,0|2,0,0]=3 1747 B16R0.221 CCCCCCCCCNCCCC(=O)NC 2230a_100000740002_100011214924 [0,0,1,0,0,0|2,0,0]=3 1748 B16R0.221 CCCCCCCCCNCCCC(=O)NC 34a_100000212291_100000741757 [0,0,1,0,0,0|2,0,0]=3 1749 B16R0.221 CCCCCCCCCNCCCC(=O)NC 34a_100000740002_100011214924 [0,0,1,0,0,0|2,0,0]=3 1750 B16R0.221 CCCCCCCCCNCCCC(=O)OC 2230a_100000212291_100011218270 [0,0,1,0,0,0|1,0,0]=2 1751 B16R0.221 CCCCCCCCCNCCCC(=O)OC 34a_100000212291_100000742333 [0,0,1,0,0,0|1,0,0]=2 1752 B16R0.221 CCCCCCCCCNCCNC(=O)CC 34a_100132302217_100011214924 [0,0,1,0,0,0|2,0,0]=3 1753 B16R0.221 CCCCCCCCCNCCNC(=O)NC 34a_100015205895_100011214924 [0,0,1,0,0,0|3,0,0]=4 1754 B16R0.221 CCCCCCCCCNCCOC(=O)NC 34a_100000212291_200011997002 [0,0,1,0,0,0|2,0,0]=3 1755 B16R0.221 CCCCCCCCCOC/C=C/C(=O)OC 34a_100000210712_100000742655 [0,0,1,0,0,0|1,0,2]=4 1756 B16R0.221 CCCCCCCCCOC/C=C/C(=O)OC 7a_100000210712_100000742655 [0,0,1,0,0,0|1,0,2]=4 1757 B16R0.221 CCCCCCCCCOCCCC(=O)NC 34a_100000210712_100000741757 [0,0,1,0,0,0|2,0,0]=3 1758 B16R0.221 CCCCCCCCCOCCCC(=O)NC 7a_100000210712_100000741757 [0,0,1,0,0,0|2,0,0]=3 1759 B16R0.221 CCCCCCCCCOCCCC(=O)NN 34a_100000211488_100011214924 [0,0,1,0,0,0|3,0,0]=4 1760 B16R0.221 CCCCCCCCCOCCCC(=O)OC 34a_100000210712_100000742333 [0,0,1,0,0,0|1,0,0]=2 1761 B16R0.221 CCCCCCCCCOCCCC(=O)OC 7a_100000210712_100011218270 [0,0,1,0,0,0|1,0,0]=2 1762 B16R0.221 CCCCCCCCCOCCNC(=O)CC 34a_200000158885_100011214924 [0,0,1,0,0,0|2,0,0]=3 1763 B16R0.221 CCCCCCCCCOCCNC(=O)CC 7a_200000158885_100000210328 [0,0,1,0,0,0|2,0,0]=3 1764 B16R0.221 CCCCCCCCCOCCNC(=O)OC 34a_100000757965_100011214924 [0,0,1,0,0,0|2,0,0]=3 1765 B16R0.221 CCCCCCCCCOCCOC(=O)CC 7a_200000031056_100000210328 [0,0,1,0,0,0|1,0,0]=2 1766 B16R0.221 CCCCCCCCCOCCOC(=O)NC 34a_100000210712_200011997002 [0,0,1,0,0,0|2,0,0]=3 1767 B16R0.221 CCCCCCCCCOCCOC(=O)NC 7a_100000210712_200011997002 [0,0,1,0,0,0|2,0,0]=3 1768 B16R0.221 CCCCCCCCCOCCOC(=O)OC 34a_100010262106_100011214924 [0,0,1,0,0,0|2,0,0]=3 1769 B16R0.221 CCCCCCCCCSC/C=C/C(=O)OC 62a_100000742655_100000210670 [0,0,1,0,0,0|1,0,2]=4 1770 B16R0.221 CCCCCCCCCSCCCC(=O)NC 62a_100000741757_100000210670 [0,0,1,0,0,0|2,0,0]=3 1771 B16R0.221 CCCCCCCCCSCCCC(=O)OC 62a_100011218270_100000210670 [0,0,1,0,0,0|1,0,0]=2 1772 B16R0.221 CCCCCCCCCSCCOC(=O)NC 62a_200011997002_100000210670 [0,0,1,0,0,0|2,0,0]=3 1773 B16R0.221 CCCCCCCCNCCCCC(=O)OC 2230a_100000229939_100000204269 [0,0,1,0,0,0|1,0,0]=2 1774 B16R0.221 CCCCCCCCNCCCCC(=O)OC 34a_100000229939_100000204269 [0,0,1,0,0,0|1,0,0]=2 1775 B16R0.221 CCCCCCCCNCCOCC(=O)OC 2230a_100000229939_100000090808 [0,0,1,0,0,0|2,0,0]=3 1776 B16R0.221 CCCCCCCCNCCOCC(=O)OC 34a_100000229939_100000090808 [0,0,1,0,0,0|2,0,0]=3 1777 B16R0.221 CCCCCCCCOCCCCC(=O)OC 34a_100000059025_100000210759 [0,0,1,0,0,0|1,0,0]=2 1778 B16R0.221 CCCCCCCCOCCCCC(=O)OC 34a_100000210232_100000204269 [0,0,1,0,0,0|1,0,0]=2 1779 B16R0.221 CCCCCCCCOCCCCC(=O)OC 7a_100000059025_100000210759 [0,0,1,0,0,0|1,0,0]=2 1780 B16R0.221 CCCCCCCCOCCCCC(=O)OC 7a_100000210232_100000204269 [0,0,1,0,0,0|1,0,0]=2 1781 B16R0.221 CCCCCCCCOCCOCC(=O)OC 34a_100000210232_100000090808 [0,0,1,0,0,0|2,0,0]=3 1782 B16R0.221 CCCCCCCCOCCOCC(=O)OC 7a_100000210232_100000090808 [0,0,1,0,0,0|2,0,0]=3 1783 B16R0.221 CCCCCCCCSCCCCC(=O)OC 62a_100000204269_100000210317 [0,0,1,0,0,0|1,0,0]=2 1784 B16R0.221 CCCCCCCCSCCCCC(=O)OC 62a_100000210759_100000204269 [0,0,1,0,0,0|1,0,0]=2 1785 B16R0.221 CCCCCCCCSCCOCC(=O)OC 62a_100000090808_100000210317 [0,0,1,0,0,0|2,0,0]=3 1786 B16R0.221 CCCCCCCCSCCOCC(=O)OC 62a_100000210759_100000090808 [0,0,1,0,0,0|2,0,0]=3 1787 B16R0.221 CCCCCCCNCCCCCC(=O)OC 2230a_100000229938_100009816466 [0,0,1,0,0,0|1,0,0]=2 1788 B16R0.221 CCCCCCCOCCCCCC(=O)OC 34a_100000074720_100000210614 [0,0,1,0,0,0|1,0,0]=2 1789 B16R0.221 CCCCCCCOCCCCCC(=O)OC 34a_100000210272_100009816466 [0,0,1,0,0,0|1,0,0]=2 1790 B16R0.221 CCCCCCCOCCCCCC(=O)OC 7a_100000074720_100000210614 [0,0,1,0,0,0|1,0,0]=2 1791 B16R0.221 CCCCCCCOCCCCCC(=O)OC 7a_100000210272_100009816466 [0,0,1,0,0,0|1,0,0]=2 1792 B16R0.221 CCCCCCCSCCCCCC(=O)OC 62a_100000210614_100009816466 [0,0,1,0,0,0|1,0,0]=2 1793 B16R0.221 CCCCCCCSCCCCCC(=O)OC 62a_100009816466_100000210316 [0,0,1,0,0,0|1,0,0]=2 1794 B16R0.221 CCCCCCNCCCCCCC(=O)OC 2230a_100000210581_100009815986 [0,0,1,0,0,0|1,0,0]=2 1795 B16R0.221 CCCCCCOCCCCCCC(=O)OC 34a_100000210259_100009815986 [0,0,1,0,0,0|1,0,0]=2 1796 B16R0.221 CCCCCCOCCCCCCC(=O)OC 34a_100009863599_100000210314 [0,0,1,0,0,0|1,0,0]=2 1797 B16R0.221 CCCCCCOCCCCCCC(=O)OC 7a_100000210259_100009815986 [0,0,1,0,0,0|1,0,0]=2 1798 B16R0.221 CCCCCCOCCCCCCC(=O)OC 7a_100009863599_100000210314 [0,0,1,0,0,0|1,0,0]=2 1799 B16R0.221 CCCCCCOCCOCCCC(=O)NC 34a_100000691444_100000741757 [0,0,1,0,0,0|3,0,0]=4 1800 B16R0.221 CCCCCCOCCOCCCC(=O)NC 7a_100000691444_100000741757 [0,0,1,0,0,0|3,0,0]=4 1801 B16R0.221 CCCCCCOCCOCCCC(=O)OC 34a_100000691444_100000742333 [0,0,1,0,0,0|2,0,0]=3 1802 B16R0.221 CCCCCCOCCOCCCC(=O)OC 7a_100000691444_100011218270 [0,0,1,0,0,0|2,0,0]=3 1803 B16R0.221 CCCCCCOCCOCCOC(=O)NC 34a_100000691444_200011997002 [0,0,1,0,0,0|3,0,0]=4 1804 B16R0.221 CCCCCCOCCOCCOC(=O)NC 7a_100000691444_200011997002 [0,0,1,0,0,0|3,0,0]=4 1805 B16R0.221 CCCCCCSCCCCCCC(=O)OC 62a_100000210314_100009815986 [0,0,1,0,0,0|1,0,0]=2 1806 B16R0.221 CCCCCCSCCCCCCC(=O)OC 62a_100009815986_100000210757 [0,0,1,0,0,0|1,0,0]=2 1807 B16R0.221 CCCCCNCCCCCCCC(=O)OC 2230a_100000209983_100010004213 [0,0,1,0,0,0|1,0,0]=2 1808 B16R0.221 CCCCCNCCOCCCCC(=O)OC 34a_100000224656_100000204269 [0,0,1,0,0,0|2,0,0]=3 1809 B16R0.221 CCCCCNCCOCCOCC(=O)OC 34a_100000224656_100000090808 [0,0,1,0,0,0|3,0,0]=4 1810 B16R0.221 CCCCCOCCCCCCCC(=O)OC 34a_100000210253_100010004213 [0,0,1,0,0,0|1,0,0]=2 1811 B16R0.221 CCCCCOCCCCCCCC(=O)OC 34a_100011022521_100000718602 [0,0,1,0,0,0|1,0,0]=2 1812 B16R0.221 CCCCCOCCCCCCCC(=O)OC 7a_100000210253_100010004213 [0,0,1,0,0,0|1,0,0]=2 1813 B16R0.221 CCCCCOCCCCCCCC(=O)OC 7a_100011022521_100000210326 [0,0,1,0,0,0|1,0,0]=2 1814 B16R0.221 CCCCCOCCOCCCCC(=O)OC 34a_100011215259_100000204269 [0,0,1,0,0,0|2,0,0]=3 1815 B16R0.221 CCCCCOCCOCCCCC(=O)OC 7a_100011215259_100000204269 [0,0,1,0,0,0|2,0,0]=3 1816 B16R0.221 CCCCCOCCOCCOCC(=O)OC 34a_100011023656_100000718602 [0,0,1,0,0,0|3,0,0]=4 1817 B16R0.221 CCCCCOCCOCCOCC(=O)OC 34a_100011215259_100000090808 [0,0,1,0,0,0|3,0,0]=4 1818 B16R0.221 CCCCCOCCOCCOCC(=O)OC 7a_100011023656_100000210326 [0,0,1,0,0,0|3,0,0]=4 1819 B16R0.221 CCCCCOCCOCCOCC(=O)OC 7a_100011215259_100000090808 [0,0,1,0,0,0|3,0,0]=4 1820 B16R0.221 CCCCCSCCCCCCCC(=O)OC 62a_100000210326_100010004213 [0,0,1,0,0,0|1,0,0]=2 1821 B16R0.221 CCCCCSCCCCCCCC(=O)OC 62a_100010004213_100000210326 [0,0,1,0,0,0|1,0,0]=2 1822 B16R0.221 CCCCNCCCCCCCCC(=O)OC 2230a_100000102301_100010282707 [0,0,1,0,0,0|1,0,0]=2 1823 B16R0.221 CCCCNCCCCCCCCC(=O)OC 7a_106832991798_100010282707 [0,0,1,0,0,0|1,0,0]=2 1824 B16R0.221 CCCCNCCCCOCCCC(=O)NC 34a_200011216965_100000741757 [0,0,1,0,0,0|3,0,0]=4 1825 B16R0.221 CCCCNCCCCOCCCC(=O)OC 34a_200011216965_100000742333 [0,0,1,0,0,0|2,0,0]=3 1826 B16R0.221 CCCCNCCCCOCCOC(=O)NC 34a_200011216965_200011997002 [0,0,1,0,0,0|3,0,0]=4 1827 B16R0.221 CCCCOCCCCCCCCC(=O)OC 34a_100000035544_100000210210 [0,0,1,0,0,0|1,0,0]=2 1828 B16R0.221 CCCCOCCCCCCCCC(=O)OC 34a_100000210227_100010282707 [0,0,1,0,0,0|1,0,0]=2 1829 B16R0.221 CCCCOCCCCCCCCC(=O)OC 7a_100000035544_100000210211 [0,0,1,0,0,0|1,0,0]=2 1830 B16R0.221 CCCCOCCCCCCCCC(=O)OC 7a_100000210227_100010282707 [0,0,1,0,0,0|1,0,0]=2 1831 B16R0.221 CCCCOCCCCOCCCC(=O)NC 34a_200000760531_100000741757 [0,0,1,0,0,0|3,0,0]=4 1832 B16R0.221 CCCCOCCCCOCCCC(=O)NC 7a_200000760531_100000741757 [0,0,1,0,0,0|3,0,0]=4 1833 B16R0.221 CCCCOCCCCOCCCC(=O)OC 34a_200000760531_100000742333 [0,0,1,0,0,0|2,0,0]=3 1834 B16R0.221 CCCCOCCCCOCCCC(=O)OC 7a_200000760531_100011218270 [0,0,1,0,0,0|2,0,0]=3 1835 B16R0.221 CCCCOCCCCOCCOC(=O)NC 34a_200000760531_200011997002 [0,0,1,0,0,0|3,0,0]=4 1836 B16R0.221 CCCCOCCCCOCCOC(=O)NC 7a_200000760531_200011997002 [0,0,1,0,0,0|3,0,0]=4 1837 B16R0.221 CCCCOCCCNCCCCC(=O)OC 2230a_200000211371_100000204269 [0,0,1,0,0,0|2,0,0]=3 1838 B16R0.221 CCCCOCCCNCCCCC(=O)OC 34a_200000211371_100000204269 [0,0,1,0,0,0|2,0,0]=3 1839 B16R0.221 CCCCOCCCNCCOCC(=O)OC 2230a_200000211371_100000090808 [0,0,1,0,0,0|3,0,0]=4 1840 B16R0.221 CCCCOCCCNCCOCC(=O)OC 34a_200000211371_100000090808 [0,0,1,0,0,0|3,0,0]=4 1841 B16R0.221 CCCCOCCCOCCCCC(=O)OC 34a_200011215613_100000204269 [0,0,1,0,0,0|2,0,0]=3 1842 B16R0.221 CCCCOCCCOCCCCC(=O)OC 7a_200011215613_100000204269 [0,0,1,0,0,0|2,0,0]=3 1843 B16R0.221 CCCCOCCCOCCOCC(=O)OC 34a_200011215613_100000090808 [0,0,1,0,0,0|3,0,0]=4 1844 B16R0.221 CCCCOCCCOCCOCC(=O)OC 7a_200011215613_100000090808 [0,0,1,0,0,0|3,0,0]=4 1845 B16R0.221 CCCCOCCOCCCCCC(=O)OC 34a_100000074720_100000743108 [0,0,1,0,0,0|2,0,0]=3 1846 B16R0.221 CCCCOCCOCCCCCC(=O)OC 34a_100000210238_100009816466 [0,0,1,0,0,0|2,0,0]=3 1847 B16R0.221 CCCCOCCOCCCCCC(=O)OC 7a_100000074720_100000743108 [0,0,1,0,0,0|2,0,0]=3 1848 B16R0.221 CCCCOCCOCCCCCC(=O)OC 7a_100000210238_100009816466 [0,0,1,0,0,0|2,0,0]=3 1849 B16R0.221 CCCCOCCOCCOCCC(=O)OC 34a_100010982084_100000210210 [0,0,1,0,0,0|3,0,0]=4 1850 B16R0.221 CCCCOCCOCCOCCC(=O)OC 34a_100011215186_100000742370 [0,0,1,0,0,0|3,0,0]=4 1851 B16R0.221 CCCCOCCOCCOCCC(=O)OC 7a_100010982084_100000210211 [0,0,1,0,0,0|3,0,0]=4 1852 B16R0.221 CCCCOCCOCCOCCC(=O)OC 7a_100011215186_100000204255 [0,0,1,0,0,0|3,0,0]=4 1853 B16R0.221 CCCCOCCSCCCCCC(=O)OC 62a_100000743108_100009816466 [0,0,1,0,0,0|2,0,0]=3 1854 B16R0.221 CCCCOCCSCCCCCC(=O)OC 62a_100009816466_100000743108 [0,0,1,0,0,0|2,0,0]=3 1855 B16R0.221 CCCCOCOCCCCCCC(=O)OC 34a_100009863599_100011995733 [0,0,1,0,0,0|2,0,0]=3 1856 B16R0.221 CCCCOCSCCCCCCC(=O)OC 62a_100009815986_100011995733 [0,0,1,0,0,0|2,0,0]=3 1857 B16R0.221 CCCCOCSCCCCCCC(=O)OC 62a_100011995733_100009815986 [0,0,1,0,0,0|2,0,0]=3 1858 B16R0.221 CCCCSCCCCCCCCC(=O)OC 62a_100000210211_100010282707 [0,0,1,0,0,0|1,0,0]=2 1859 B16R0.221 CCCCSCCCCCCCCC(=O)OC 62a_100010282707_100000210210 [0,0,1,0,0,0|1,0,0]=2 1860 B16R0.221 CCCCSCCNCCCCCC(=O)OC 2230a_100025743550_100009816466 [0,0,1,0,0,0|2,0,0]=3 1861 B16R0.221 CCCCSCCOCCCCCC(=O)OC 34a_200000230436_100009816466 [0,0,1,0,0,0|2,0,0]=3 1862 B16R0.221 CCCCSCCOCCCCCC(=O)OC 7a_200000230436_100009816466 [0,0,1,0,0,0|2,0,0]=3 1863 B16R0.221 CCCOCCCCCCCCCC(=O)OC 34a_100000210258_100009813843 [0,0,1,0,0,0|1,0,0]=2 1864 B16R0.221 CCCOCCCNCCCCCC(=O)OC 2230a_100011217757_100009816466 [0,0,1,0,0,0|2,0,0]=3 1865 B16R0.221 CCCOCCCNCCCCCC(=O)OC 34a_100011217757_100009816466 [0,0,1,0,0,0|2,0,0]=3 1866 B16R0.221 CCCOCCNCCCCCCC(=O)OC 2230a_100161115042_100009815986 [0,0,1,0,0,0|2,0,0]=3 1867 B16R0.221 CCCOCCNCCCCCCC(=O)OC 34a_100161115042_100009815986 [0,0,1,0,0,0|2,0,0]=3 1868 B16R0.221 CCCOCCOCCCCCCC(=O)OC 34a_100000752267_100009815986 [0,0,1,0,0,0|2,0,0]=3 1869 B16R0.221 CCCOCCOCCCCCCC(=O)OC 34a_100009863599_100011215938 [0,0,1,0,0,0|2,0,0]=3 1870 B16R0.221 CCCOCCOCCCCCCC(=O)OC 7a_100000752267_100009815986 [0,0,1,0,0,0|2,0,0]=3 1871 B16R0.221 CCCOCCOCCCCCCC(=O)OC 7a_100009863599_100011215938 [0,0,1,0,0,0|2,0,0]=3 1872 B16R0.221 CCCOCCOCCNCCCC(=O)OC 2230a_200011904461_100011218270 [0,0,1,0,0,0|3,0,0]=4 1873 B16R0.221 CCCOCCOCCNCCCC(=O)OC 34a_200011904461_100000742333 [0,0,1,0,0,0|3,0,0]=4 1874 B16R0.221 CCCOCCSCCCCCCC(=O)OC 62a_100009815986_100011215938 [0,0,1,0,0,0|2,0,0]=3 1875 B16R0.221 CCCOCCSCCCCCCC(=O)OC 62a_100011215938_100009815986 [0,0,1,0,0,0|2,0,0]=3 1876 B16R0.221 CCCSCCCCCCCCCC(=O)OC 62a_100000210303_100009813843 [0,0,1,0,0,0|1,0,0]=2 1877 B16R0.221 CCCSCCNCCCCCCC(=O)OC 2230a_100020603323_100009815986 [0,0,1,0,0,0|2,0,0]=3 1878 B16R0.221 CCCSCCOCCCCCCC(=O)OC 34a_200000230433_100009815986 [0,0,1,0,0,0|2,0,0]=3 1879 B16R0.221 CCCSCCOCCCCCCC(=O)OC 7a_200000230433_100009815986 [0,0,1,0,0,0|2,0,0]=3 1880 B16R0.221 CCNCCCCCCCCCCC(=O)OC 2230a_100015525214_100009812566 [0,0,1,0,0,0|1,0,0]=2 1881 B16R0.221 CCNN=CCCCCCCCCC(=O)OC 4a_100000756455_200010166605 [0,0,1,0,0,0|2,0,1]=4 1882 B16R0.221 CCOCCCCCCCCCCC(=O)OC 34a_100011003013_100000210202 [0,0,1,0,0,0|1,0,0]=2 1883 B16R0.221 CCOCCCCCCCCCCC(=O)OC 34a_100121572206_100009812566 [0,0,1,0,0,0|1,0,0]=2 1884 B16R0.221 CCOCCCCCCCCCCC(=O)OC 7a_100011003013_100000210202 [0,0,1,0,0,0|1,0,0]=2 1885 B16R0.221 CCOCCCCCCCCCOC(C)CC 34a_100009875440_100011215416 [0,0,1,0,0,0|2,0,1]=4 1886 B16R0.221 CCOCCCCCCCCCOC(C)CC 7a_100009875440_100000758301 [0,0,1,0,0,0|2,0,1]=4 1887 B16R0.221 CCOCCCNCCCCCCC(=O)OC 2230a_100000210961_100009815986 [0,0,1,0,0,0|2,0,0]=3 1888 B16R0.221 CCOCCCNCCCCCCC(=O)OC 34a_100000210961_100009815986 [0,0,1,0,0,0|2,0,0]=3 1889 B16R0.221 CCOCCCOCCCCCCC(=O)OC 34a_100000757476_100009815986 [0,0,1,0,0,0|2,0,0]=3 1890 B16R0.221 CCOCCCOCCCCCCC(=O)OC 34a_100009863599_100012232248 [0,0,1,0,0,0|2,0,0]=3 1891 B16R0.221 CCOCCCOCCCCCCC(=O)OC 7a_100000757476_100009815986 [0,0,1,0,0,0|2,0,0]=3 1892 B16R0.221 CCOCCCOCCCCCCC(=O)OC 7a_100009863599_100012232248 [0,0,1,0,0,0|2,0,0]=3 1893 B16R0.221 CCOCCCSCCCCCCC(=O)OC 62a_100009815986_100012232248 [0,0,1,0,0,0|2,0,0]=3 1894 B16R0.221 CCOCCCSCCCCCCC(=O)OC 62a_100012232248_100009815986 [0,0,1,0,0,0|2,0,0]=3 1895 B16R0.221 CCOCCNCCCCCCCC(=O)OC 2230a_102516460346_100010004213 [0,0,1,0,0,0|2,0,0]=3 1896 B16R0.221 CCOCCNCCCCCCCC(=O)OC 34a_102516460346_100010004213 [0,0,1,0,0,0|2,0,0]=3 1897 B16R0.221 CCOCCOCCCCCCCC(=O)OC 34a_100000210136_100010004213 [0,0,1,0,0,0|2,0,0]=3 1898 B16R0.221 CCOCCOCCCCCCCC(=O)OC 34a_100011022521_100000210147 [0,0,1,0,0,0|2,0,0]=3 1899 B16R0.221 CCOCCOCCCCCCCC(=O)OC 7a_100000210136_100010004213 [0,0,1,0,0,0|2,0,0]=3 1900 B16R0.221 CCOCCOCCCCCCCC(=O)OC 7a_100011022521_100011215890 [0,0,1,0,0,0|2,0,0]=3 1901 B16R0.221 CCOCCOCCNCCCCC(=O)OC 2230a_100102712874_100000204269 [0,0,1,0,0,0|3,0,0]=4 1902 B16R0.221 CCOCCOCCNCCCCC(=O)OC 34a_100102712874_100000204269 [0,0,1,0,0,0|3,0,0]=4 1903 B16R0.221 CCOCCOCCOCCCCC(=O)OC 34a_100000059025_100011211534 [0,0,1,0,0,0|3,0,0]=4 1904 B16R0.221 CCOCCOCCOCCCCC(=O)OC 34a_100000210240_100000204269 [0,0,1,0,0,0|3,0,0]=4 1905 B16R0.221 CCOCCOCCOCCCCC(=O)OC 7a_100000059025_100011211534 [0,0,1,0,0,0|3,0,0]=4 1906 B16R0.221 CCOCCOCCOCCCCC(=O)OC 7a_100000210240_100000204269 [0,0,1,0,0,0|3,0,0]=4 1907 B16R0.221 CCOCCOCCSCCCCC(=O)OC 62a_100000204269_100011211534 [0,0,1,0,0,0|3,0,0]=4 1908 B16R0.221 CCOCCOCCSCCCCC(=O)OC 62a_100011211534_100000204269 [0,0,1,0,0,0|3,0,0]=4 1909 B16R0.221 CCOCCSCCCCCCCC(=O)OC 62a_100000210147_100010004213 [0,0,1,0,0,0|2,0,0]=3 1910 B16R0.221 CCOCCSCCCCCCCC(=O)OC 62a_100010004213_100011215890 [0,0,1,0,0,0|2,0,0]=3 1911 B16R0.221 CCOCSCCCCCCCCC(=O)OC 62a_100000739092_100010282707 [0,0,1,0,0,0|2,0,0]=3 1912 B16R0.221 CCOCSCCCCCCCCC(=O)OC 62a_100010282707_100000739092 [0,0,1,0,0,0|2,0,0]=3 1913 B16R0.221 CCSCCCCCCCCCCC(=O)OC 62a_100000210202_100009812566 [0,0,1,0,0,0|1,0,0]=2 1914 B16R0.221 CCSCCCOCCCCCCC(=O)OC 34a_100011216438_100009815986 [0,0,1,0,0,0|2,0,0]=3 1915 B16R0.221 CCSCCCOCCCCCCC(=O)OC 7a_100011216438_100009815986 [0,0,1,0,0,0|2,0,0]=3 1916 B16R0.221 CCSCCNCCCCCCCC(=O)OC 2230a_100000106463_100010004213 [0,0,1,0,0,0|2,0,0]=3 1917 B16R0.221 CCSCCOCCCCCCCC(=O)OC 34a_100000212035_100010004213 [0,0,1,0,0,0|2,0,0]=3 1918 B16R0.221 CCSCCOCCCCCCCC(=O)OC 34a_100011022521_100000757381 [0,0,1,0,0,0|2,0,0]=3 1919 B16R0.221 CCSCCOCCCCCCCC(=O)OC 7a_100000212035_100010004213 [0,0,1,0,0,0|2,0,0]=3 1920 B16R0.221 CCSCCOCCCCCCCC(=O)OC 7a_100011022521_100000757381 [0,0,1,0,0,0|2,0,0]=3 1921 B16R0.221 CCSCCSCCCCCCCC(=O)OC 62a_100000757381_100010004213 [0,0,1,0,0,0|2,0,0]=3 1922 B16R0.221 CCSCCSCCCCCCCC(=O)OC 62a_100010004213_100000757381 [0,0,1,0,0,0|2,0,0]=3 1923 B16R0.221 CNC(=O)CCCCCCCCCCCCO 240690a_100102657272_100102582631 [0,0,1,0,0,0|2,0,0]=3 1924 B16R0.221 CNC(=O)CCCNCCCCCCCCO 2230a_100000740002_100000033203 [0,0,1,0,0,0|3,0,0]=4 1925 B16R0.221 CNC(=O)CCCNCCCCCCCCO 2230a_102515433106_100000741757 [0,0,1,0,0,0|3,0,0]=4 1926 B16R0.221 CNC(=O)CCCNCCCCCCCCO 34a_100000740002_100000033203 [0,0,1,0,0,0|3,0,0]=4 1927 B16R0.221 CNC(=O)CCCNCCCCCCCCO 34a_102515433106_100000741757 [0,0,1,0,0,0|3,0,0]=4 1928 B16R0.221 CNC(=O)CCCOCCCCCCCCBr 34a_100009813846_100000741757 [0,0,1,0,0,0|3,0,0]=4 1929 B16R0.221 CNC(=O)CCCOCCCCCCCCBr 7a_100009813846_100000741757 [0,0,1,0,0,0|3,0,0]=4 1930 B16R0.221 CNC(=O)CCCOCCCCCCCCCl 34a_100000033203_100000741757 [0,0,1,0,0,0|3,0,0]=4 1931 B16R0.221 CNC(=O)CCCOCCCCCCCCCl 7a_100000033203_100000741757 [0,0,1,0,0,0|3,0,0]=4 1932 B16R0.221 CNC(=O)CCCOCCCCCCCCN 34a_102515433106_100000741757 [0,0,1,0,0,0|3,0,0]=4 1933 B16R0.221 CNC(=O)CCCSCCCCCCCCO 62a_100000033203_100000741757 [0,0,1,0,0,0|3,0,0]=4 1934 B16R0.221 CNC(=O)CCCSCCCCCCCCO 62a_100000741757_100000033203 [0,0,1,0,0,0|3,0,0]=4 1935 B16R0.221 CNC(=O)CCNCCCCCCCCCO 2230a_100000078944_100000737683 [0,0,1,0,0,0|3,0,0]=4 1936 B16R0.221 CNC(=O)CCNCCCCCCCCCO 2230a_100000738227_100009813782 [0,0,1,0,0,0|3,0,0]=4 1937 B16R0.221 CNC(=O)CCNCCCCCCCCCO 34a_100000078944_100012179268 [0,0,1,0,0,0|3,0,0]=4 1938 B16R0.221 CNC(=O)CCNCCCCCCCCCO 34a_100000738227_100009813782 [0,0,1,0,0,0|3,0,0]=4 1939 B16R0.221 CNC(=O)CCOCCCCCCCCCBr 34a_100009813782_100012179268 [0,0,1,0,0,0|3,0,0]=4 1940 B16R0.221 CNC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000737683 [0,0,1,0,0,0|3,0,0]=4 1941 B16R0.221 CNC(=O)CCOCCCCCCCCCCl 34a_100009868337_100012179268 [0,0,1,0,0,0|3,0,0]=4 1942 B16R0.221 CNC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000737683 [0,0,1,0,0,0|3,0,0]=4 1943 B16R0.221 CNC(=O)CCOCCCCCCCCCN 34a_100000078944_100012179268 [0,0,1,0,0,0|3,0,0]=4 1944 B16R0.221 CNC(=O)CCOCCCCCCCCCO 34a_100000754576_100009813782 [0,0,1,0,0,0|3,0,0]=4 1945 B16R0.221 CNC(=O)CCSCCCCCCCCCO 62a_100000737683_100009813782 [0,0,1,0,0,0|3,0,0]=4 1946 B16R0.221 CNC(=O)CCSCCCCCCCCCO 62a_100009813782_100000737683 [0,0,1,0,0,0|3,0,0]=4 1947 B16R0.221 CNC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000183359 [0,0,1,0,0,0|3,0,0]=4 1948 B16R0.221 CNC(=O)CNCCCCCCCCCCO 2230a_100000693194_100009813290 [0,0,1,0,0,0|3,0,0]=4 1949 B16R0.221 CNC(=O)CNCCCCCCCCCCO 34a_100000066964_100000183359 [0,0,1,0,0,0|3,0,0]=4 1950 B16R0.221 CNC(=O)COCCCCCCCCCCBr 34a_100009813290_100000183359 [0,0,1,0,0,0|3,0,0]=4 1951 B16R0.221 CNC(=O)COCCCCCCCCCCBr 7a_100009813290_100000183359 [0,0,1,0,0,0|3,0,0]=4 1952 B16R0.221 CNC(=O)COCCCCCCCCCCCl 34a_200000033068_100000183359 [0,0,1,0,0,0|3,0,0]=4 1953 B16R0.221 CNC(=O)COCCCCCCCCCCCl 7a_200000033068_100000183359 [0,0,1,0,0,0|3,0,0]=4 1954 B16R0.221 CNC(=O)COCCCCCCCCCCN 34a_100000066964_100000183359 [0,0,1,0,0,0|3,0,0]=4 1955 B16R0.221 CNC(=O)COCCCCCCCCCCO 34a_100000750040_100009813290 [0,0,1,0,0,0|3,0,0]=4 1956 B16R0.221 CNC(=O)CSCCCCCCCCCCO 62a_100000183359_200000033068 [0,0,1,0,0,0|3,0,0]=4 1957 B16R0.221 CNC(=O)CSCCCCCCCCCCO 62a_100009813290_100000183359 [0,0,1,0,0,0|3,0,0]=4 1958 B16R0.221 CNC(=O)OCCNCCCCCCCCO 34a_102515433106_200011997002 [0,0,1,0,0,0|3,0,0]=4 1959 B16R0.221 CNC(=O)OCCOCCCCCCCCBr 34a_100009813846_200011997002 [0,0,1,0,0,0|3,0,0]=4 1960 B16R0.221 CNC(=O)OCCOCCCCCCCCBr 7a_100009813846_200011997002 [0,0,1,0,0,0|3,0,0]=4 1961 B16R0.221 CNC(=O)OCCOCCCCCCCCCl 34a_100000033203_200011997002 [0,0,1,0,0,0|3,0,0]=4 1962 B16R0.221 CNC(=O)OCCOCCCCCCCCCl 7a_100000033203_200011997002 [0,0,1,0,0,0|3,0,0]=4 1963 B16R0.221 CNC(=O)OCCOCCCCCCCCN 34a_102515433106_200011997002 [0,0,1,0,0,0|3,0,0]=4 1964 B16R0.221 CNC(=O)OCCSCCCCCCCCO 62a_100000033203_200011997002 [0,0,1,0,0,0|3,0,0]=4 1965 B16R0.221 CNC(=O)OCCSCCCCCCCCO 62a_200011997002_100000033203 [0,0,1,0,0,0|3,0,0]=4 1966 B16R0.221 CNCCCCCCCCCCCC(=O)OC 2230a_106832991635_100010983606 [0,0,1,0,0,0|1,0,0]=2 1967 B16R0.221 CNCCCCCCCCCCCC(=O)OC 34a_100102657272_100010983606 [0,0,1,0,0,0|1,0,0]=2 1968 B16R0.221 CNCCCCCCCCCCCC(=O)OC 7a_106832991635_100010983606 [0,0,1,0,0,0|1,0,0]=2 1969 B16R0.221 CNCCCCCOCCCCCC(=O)OC 34a_100000722520_100009816466 [0,0,1,0,0,0|2,0,0]=3 1970 B16R0.221 CNCCCOCCCCCCCC(=O)OC 34a_100000213112_100010004213 [0,0,1,0,0,0|2,0,0]=3 1971 B16R0.221 CNCCOCCOCCCCCC(=O)OC 34a_100000228057_100009816466 [0,0,1,0,0,0|3,0,0]=4 1972 B16R0.221 COC(=O)CCCCCCCCCCCSC 62a_200000210301_100010983606 [0,0,1,0,0,0|1,0,0]=2 1973 B16R0.221 COC(=O)CCCCCCCCCCCS[13CH3] 62a_200025704644_100010983606 [0,0,1,0,0,0|1,0,0]=2 1974 B16R0.221 COC(=O)CCCCCCCCCCOCF 34a_100011003013_100015361967 [0,0,1,0,0,0|2,0,0]=3 1975 B16R0.221 COC(=O)CCCCCCCCCCOCF 7a_100011003013_100015361967 [0,0,1,0,0,0|2,0,0]=3 1976 B16R0.221 COC(=O)CCCCCCCCCCSCF 62a_100015361967_100009812566 [0,0,1,0,0,0|2,0,0]=3 1977 B16R0.221 COC(=O)CCCCCCCCCNCCF 34a_100000724931_100009813843 [0,0,1,0,0,0|2,0,0]=3 1978 B16R0.221 COC(=O)CCCCCCCCCNCCO 2230a_100016997473_100009813843 [0,0,1,0,0,0|2,0,0]=3 1979 B16R0.221 COC(=O)CCCCCCCCCNCCO 34a_100016990907_100009813843 [0,0,1,0,0,0|2,0,0]=3 1980 B16R0.221 COC(=O)CCCCCCCCCOCCBr 34a_100000211926_100009813843 [0,0,1,0,0,0|2,0,0]=3 1981 B16R0.221 COC(=O)CCCCCCCCCOCCN 34a_100000210304_100009813843 [0,0,1,0,0,0|2,0,0]=3 1982 B16R0.221 COC(=O)CCCCCCCCCSCC#N 62a_100011215382_100009813843 [0,0,1,0,0,0|2,0,1]=4 1983 B16R0.221 COC(=O)CCCCCCCCCSCC=O 62a_200015260668_100009813843 [0,0,1,0,0,0|2,0,1]=4 1984 B16R0.221 COC(=O)CCCCCCCCCSCCF 62a_100011217306_100009813843 [0,0,1,0,0,0|2,0,0]=3 1985 B16R0.221 COC(=O)CCCCCCCCCSCCO 62a_100000211926_100009813843 [0,0,1,0,0,0|2,0,0]=3 1986 B16R0.221 COC(=O)CCCCCCCCCSCSC 62a_100011218213_100009813843 [0,0,1,0,0,0|2,0,0]=3 1987 B16R0.221 COC(=O)CCCCCCCCNCCCF 2230a_100015189416_100010282707 [0,0,1,0,0,0|2,0,0]=3 1988 B16R0.221 COC(=O)CCCCCCCCNCCCF 34a_100015189416_100010282707 [0,0,1,0,0,0|2,0,0]=3 1989 B16R0.221 COC(=O)CCCCCCCCNCCSC 2230a_100020590264_100010282707 [0,0,1,0,0,0|2,0,0]=3 1990 B16R0.221 COC(=O)CCCCCCCCOCCC#N 7a_100000035544_100000184422 [0,0,1,0,0,0|2,0,1]=4 1991 B16R0.221 COC(=O)CCCCCCCCOCCCBr 34a_100011217188_100010282707 [0,0,1,0,0,0|2,0,0]=3 1992 B16R0.221 COC(=O)CCCCCCCCOCCCCl 34a_100000230001_100010282707 [0,0,1,0,0,0|2,0,0]=3 1993 B16R0.221 COC(=O)CCCCCCCCOCCCF 34a_100000035544_100011934791 [0,0,1,0,0,0|2,0,0]=3 1994 B16R0.221 COC(=O)CCCCCCCCOCCCF 34a_100000759539_100010282707 [0,0,1,0,0,0|2,0,0]=3 1995 B16R0.221 COC(=O)CCCCCCCCOCCCF 7a_100000035544_100011934791 [0,0,1,0,0,0|2,0,0]=3 1996 B16R0.221 COC(=O)CCCCCCCCOCCCN 34a_100000182051_100010282707 [0,0,1,0,0,0|2,0,0]=3 1997 B16R0.221 COC(=O)CCCCCCCCOCCCO 34a_100000035544_100000230001 [0,0,1,0,0,0|2,0,0]=3 1998 B16R0.221 COC(=O)CCCCCCCCOCCCO 7a_100000035544_100011215043 [0,0,1,0,0,0|2,0,0]=3 1999 B16R0.221 COC(=O)CCCCCCCCOCCON 34a_100000700252_100010282707 [0,0,1,0,0,0|3,0,0]=4 2000 B16R0.221 COC(=O)CCCCCCCCOCCSC 34a_100000035544_100000212216 [0,0,1,0,0,0|2,0,0]=3 2001 B16R0.221 COC(=O)CCCCCCCCOCCSC 34a_100000230434_100010282707 [0,0,1,0,0,0|2,0,0]=3 2002 B16R0.221 COC(=O)CCCCCCCCOCCSC 7a_100000035544_100000212216 [0,0,1,0,0,0|2,0,0]=3 2003 B16R0.221 COC(=O)CCCCCCCCOCCSC 7a_100000230434_100010282707 [0,0,1,0,0,0|2,0,0]=3 2004 B16R0.221 COC(=O)CCCCCCCCSCCC#N 62a_100010282707_100011215226 [0,0,1,0,0,0|2,0,1]=4 2005 B16R0.221 COC(=O)CCCCCCCCSCCC#N 62a_100011215226_100010282707 [0,0,1,0,0,0|2,0,1]=4 2006 B16R0.221 COC(=O)CCCCCCCCSCCCF 62a_100010282707_100011934791 [0,0,1,0,0,0|2,0,0]=3 2007 B16R0.221 COC(=O)CCCCCCCCSCCCF 62a_100011934791_100010282707 [0,0,1,0,0,0|2,0,0]=3 2008 B16R0.221 COC(=O)CCCCCCCCSCCCO 62a_100010282707_100011215043 [0,0,1,0,0,0|2,0,0]=3 2009 B16R0.221 COC(=O)CCCCCCCCSCCCO 62a_100011215043_100010282707 [0,0,1,0,0,0|2,0,0]=3 2010 B16R0.221 COC(=O)CCCCCCCCSCCSC 62a_100000212216_100010282707 [0,0,1,0,0,0|2,0,0]=3 2011 B16R0.221 COC(=O)CCCCCCCCSCCSC 62a_100010282707_100000751147 [0,0,1,0,0,0|2,0,0]=3 2012 B16R0.221 COC(=O)CCCCCCCNCCCCO 2230a_100000750430_100010004213 [0,0,1,0,0,0|2,0,0]=3 2013 B16R0.221 COC(=O)CCCCCCCNCCCCO 34a_100000750430_100010004213 [0,0,1,0,0,0|2,0,0]=3 2014 B16R0.221 COC(=O)CCCCCCCNCCCSC 2230a_100000749238_100010004213 [0,0,1,0,0,0|2,0,0]=3 2015 B16R0.221 COC(=O)CCCCCCCOCCCC#N 7a_100011022521_100000687738 [0,0,1,0,0,0|2,0,1]=4 2016 B16R0.221 COC(=O)CCCCCCCOCCCC=O 7a_100011022521_200011292268 [0,0,1,0,0,0|2,0,1]=4 2017 B16R0.221 COC(=O)CCCCCCCOCCCCBr 34a_100011216708_100010004213 [0,0,1,0,0,0|2,0,0]=3 2018 B16R0.221 COC(=O)CCCCCCCOCCCCCl 34a_100000210776_100010004213 [0,0,1,0,0,0|2,0,0]=3 2019 B16R0.221 COC(=O)CCCCCCCOCCCCCl 7a_100000210776_100010004213 [0,0,1,0,0,0|2,0,0]=3 2020 B16R0.221 COC(=O)CCCCCCCOCCCCF 34a_100011022521_100000729493 [0,0,1,0,0,0|2,0,0]=3 2021 B16R0.221 COC(=O)CCCCCCCOCCCCF 34a_100011995726_100010004213 [0,0,1,0,0,0|2,0,0]=3 2022 B16R0.221 COC(=O)CCCCCCCOCCCCF 7a_100011022521_100000729493 [0,0,1,0,0,0|2,0,0]=3 2023 B16R0.221 COC(=O)CCCCCCCOCCCCF 7a_100011995726_100010004213 [0,0,1,0,0,0|2,0,0]=3 2024 B16R0.221 COC(=O)CCCCCCCOCCCCI 34a_200012148704_100010004213 [0,0,1,0,0,0|2,0,0]=3 2025 B16R0.221 COC(=O)CCCCCCCOCCCCN 34a_100000750430_100010004213 [0,0,1,0,0,0|2,0,0]=3 2026 B16R0.221 COC(=O)CCCCCCCOCCCCO 34a_100011022521_100011216708 [0,0,1,0,0,0|2,0,0]=3 2027 B16R0.221 COC(=O)CCCCCCCOCCCCO 7a_100011022521_100000210776 [0,0,1,0,0,0|2,0,0]=3 2028 B16R0.221 COC(=O)CCCCCCCOCCCSC 34a_100000690336_100010004213 [0,0,1,0,0,0|2,0,0]=3 2029 B16R0.221 COC(=O)CCCCCCCOCCCSC 7a_100000690336_100010004213 [0,0,1,0,0,0|2,0,0]=3 2030 B16R0.221 COC(=O)CCCCCCCSCCCC#N 62a_100000687738_100010004213 [0,0,1,0,0,0|2,0,1]=4 2031 B16R0.221 COC(=O)CCCCCCCSCCCC#N 62a_100010004213_100000687738 [0,0,1,0,0,0|2,0,1]=4 2032 B16R0.221 COC(=O)CCCCCCCSCCCC=O 62a_100010004213_200011292268 [0,0,1,0,0,0|2,0,1]=4 2033 B16R0.221 COC(=O)CCCCCCCSCCCC=O 62a_200011292268_100010004213 [0,0,1,0,0,0|2,0,1]=4 2034 B16R0.221 COC(=O)CCCCCCCSCCCCF 62a_100000729493_100010004213 [0,0,1,0,0,0|2,0,0]=3 2035 B16R0.221 COC(=O)CCCCCCCSCCCCF 62a_100010004213_100000729493 [0,0,1,0,0,0|2,0,0]=3 2036 B16R0.221 COC(=O)CCCCCCCSCCCCO 62a_100000210776_100010004213 [0,0,1,0,0,0|2,0,0]=3 2037 B16R0.221 COC(=O)CCCCCCCSCCCCO 62a_100010004213_100000210776 [0,0,1,0,0,0|2,0,0]=3 2038 B16R0.221 COC(=O)CCCCCCNCCCCCO 2230a_100000762737_100009815986 [0,0,1,0,0,0|2,0,0]=3 2039 B16R0.221 COC(=O)CCCCCCNCCCCCO 34a_100000762737_100009815986 [0,0,1,0,0,0|2,0,0]=3 2040 B16R0.221 COC(=O)CCCCCCNCCOCCO 2230a_100000211614_100009815986 [0,0,1,0,0,0|3,0,0]=4 2041 B16R0.221 COC(=O)CCCCCCNCCOCCO 34a_100000211614_100009815986 [0,0,1,0,0,0|3,0,0]=4 2042 B16R0.221 COC(=O)CCCCCCNCCSCCO 2230a_100011219999_100009815986 [0,0,1,0,0,0|3,0,0]=4 2043 B16R0.221 COC(=O)CCCCCCOCCCCC#N 7a_100009863599_100000211819 [0,0,1,0,0,0|2,0,1]=4 2044 B16R0.221 COC(=O)CCCCCCOCCCCC=O 7a_100009863599_100000139335 [0,0,1,0,0,0|2,0,1]=4 2045 B16R0.221 COC(=O)CCCCCCOCCCCCBr 34a_100000746331_100009815986 [0,0,1,0,0,0|2,0,0]=3 2046 B16R0.221 COC(=O)CCCCCCOCCCCCBr 7a_100000746331_100009815986 [0,0,1,0,0,0|2,0,0]=3 2047 B16R0.221 COC(=O)CCCCCCOCCCCCCl 34a_100000746330_100009815986 [0,0,1,0,0,0|2,0,0]=3 2048 B16R0.221 COC(=O)CCCCCCOCCCCCCl 7a_100000746330_100009815986 [0,0,1,0,0,0|2,0,0]=3 2049 B16R0.221 COC(=O)CCCCCCOCCCCCF 34a_100009863599_100000729378 [0,0,1,0,0,0|2,0,0]=3 2050 B16R0.221 COC(=O)CCCCCCOCCCCCF 7a_100009863599_100000729378 [0,0,1,0,0,0|2,0,0]=3 2051 B16R0.221 COC(=O)CCCCCCOCCCCCI 34a_200012148887_100009815986 [0,0,1,0,0,0|2,0,0]=3 2052 B16R0.221 COC(=O)CCCCCCOCCCCCI 7a_200012148887_100009815986 [0,0,1,0,0,0|2,0,0]=3 2053 B16R0.221 COC(=O)CCCCCCOCCCCCN 34a_100000762737_100009815986 [0,0,1,0,0,0|2,0,0]=3 2054 B16R0.221 COC(=O)CCCCCCOCCCCCO 34a_100009863599_100000746330 [0,0,1,0,0,0|2,0,0]=3 2055 B16R0.221 COC(=O)CCCCCCOCCCCCO 7a_100009863599_100000746330 [0,0,1,0,0,0|2,0,0]=3 2056 B16R0.221 COC(=O)CCCCCCOCCCCSC 34a_100011217163_100009815986 [0,0,1,0,0,0|2,0,0]=3 2057 B16R0.221 COC(=O)CCCCCCOCCCCSC 7a_100011217163_100009815986 [0,0,1,0,0,0|2,0,0]=3 2058 B16R0.221 COC(=O)CCCCCCOCCOCCBr 34a_100000692535_100009815986 [0,0,1,0,0,0|3,0,0]=4 2059 B16R0.221 COC(=O)CCCCCCOCCOCCBr 7a_100000692535_100009815986 [0,0,1,0,0,0|3,0,0]=4 2060 B16R0.221 COC(=O)CCCCCCOCCOCCCl 34a_100011215305_100009815986 [0,0,1,0,0,0|3,0,0]=4 2061 B16R0.221 COC(=O)CCCCCCOCCOCCCl 7a_100011215305_100009815986 [0,0,1,0,0,0|3,0,0]=4 2062 B16R0.221 COC(=O)CCCCCCOCCOCCF 34a_200015357709_100009815986 [0,0,1,0,0,0|3,0,0]=4 2063 B16R0.221 COC(=O)CCCCCCOCCOCCF 7a_200015357709_100009815986 [0,0,1,0,0,0|3,0,0]=4 2064 B16R0.221 COC(=O)CCCCCCOCCOCCI 34a_100012149058_100009815986 [0,0,1,0,0,0|3,0,0]=4 2065 B16R0.221 COC(=O)CCCCCCOCCOCCI 7a_100012149058_100009815986 [0,0,1,0,0,0|3,0,0]=4 2066 B16R0.221 COC(=O)CCCCCCOCCOCCN 34a_100000211614_100009815986 [0,0,1,0,0,0|3,0,0]=4 2067 B16R0.221 COC(=O)CCCCCCOCCOCCO 34a_100009863599_100000692535 [0,0,1,0,0,0|3,0,0]=4 2068 B16R0.221 COC(=O)CCCCCCOCCOCCO 7a_100009863599_100011215305 [0,0,1,0,0,0|3,0,0]=4 2069 B16R0.221 COC(=O)CCCCCCSCCCCC#N 62a_100009815986_100000211819 [0,0,1,0,0,0|2,0,1]=4 2070 B16R0.221 COC(=O)CCCCCCSCCCCC#N 62a_100011219923_100009815986 [0,0,1,0,0,0|2,0,1]=4 2071 B16R0.221 COC(=O)CCCCCCSCCCCC=O 62a_100000139335_100009815986 [0,0,1,0,0,0|2,0,1]=4 2072 B16R0.221 COC(=O)CCCCCCSCCCCC=O 62a_100009815986_100000139335 [0,0,1,0,0,0|2,0,1]=4 2073 B16R0.221 COC(=O)CCCCCCSCCCCCF 62a_100000729378_100009815986 [0,0,1,0,0,0|2,0,0]=3 2074 B16R0.221 COC(=O)CCCCCCSCCCCCF 62a_100009815986_100000729378 [0,0,1,0,0,0|2,0,0]=3 2075 B16R0.221 COC(=O)CCCCCCSCCCCCO 62a_100000746330_100009815986 [0,0,1,0,0,0|2,0,0]=3 2076 B16R0.221 COC(=O)CCCCCCSCCCCCO 62a_100009815986_100000746330 [0,0,1,0,0,0|2,0,0]=3 2077 B16R0.221 COC(=O)CCCCCCSCCOCCO 62a_100009815986_100011215305 [0,0,1,0,0,0|3,0,0]=4 2078 B16R0.221 COC(=O)CCCCCCSCCOCCO 62a_100011215305_100009815986 [0,0,1,0,0,0|3,0,0]=4 2079 B16R0.221 COC(=O)CCCCCNCCCCCCO 2230a_100000686447_100009816466 [0,0,1,0,0,0|2,0,0]=3 2080 B16R0.221 COC(=O)CCCCCNCCCCCCO 34a_100000686447_100009816466 [0,0,1,0,0,0|2,0,0]=3 2081 B16R0.221 COC(=O)CCCCCOCCCCCC#N 7a_100000074720_100009813376 [0,0,1,0,0,0|2,0,1]=4 2082 B16R0.221 COC(=O)CCCCCOCCCCCC=O 7a_100000074720_100000139337 [0,0,1,0,0,0|2,0,1]=4 2083 B16R0.221 COC(=O)CCCCCOCCCCCCBr 34a_100011215345_100009816466 [0,0,1,0,0,0|2,0,0]=3 2084 B16R0.221 COC(=O)CCCCCOCCCCCCBr 7a_100011215345_100009816466 [0,0,1,0,0,0|2,0,0]=3 2085 B16R0.221 COC(=O)CCCCCOCCCCCCCl 34a_100000766143_100009816466 [0,0,1,0,0,0|2,0,0]=3 2086 B16R0.221 COC(=O)CCCCCOCCCCCCCl 7a_100000766143_100009816466 [0,0,1,0,0,0|2,0,0]=3 2087 B16R0.221 COC(=O)CCCCCOCCCCCCF 34a_100000074720_100015922095 [0,0,1,0,0,0|2,0,0]=3 2088 B16R0.221 COC(=O)CCCCCOCCCCCCF 34a_100000732779_100009816466 [0,0,1,0,0,0|2,0,0]=3 2089 B16R0.221 COC(=O)CCCCCOCCCCCCF 7a_100000074720_100015922095 [0,0,1,0,0,0|2,0,0]=3 2090 B16R0.221 COC(=O)CCCCCOCCCCCCF 7a_100000732779_100009816466 [0,0,1,0,0,0|2,0,0]=3 2091 B16R0.221 COC(=O)CCCCCOCCCCCCN 34a_100000686447_100009816466 [0,0,1,0,0,0|2,0,0]=3 2092 B16R0.221 COC(=O)CCCCCOCCCCCCO 34a_100000074720_100000766143 [0,0,1,0,0,0|2,0,0]=3 2093 B16R0.221 COC(=O)CCCCCOCCCCCCO 7a_100000074720_100000766143 [0,0,1,0,0,0|2,0,0]=3 2094 B16R0.221 COC(=O)CCCCCSCCCCCC#N 62a_100009813376_100009816466 [0,0,1,0,0,0|2,0,1]=4 2095 B16R0.221 COC(=O)CCCCCSCCCCCC#N 62a_100009816466_100009813376 [0,0,1,0,0,0|2,0,1]=4 2096 B16R0.221 COC(=O)CCCCCSCCCCCC=O 62a_100000139337_100009816466 [0,0,1,0,0,0|2,0,1]=4 2097 B16R0.221 COC(=O)CCCCCSCCCCCC=O 62a_100009816466_100000139337 [0,0,1,0,0,0|2,0,1]=4 2098 B16R0.221 COC(=O)CCCCCSCCCCCCF 62a_100009816466_100015922095 [0,0,1,0,0,0|2,0,0]=3 2099 B16R0.221 COC(=O)CCCCCSCCCCCCF 62a_100015922095_100009816466 [0,0,1,0,0,0|2,0,0]=3 2100 B16R0.221 COC(=O)CCCCCSCCCCCCO 62a_100000766143_100009816466 [0,0,1,0,0,0|2,0,0]=3 2101 B16R0.221 COC(=O)CCCCCSCCCCCCO 62a_100009816466_100000766143 [0,0,1,0,0,0|2,0,0]=3 2102 B16R0.221 COC(=O)CCCCNCCCCCCCO 2230a_100011996573_100000204269 [0,0,1,0,0,0|2,0,0]=3 2103 B16R0.221 COC(=O)CCCCNCCCCCCCO 34a_100011996573_100000204269 [0,0,1,0,0,0|2,0,0]=3 2104 B16R0.221 COC(=O)CCCCNCCCOCCCO 2230a_100011310245_100000204269 [0,0,1,0,0,0|3,0,0]=4 2105 B16R0.221 COC(=O)CCCCNCCCOCCCO 34a_100011310245_100000204269 [0,0,1,0,0,0|3,0,0]=4 2106 B16R0.221 COC(=O)CCCCOCCCCCCC#N 7a_100000059025_100009813337 [0,0,1,0,0,0|2,0,1]=4 2107 B16R0.221 COC(=O)CCCCOCCCCCCCBr 34a_100000760002_100000204269 [0,0,1,0,0,0|2,0,0]=3 2108 B16R0.221 COC(=O)CCCCOCCCCCCCBr 7a_100000760002_100000204269 [0,0,1,0,0,0|2,0,0]=3 2109 B16R0.221 COC(=O)CCCCOCCCCCCCN 34a_100011996573_100000204269 [0,0,1,0,0,0|2,0,0]=3 2110 B16R0.221 COC(=O)CCCCOCCCCCCCO 34a_100000059025_100000760002 [0,0,1,0,0,0|2,0,0]=3 2111 B16R0.221 COC(=O)CCCCOCCCCCCCO 7a_100000059025_100000760002 [0,0,1,0,0,0|2,0,0]=3 2112 B16R0.221 COC(=O)CCCCOCCCOCCCN 34a_100011310245_100000204269 [0,0,1,0,0,0|3,0,0]=4 2113 B16R0.221 COC(=O)CCCCSCCCCCCC#N 62a_100000204269_100009813337 [0,0,1,0,0,0|2,0,1]=4 2114 B16R0.221 COC(=O)CCCCSCCCCCCC#N 62a_100009813337_100000204269 [0,0,1,0,0,0|2,0,1]=4 2115 B16R0.221 COC(=O)CCCCSCCCCCCCO 62a_100000204269_100000760002 [0,0,1,0,0,0|2,0,0]=3 2116 B16R0.221 COC(=O)CCCCSCCCCCCCO 62a_100000760002_100000204269 [0,0,1,0,0,0|2,0,0]=3 2117 B16R0.221 COC(=O)CCCNCCCCCCCCO 2230a_102515433106_100011218270 [0,0,1,0,0,0|2,0,0]=3 2118 B16R0.221 COC(=O)CCCNCCCCCCCCO 34a_102515433106_100000742333 [0,0,1,0,0,0|2,0,0]=3 2119 B16R0.221 COC(=O)CCCOCCCCCCCCBr 34a_100009813846_100000742333 [0,0,1,0,0,0|2,0,0]=3 2120 B16R0.221 COC(=O)CCCOCCCCCCCCBr 7a_100009813846_100011218270 [0,0,1,0,0,0|2,0,0]=3 2121 B16R0.221 COC(=O)CCCOCCCCCCCCCl 34a_100000033203_100000742333 [0,0,1,0,0,0|2,0,0]=3 2122 B16R0.221 COC(=O)CCCOCCCCCCCCCl 7a_100000033203_100011218270 [0,0,1,0,0,0|2,0,0]=3 2123 B16R0.221 COC(=O)CCCOCCCCCCCCN 34a_102515433106_100000742333 [0,0,1,0,0,0|2,0,0]=3 2124 B16R0.221 COC(=O)CCCOCCCCCNCCN 34a_103619048469_100000742333 [0,0,1,0,0,0|3,0,0]=4 2125 B16R0.221 COC(=O)CCCSCCCCCCCCO 62a_100000033203_100011218270 [0,0,1,0,0,0|2,0,0]=3 2126 B16R0.221 COC(=O)CCCSCCCCCCCCO 62a_100011218270_100000033203 [0,0,1,0,0,0|2,0,0]=3 2127 B16R0.221 COC(=O)CCNCCCCCCCCCO 2230a_100000078944_100000204255 [0,0,1,0,0,0|2,0,0]=3 2128 B16R0.221 COC(=O)CCNCCCCCCCCCO 34a_100000078944_100000742370 [0,0,1,0,0,0|2,0,0]=3 2129 B16R0.221 COC(=O)CCOCCCCCCCCCBr 34a_100009813782_100000742370 [0,0,1,0,0,0|2,0,0]=3 2130 B16R0.221 COC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000204255 [0,0,1,0,0,0|2,0,0]=3 2131 B16R0.221 COC(=O)CCOCCCCCCCCCCl 34a_100009868337_100000742370 [0,0,1,0,0,0|2,0,0]=3 2132 B16R0.221 COC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000204255 [0,0,1,0,0,0|2,0,0]=3 2133 B16R0.221 COC(=O)CCOCCCCCCCCCN 34a_100000078944_100000742370 [0,0,1,0,0,0|2,0,0]=3 2134 B16R0.221 COC(=O)CCSCCCCCCCCCO 62a_100000204255_100009813782 [0,0,1,0,0,0|2,0,0]=3 2135 B16R0.221 COC(=O)CCSCCCCCCCCCO 62a_100009813782_100000204255 [0,0,1,0,0,0|2,0,0]=3 2136 B16R0.221 COC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000747449 [0,0,1,0,0,0|2,0,0]=3 2137 B16R0.221 COC(=O)CNCCCCCCCCCCO 34a_100000066964_100000747449 [0,0,1,0,0,0|2,0,0]=3 2138 B16R0.221 COC(=O)COCCCCCCCCCCBr 34a_100009813290_100000747449 [0,0,1,0,0,0|2,0,0]=3 2139 B16R0.221 COC(=O)COCCCCCCCCCCBr 7a_100009813290_100000747449 [0,0,1,0,0,0|2,0,0]=3 2140 B16R0.221 COC(=O)COCCCCCCCCCCCl 34a_200000033068_100000747449 [0,0,1,0,0,0|2,0,0]=3 2141 B16R0.221 COC(=O)COCCCCCCCCCCCl 7a_200000033068_100000747449 [0,0,1,0,0,0|2,0,0]=3 2142 B16R0.221 COC(=O)COCCCCCCCCCCN 34a_100000066964_100000747449 [0,0,1,0,0,0|2,0,0]=3 2143 B16R0.221 COC(=O)COCCNCCCCCCCO 2230a_100011996573_100000090808 [0,0,1,0,0,0|3,0,0]=4 2144 B16R0.221 COC(=O)COCCNCCCCCCCO 34a_100011996573_100000090808 [0,0,1,0,0,0|3,0,0]=4 2145 B16R0.221 COC(=O)COCCOCCCCCCCBr 34a_100000760002_100000090808 [0,0,1,0,0,0|3,0,0]=4 2146 B16R0.221 COC(=O)COCCOCCCCCCCBr 7a_100000760002_100000090808 [0,0,1,0,0,0|3,0,0]=4 2147 B16R0.221 COC(=O)COCCOCCCCCCCN 34a_100011996573_100000090808 [0,0,1,0,0,0|3,0,0]=4 2148 B16R0.221 COC(=O)COCCSCCCCCCCO 62a_100000090808_100000760002 [0,0,1,0,0,0|3,0,0]=4 2149 B16R0.221 COC(=O)COCCSCCCCCCCO 62a_100000760002_100000090808 [0,0,1,0,0,0|3,0,0]=4 2150 B16R0.221 COC(=O)CSCCCCCCCCCCO 62a_100000747449_200000033068 [0,0,1,0,0,0|2,0,0]=3 2151 B16R0.221 COC(=O)CSCCCCCCCCCCO 62a_100009813290_100000747449 [0,0,1,0,0,0|2,0,0]=3 2152 B16R0.221 COC(=O)NCCOCCCCCCCCO 34a_100000757965_100000033203 [0,0,1,0,0,0|3,0,0]=4 2153 B16R0.221 COC(=O)OCCOCCCCCCCCO 34a_100010262106_100000033203 [0,0,1,0,0,0|3,0,0]=4 2154 B16R0.221 COC(=O)OCSCCCCCCCCCO 62a_100009813782_100000139417 [0,0,1,0,0,0|3,0,0]=4 2155 B16R0.221 COCCCCCCCCCCCC(=O)OC 34a_100138415774_100010983606 [0,0,1,0,0,0|1,0,0]=2 2156 B16R0.221 COCCCCCCOCCCCC(=O)OC 34a_100000059025_100011998445 [0,0,1,0,0,0|2,0,0]=3 2157 B16R0.221 COCCCCCCOCCCCC(=O)OC 34a_200012092642_100000204269 [0,0,1,0,0,0|2,0,0]=3 2158 B16R0.221 COCCCCCCOCCCCC(=O)OC 7a_100000059025_100011998445 [0,0,1,0,0,0|2,0,0]=3 2159 B16R0.221 COCCCCCCOCCCCC(=O)OC 7a_200012092642_100000204269 [0,0,1,0,0,0|2,0,0]=3 2160 B16R0.221 COCCCCCCOCCOCC(=O)OC 34a_200012092642_100000090808 [0,0,1,0,0,0|3,0,0]=4 2161 B16R0.221 COCCCCCCOCCOCC(=O)OC 7a_200012092642_100000090808 [0,0,1,0,0,0|3,0,0]=4 2162 B16R0.221 COCCCCCCSCCCCC(=O)OC 62a_100000204269_100011998445 [0,0,1,0,0,0|2,0,0]=3 2163 B16R0.221 COCCCCCCSCCCCC(=O)OC 62a_100011998445_100000204269 [0,0,1,0,0,0|2,0,0]=3 2164 B16R0.221 COCCCCCCSCCOCC(=O)OC 62a_100000090808_100011998445 [0,0,1,0,0,0|3,0,0]=4 2165 B16R0.221 COCCCCCCSCCOCC(=O)OC 62a_100011998445_100000090808 [0,0,1,0,0,0|3,0,0]=4 2166 B16R0.221 COCCCCCNCCCCCC(=O)OC 2230a_100000747528_100009816466 [0,0,1,0,0,0|2,0,0]=3 2167 B16R0.221 COCCCCCNCCCCCC(=O)OC 34a_100000747528_100009816466 [0,0,1,0,0,0|2,0,0]=3 2168 B16R0.221 COCCCCOCCCCCCC(=O)OC 34a_100000740925_100009815986 [0,0,1,0,0,0|2,0,0]=3 2169 B16R0.221 COCCCCOCCCCCCC(=O)OC 34a_100009863599_100000755781 [0,0,1,0,0,0|2,0,0]=3 2170 B16R0.221 COCCCCOCCCCCCC(=O)OC 7a_100009863599_100000730899 [0,0,1,0,0,0|2,0,0]=3 2171 B16R0.221 COCCCCSCCCCCCC(=O)OC 62a_100000730899_100009815986 [0,0,1,0,0,0|2,0,0]=3 2172 B16R0.221 COCCCCSCCCCCCC(=O)OC 62a_100009815986_100000730899 [0,0,1,0,0,0|2,0,0]=3 2173 B16R0.221 COCCCNCCCCCCCC(=O)OC 34a_100150723488_100010004213 [0,0,1,0,0,0|2,0,0]=3 2174 B16R0.221 COCCCOCCCCCCCC(=O)OC 34a_100000740835_100010004213 [0,0,1,0,0,0|2,0,0]=3 2175 B16R0.221 COCCCOCCCCCCCC(=O)OC 34a_100011022521_100000740836 [0,0,1,0,0,0|2,0,0]=3 2176 B16R0.221 COCCCOCCCCCCCC(=O)OC 7a_100011022521_100000740836 [0,0,1,0,0,0|2,0,0]=3 2177 B16R0.221 COCCCOCCCOCCCC(=O)OC 34a_200011215475_100000742333 [0,0,1,0,0,0|3,0,0]=4 2178 B16R0.221 COCCCOCCCOCCCC(=O)OC 7a_200011215475_100011218270 [0,0,1,0,0,0|3,0,0]=4 2179 B16R0.221 COCCCSCCCCCCCC(=O)OC 62a_100000709357_100010004213 [0,0,1,0,0,0|2,0,0]=3 2180 B16R0.221 COCCCSCCCCCCCC(=O)OC 62a_100010004213_100000709357 [0,0,1,0,0,0|2,0,0]=3 2181 B16R0.221 COCCNCCCCCCCCC(=O)OC 2230a_100000209980_100010282707 [0,0,1,0,0,0|2,0,0]=3 2182 B16R0.221 COCCOCCCCCCCCC(=O)OC 34a_100000035544_100011201679 [0,0,1,0,0,0|2,0,0]=3 2183 B16R0.221 COCCOCCCCCCCCC(=O)OC 34a_100000210237_100010282707 [0,0,1,0,0,0|2,0,0]=3 2184 B16R0.221 COCCOCCCCCCCCC(=O)OC 7a_100000035544_100000233755 [0,0,1,0,0,0|2,0,0]=3 2185 B16R0.221 COCCOCCCNCCCCC(=O)OC 2230a_100000206027_100000204269 [0,0,1,0,0,0|3,0,0]=4 2186 B16R0.221 COCCOCCCNCCCCC(=O)OC 34a_100000206027_100000204269 [0,0,1,0,0,0|3,0,0]=4 2187 B16R0.221 COCCOCCCOCCCCC(=O)OC 34a_100000059025_100011216529 [0,0,1,0,0,0|3,0,0]=4 2188 B16R0.221 COCCOCCCOCCCCC(=O)OC 7a_100000059025_100011216529 [0,0,1,0,0,0|3,0,0]=4 2189 B16R0.221 COCCOCCCSCCCCC(=O)OC 62a_100000204269_100011216529 [0,0,1,0,0,0|3,0,0]=4 2190 B16R0.221 COCCOCCCSCCCCC(=O)OC 62a_100011216529_100000204269 [0,0,1,0,0,0|3,0,0]=4 2191 B16R0.221 COCCOCCNCCCCCC(=O)OC 2230a_100000745349_100009816466 [0,0,1,0,0,0|3,0,0]=4 2192 B16R0.221 COCCOCCNCCCCCC(=O)OC 34a_100000745349_100009816466 [0,0,1,0,0,0|3,0,0]=4 2193 B16R0.221 COCCOCCOCCCCCC(=O)OC 34a_100000074720_100000695917 [0,0,1,0,0,0|3,0,0]=4 2194 B16R0.221 COCCOCCOCCCCCC(=O)OC 34a_100011215163_100009816466 [0,0,1,0,0,0|3,0,0]=4 2195 B16R0.221 COCCOCCOCCCCCC(=O)OC 7a_100000074720_100000695917 [0,0,1,0,0,0|3,0,0]=4 2196 B16R0.221 COCCOCCOCCCCCC(=O)OC 7a_100011215163_100009816466 [0,0,1,0,0,0|3,0,0]=4 2197 B16R0.221 COCCOCCSCCCCCC(=O)OC 62a_100000695917_100009816466 [0,0,1,0,0,0|3,0,0]=4 2198 B16R0.221 COCCOCCSCCCCCC(=O)OC 62a_100009816466_100000695917 [0,0,1,0,0,0|3,0,0]=4 2199 B16R0.221 COCCOCSCCCCCCC(=O)OC 62a_100000231047_100009815986 [0,0,1,0,0,0|3,0,0]=4 2200 B16R0.221 COCCOCSCCCCCCC(=O)OC 62a_100009815986_100000231047 [0,0,1,0,0,0|3,0,0]=4 2201 B16R0.221 COCCSCCCCCCCCC(=O)OC 62a_100000233755_100010282707 [0,0,1,0,0,0|2,0,0]=3 2202 B16R0.221 COCCSCCCCCCCCC(=O)OC 62a_100010282707_100000233755 [0,0,1,0,0,0|2,0,0]=3 2203 B16R0.221 COCSCCCCCCCCCC(=O)OC 62a_100000766300_100009813843 [0,0,1,0,0,0|2,0,0]=3 2204 B16R0.221 O=C(CO)CCCCCCCCCCCCO 1458a_100000210174_100009813331 [0,0,1,0,0,0|3,0,0]=4 2205 B16R0.274 C#CCCCCCCCCCOCOC(=O)C 34a_100000034437_100009813279 [0,0,1,0,0,0|1,0,2]=4 2206 B16R0.274 C#CCCCCCCCCOCCOC(=O)C 34a_100000065265_100009814007 [0,0,1,0,0,0|1,0,2]=4 2207 B16R0.274 C#CCCCCCCCCOCCOC(=O)C 7a_100000065265_100009814007 [0,0,1,0,0,0|1,0,2]=4 2208 B16R0.274 C#CCCCCCCCOCCCOC(=O)C 34a_100000054614_100000042594 [0,0,1,0,0,0|1,0,2]=4 2209 B16R0.274 C#CCCCCCCCOCCCOC(=O)C 7a_100000054614_100000042594 [0,0,1,0,0,0|1,0,2]=4 2210 B16R0.274 C#CCCCCCCCSCCCOC(=O)C 62a_100000042594_100153394163 [0,0,1,0,0,0|1,0,2]=4 2211 B16R0.274 C#CCCCCCCCSCCCOC(=O)C 62a_100153394163_100000042594 [0,0,1,0,0,0|1,0,2]=4 2212 B16R0.274 C#CCCCCCCOCCCCOC(=O)C 34a_100000073216_100012276617 [0,0,1,0,0,0|1,0,2]=4 2213 B16R0.274 C#CCCCCCCOCCCCOC(=O)C 34a_100011217361_100000033659 [0,0,1,0,0,0|1,0,2]=4 2214 B16R0.274 C#CCCCCCCOCCCCOC(=O)C 7a_100000073216_100012276617 [0,0,1,0,0,0|1,0,2]=4 2215 B16R0.274 C#CCCCCCCOCCCCOC(=O)C 7a_100011217361_100000033659 [0,0,1,0,0,0|1,0,2]=4 2216 B16R0.274 C#CCCCCCCSCCCCOC(=O)C 62a_100000033659_100012276617 [0,0,1,0,0,0|1,0,2]=4 2217 B16R0.274 C#CCCCCCCSCCCCOC(=O)C 62a_100012276617_100000033659 [0,0,1,0,0,0|1,0,2]=4 2218 B16R0.274 C#CCCCCCOCCCCCOC(=O)C 34a_100000766912_100000033007 [0,0,1,0,0,0|1,0,2]=4 2219 B16R0.274 C#CCCCCCOCCCCCOC(=O)C 7a_100000766912_100000033007 [0,0,1,0,0,0|1,0,2]=4 2220 B16R0.274 C#CCCCCCSCCCCCOC(=O)C 62a_100000033007_100012094781 [0,0,1,0,0,0|1,0,2]=4 2221 B16R0.274 C#CCCCCCSCCCCCOC(=O)C 62a_100012094781_100000033007 [0,0,1,0,0,0|1,0,2]=4 2222 B16R0.274 C=C(Br)CCOCCCCCCCCCCC 34a_100009813270_100011215454 [0,0,1,0,0,0|3,0,0]=4 2223 B16R0.274 C=C(C)CCNCCCCCCCCCCC 2230a_200011215754_100000730704 [0,0,1,0,0,0|3,0,0]=4 2224 B16R0.274 C=C(C)CCNCCCCCCCCCCC 34a_200011215754_100000730704 [0,0,1,0,0,0|3,0,0]=4 2225 B16R0.274 C=C(C)CCOCCCCCCCCCCC 34a_100000210809_100000730704 [0,0,1,0,0,0|3,0,0]=4 2226 B16R0.274 C=C(C)CCOCCCCCCCCCCC 34a_100000764851_100011215454 [0,0,1,0,0,0|3,0,0]=4 2227 B16R0.274 C=C(C)CCOCCCCCCCCCCC 7a_100000210809_100000730704 [0,0,1,0,0,0|3,0,0]=4 2228 B16R0.274 C=C(C)CNCCCCCCCCCCCC 2230a_100000210451_100000748629 [0,0,1,0,0,0|3,0,0]=4 2229 B16R0.274 C=C(C)CNCCCCCCCCCCCC 34a_100000210451_100000748629 [0,0,1,0,0,0|3,0,0]=4 2230 B16R0.274 C=C(C)COCCCCCCCCCCCC 34a_100000210245_100000759014 [0,0,1,0,0,0|3,0,0]=4 2231 B16R0.274 C=C(C)COCCCCCCCCCCCC 34a_100000210810_100000748629 [0,0,1,0,0,0|3,0,0]=4 2232 B16R0.274 C=C(C)COCCCCCCCCCCCC 7a_100000210810_100000748629 [0,0,1,0,0,0|3,0,0]=4 2233 B16R0.274 C=C(F)CNCCCCCCCCCCCC 2230a_100000210451_100009893438 [0,0,1,0,0,0|3,0,0]=4 2234 B16R0.274 C=C(F)CNCCCCCCCCCCCC 34a_100000210451_100009893438 [0,0,1,0,0,0|3,0,0]=4 2235 B16R0.274 C=C(F)COCCCCCCCCCCCC 34a_100000210810_100009893438 [0,0,1,0,0,0|3,0,0]=4 2236 B16R0.274 C=C(F)COCCCCCCCCCCCC 34a_200010262243_100000759014 [0,0,1,0,0,0|3,0,0]=4 2237 B16R0.274 C=C(F)COCCCCCCCCCCCC 7a_100000210810_100000042424 [0,0,1,0,0,0|3,0,0]=4 2238 B16R0.274 C=CCCCCCCCCCCNCC(=O)O 269956a_100016091260_100011093070 [0,0,1,0,0,0|1,0,2]=4 2239 B16R0.274 C=CCCCCCCCCCNCOC(=O)C 34a_100000081888_100009813279 [0,0,1,0,0,0|1,0,2]=4 2240 B16R0.274 C=CCCCCCCCCCOCOC(=O)C 34a_100000038209_100009813279 [0,0,1,0,0,0|1,0,2]=4 2241 B16R0.274 C=CCCCCCCCCCSCOC(=O)C 62a_100000076356_100009814027 [0,0,1,0,0,0|1,0,2]=4 2242 B16R0.274 C=CCCCCCCCCCSCOC(=O)C 62a_100009814027_100000076356 [0,0,1,0,0,0|1,0,2]=4 2243 B16R0.274 C=CCCCCCCCCOCCOC(=O)C 34a_100011215194_100009814007 [0,0,1,0,0,0|1,0,2]=4 2244 B16R0.274 C=CCCCCCCCCOCCOC(=O)C 7a_100011215194_100009814007 [0,0,1,0,0,0|1,0,2]=4 2245 B16R0.274 C=CCCCCCCCCSCCOC(=O)C 62a_100009814007_100011933949 [0,0,1,0,0,0|1,0,2]=4 2246 B16R0.274 C=CCCCCCCCCSCCOC(=O)C 62a_100011933949_100009814007 [0,0,1,0,0,0|1,0,2]=4 2247 B16R0.274 C=CCCCCCCCOCCCOC(=O)C 34a_100000730831_100000042594 [0,0,1,0,0,0|1,0,2]=4 2248 B16R0.274 C=CCCCCCCCOCCCOC(=O)C 7a_100000730831_100000042594 [0,0,1,0,0,0|1,0,2]=4 2249 B16R0.274 C=CCCCCCCCSCCCOC(=O)C 62a_100000042594_100012355270 [0,0,1,0,0,0|1,0,2]=4 2250 B16R0.274 C=CCCCCCCCSCCCOC(=O)C 62a_100012355270_100000042594 [0,0,1,0,0,0|1,0,2]=4 2251 B16R0.274 C=CCCCCCCOCCCCOC(=O)C 34a_100000073216_100011215473 [0,0,1,0,0,0|1,0,2]=4 2252 B16R0.274 C=CCCCCCCOCCCCOC(=O)C 34a_200011216477_100000033659 [0,0,1,0,0,0|1,0,2]=4 2253 B16R0.274 C=CCCCCCCOCCCCOC(=O)C 7a_100000073216_100011215473 [0,0,1,0,0,0|1,0,2]=4 2254 B16R0.274 C=CCCCCCCOCCCCOC(=O)C 7a_200011216477_100000033659 [0,0,1,0,0,0|1,0,2]=4 2255 B16R0.274 C=CCCCCCCSCCCCOC(=O)C 62a_100000033659_100011215473 [0,0,1,0,0,0|1,0,2]=4 2256 B16R0.274 C=CCCCCCCSCCCCOC(=O)C 62a_100011215473_100000033659 [0,0,1,0,0,0|1,0,2]=4 2257 B16R0.274 C=CCCCCCOCCCCCOC(=O)C 34a_100011216702_100000033007 [0,0,1,0,0,0|1,0,2]=4 2258 B16R0.274 C=CCCCCCOCCCCCOC(=O)C 7a_100011216702_100000033007 [0,0,1,0,0,0|1,0,2]=4 2259 B16R0.274 C=CCCCCCSCCCCCOC(=O)C 62a_100000033007_100000700193 [0,0,1,0,0,0|1,0,2]=4 2260 B16R0.274 C=CCCCCCSCCCCCOC(=O)C 62a_100000700193_100000033007 [0,0,1,0,0,0|1,0,2]=4 2261 B16R0.274 CC(=O)CCCCCCCCCCCCCO 1458a_100000070787_100009812470 [0,0,1,0,0,0|2,0,0]=3 2262 B16R0.274 CC(=O)CCCCNCCCCCCCCO 34a_102515433106_100009817362 [0,0,1,0,0,0|3,0,0]=4 2263 B16R0.274 CC(=O)CCCCOCCCCCCCCBr 34a_100009813846_100009817362 [0,0,1,0,0,0|3,0,0]=4 2264 B16R0.274 CC(=O)CCCCOCCCCCCCCBr 7a_100009813846_100000735457 [0,0,1,0,0,0|3,0,0]=4 2265 B16R0.274 CC(=O)CCCCOCCCCCCCCCl 34a_100000033203_100009817362 [0,0,1,0,0,0|3,0,0]=4 2266 B16R0.274 CC(=O)CCCCOCCCCCCCCCl 7a_100000033203_100000735457 [0,0,1,0,0,0|3,0,0]=4 2267 B16R0.274 CC(=O)CCCCOCCCCCCCCN 34a_102515433106_100009817362 [0,0,1,0,0,0|3,0,0]=4 2268 B16R0.274 CC(=O)CCCCSCCCCCCCCO 62a_100000033203_100000735457 [0,0,1,0,0,0|3,0,0]=4 2269 B16R0.274 CC(=O)CCCCSCCCCCCCCO 62a_100000735457_100000033203 [0,0,1,0,0,0|3,0,0]=4 2270 B16R0.274 CC(=O)CCCNCCCCCCCCCO 34a_100000078944_100000685027 [0,0,1,0,0,0|3,0,0]=4 2271 B16R0.274 CC(=O)CCCOCCCCCCCCCBr 34a_100009813782_100000685027 [0,0,1,0,0,0|3,0,0]=4 2272 B16R0.274 CC(=O)CCCOCCCCCCCCCBr 7a_100009813782_100011215641 [0,0,1,0,0,0|3,0,0]=4 2273 B16R0.274 CC(=O)CCCOCCCCCCCCCCl 34a_100009868337_100000685027 [0,0,1,0,0,0|3,0,0]=4 2274 B16R0.274 CC(=O)CCCOCCCCCCCCCCl 7a_100009868337_100011215641 [0,0,1,0,0,0|3,0,0]=4 2275 B16R0.274 CC(=O)CCCOCCCCCCCCCN 34a_100000078944_100000685027 [0,0,1,0,0,0|3,0,0]=4 2276 B16R0.274 CC(=O)CCCOCCCCCCCCCO 34a_100000759063_100009813782 [0,0,1,0,0,0|3,0,0]=4 2277 B16R0.274 CC(=O)CCCOCCCCCCCCCO 7a_100000759063_100009813782 [0,0,1,0,0,0|3,0,0]=4 2278 B16R0.274 CC(=O)CCCSCCCCCCCCCO 62a_100009813782_100011215641 [0,0,1,0,0,0|3,0,0]=4 2279 B16R0.274 CC(=O)CCCSCCCCCCCCCO 62a_100011215641_100009813782 [0,0,1,0,0,0|3,0,0]=4 2280 B16R0.274 CC(=O)CCOCCCCCCCCCCBr 7a_100009813290_100000053229 [0,0,1,0,0,0|3,0,0]=4 2281 B16R0.274 CC(=O)CCOCCCCCCCCCCCl 7a_200000033068_100000053229 [0,0,1,0,0,0|3,0,0]=4 2282 B16R0.274 CC(=O)CCOCCCCCCCCCCO 34a_100000759926_100009813290 [0,0,1,0,0,0|3,0,0]=4 2283 B16R0.274 CC(=O)CCOCCCCCCCCCCO 7a_100000759926_100009813290 [0,0,1,0,0,0|3,0,0]=4 2284 B16R0.274 CC(=O)CCSCCCCCCCCCCO 62a_100000053229_200000033068 [0,0,1,0,0,0|3,0,0]=4 2285 B16R0.274 CC(=O)CCSCCCCCCCCCCO 62a_100009813290_100000053229 [0,0,1,0,0,0|3,0,0]=4 2286 B16R0.274 CC(=O)COCCCCCCCCCCCO 34a_100000211253_100009812471 [0,0,1,0,0,0|3,0,0]=4 2287 B16R0.274 CC(=O)NCCCCCCCCCCCCO 240690a_100000066677_100015343762 [0,0,1,0,0,0|2,0,0]=3 2288 B16R0.274 CC(=O)NCCCCCCNCCCCCF 2230a_200011996284_100000729378 [0,0,1,0,0,0|3,0,0]=4 2289 B16R0.274 CC(=O)NCCCCCCNCCCCCF 34a_200011996284_100000729378 [0,0,1,0,0,0|3,0,0]=4 2290 B16R0.274 CC(=O)NCCCCCCNCCCCCO 2230a_200011996284_100000746330 [0,0,1,0,0,0|3,0,0]=4 2291 B16R0.274 CC(=O)NCCCCCCNCCCCCO 34a_200011996284_100000746330 [0,0,1,0,0,0|3,0,0]=4 2292 B16R0.274 CC(=O)NCCCCCNCCCCCCF 2230a_200012022750_100015922095 [0,0,1,0,0,0|3,0,0]=4 2293 B16R0.274 CC(=O)NCCCCCNCCCCCCF 34a_200012022750_100015922095 [0,0,1,0,0,0|3,0,0]=4 2294 B16R0.274 CC(=O)NCCCCCNCCCCCCO 2230a_200012022750_100000766143 [0,0,1,0,0,0|3,0,0]=4 2295 B16R0.274 CC(=O)NCCCCCNCCCCCCO 34a_200012022750_100000766143 [0,0,1,0,0,0|3,0,0]=4 2296 B16R0.274 CC(=O)NCCCCNCCCCCCCO 2230a_200011368371_100000760002 [0,0,1,0,0,0|3,0,0]=4 2297 B16R0.274 CC(=O)NCCCCNCCCCCCCO 34a_200011368371_100000760002 [0,0,1,0,0,0|3,0,0]=4 2298 B16R0.274 CC(=O)NCCCNCCCCCCCCO 34a_100000736810_100000033203 [0,0,1,0,0,0|3,0,0]=4 2299 B16R0.274 CC(=O)NCCCOCCCCCCCCO 34a_100000752032_100000033203 [0,0,1,0,0,0|3,0,0]=4 2300 B16R0.274 CC(=O)NCCNCCCCCCCCCO 2230a_100000078944_100000189650 [0,0,1,0,0,0|3,0,0]=4 2301 B16R0.274 CC(=O)NCCNCCCCCCCCCO 2230a_100000209853_100009813782 [0,0,1,0,0,0|3,0,0]=4 2302 B16R0.274 CC(=O)NCCOCCCCCCCCCBr 7a_100009813782_100000189650 [0,0,1,0,0,0|3,0,0]=4 2303 B16R0.274 CC(=O)NCCOCCCCCCCCCCl 7a_100009868337_100000189650 [0,0,1,0,0,0|3,0,0]=4 2304 B16R0.274 CC(=O)NCCOCCCCCCCCCO 34a_100000158858_100009813782 [0,0,1,0,0,0|3,0,0]=4 2305 B16R0.274 CC(=O)NCCSCCCCCCCCCO 62a_100000189650_100009813782 [0,0,1,0,0,0|3,0,0]=4 2306 B16R0.274 CC(=O)NCCSCCCCCCCCCO 62a_100009813782_100000189650 [0,0,1,0,0,0|3,0,0]=4 2307 B16R0.274 CC(=O)OCCCCCNCCCCCCO 2230a_100000686447_100009813381 [0,0,1,0,0,0|2,0,0]=3 2308 B16R0.274 CC(=O)OCCCCCNCCCCCCO 34a_100000686447_100000033007 [0,0,1,0,0,0|2,0,0]=3 2309 B16R0.274 CC(=O)OCCCCCOCCCCCCBr 34a_100011215345_100000033007 [0,0,1,0,0,0|2,0,0]=3 2310 B16R0.274 CC(=O)OCCCCCOCCCCCCBr 7a_100011215345_100000033007 [0,0,1,0,0,0|2,0,0]=3 2311 B16R0.274 CC(=O)OCCCCCOCCCCCCCl 34a_100000766143_100000033007 [0,0,1,0,0,0|2,0,0]=3 2312 B16R0.274 CC(=O)OCCCCCOCCCCCCCl 7a_100000766143_100000033007 [0,0,1,0,0,0|2,0,0]=3 2313 B16R0.274 CC(=O)OCCCCCOCCCCCCF 34a_100000732779_100000033007 [0,0,1,0,0,0|2,0,0]=3 2314 B16R0.274 CC(=O)OCCCCCOCCCCCCF 7a_100000732779_100000033007 [0,0,1,0,0,0|2,0,0]=3 2315 B16R0.274 CC(=O)OCCCCCOCCCCCCN 34a_100000686447_100000033007 [0,0,1,0,0,0|2,0,0]=3 2316 B16R0.274 CC(=O)OCCCCCSCCCCCC#N 62a_100000033007_100009813376 [0,0,1,0,0,0|2,0,1]=4 2317 B16R0.274 CC(=O)OCCCCCSCCCCCC#N 62a_100009813376_100000033007 [0,0,1,0,0,0|2,0,1]=4 2318 B16R0.274 CC(=O)OCCCCCSCCCCCC=O 62a_100000033007_100000139337 [0,0,1,0,0,0|2,0,1]=4 2319 B16R0.274 CC(=O)OCCCCCSCCCCCC=O 62a_100000139337_100000033007 [0,0,1,0,0,0|2,0,1]=4 2320 B16R0.274 CC(=O)OCCCCCSCCCCCCF 62a_100000033007_100015922095 [0,0,1,0,0,0|2,0,0]=3 2321 B16R0.274 CC(=O)OCCCCCSCCCCCCF 62a_100015922095_100000033007 [0,0,1,0,0,0|2,0,0]=3 2322 B16R0.274 CC(=O)OCCCCCSCCCCCCO 62a_100000033007_100000766143 [0,0,1,0,0,0|2,0,0]=3 2323 B16R0.274 CC(=O)OCCCCCSCCCCCCO 62a_100000766143_100000033007 [0,0,1,0,0,0|2,0,0]=3 2324 B16R0.274 CC(=O)OCCCCNCCCCCCCO 34a_100011996573_100000033659 [0,0,1,0,0,0|2,0,0]=3 2325 B16R0.274 CC(=O)OCCCCNCCCOCCCO 34a_100011310245_100000033659 [0,0,1,0,0,0|3,0,0]=4 2326 B16R0.274 CC(=O)OCCCCOCCCCCCC#N 7a_100000073216_100009813337 [0,0,1,0,0,0|2,0,1]=4 2327 B16R0.274 CC(=O)OCCCCOCCCCCCCBr 34a_100000760002_100000033659 [0,0,1,0,0,0|2,0,0]=3 2328 B16R0.274 CC(=O)OCCCCOCCCCCCCBr 7a_100000760002_100000033659 [0,0,1,0,0,0|2,0,0]=3 2329 B16R0.274 CC(=O)OCCCCOCCCCCCCN 34a_100011996573_100000033659 [0,0,1,0,0,0|2,0,0]=3 2330 B16R0.274 CC(=O)OCCCCOCCCCCCCO 34a_100000073216_100000760002 [0,0,1,0,0,0|2,0,0]=3 2331 B16R0.274 CC(=O)OCCCCOCCCCCCCO 7a_100000073216_100000760002 [0,0,1,0,0,0|2,0,0]=3 2332 B16R0.274 CC(=O)OCCCCOCCCOCCCN 34a_100011310245_100000033659 [0,0,1,0,0,0|3,0,0]=4 2333 B16R0.274 CC(=O)OCCCCSCCCCCCC#N 62a_100000033659_100009813337 [0,0,1,0,0,0|2,0,1]=4 2334 B16R0.274 CC(=O)OCCCCSCCCCCCC#N 62a_100009813337_100000033659 [0,0,1,0,0,0|2,0,1]=4 2335 B16R0.274 CC(=O)OCCCCSCCCCCCCO 62a_100000033659_100000760002 [0,0,1,0,0,0|2,0,0]=3 2336 B16R0.274 CC(=O)OCCCCSCCCCCCCO 62a_100000760002_100000033659 [0,0,1,0,0,0|2,0,0]=3 2337 B16R0.274 CC(=O)OCCCNCCCCCCCCO 34a_102515433106_100000042594 [0,0,1,0,0,0|2,0,0]=3 2338 B16R0.274 CC(=O)OCCCOCCCCCCCCBr 34a_100009813846_100000042594 [0,0,1,0,0,0|2,0,0]=3 2339 B16R0.274 CC(=O)OCCCOCCCCCCCCBr 7a_100009813846_100000042594 [0,0,1,0,0,0|2,0,0]=3 2340 B16R0.274 CC(=O)OCCCOCCCCCCCCCl 34a_100000033203_100000042594 [0,0,1,0,0,0|2,0,0]=3 2341 B16R0.274 CC(=O)OCCCOCCCCCCCCCl 7a_100000033203_100000042594 [0,0,1,0,0,0|2,0,0]=3 2342 B16R0.274 CC(=O)OCCCOCCCCCCCCN 34a_102515433106_100000042594 [0,0,1,0,0,0|2,0,0]=3 2343 B16R0.274 CC(=O)OCCCOCCCCCNCCN 34a_103619048469_100000042594 [0,0,1,0,0,0|3,0,0]=4 2344 B16R0.274 CC(=O)OCCCSCCCCCCCCO 62a_100000033203_100000042594 [0,0,1,0,0,0|2,0,0]=3 2345 B16R0.274 CC(=O)OCCCSCCCCCCCCO 62a_100000042594_100000033203 [0,0,1,0,0,0|2,0,0]=3 2346 B16R0.274 CC(=O)OCCNCCCCCCCCCO 34a_100000078944_100009814007 [0,0,1,0,0,0|2,0,0]=3 2347 B16R0.274 CC(=O)OCCOCCCCCCCCCBr 34a_100009813782_100009814007 [0,0,1,0,0,0|2,0,0]=3 2348 B16R0.274 CC(=O)OCCOCCCCCCCCCBr 7a_100009813782_100009814007 [0,0,1,0,0,0|2,0,0]=3 2349 B16R0.274 CC(=O)OCCOCCCCCCCCCCl 34a_100009868337_100009814007 [0,0,1,0,0,0|2,0,0]=3 2350 B16R0.274 CC(=O)OCCOCCCCCCCCCCl 7a_100009868337_100009814007 [0,0,1,0,0,0|2,0,0]=3 2351 B16R0.274 CC(=O)OCCOCCCCCCCCCN 34a_100000078944_100009814007 [0,0,1,0,0,0|2,0,0]=3 2352 B16R0.274 CC(=O)OCCOCCNCCCCCCO 2230a_100000686447_200000083610 [0,0,1,0,0,0|3,0,0]=4 2353 B16R0.274 CC(=O)OCCOCCNCCCCCCO 34a_100000686447_200000083610 [0,0,1,0,0,0|3,0,0]=4 2354 B16R0.274 CC(=O)OCCOCCOCCCCCCBr 34a_100011215345_200000083610 [0,0,1,0,0,0|3,0,0]=4 2355 B16R0.274 CC(=O)OCCOCCOCCCCCCBr 7a_100011215345_200000083610 [0,0,1,0,0,0|3,0,0]=4 2356 B16R0.274 CC(=O)OCCOCCOCCCCCCCl 34a_100000766143_200000083610 [0,0,1,0,0,0|3,0,0]=4 2357 B16R0.274 CC(=O)OCCOCCOCCCCCCCl 7a_100000766143_200000083610 [0,0,1,0,0,0|3,0,0]=4 2358 B16R0.274 CC(=O)OCCOCCOCCCCCCF 34a_100000732779_200000083610 [0,0,1,0,0,0|3,0,0]=4 2359 B16R0.274 CC(=O)OCCOCCOCCCCCCF 7a_100000732779_200000083610 [0,0,1,0,0,0|3,0,0]=4 2360 B16R0.274 CC(=O)OCCOCCOCCCCCCN 34a_100000686447_200000083610 [0,0,1,0,0,0|3,0,0]=4 2361 B16R0.274 CC(=O)OCCOCCSCCCCCCF 62a_100015922095_200000083610 [0,0,1,0,0,0|3,0,0]=4 2362 B16R0.274 CC(=O)OCCOCCSCCCCCCF 62a_200000083610_100015922095 [0,0,1,0,0,0|3,0,0]=4 2363 B16R0.274 CC(=O)OCCOCCSCCCCCCO 62a_100000766143_200000083610 [0,0,1,0,0,0|3,0,0]=4 2364 B16R0.274 CC(=O)OCCOCCSCCCCCCO 62a_200000083610_100000766143 [0,0,1,0,0,0|3,0,0]=4 2365 B16R0.274 CC(=O)OCCOCNCCCCCCCO 34a_100011996573_100000076355 [0,0,1,0,0,0|3,0,0]=4 2366 B16R0.274 CC(=O)OCCOCOCCCCCCCBr 34a_100000760002_100000076355 [0,0,1,0,0,0|3,0,0]=4 2367 B16R0.274 CC(=O)OCCOCOCCCCCCCN 34a_100011996573_100000076355 [0,0,1,0,0,0|3,0,0]=4 2368 B16R0.274 CC(=O)OCCOCSCCCCCCCO 62a_100000076355_100000760002 [0,0,1,0,0,0|3,0,0]=4 2369 B16R0.274 CC(=O)OCCOCSCCCCCCCO 62a_100000760002_100000076355 [0,0,1,0,0,0|3,0,0]=4 2370 B16R0.274 CC(=O)OCCSCCCCCCCCCO 62a_100009813782_100009814007 [0,0,1,0,0,0|2,0,0]=3 2371 B16R0.274 CC(=O)OCCSCCCCCCCCCO 62a_100009814007_100009813782 [0,0,1,0,0,0|2,0,0]=3 2372 B16R0.274 CC(=O)OCNCCCCCCCCCCO 34a_100000066964_100009813279 [0,0,1,0,0,0|2,0,0]=3 2373 B16R0.274 CC(=O)OCOCCCCCCCCCCBr 34a_100009813290_100009813279 [0,0,1,0,0,0|2,0,0]=3 2374 B16R0.274 CC(=O)OCOCCCCCCCCCCCl 34a_200000033068_100009813279 [0,0,1,0,0,0|2,0,0]=3 2375 B16R0.274 CC(=O)OCOCCCCCCCCCCN 34a_100000066964_100009813279 [0,0,1,0,0,0|2,0,0]=3 2376 B16R0.274 CC(=O)OCSCCCCCCCCCCO 62a_100000076356_200000033068 [0,0,1,0,0,0|2,0,0]=3 2377 B16R0.274 CC(=O)OCSCCCCCCCCCCO 62a_100009813290_100000076356 [0,0,1,0,0,0|2,0,0]=3 2378 B16R0.274 CC(=O)SCCCCCCCCCCCS[13CH3] 62a_100010140907_200025704644 [0,0,1,0,0,0|1,1,0]=3 2379 B16R0.274 CC(=O)SCCCCCCCCCCCS[13CH3] 62a_200025704644_100010140907 [0,0,1,0,0,0|1,1,0]=3 2380 B16R0.274 CC(=O)SCCCCNCCCCCCCO 2230a_100011996573_200010402107 [0,0,1,0,0,0|2,1,0]=4 2381 B16R0.274 CC(=O)SCCCCNCCCCCCCO 34a_100011996573_200010402107 [0,0,1,0,0,0|2,1,0]=4 2382 B16R0.274 CC(=O)SCCCCOCCCCCCCBr 34a_100000760002_200010402107 [0,0,1,0,0,0|2,1,0]=4 2383 B16R0.274 CC(=O)SCCCCOCCCCCCCBr 7a_100000760002_200010402107 [0,0,1,0,0,0|2,1,0]=4 2384 B16R0.274 CC(=O)SCCCCOCCCCCCCN 34a_100011996573_200010402107 [0,0,1,0,0,0|2,1,0]=4 2385 B16R0.274 CC(=O)SCCCCSCCCCCCCO 62a_100000760002_200010402107 [0,0,1,0,0,0|2,1,0]=4 2386 B16R0.274 CC(=O)SCCCCSCCCCCCCO 62a_200010402107_100000760002 [0,0,1,0,0,0|2,1,0]=4 2387 B16R0.274 CC(=O)SCCCNCCCCCCCCO 2230a_102515433106_100000038929 [0,0,1,0,0,0|2,1,0]=4 2388 B16R0.274 CC(=O)SCCCNCCCCCCCCO 34a_102515433106_100000038929 [0,0,1,0,0,0|2,1,0]=4 2389 B16R0.274 CC(=O)SCCCOCCCCCCCCBr 34a_100009813846_100000038929 [0,0,1,0,0,0|2,1,0]=4 2390 B16R0.274 CC(=O)SCCCOCCCCCCCCBr 7a_100009813846_100000038929 [0,0,1,0,0,0|2,1,0]=4 2391 B16R0.274 CC(=O)SCCCOCCCCCCCCCl 34a_100000033203_100000038929 [0,0,1,0,0,0|2,1,0]=4 2392 B16R0.274 CC(=O)SCCCOCCCCCCCCCl 7a_100000033203_100000038929 [0,0,1,0,0,0|2,1,0]=4 2393 B16R0.274 CC(=O)SCCCOCCCCCCCCN 34a_102515433106_100000038929 [0,0,1,0,0,0|2,1,0]=4 2394 B16R0.274 CC(=O)SCCCSCCCCCCCCO 62a_100000033203_100000038929 [0,0,1,0,0,0|2,1,0]=4 2395 B16R0.274 CC(=O)SCCCSCCCCCCCCO 62a_100000038929_100000033203 [0,0,1,0,0,0|2,1,0]=4 2396 B16R0.274 CC(=S)OCCCNCCCCCCCCO 2230a_102515433106_200135323944 [0,0,1,0,0,0|2,1,0]=4 2397 B16R0.274 CC(=S)OCCCNCCCCCCCCO 34a_102515433106_200135323944 [0,0,1,0,0,0|2,1,0]=4 2398 B16R0.274 CC(=S)OCCCOCCCCCCCCBr 34a_100009813846_200135323944 [0,0,1,0,0,0|2,1,0]=4 2399 B16R0.274 CC(=S)OCCCOCCCCCCCCBr 7a_100009813846_200135323944 [0,0,1,0,0,0|2,1,0]=4 2400 B16R0.274 CC(=S)OCCCOCCCCCCCCCl 34a_100000033203_200135323944 [0,0,1,0,0,0|2,1,0]=4 2401 B16R0.274 CC(=S)OCCCOCCCCCCCCCl 7a_100000033203_200135323944 [0,0,1,0,0,0|2,1,0]=4 2402 B16R0.274 CC(=S)OCCCOCCCCCCCCN 34a_102515433106_200135323944 [0,0,1,0,0,0|2,1,0]=4 2403 B16R0.274 CC(=S)OCCCSCCCCCCCCO 62a_100000033203_200135323944 [0,0,1,0,0,0|2,1,0]=4 2404 B16R0.274 CC(=S)OCCCSCCCCCCCCO 62a_200135323944_100000033203 [0,0,1,0,0,0|2,1,0]=4 2405 B16R0.274 CC(C)OCCCCCCCCCCCCBr 34a_100009813331_100000210206 [0,0,1,0,0,0|2,0,1]=4 2406 B16R0.274 CC(C)OCCCCCCCCCCCCBr 7a_100009813331_100000210206 [0,0,1,0,0,0|2,0,1]=4 2407 B16R0.274 CC(C)OCCCCCCCCCCCCN 34a_100000066677_100000210206 [0,0,1,0,0,0|2,0,1]=4 2408 B16R0.274 CC(C)OCCCCCCCCCCCCO 34a_100000212225_100009813331 [0,0,1,0,0,0|2,0,1]=4 2409 B16R0.274 CC/C=C/CCCOCCCCCOC(=O)C 34a_100016287902_100000033007 [0,0,1,0,0,0|1,0,2]=4 2410 B16R0.274 CC/C=C/CCCOCCCCCOC(=O)C 7a_100016287902_100000033007 [0,0,1,0,0,0|1,0,2]=4 2411 B16R0.274 CC/C=C\CCCCCOCCCOC(=O)C 34a_100016268722_100000042594 [0,0,1,0,0,0|1,0,2]=4 2412 B16R0.274 CC/C=C\CCCCCOCCCOC(=O)C 7a_100016268722_100000042594 [0,0,1,0,0,0|1,0,2]=4 2413 B16R0.274 CC/C=C\CCCCOCCCCOC(=O)C 34a_100016287862_100000033659 [0,0,1,0,0,0|1,0,2]=4 2414 B16R0.274 CC/C=C\CCCCOCCCCOC(=O)C 7a_100016287862_100000033659 [0,0,1,0,0,0|1,0,2]=4 2415 B16R0.274 CCC#CCCCCCCSCCOC(=O)C 62a_100009814007_200000036426 [0,0,1,0,0,0|1,0,2]=4 2416 B16R0.274 CCC#CCCCCCCSCCOC(=O)C 62a_200000036426_100009814007 [0,0,1,0,0,0|1,0,2]=4 2417 B16R0.274 CCCC#CCCOCCCCCOC(=O)C 34a_100000042726_100000033007 [0,0,1,0,0,0|1,0,2]=4 2418 B16R0.274 CCCC#CCCOCCCCCOC(=O)C 7a_100000042726_100000033007 [0,0,1,0,0,0|1,0,2]=4 2419 B16R0.274 CCCC/C=C/CCCCOCCOC(=O)C 34a_200020645093_100009814007 [0,0,1,0,0,0|1,0,2]=4 2420 B16R0.274 CCCC/C=C/CCCCOCCOC(=O)C 7a_200020645093_100009814007 [0,0,1,0,0,0|1,0,2]=4 2421 B16R0.274 CCCC/C=C/COCCCCCOC(=O)C 34a_200016272032_100000033007 [0,0,1,0,0,0|1,0,2]=4 2422 B16R0.274 CCCC/C=C/COCCCCCOC(=O)C 7a_200016272032_100000033007 [0,0,1,0,0,0|1,0,2]=4 2423 B16R0.274 CCCC/C=C\CCOCCCCOC(=O)C 34a_200016286491_100000033659 [0,0,1,0,0,0|1,0,2]=4 2424 B16R0.274 CCCC/C=C\CCOCCCCOC(=O)C 7a_200016286491_100000033659 [0,0,1,0,0,0|1,0,2]=4 2425 B16R0.274 CCCCC#CCCCCCCNCC(=O)O 269956a_100016091260_200000043322 [0,0,1,0,0,0|1,0,2]=4 2426 B16R0.274 CCCCC#CCCCCOCCOC(=O)C 34a_200000066234_100009814007 [0,0,1,0,0,0|1,0,2]=4 2427 B16R0.274 CCCCC#CCCCCOCCOC(=O)C 7a_200000066234_100009814007 [0,0,1,0,0,0|1,0,2]=4 2428 B16R0.274 CCCCC#CCCCSCCCOC(=O)C 62a_100000042594_200000047210 [0,0,1,0,0,0|1,0,2]=4 2429 B16R0.274 CCCCC#CCCCSCCCOC(=O)C 62a_200000047210_100000042594 [0,0,1,0,0,0|1,0,2]=4 2430 B16R0.274 CCCCC#CCCOCCCCOC(=O)C 34a_100000037610_100000033659 [0,0,1,0,0,0|1,0,2]=4 2431 B16R0.274 CCCCC#CCCOCCCCOC(=O)C 7a_100000037610_100000033659 [0,0,1,0,0,0|1,0,2]=4 2432 B16R0.274 CCCCC#CCOCCCCCOC(=O)C 34a_200000034558_100000033007 [0,0,1,0,0,0|1,0,2]=4 2433 B16R0.274 CCCCC#CCOCCCCCOC(=O)C 7a_200000034558_100000033007 [0,0,1,0,0,0|1,0,2]=4 2434 B16R0.274 CCCCC/C=C/COCCCCOC(=O)C 34a_100016258190_100000033659 [0,0,1,0,0,0|1,0,2]=4 2435 B16R0.274 CCCCC/C=C/COCCCCOC(=O)C 7a_100016258190_100000033659 [0,0,1,0,0,0|1,0,2]=4 2436 B16R0.274 CCCCC/C=C\CCCOCCOC(=O)C 34a_100020655193_100009814007 [0,0,1,0,0,0|1,0,2]=4 2437 B16R0.274 CCCCC/C=C\CCCOCCOC(=O)C 7a_100020655193_100009814007 [0,0,1,0,0,0|1,0,2]=4 2438 B16R0.274 CCCCC/C=C\CCOCCCOC(=O)C 34a_100016277358_100000042594 [0,0,1,0,0,0|1,0,2]=4 2439 B16R0.274 CCCCC/C=C\CCOCCCOC(=O)C 7a_100016277358_100000042594 [0,0,1,0,0,0|1,0,2]=4 2440 B16R0.274 CCCCCC#CCCOCCCOC(=O)C 34a_200000042877_100000042594 [0,0,1,0,0,0|1,0,2]=4 2441 B16R0.274 CCCCCC#CCCOCCCOC(=O)C 7a_200000042877_100000042594 [0,0,1,0,0,0|1,0,2]=4 2442 B16R0.274 CCCCCC#CCOCCCCOC(=O)C 34a_100000073216_100009816472 [0,0,1,0,0,0|1,0,2]=4 2443 B16R0.274 CCCCCC#CCOCCCCOC(=O)C 34a_200000033628_100000033659 [0,0,1,0,0,0|1,0,2]=4 2444 B16R0.274 CCCCCC#CCOCCCCOC(=O)C 7a_100000073216_100009816472 [0,0,1,0,0,0|1,0,2]=4 2445 B16R0.274 CCCCCC#CCOCCCCOC(=O)C 7a_200000033628_100000033659 [0,0,1,0,0,0|1,0,2]=4 2446 B16R0.274 CCCCCC#CCSCCCCOC(=O)C 62a_100000033659_100009816472 [0,0,1,0,0,0|1,0,2]=4 2447 B16R0.274 CCCCCC#CCSCCCCOC(=O)C 62a_100009816472_100000033659 [0,0,1,0,0,0|1,0,2]=4 2448 B16R0.274 CCCCCC/C=C/COCCCOC(=O)C 34a_200016276170_100000042594 [0,0,1,0,0,0|1,0,2]=4 2449 B16R0.274 CCCCCC/C=C/COCCCOC(=O)C 7a_200016276170_100000042594 [0,0,1,0,0,0|1,0,2]=4 2450 B16R0.274 CCCCCCC#CCCOCCOC(=O)C 34a_200000033163_100009814007 [0,0,1,0,0,0|1,0,2]=4 2451 B16R0.274 CCCCCCC#CCCOCCOC(=O)C 7a_200000033163_100009814007 [0,0,1,0,0,0|1,0,2]=4 2452 B16R0.274 CCCCCCC#CCOCCCOC(=O)C 34a_200000037284_100000042594 [0,0,1,0,0,0|1,0,2]=4 2453 B16R0.274 CCCCCCC#CCOCCCOC(=O)C 7a_200000037284_100000042594 [0,0,1,0,0,0|1,0,2]=4 2454 B16R0.274 CCCCCCCC#CCOCCOC(=O)C 34a_200000061759_100009814007 [0,0,1,0,0,0|1,0,2]=4 2455 B16R0.274 CCCCCCCC#CCOCCOC(=O)C 7a_200000061759_100009814007 [0,0,1,0,0,0|1,0,2]=4 2456 B16R0.274 CCCCCCCC/C=C/COCOC(=O)C 34a_200020667288_100009813279 [0,0,1,0,0,0|1,0,2]=4 2457 B16R0.274 CCCCCCCCCCCC=NNC(=O)C 4a_100000189765_100011218549 [0,0,1,0,0,0|2,0,1]=4 2458 B16R0.274 CCCCCCCCCCCCCCC(=O)C 1458a_100000070787_100011215471 [0,0,1,0,0,0|1,0,0]=2 2459 B16R0.274 CCCCCCCCCCCCCCC(=O)C 1458a_100000297455_200000210301 [0,0,1,0,0,0|1,0,0]=2 2460 B16R0.274 CCCCCCCCCCCCCCC(=O)[13CH3] 1458a_100000297455_200025704644 [0,0,1,0,0,0|1,0,0]=2 2461 B16R0.274 CCCCCCCCCCCCCCN(C)C 2230a_100102631434_100011215471 [0,0,1,0,0,0|3,0,0]=4 2462 B16R0.274 CCCCCCCCCCCCCCN(C)C 269982a_100102631434_100011215471 [0,0,1,0,0,0|3,0,0]=4 2463 B16R0.274 CCCCCCCCCCCCCCN(C)C 270004a_100102631434_200011216147 [0,0,1,0,0,0|3,0,0]=4 2464 B16R0.274 CCCCCCCCCCCCCNC(=O)C 11a_100011215765_100015343762 [0,0,1,0,0,0|1,0,0]=2 2465 B16R0.274 CCCCCCCCCCCCCNC(=O)C 1626a_100011215765_100015343762 [0,0,1,0,0,0|1,0,0]=2 2466 B16R0.274 CCCCCCCCCCCCCNC(=O)C 240690a_100011215765_100015343762 [0,0,1,0,0,0|1,0,0]=2 2467 B16R0.274 CCCCCCCCCCCCCNC(=O)C 527a_100011215765_100103153847 [0,0,1,0,0,0|1,0,0]=2 2468 B16R0.274 CCCCCCCCCCCCCNC(C)C 2230a_100011215765_100000210206 [0,0,1,0,0,0|2,0,1]=4 2469 B16R0.274 CCCCCCCCCCCCCNC(C)C 2230a_100138425928_100000210684 [0,0,1,0,0,0|2,0,1]=4 2470 B16R0.274 CCCCCCCCCCCCCNC(C)C 34a_100011215765_100000210206 [0,0,1,0,0,0|2,0,1]=4 2471 B16R0.274 CCCCCCCCCCCCCNC(C)C 34a_100138425928_100000210684 [0,0,1,0,0,0|2,0,1]=4 2472 B16R0.274 CCCCCCCCCCCCCOC(C)C 34a_100000185773_100000210206 [0,0,1,0,0,0|1,0,1]=3 2473 B16R0.274 CCCCCCCCCCCCCOC(C)C 34a_100000212225_100000210684 [0,0,1,0,0,0|1,0,1]=3 2474 B16R0.274 CCCCCCCCCCCCCOC(C)C 7a_100000185773_100000210206 [0,0,1,0,0,0|1,0,1]=3 2475 B16R0.274 CCCCCCCCCCCCNCC(=O)N 2230a_100000210451_100000747473 [0,0,1,0,0,0|2,0,0]=3 2476 B16R0.274 CCCCCCCCCCCCNCC(=O)N 2230a_100000711301_100011215052 [0,0,1,0,0,0|2,0,0]=3 2477 B16R0.274 CCCCCCCCCCCCNCC(=O)N 34a_100000210451_100000187820 [0,0,1,0,0,0|2,0,0]=3 2478 B16R0.274 CCCCCCCCCCCCNCC(=O)O 269956a_100016091260_100000759014 [0,0,1,0,0,0|1,0,0]=2 2479 B16R0.274 CCCCCCCCCCCCNCC(=O)[O-] 34a_100000210451_100020667443 [0,0,1,0,0,0|1,0,1]=3 2480 B16R0.274 CCCCCCCCCCCCNCC(C)O 2230a_100000210451_100011218427 [0,0,1,0,0,0|2,0,1]=4 2481 B16R0.274 CCCCCCCCCCCCNCC(C)O 2230a_100000210904_100011215052 [0,0,1,0,0,0|2,0,1]=4 2482 B16R0.274 CCCCCCCCCCCCNCC(C)O 270004a_100000210904_100011218549 [0,0,1,0,0,0|2,0,1]=4 2483 B16R0.274 CCCCCCCCCCCCNCC(C)O 34a_100000210451_100011218427 [0,0,1,0,0,0|2,0,1]=4 2484 B16R0.274 CCCCCCCCCCCCNCC(C)O 34a_100000210904_100000759014 [0,0,1,0,0,0|2,0,1]=4 2485 B16R0.274 CCCCCCCCCCCCNC[C@@H](C)O 2230a_100000210451_100009817552 [0,0,1,0,0,0|2,0,1]=4 2486 B16R0.274 CCCCCCCCCCCCNC[C@@H](C)O 34a_100000210451_100009817552 [0,0,1,0,0,0|2,0,1]=4 2487 B16R0.274 CCCCCCCCCCCCNC[N+](=O)[O-] 34a_100000210451_100000761209 [0,0,1,0,0,0|2,0,1]=4 2488 B16R0.274 CCCCCCCCCCCCOCC(=O)C 34a_100000211253_100000759014 [0,0,1,0,0,0|2,0,0]=3 2489 B16R0.274 CCCCCCCCCCCCOCC(=O)N 34a_100000210810_100000187820 [0,0,1,0,0,0|2,0,0]=3 2490 B16R0.274 CCCCCCCCCCCCOCC(=O)N 7a_100000210810_100000187820 [0,0,1,0,0,0|2,0,0]=3 2491 B16R0.274 CCCCCCCCCCCCOCC(=O)[O-] 34a_100000210810_100020667443 [0,0,1,0,0,0|1,0,1]=3 2492 B16R0.274 CCCCCCCCCCCCOCC(C)O 34a_100000210810_100011218427 [0,0,1,0,0,0|2,0,1]=4 2493 B16R0.274 CCCCCCCCCCCCOCC(C)O 7a_100000210810_100011218427 [0,0,1,0,0,0|2,0,1]=4 2494 B16R0.274 CCCCCCCCCCCCOC[C@@H](C)O 34a_100000210810_100009817552 [0,0,1,0,0,0|2,0,1]=4 2495 B16R0.274 CCCCCCCCCCCCOC[C@@H](C)O 7a_100000210810_100009817552 [0,0,1,0,0,0|2,0,1]=4 2496 B16R0.274 CCCCCCCCCCCCOC[N+](=O)[O-] 34a_100000210810_100000761209 [0,0,1,0,0,0|2,0,1]=4 2497 B16R0.274 CCCCCCCCCCCCSCC(=O)N 62a_100000747473_100000759014 [0,0,1,0,0,0|2,0,0]=3 2498 B16R0.274 CCCCCCCCCCCCSCC(=O)[O-] 62a_100020667443_100000759014 [0,0,1,0,0,0|1,0,1]=3 2499 B16R0.274 CCCCCCCCCCCCSCC(C)O 62a_100011218427_100000759014 [0,0,1,0,0,0|2,0,1]=4 2500 B16R0.274 CCCCCCCCCCCCSC[C@@H](C)O 62a_100009817552_100000759014 [0,0,1,0,0,0|2,0,1]=4 2501 B16R0.274 CCCCCCCCCCCNCC=C(C)C 2230a_200011215754_100000761012 [0,0,1,0,0,0|3,0,0]=4 2502 B16R0.274 CCCCCCCCCCCNCC=C(C)C 34a_100000718196_100011215454 [0,0,1,0,0,0|3,0,0]=4 2503 B16R0.274 CCCCCCCCCCCNCC=C(C)C 34a_200011215754_100000761012 [0,0,1,0,0,0|3,0,0]=4 2504 B16R0.274 CCCCCCCCCCCNCCC(=O)N 2230a_200011215754_100000744528 [0,0,1,0,0,0|2,0,0]=3 2505 B16R0.274 CCCCCCCCCCCNCCC(=O)N 34a_200011215754_100000731001 [0,0,1,0,0,0|2,0,0]=3 2506 B16R0.274 CCCCCCCCCCCNCCC(C)O 2230a_200000755665_100011215454 [0,0,1,0,0,0|2,0,1]=4 2507 B16R0.274 CCCCCCCCCCCNCCC(C)O 2230a_200011215754_100012276601 [0,0,1,0,0,0|2,0,1]=4 2508 B16R0.274 CCCCCCCCCCCNCCC(C)O 34a_200011215754_100012276601 [0,0,1,0,0,0|2,0,1]=4 2509 B16R0.274 CCCCCCCCCCCNCOC(=O)C 34a_200011215754_100009813279 [0,0,1,0,0,0|1,0,0]=2 2510 B16R0.274 CCCCCCCCCCCNCOC(C)C 2230a_200011215754_100000709892 [0,0,1,0,0,0|2,0,1]=4 2511 B16R0.274 CCCCCCCCCCCNCOC(C)C 34a_200011215754_100000709892 [0,0,1,0,0,0|2,0,1]=4 2512 B16R0.274 CCCCCCCCCCCNOCC(=O)O 269956a_100000106656_100011215454 [0,0,1,0,0,0|2,0,0]=3 2513 B16R0.274 CCCCCCCCCCCOCC=C(C)C 34a_100000210809_100000761012 [0,0,1,0,0,0|3,0,0]=4 2514 B16R0.274 CCCCCCCCCCCOCC=C(C)C 34a_100000753907_100011215454 [0,0,1,0,0,0|3,0,0]=4 2515 B16R0.274 CCCCCCCCCCCOCC=C(C)C 7a_100000210809_100000761012 [0,0,1,0,0,0|3,0,0]=4 2516 B16R0.274 CCCCCCCCCCCOCCC(=O)C 34a_100000759926_100011215454 [0,0,1,0,0,0|2,0,0]=3 2517 B16R0.274 CCCCCCCCCCCOCCC(=O)C 7a_100000210809_100000053229 [0,0,1,0,0,0|2,0,0]=3 2518 B16R0.274 CCCCCCCCCCCOCCC(=O)C 7a_100000759926_100011215454 [0,0,1,0,0,0|2,0,0]=3 2519 B16R0.274 CCCCCCCCCCCOCCC(=O)N 34a_100000210809_100000731001 [0,0,1,0,0,0|2,0,0]=3 2520 B16R0.274 CCCCCCCCCCCOCCC(=O)N 34a_100000757172_100011215454 [0,0,1,0,0,0|2,0,0]=3 2521 B16R0.274 CCCCCCCCCCCOCCC(=O)N 7a_100000210809_100000744528 [0,0,1,0,0,0|2,0,0]=3 2522 B16R0.274 CCCCCCCCCCCOCCC(=O)N 7a_100000757172_100011215454 [0,0,1,0,0,0|2,0,0]=3 2523 B16R0.274 CCCCCCCCCCCOCCC(C)O 34a_100000210809_100012276601 [0,0,1,0,0,0|2,0,1]=4 2524 B16R0.274 CCCCCCCCCCCOCCC(C)O 7a_100000210809_100012276601 [0,0,1,0,0,0|2,0,1]=4 2525 B16R0.274 CCCCCCCCCCCOCOC(=O)C 34a_100000210809_100009813279 [0,0,1,0,0,0|1,0,0]=2 2526 B16R0.274 CCCCCCCCCCCOCOC(C)C 34a_100000210809_100000709892 [0,0,1,0,0,0|2,0,1]=4 2527 B16R0.274 CCCCCCCCCCCSCCC(=O)C 62a_100000053229_100011215454 [0,0,1,0,0,0|2,0,0]=3 2528 B16R0.274 CCCCCCCCCCCSCCC(=O)N 62a_100000744528_100011215454 [0,0,1,0,0,0|2,0,0]=3 2529 B16R0.274 CCCCCCCCCCCSCCC(C)O 62a_100012276601_100011215454 [0,0,1,0,0,0|2,0,1]=4 2530 B16R0.274 CCCCCCCCCCCSCOC(=O)C 62a_100000076356_100011215454 [0,0,1,0,0,0|1,0,0]=2 2531 B16R0.274 CCCCCCCCCCCSCOC(C)C 62a_100000709892_100011215454 [0,0,1,0,0,0|2,0,1]=4 2532 B16R0.274 CCCCCCCCCCNCCC=C(C)C 2230a_100000684558_100011217483 [0,0,1,0,0,0|3,0,0]=4 2533 B16R0.274 CCCCCCCCCCNCCC=C(C)C 34a_100000684558_100011217483 [0,0,1,0,0,0|3,0,0]=4 2534 B16R0.274 CCCCCCCCCCNCCCC(=O)C 34a_100000684558_100000685027 [0,0,1,0,0,0|2,0,0]=3 2535 B16R0.274 CCCCCCCCCCNCCCC(=O)N 34a_100000684558_100102525003 [0,0,1,0,0,0|2,0,0]=3 2536 B16R0.274 CCCCCCCCCCNCCCC(=O)N 34a_100000739312_100000210320 [0,0,1,0,0,0|2,0,0]=3 2537 B16R0.274 CCCCCCCCCCNCCCC(C)O 2230a_100000684558_200000718107 [0,0,1,0,0,0|2,0,1]=4 2538 B16R0.274 CCCCCCCCCCNCCCC(C)O 34a_100000684558_200000718107 [0,0,1,0,0,0|2,0,1]=4 2539 B16R0.274 CCCCCCCCCCNCCCS(=O)C 2230a_200000753449_100000210320 [0,0,1,0,0,0|3,0,0]=4 2540 B16R0.274 CCCCCCCCCCNCCNC(=O)C 2230a_100000209853_100000210320 [0,0,1,0,0,0|2,0,0]=3 2541 B16R0.274 CCCCCCCCCCNCCNC(=O)C 2230a_100000684558_100000189650 [0,0,1,0,0,0|2,0,0]=3 2542 B16R0.274 CCCCCCCCCCNCCNC(=O)N 2230a_100000684558_200000034859 [0,0,1,0,0,0|3,0,0]=4 2543 B16R0.274 CCCCCCCCCCNCCNC(=O)N 34a_100020590234_100000210320 [0,0,1,0,0,0|3,0,0]=4 2544 B16R0.274 CCCCCCCCCCNCCOC(=O)C 34a_100000684558_100009814007 [0,0,1,0,0,0|1,0,0]=2 2545 B16R0.274 CCCCCCCCCCNCCOC(=O)N 34a_100000684558_200011214921 [0,0,1,0,0,0|2,0,0]=3 2546 B16R0.274 CCCCCCCCCCNCCOC(C)C 2230a_100000684558_100000211751 [0,0,1,0,0,0|2,0,1]=4 2547 B16R0.274 CCCCCCCCCCNCCOC(C)C 2230a_100000701111_100000210320 [0,0,1,0,0,0|2,0,1]=4 2548 B16R0.274 CCCCCCCCCCNCCOC(C)C 34a_100000684558_100000211751 [0,0,1,0,0,0|2,0,1]=4 2549 B16R0.274 CCCCCCCCCCNCCOC(C)C 34a_100000701111_100000210320 [0,0,1,0,0,0|2,0,1]=4 2550 B16R0.274 CCCCCCCCCCOCCC=C(C)C 34a_100000210711_100011217483 [0,0,1,0,0,0|3,0,0]=4 2551 B16R0.274 CCCCCCCCCCOCCC=C(C)C 7a_100000210711_100011217483 [0,0,1,0,0,0|3,0,0]=4 2552 B16R0.274 CCCCCCCCCCOCCCC(=O)C 34a_100000210711_100000685027 [0,0,1,0,0,0|2,0,0]=3 2553 B16R0.274 CCCCCCCCCCOCCCC(=O)C 34a_100000759063_100000210320 [0,0,1,0,0,0|2,0,0]=3 2554 B16R0.274 CCCCCCCCCCOCCCC(=O)C 7a_100000210711_100011215641 [0,0,1,0,0,0|2,0,0]=3 2555 B16R0.274 CCCCCCCCCCOCCCC(=O)C 7a_100000759063_100000210320 [0,0,1,0,0,0|2,0,0]=3 2556 B16R0.274 CCCCCCCCCCOCCCC(=O)N 34a_100000210711_100102525003 [0,0,1,0,0,0|2,0,0]=3 2557 B16R0.274 CCCCCCCCCCOCCCC(=O)N 7a_100000210711_100102525003 [0,0,1,0,0,0|2,0,0]=3 2558 B16R0.274 CCCCCCCCCCOCCCC(C)O 34a_100000210711_200000718107 [0,0,1,0,0,0|2,0,1]=4 2559 B16R0.274 CCCCCCCCCCOCCCC(C)O 7a_100000210711_200000718107 [0,0,1,0,0,0|2,0,1]=4 2560 B16R0.274 CCCCCCCCCCOCCC[N+](=O)[O-] 34a_200000037920_100000210320 [0,0,1,0,0,0|2,0,1]=4 2561 B16R0.274 CCCCCCCCCCOCCNC(=O)C 34a_100000158858_100000210320 [0,0,1,0,0,0|2,0,0]=3 2562 B16R0.274 CCCCCCCCCCOCCNC(=O)C 7a_100000210711_100000189650 [0,0,1,0,0,0|2,0,0]=3 2563 B16R0.274 CCCCCCCCCCOCCNC(=O)N 34a_100000181757_100000210320 [0,0,1,0,0,0|3,0,0]=4 2564 B16R0.274 CCCCCCCCCCOCCNC(=O)N 7a_100000210711_200000034859 [0,0,1,0,0,0|3,0,0]=4 2565 B16R0.274 CCCCCCCCCCOCCOC(=O)C 34a_100000210711_100009814007 [0,0,1,0,0,0|1,0,0]=2 2566 B16R0.274 CCCCCCCCCCOCCOC(=O)C 7a_100000210711_100009814007 [0,0,1,0,0,0|1,0,0]=2 2567 B16R0.274 CCCCCCCCCCOCCOC(=O)N 34a_100000210711_200011214921 [0,0,1,0,0,0|2,0,0]=3 2568 B16R0.274 CCCCCCCCCCOCCOC(=O)N 7a_100000210711_200011214921 [0,0,1,0,0,0|2,0,0]=3 2569 B16R0.274 CCCCCCCCCCOCCOC(=O)N 7a_100000766696_100000210320 [0,0,1,0,0,0|2,0,0]=3 2570 B16R0.274 CCCCCCCCCCOCCOC(C)C 34a_100000210711_100000211751 [0,0,1,0,0,0|2,0,1]=4 2571 B16R0.274 CCCCCCCCCCOCCOC(C)C 34a_100000211219_100000210320 [0,0,1,0,0,0|2,0,1]=4 2572 B16R0.274 CCCCCCCCCCOCCOC(C)C 7a_100000210711_100000211751 [0,0,1,0,0,0|2,0,1]=4 2573 B16R0.274 CCCCCCCCCCOCCOC(C)C 7a_100000211219_100000210320 [0,0,1,0,0,0|2,0,1]=4 2574 B16R0.274 CCCCCCCCCCSCCCC(=O)C 62a_100011215641_100000210320 [0,0,1,0,0,0|2,0,0]=3 2575 B16R0.274 CCCCCCCCCCSCCCC(=O)N 62a_100102525003_100000210320 [0,0,1,0,0,0|2,0,0]=3 2576 B16R0.274 CCCCCCCCCCSCCCC(C)O 62a_200000718107_100000210320 [0,0,1,0,0,0|2,0,1]=4 2577 B16R0.274 CCCCCCCCCCSCCNC(=O)C 62a_100000189650_100000210320 [0,0,1,0,0,0|2,0,0]=3 2578 B16R0.274 CCCCCCCCCCSCCNC(=O)N 62a_200000034859_100000210320 [0,0,1,0,0,0|3,0,0]=4 2579 B16R0.274 CCCCCCCCCCSCCOC(=O)C 62a_100009814007_100000210320 [0,0,1,0,0,0|1,0,0]=2 2580 B16R0.274 CCCCCCCCCCSCCOC(=O)N 62a_200011214921_100000210320 [0,0,1,0,0,0|2,0,0]=3 2581 B16R0.274 CCCCCCCCCCSCCOC(C)C 34a_100011628728_100000210206 [0,0,1,0,0,0|2,0,1]=4 2582 B16R0.274 CCCCCCCCCCSCCOC(C)C 62a_100000211751_100000210320 [0,0,1,0,0,0|2,0,1]=4 2583 B16R0.274 CCCCCCCCCCSCCOC(C)C 7a_100011628728_100000210206 [0,0,1,0,0,0|2,0,1]=4 2584 B16R0.274 CCCCCCCCCNCCCCB(O)O 2230a_100000212291_200009817182 [0,0,1,0,0,0|2,0,1]=4 2585 B16R0.274 CCCCCCCCCNCCCCB(O)O 34a_100000212291_200009817182 [0,0,1,0,0,0|2,0,1]=4 2586 B16R0.274 CCCCCCCCCNCCCCC(=O)C 34a_100000212291_100009817362 [0,0,1,0,0,0|2,0,0]=3 2587 B16R0.274 CCCCCCCCCNCCCCC(=O)N 34a_100000696515_100011214924 [0,0,1,0,0,0|2,0,0]=3 2588 B16R0.274 CCCCCCCCCNCCCNC(=O)C 34a_100000736810_100011214924 [0,0,1,0,0,0|2,0,0]=3 2589 B16R0.274 CCCCCCCCCNCCCOC(=O)C 34a_100000212291_100000042594 [0,0,1,0,0,0|1,0,0]=2 2590 B16R0.274 CCCCCCCCCNCCCOC(=S)C 2230a_100000212291_200135323944 [0,0,1,0,0,0|1,1,0]=3 2591 B16R0.274 CCCCCCCCCNCCCOC(=S)C 34a_100000212291_200135323944 [0,0,1,0,0,0|1,1,0]=3 2592 B16R0.274 CCCCCCCCCNCCCOC(C)C 2230a_100000737246_100011214924 [0,0,1,0,0,0|2,0,1]=4 2593 B16R0.274 CCCCCCCCCNCCCOC(C)C 34a_100000737246_100011214924 [0,0,1,0,0,0|2,0,1]=4 2594 B16R0.274 CCCCCCCCCNCCCSC(=O)C 2230a_100000212291_100000038929 [0,0,1,0,0,0|1,1,0]=3 2595 B16R0.274 CCCCCCCCCNCCCSC(=O)C 34a_100000212291_100000038929 [0,0,1,0,0,0|1,1,0]=3 2596 B16R0.274 CCCCCCCCCNCCOCC(=O)N 2230a_100000212291_100000076697 [0,0,1,0,0,0|3,0,0]=4 2597 B16R0.274 CCCCCCCCCNCCOCC(=O)N 34a_100000212291_100000076697 [0,0,1,0,0,0|3,0,0]=4 2598 B16R0.274 CCCCCCCCCNCCOCC(=O)O 269956a_100000700818_100000210670 [0,0,1,0,0,0|2,0,0]=3 2599 B16R0.274 CCCCCCCCCOCCCCB(O)O 34a_100000210712_200009817182 [0,0,1,0,0,0|2,0,1]=4 2600 B16R0.274 CCCCCCCCCOCCCCB(O)O 7a_100000210712_200009817182 [0,0,1,0,0,0|2,0,1]=4 2601 B16R0.274 CCCCCCCCCOCCCCC(=O)C 34a_100000210712_100009817362 [0,0,1,0,0,0|2,0,0]=3 2602 B16R0.274 CCCCCCCCCOCCCCC(=O)C 7a_100000210712_100000735457 [0,0,1,0,0,0|2,0,0]=3 2603 B16R0.274 CCCCCCCCCOCCCCC(=O)N 34a_100012022536_100011214924 [0,0,1,0,0,0|2,0,0]=3 2604 B16R0.274 CCCCCCCCCOCCCCC(=O)N 7a_100012022536_100000210328 [0,0,1,0,0,0|2,0,0]=3 2605 B16R0.274 CCCCCCCCCOCCCC[N+](=O)[O-] 34a_200015379883_100011214924 [0,0,1,0,0,0|2,0,1]=4 2606 B16R0.274 CCCCCCCCCOCCCC[N+](=O)[O-] 7a_200015379883_100000210328 [0,0,1,0,0,0|2,0,1]=4 2607 B16R0.274 CCCCCCCCCOCCCNC(=O)C 34a_100000752032_100011214924 [0,0,1,0,0,0|2,0,0]=3 2608 B16R0.274 CCCCCCCCCOCCCOC(=O)C 34a_100000210712_100000042594 [0,0,1,0,0,0|1,0,0]=2 2609 B16R0.274 CCCCCCCCCOCCCOC(=O)C 7a_100000210712_100000042594 [0,0,1,0,0,0|1,0,0]=2 2610 B16R0.274 CCCCCCCCCOCCCOC(=S)C 34a_100000210712_200135323944 [0,0,1,0,0,0|1,1,0]=3 2611 B16R0.274 CCCCCCCCCOCCCOC(=S)C 7a_100000210712_200135323944 [0,0,1,0,0,0|1,1,0]=3 2612 B16R0.274 CCCCCCCCCOCCCSC(=O)C 34a_100000210712_100000038929 [0,0,1,0,0,0|1,1,0]=3 2613 B16R0.274 CCCCCCCCCOCCCSC(=O)C 7a_100000210712_100000038929 [0,0,1,0,0,0|1,1,0]=3 2614 B16R0.274 CCCCCCCCCOCCOCC(=O)N 34a_100000210712_100000076697 [0,0,1,0,0,0|3,0,0]=4 2615 B16R0.274 CCCCCCCCCOCCOCC(=O)N 7a_100000210712_100000076697 [0,0,1,0,0,0|3,0,0]=4 2616 B16R0.274 CCCCCCCCCSCCCCB(O)O 62a_200009817182_100000210670 [0,0,1,0,0,0|2,0,1]=4 2617 B16R0.274 CCCCCCCCCSCCCCC(=O)C 62a_100000735457_100000210670 [0,0,1,0,0,0|2,0,0]=3 2618 B16R0.274 CCCCCCCCCSCCCOC(=O)C 62a_100000042594_100000210670 [0,0,1,0,0,0|1,0,0]=2 2619 B16R0.274 CCCCCCCCCSCCCOC(=S)C 62a_200135323944_100000210670 [0,0,1,0,0,0|1,1,0]=3 2620 B16R0.274 CCCCCCCCCSCCCSC(=O)C 62a_100000038929_100000210670 [0,0,1,0,0,0|1,1,0]=3 2621 B16R0.274 CCCCCCCCCSCCOCC(=O)N 62a_100000076697_100000210670 [0,0,1,0,0,0|3,0,0]=4 2622 B16R0.274 CCCCCCCCNCCCCCB(O)O 2230a_100000229939_200009817188 [0,0,1,0,0,0|2,0,1]=4 2623 B16R0.274 CCCCCCCCNCCCCCB(O)O 34a_100000229939_200009817188 [0,0,1,0,0,0|2,0,1]=4 2624 B16R0.274 CCCCCCCCNCCCCCC(=O)N 2230a_100000229939_100009817443 [0,0,1,0,0,0|2,0,0]=3 2625 B16R0.274 CCCCCCCCNCCCCCC(=O)N 34a_100000229939_100009817443 [0,0,1,0,0,0|2,0,0]=3 2626 B16R0.274 CCCCCCCCNCCCCNC(=O)C 2230a_200011368371_100000210759 [0,0,1,0,0,0|2,0,0]=3 2627 B16R0.274 CCCCCCCCNCCCCNC(=O)C 34a_200011368371_100000210759 [0,0,1,0,0,0|2,0,0]=3 2628 B16R0.274 CCCCCCCCNCCCCOC(=O)C 34a_100000229939_100000033659 [0,0,1,0,0,0|1,0,0]=2 2629 B16R0.274 CCCCCCCCNCCCCO[N+](=O)[O-] 34a_100000229939_100015694321 [0,0,1,0,0,0|3,0,0]=4 2630 B16R0.274 CCCCCCCCNCCCCSC(=O)C 2230a_100000229939_200010402107 [0,0,1,0,0,0|1,1,0]=3 2631 B16R0.274 CCCCCCCCNCCCCSC(=O)C 34a_100000229939_200010402107 [0,0,1,0,0,0|1,1,0]=3 2632 B16R0.274 CCCCCCCCNCOCCOC(=O)C 34a_100000229939_100000076355 [0,0,1,0,0,0|2,0,0]=3 2633 B16R0.274 CCCCCCCCOCCCCCB(O)O 34a_100000210232_200009817188 [0,0,1,0,0,0|2,0,1]=4 2634 B16R0.274 CCCCCCCCOCCCCCB(O)O 7a_100000210232_200009817188 [0,0,1,0,0,0|2,0,1]=4 2635 B16R0.274 CCCCCCCCOCCCCCC(=O)N 34a_100000123541_100000210759 [0,0,1,0,0,0|2,0,0]=3 2636 B16R0.274 CCCCCCCCOCCCCCC(=O)N 34a_100000210232_100009817443 [0,0,1,0,0,0|2,0,0]=3 2637 B16R0.274 CCCCCCCCOCCCCCC(=O)N 7a_100000123541_100000210759 [0,0,1,0,0,0|2,0,0]=3 2638 B16R0.274 CCCCCCCCOCCCCCC(=O)N 7a_100000210232_100009817443 [0,0,1,0,0,0|2,0,0]=3 2639 B16R0.274 CCCCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210759 [0,0,1,0,0,0|1,0,1]=3 2640 B16R0.274 CCCCCCCCOCCCCOC(=O)C 34a_100000073216_100000210759 [0,0,1,0,0,0|1,0,0]=2 2641 B16R0.274 CCCCCCCCOCCCCOC(=O)C 34a_100000210232_100000033659 [0,0,1,0,0,0|1,0,0]=2 2642 B16R0.274 CCCCCCCCOCCCCOC(=O)C 7a_100000073216_100000210759 [0,0,1,0,0,0|1,0,0]=2 2643 B16R0.274 CCCCCCCCOCCCCOC(=O)C 7a_100000210232_100000033659 [0,0,1,0,0,0|1,0,0]=2 2644 B16R0.274 CCCCCCCCOCCCCO[N+](=O)[O-] 34a_100000210232_100015694321 [0,0,1,0,0,0|3,0,0]=4 2645 B16R0.274 CCCCCCCCOCCCCO[N+](=O)[O-] 7a_100000210232_100015694321 [0,0,1,0,0,0|3,0,0]=4 2646 B16R0.274 CCCCCCCCOCCCCSC(=O)C 34a_100000210232_200010402107 [0,0,1,0,0,0|1,1,0]=3 2647 B16R0.274 CCCCCCCCOCCCCSC(=O)C 7a_100000210232_200010402107 [0,0,1,0,0,0|1,1,0]=3 2648 B16R0.274 CCCCCCCCOCOCCOC(=O)C 34a_100000210232_100000076355 [0,0,1,0,0,0|2,0,0]=3 2649 B16R0.274 CCCCCCCCSCCCCCB(O)O 62a_100000210759_200009817188 [0,0,1,0,0,0|2,0,1]=4 2650 B16R0.274 CCCCCCCCSCCCCCB(O)O 62a_200009817188_100000210317 [0,0,1,0,0,0|2,0,1]=4 2651 B16R0.274 CCCCCCCCSCCCCCC(=O)N 62a_100000210759_100009817443 [0,0,1,0,0,0|2,0,0]=3 2652 B16R0.274 CCCCCCCCSCCCCCC(=O)N 62a_100009817443_100000210317 [0,0,1,0,0,0|2,0,0]=3 2653 B16R0.274 CCCCCCCCSCCCCOC(=O)C 62a_100000033659_100000210317 [0,0,1,0,0,0|1,0,0]=2 2654 B16R0.274 CCCCCCCCSCCCCOC(=O)C 62a_100000210759_100000033659 [0,0,1,0,0,0|1,0,0]=2 2655 B16R0.274 CCCCCCCCSCCCCO[N+](=O)[O-] 62a_100000210759_100015694321 [0,0,1,0,0,0|3,0,0]=4 2656 B16R0.274 CCCCCCCCSCCCCSC(=O)C 62a_100000210759_200010402107 [0,0,1,0,0,0|1,1,0]=3 2657 B16R0.274 CCCCCCCCSCCCCSC(=O)C 62a_200010402107_100000210317 [0,0,1,0,0,0|1,1,0]=3 2658 B16R0.274 CCCCCCCCSCOCCOC(=O)C 62a_100000076355_100000210317 [0,0,1,0,0,0|2,0,0]=3 2659 B16R0.274 CCCCCCCCSCOCCOC(=O)C 62a_100000210759_100000076355 [0,0,1,0,0,0|2,0,0]=3 2660 B16R0.274 CCCCCCCNCCCCCCB(O)O 2230a_100000229938_100009817187 [0,0,1,0,0,0|2,0,1]=4 2661 B16R0.274 CCCCCCCNCCCCCNC(=O)C 2230a_200012022750_100000210681 [0,0,1,0,0,0|2,0,0]=3 2662 B16R0.274 CCCCCCCNCCCCCNC(=O)C 34a_200012022750_100000210614 [0,0,1,0,0,0|2,0,0]=3 2663 B16R0.274 CCCCCCCNCCCCCOC(=O)C 2230a_100000229938_100009813381 [0,0,1,0,0,0|1,0,0]=2 2664 B16R0.274 CCCCCCCNCCOCCOC(=O)C 2230a_100000229938_200000083610 [0,0,1,0,0,0|2,0,0]=3 2665 B16R0.274 CCCCCCCOCCCCCCB(O)O 34a_100000210272_100009817187 [0,0,1,0,0,0|2,0,1]=4 2666 B16R0.274 CCCCCCCOCCCCCCB(O)O 7a_100000210272_100009817187 [0,0,1,0,0,0|2,0,1]=4 2667 B16R0.274 CCCCCCCOCCCCCOC(=O)C 34a_100000210272_100000033007 [0,0,1,0,0,0|1,0,0]=2 2668 B16R0.274 CCCCCCCOCCCCCOC(=O)C 7a_100000210272_100000033007 [0,0,1,0,0,0|1,0,0]=2 2669 B16R0.274 CCCCCCCOCCOCCOC(=O)C 34a_100000210272_200000083610 [0,0,1,0,0,0|2,0,0]=3 2670 B16R0.274 CCCCCCCOCCOCCOC(=O)C 7a_100000210272_200000083610 [0,0,1,0,0,0|2,0,0]=3 2671 B16R0.274 CCCCCCCSCCCCCCB(O)O 62a_100000210614_100009817187 [0,0,1,0,0,0|2,0,1]=4 2672 B16R0.274 CCCCCCCSCCCCCCB(O)O 62a_100009817187_100000210316 [0,0,1,0,0,0|2,0,1]=4 2673 B16R0.274 CCCCCCCSCCCCCOC(=O)C 62a_100000033007_100000210316 [0,0,1,0,0,0|1,0,0]=2 2674 B16R0.274 CCCCCCCSCCCCCOC(=O)C 62a_100000210614_100000033007 [0,0,1,0,0,0|1,0,0]=2 2675 B16R0.274 CCCCCCCSCCOCCOC(=O)C 62a_100000210614_200000083610 [0,0,1,0,0,0|2,0,0]=3 2676 B16R0.274 CCCCCCCSCCOCCOC(=O)C 62a_200000083610_100000210316 [0,0,1,0,0,0|2,0,0]=3 2677 B16R0.274 CCCCCCNCCCCCCNC(=O)C 2230a_200011996284_100000210314 [0,0,1,0,0,0|2,0,0]=3 2678 B16R0.274 CCCCCCNCCCCCCNC(=O)C 34a_200011996284_100000210314 [0,0,1,0,0,0|2,0,0]=3 2679 B16R0.274 CCCCCCNCCOCCOCC(=O)O 269956a_100009854275_100000210757 [0,0,1,0,0,0|3,0,0]=4 2680 B16R0.274 CCCCCCOCCOCCCCC(=O)C 34a_100000691444_100009817362 [0,0,1,0,0,0|3,0,0]=4 2681 B16R0.274 CCCCCCOCCOCCCCC(=O)C 7a_100000691444_100000735457 [0,0,1,0,0,0|3,0,0]=4 2682 B16R0.274 CCCCCCOCCOCCCOC(=O)C 34a_100000691444_100000042594 [0,0,1,0,0,0|2,0,0]=3 2683 B16R0.274 CCCCCCOCCOCCCOC(=O)C 7a_100000691444_100000042594 [0,0,1,0,0,0|2,0,0]=3 2684 B16R0.274 CCCCCCOCCOCCCOC(=S)C 34a_100000691444_200135323944 [0,0,1,0,0,0|2,1,0]=4 2685 B16R0.274 CCCCCCOCCOCCCOC(=S)C 7a_100000691444_200135323944 [0,0,1,0,0,0|2,1,0]=4 2686 B16R0.274 CCCCCCOCCOCCCSC(=O)C 34a_100000691444_100000038929 [0,0,1,0,0,0|2,1,0]=4 2687 B16R0.274 CCCCCCOCCOCCCSC(=O)C 7a_100000691444_100000038929 [0,0,1,0,0,0|2,1,0]=4 2688 B16R0.274 CCCCCNCCOCCCCCC(=O)N 34a_100000224656_100009817443 [0,0,1,0,0,0|3,0,0]=4 2689 B16R0.274 CCCCCNCCOCCCCOC(=O)C 34a_100000224656_100000033659 [0,0,1,0,0,0|2,0,0]=3 2690 B16R0.274 CCCCCNCCOCCCCSC(=O)C 34a_100000224656_200010402107 [0,0,1,0,0,0|2,1,0]=4 2691 B16R0.274 CCCCCNCCOCOCCOC(=O)C 34a_100000224656_100000076355 [0,0,1,0,0,0|3,0,0]=4 2692 B16R0.274 CCCCCOCCOCCCCCC(=O)N 34a_100011215259_100009817443 [0,0,1,0,0,0|3,0,0]=4 2693 B16R0.274 CCCCCOCCOCCCCCC(=O)N 7a_100011215259_100009817443 [0,0,1,0,0,0|3,0,0]=4 2694 B16R0.274 CCCCCOCCOCCCCOC(=O)C 34a_100011215259_100000033659 [0,0,1,0,0,0|2,0,0]=3 2695 B16R0.274 CCCCCOCCOCCCCOC(=O)C 7a_100011215259_100000033659 [0,0,1,0,0,0|2,0,0]=3 2696 B16R0.274 CCCCCOCCOCCCCSC(=O)C 34a_100011215259_200010402107 [0,0,1,0,0,0|2,1,0]=4 2697 B16R0.274 CCCCCOCCOCCCCSC(=O)C 7a_100011215259_200010402107 [0,0,1,0,0,0|2,1,0]=4 2698 B16R0.274 CCCCCOCCOCOCCOC(=O)C 34a_100011215259_100000076355 [0,0,1,0,0,0|3,0,0]=4 2699 B16R0.274 CCCCNCCCCOCCCCC(=O)C 34a_200011216965_100009817362 [0,0,1,0,0,0|3,0,0]=4 2700 B16R0.274 CCCCNCCCCOCCCOC(=O)C 34a_200011216965_100000042594 [0,0,1,0,0,0|2,0,0]=3 2701 B16R0.274 CCCCNCCCCOCCCOC(=S)C 34a_200011216965_200135323944 [0,0,1,0,0,0|2,1,0]=4 2702 B16R0.274 CCCCNCCCCOCCCSC(=O)C 34a_200011216965_100000038929 [0,0,1,0,0,0|2,1,0]=4 2703 B16R0.274 CCCCOCCCCOCCCCC(=O)C 34a_200000760531_100009817362 [0,0,1,0,0,0|3,0,0]=4 2704 B16R0.274 CCCCOCCCCOCCCCC(=O)C 7a_200000760531_100000735457 [0,0,1,0,0,0|3,0,0]=4 2705 B16R0.274 CCCCOCCCCOCCCOC(=O)C 34a_200000760531_100000042594 [0,0,1,0,0,0|2,0,0]=3 2706 B16R0.274 CCCCOCCCCOCCCOC(=O)C 7a_200000760531_100000042594 [0,0,1,0,0,0|2,0,0]=3 2707 B16R0.274 CCCCOCCCCOCCCOC(=S)C 34a_200000760531_200135323944 [0,0,1,0,0,0|2,1,0]=4 2708 B16R0.274 CCCCOCCCCOCCCOC(=S)C 7a_200000760531_200135323944 [0,0,1,0,0,0|2,1,0]=4 2709 B16R0.274 CCCCOCCCCOCCCSC(=O)C 34a_200000760531_100000038929 [0,0,1,0,0,0|2,1,0]=4 2710 B16R0.274 CCCCOCCCCOCCCSC(=O)C 7a_200000760531_100000038929 [0,0,1,0,0,0|2,1,0]=4 2711 B16R0.274 CCCCOCCCNCCCCCC(=O)N 2230a_200000211371_100009817443 [0,0,1,0,0,0|3,0,0]=4 2712 B16R0.274 CCCCOCCCNCCCCCC(=O)N 34a_200000211371_100009817443 [0,0,1,0,0,0|3,0,0]=4 2713 B16R0.274 CCCCOCCCNCCCCOC(=O)C 34a_200000211371_100000033659 [0,0,1,0,0,0|2,0,0]=3 2714 B16R0.274 CCCCOCCCNCCCCSC(=O)C 2230a_200000211371_200010402107 [0,0,1,0,0,0|2,1,0]=4 2715 B16R0.274 CCCCOCCCNCCCCSC(=O)C 34a_200000211371_200010402107 [0,0,1,0,0,0|2,1,0]=4 2716 B16R0.274 CCCCOCCCNCOCCOC(=O)C 34a_200000211371_100000076355 [0,0,1,0,0,0|3,0,0]=4 2717 B16R0.274 CCCCOCCCOCCCCCC(=O)N 34a_200011215613_100009817443 [0,0,1,0,0,0|3,0,0]=4 2718 B16R0.274 CCCCOCCCOCCCCCC(=O)N 7a_200011215613_100009817443 [0,0,1,0,0,0|3,0,0]=4 2719 B16R0.274 CCCCOCCCOCCCCOC(=O)C 34a_200011215613_100000033659 [0,0,1,0,0,0|2,0,0]=3 2720 B16R0.274 CCCCOCCCOCCCCOC(=O)C 7a_200011215613_100000033659 [0,0,1,0,0,0|2,0,0]=3 2721 B16R0.274 CCCCOCCCOCCCCSC(=O)C 34a_200011215613_200010402107 [0,0,1,0,0,0|2,1,0]=4 2722 B16R0.274 CCCCOCCCOCCCCSC(=O)C 7a_200011215613_200010402107 [0,0,1,0,0,0|2,1,0]=4 2723 B16R0.274 CCCCOCCCOCOCCOC(=O)C 34a_200011215613_100000076355 [0,0,1,0,0,0|3,0,0]=4 2724 B16R0.274 CCCCOCCNCCCCCNC(=O)C 2230a_200012022750_100000743108 [0,0,1,0,0,0|3,0,0]=4 2725 B16R0.274 CCCCOCCNCCCCCNC(=O)C 34a_200012022750_100000743108 [0,0,1,0,0,0|3,0,0]=4 2726 B16R0.274 CCCCOCCOCCCCCOC(=O)C 34a_100000210238_100000033007 [0,0,1,0,0,0|2,0,0]=3 2727 B16R0.274 CCCCOCCOCCCCCOC(=O)C 7a_100000210238_100000033007 [0,0,1,0,0,0|2,0,0]=3 2728 B16R0.274 CCCCOCCOCCOCCOC(=O)C 34a_100000210238_200000083610 [0,0,1,0,0,0|3,0,0]=4 2729 B16R0.274 CCCCOCCOCCOCCOC(=O)C 34a_100011215186_100009814007 [0,0,1,0,0,0|3,0,0]=4 2730 B16R0.274 CCCCOCCOCCOCCOC(=O)C 7a_100000210238_200000083610 [0,0,1,0,0,0|3,0,0]=4 2731 B16R0.274 CCCCOCCOCCOCCOC(=O)C 7a_100011215186_100009814007 [0,0,1,0,0,0|3,0,0]=4 2732 B16R0.274 CCCCOCCSCCCCCOC(=O)C 62a_100000033007_100000743108 [0,0,1,0,0,0|2,0,0]=3 2733 B16R0.274 CCCCOCCSCCCCCOC(=O)C 62a_100000743108_100000033007 [0,0,1,0,0,0|2,0,0]=3 2734 B16R0.274 CCCCOCCSCCOCCOC(=O)C 62a_100000743108_200000083610 [0,0,1,0,0,0|3,0,0]=4 2735 B16R0.274 CCCCOCCSCCOCCOC(=O)C 62a_200000083610_100000743108 [0,0,1,0,0,0|3,0,0]=4 2736 B16R0.274 CCCCOCNCCCCCCNC(=O)C 2230a_200011996284_100011995733 [0,0,1,0,0,0|3,0,0]=4 2737 B16R0.274 CCCCOCNCCCCCCNC(=O)C 34a_200011996284_100011995733 [0,0,1,0,0,0|3,0,0]=4 2738 B16R0.274 CCCCSCCNCCCCCOC(=O)C 2230a_100025743550_100009813381 [0,0,1,0,0,0|2,0,0]=3 2739 B16R0.274 CCCCSCCNCCOCCOC(=O)C 2230a_100025743550_200000083610 [0,0,1,0,0,0|3,0,0]=4 2740 B16R0.274 CCCCSCCOCCCCCOC(=O)C 34a_200000230436_100000033007 [0,0,1,0,0,0|2,0,0]=3 2741 B16R0.274 CCCCSCCOCCCCCOC(=O)C 7a_200000230436_100000033007 [0,0,1,0,0,0|2,0,0]=3 2742 B16R0.274 CCCCSCCOCCOCCOC(=O)C 34a_200000230436_200000083610 [0,0,1,0,0,0|3,0,0]=4 2743 B16R0.274 CCCCSCCOCCOCCOC(=O)C 7a_200000230436_200000083610 [0,0,1,0,0,0|3,0,0]=4 2744 B16R0.274 CCCOCCCCCCCCCCC(=O)N 34a_100000210258_200010167045 [0,0,1,0,0,0|2,0,0]=3 2745 B16R0.274 CCCOCCCNCCCCCOC(=O)C 2230a_100011217757_100009813381 [0,0,1,0,0,0|2,0,0]=3 2746 B16R0.274 CCCOCCCNCCCCCOC(=O)C 34a_100011217757_100000033007 [0,0,1,0,0,0|2,0,0]=3 2747 B16R0.274 CCCOCCCNCCOCCOC(=O)C 2230a_100011217757_200000083610 [0,0,1,0,0,0|3,0,0]=4 2748 B16R0.274 CCCOCCCNCCOCCOC(=O)C 34a_100011217757_200000083610 [0,0,1,0,0,0|3,0,0]=4 2749 B16R0.274 CCCOCCNCCCCCCNC(=O)C 2230a_200011996284_100011215938 [0,0,1,0,0,0|3,0,0]=4 2750 B16R0.274 CCCOCCNCCCCCCNC(=O)C 34a_200011996284_100011215938 [0,0,1,0,0,0|3,0,0]=4 2751 B16R0.274 CCCOCCOCCNCCCOC(=O)C 34a_200011904461_100000042594 [0,0,1,0,0,0|3,0,0]=4 2752 B16R0.274 CCCSCCCCCCCCCCC(=O)N 62a_100000210303_200010167045 [0,0,1,0,0,0|2,0,0]=3 2753 B16R0.274 CCCSCCCCCCCCCCC(=O)N 62a_200010167045_100000210303 [0,0,1,0,0,0|2,0,0]=3 2754 B16R0.274 CCOCCCCCCCCCOCC(=O)N 34a_100009875440_100000187820 [0,0,1,0,0,0|3,0,0]=4 2755 B16R0.274 CCOCCCCCCCCCOCC(=O)N 7a_100009875440_100000187820 [0,0,1,0,0,0|3,0,0]=4 2756 B16R0.274 CCOCCCCCCCCCOCC(=O)[O-] 34a_100009875440_100020667443 [0,0,1,0,0,0|2,0,1]=4 2757 B16R0.274 CCOCCCNCCCCCCNC(=O)C 2230a_200011996284_100012232248 [0,0,1,0,0,0|3,0,0]=4 2758 B16R0.274 CCOCCCNCCCCCCNC(=O)C 34a_200011996284_100012232248 [0,0,1,0,0,0|3,0,0]=4 2759 B16R0.274 CCOCCOCCNCCCCOC(=O)C 34a_100102712874_100000033659 [0,0,1,0,0,0|3,0,0]=4 2760 B16R0.274 CCOCCOCCOCCCCOC(=O)C 34a_100000073216_100011211534 [0,0,1,0,0,0|3,0,0]=4 2761 B16R0.274 CCOCCOCCOCCCCOC(=O)C 34a_100000210240_100000033659 [0,0,1,0,0,0|3,0,0]=4 2762 B16R0.274 CCOCCOCCOCCCCOC(=O)C 7a_100000073216_100011211534 [0,0,1,0,0,0|3,0,0]=4 2763 B16R0.274 CCOCCOCCOCCCCOC(=O)C 7a_100000210240_100000033659 [0,0,1,0,0,0|3,0,0]=4 2764 B16R0.274 CCOCCOCCSCCCCOC(=O)C 62a_100000033659_100011211534 [0,0,1,0,0,0|3,0,0]=4 2765 B16R0.274 CCOCCOCCSCCCCOC(=O)C 62a_100011211534_100000033659 [0,0,1,0,0,0|3,0,0]=4 2766 B16R0.274 CNCCCCCCCCCCCSC(=O)C 2230a_106832991635_100010140907 [0,0,1,0,0,0|1,1,0]=3 2767 B16R0.274 CNCCCCCCCCCCCSC(=O)C 34a_100102657272_100010140907 [0,0,1,0,0,0|1,1,0]=3 2768 B16R0.274 CNCCCCCCCCCCCSC(=O)C 7a_106832991635_100010140907 [0,0,1,0,0,0|1,1,0]=3 2769 B16R0.274 CNCCCCCOCCCCCOC(=O)C 34a_100000722520_100000033007 [0,0,1,0,0,0|2,0,0]=3 2770 B16R0.274 CNCCCCCOCCOCCOC(=O)C 34a_100000722520_200000083610 [0,0,1,0,0,0|3,0,0]=4 2771 B16R0.274 CNCCOCCOCCCCCOC(=O)C 34a_100000228057_100000033007 [0,0,1,0,0,0|3,0,0]=4 2772 B16R0.274 COCCCCCCCCCCCSC(=O)C 34a_100138415774_100010140907 [0,0,1,0,0,0|1,1,0]=3 2773 B16R0.274 COCCCCCCNCCCCNC(=O)C 2230a_200011368371_100011998445 [0,0,1,0,0,0|3,0,0]=4 2774 B16R0.274 COCCCCCCNCCCCNC(=O)C 34a_200011368371_100011998445 [0,0,1,0,0,0|3,0,0]=4 2775 B16R0.274 COCCCCCCOCCCCCC(=O)N 34a_100000123541_100011998445 [0,0,1,0,0,0|3,0,0]=4 2776 B16R0.274 COCCCCCCOCCCCCC(=O)N 34a_200012092642_100009817443 [0,0,1,0,0,0|3,0,0]=4 2777 B16R0.274 COCCCCCCOCCCCCC(=O)N 7a_100000123541_100011998445 [0,0,1,0,0,0|3,0,0]=4 2778 B16R0.274 COCCCCCCOCCCCCC(=O)N 7a_200012092642_100009817443 [0,0,1,0,0,0|3,0,0]=4 2779 B16R0.274 COCCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100011998445 [0,0,1,0,0,0|2,0,1]=4 2780 B16R0.274 COCCCCCCOCCCCOC(=O)C 34a_100000073216_100011998445 [0,0,1,0,0,0|2,0,0]=3 2781 B16R0.274 COCCCCCCOCCCCOC(=O)C 34a_200012092642_100000033659 [0,0,1,0,0,0|2,0,0]=3 2782 B16R0.274 COCCCCCCOCCCCOC(=O)C 7a_100000073216_100011998445 [0,0,1,0,0,0|2,0,0]=3 2783 B16R0.274 COCCCCCCOCCCCOC(=O)C 7a_200012092642_100000033659 [0,0,1,0,0,0|2,0,0]=3 2784 B16R0.274 COCCCCCCOCCCCSC(=O)C 34a_200012092642_200010402107 [0,0,1,0,0,0|2,1,0]=4 2785 B16R0.274 COCCCCCCOCCCCSC(=O)C 7a_200012092642_200010402107 [0,0,1,0,0,0|2,1,0]=4 2786 B16R0.274 COCCCCCCOCOCCOC(=O)C 34a_200012092642_100000076355 [0,0,1,0,0,0|3,0,0]=4 2787 B16R0.274 COCCCCCCSCCCCCC(=O)N 62a_100009817443_100011998445 [0,0,1,0,0,0|3,0,0]=4 2788 B16R0.274 COCCCCCCSCCCCCC(=O)N 62a_100011998445_100009817443 [0,0,1,0,0,0|3,0,0]=4 2789 B16R0.274 COCCCCCCSCCCCOC(=O)C 62a_100000033659_100011998445 [0,0,1,0,0,0|2,0,0]=3 2790 B16R0.274 COCCCCCCSCCCCOC(=O)C 62a_100011998445_100000033659 [0,0,1,0,0,0|2,0,0]=3 2791 B16R0.274 COCCCCCCSCCCCSC(=O)C 62a_100011998445_200010402107 [0,0,1,0,0,0|2,1,0]=4 2792 B16R0.274 COCCCCCCSCCCCSC(=O)C 62a_200010402107_100011998445 [0,0,1,0,0,0|2,1,0]=4 2793 B16R0.274 COCCCCCCSCOCCOC(=O)C 62a_100000076355_100011998445 [0,0,1,0,0,0|3,0,0]=4 2794 B16R0.274 COCCCCCCSCOCCOC(=O)C 62a_100011998445_100000076355 [0,0,1,0,0,0|3,0,0]=4 2795 B16R0.274 COCCCCCNCCCCCOC(=O)C 2230a_100000747528_100009813381 [0,0,1,0,0,0|2,0,0]=3 2796 B16R0.274 COCCCCCNCCCCCOC(=O)C 34a_100000747528_100000033007 [0,0,1,0,0,0|2,0,0]=3 2797 B16R0.274 COCCCCCNCCOCCOC(=O)C 2230a_100000747528_200000083610 [0,0,1,0,0,0|3,0,0]=4 2798 B16R0.274 COCCCCCNCCOCCOC(=O)C 34a_100000747528_200000083610 [0,0,1,0,0,0|3,0,0]=4 2799 B16R0.274 COCCCCNCCCCCCNC(=O)C 2230a_200011996284_100000730899 [0,0,1,0,0,0|3,0,0]=4 2800 B16R0.274 COCCCCNCCCCCCNC(=O)C 34a_200011996284_100000755781 [0,0,1,0,0,0|3,0,0]=4 2801 B16R0.274 COCCCOCCCOCCCOC(=O)C 34a_200011215475_100000042594 [0,0,1,0,0,0|3,0,0]=4 2802 B16R0.274 COCCCOCCCOCCCOC(=O)C 7a_200011215475_100000042594 [0,0,1,0,0,0|3,0,0]=4 2803 B16R0.274 COCCOCCCNCCCCOC(=O)C 34a_100000206027_100000033659 [0,0,1,0,0,0|3,0,0]=4 2804 B16R0.274 COCCOCCCOCCCCOC(=O)C 34a_100000073216_100011216529 [0,0,1,0,0,0|3,0,0]=4 2805 B16R0.274 COCCOCCCOCCCCOC(=O)C 7a_100000073216_100011216529 [0,0,1,0,0,0|3,0,0]=4 2806 B16R0.274 COCCOCCCSCCCCOC(=O)C 62a_100000033659_100011216529 [0,0,1,0,0,0|3,0,0]=4 2807 B16R0.274 COCCOCCCSCCCCOC(=O)C 62a_100011216529_100000033659 [0,0,1,0,0,0|3,0,0]=4 2808 B16R0.274 COCCOCCNCCCCCOC(=O)C 2230a_100000745349_100009813381 [0,0,1,0,0,0|3,0,0]=4 2809 B16R0.274 COCCOCCNCCCCCOC(=O)C 34a_100000745349_100000033007 [0,0,1,0,0,0|3,0,0]=4 2810 B16R0.274 COCCOCCOCCCCCOC(=O)C 34a_100011215163_100000033007 [0,0,1,0,0,0|3,0,0]=4 2811 B16R0.274 COCCOCCOCCCCCOC(=O)C 7a_100011215163_100000033007 [0,0,1,0,0,0|3,0,0]=4 2812 B16R0.274 COCCOCCSCCCCCOC(=O)C 62a_100000033007_100000695917 [0,0,1,0,0,0|3,0,0]=4 2813 B16R0.274 COCCOCCSCCCCCOC(=O)C 62a_100000695917_100000033007 [0,0,1,0,0,0|3,0,0]=4 2814 B16R0.274 COCSCCCCCCCCCCC(=O)N 62a_100000766300_200010167045 [0,0,1,0,0,0|3,0,0]=4 2815 B16R0.274 COCSCCCCCCCCCCC(=O)N 62a_200010167045_100000766300 [0,0,1,0,0,0|3,0,0]=4 2816 B16R0.274 CSCCCCCCCCCCCSC(=O)C 62a_100010140907_200000210301 [0,0,1,0,0,0|1,1,0]=3 2817 B16R0.274 CSCCCCCCCCCCCSC(=O)C 62a_200000210301_100010140907 [0,0,1,0,0,0|1,1,0]=3 2818 B16R0.274 CSCSCCCCCCCCCCC(=O)N 62a_100011218213_200010167045 [0,0,1,0,0,0|3,0,0]=4 2819 B16R0.274 CSCSCCCCCCCCCCC(=O)N 62a_200010167045_100011218213 [0,0,1,0,0,0|3,0,0]=4 2820 B16R0.274 NC(=O)CCCCCCCCCCNCCF 34a_100000724931_200010167045 [0,0,1,0,0,0|3,0,0]=4 2821 B16R0.274 NC(=O)CCCCCCCCCCNCCO 2230a_100016997473_200010167045 [0,0,1,0,0,0|3,0,0]=4 2822 B16R0.274 NC(=O)CCCCCCCCCCNCCO 34a_100016990907_200010167045 [0,0,1,0,0,0|3,0,0]=4 2823 B16R0.274 NC(=O)CCCCCCCCCCOCCBr 34a_100000211926_200010167045 [0,0,1,0,0,0|3,0,0]=4 2824 B16R0.274 NC(=O)CCCCCCCCCCSCCF 62a_100011217306_200010167045 [0,0,1,0,0,0|3,0,0]=4 2825 B16R0.274 NC(=O)CCCCCCCCCCSCCF 62a_200010167045_100011217306 [0,0,1,0,0,0|3,0,0]=4 2826 B16R0.274 NC(=O)CCCCCCCCCCSCCO 62a_100000211926_200010167045 [0,0,1,0,0,0|3,0,0]=4 2827 B16R0.274 NC(=O)CCCCCCCCCCSCCO 62a_200010167045_100000211926 [0,0,1,0,0,0|3,0,0]=4 2828 B16R0.274 NC(=O)CCCCCNCCCCCCCO 2230a_100011996573_100009817443 [0,0,1,0,0,0|3,0,0]=4 2829 B16R0.274 NC(=O)CCCCCNCCCCCCCO 34a_100011996573_100009817443 [0,0,1,0,0,0|3,0,0]=4 2830 B16R0.274 NC(=O)CCCCCOCCCCCCCBr 34a_100000760002_100009817443 [0,0,1,0,0,0|3,0,0]=4 2831 B16R0.274 NC(=O)CCCCCOCCCCCCCBr 7a_100000760002_100009817443 [0,0,1,0,0,0|3,0,0]=4 2832 B16R0.274 NC(=O)CCCCCOCCCCCCCO 34a_100000123541_100000760002 [0,0,1,0,0,0|3,0,0]=4 2833 B16R0.274 NC(=O)CCCCCOCCCCCCCO 7a_100000123541_100000760002 [0,0,1,0,0,0|3,0,0]=4 2834 B16R0.274 NC(=O)CCCCCSCCCCCCCO 62a_100000760002_100009817443 [0,0,1,0,0,0|3,0,0]=4 2835 B16R0.274 NC(=O)CCCCCSCCCCCCCO 62a_100009817443_100000760002 [0,0,1,0,0,0|3,0,0]=4 2836 B16R0.274 NC(=O)CCCCNCCCCCCCCO 34a_100000696515_100000033203 [0,0,1,0,0,0|3,0,0]=4 2837 B16R0.274 NC(=O)CCCCOCCCCCCCCO 34a_100012022536_100000033203 [0,0,1,0,0,0|3,0,0]=4 2838 B16R0.274 NC(=O)CCCCOCCCCCCCCO 7a_100012022536_100000033203 [0,0,1,0,0,0|3,0,0]=4 2839 B16R0.274 NC(=O)CCCNCCCCCCCCCO 34a_100000078944_100102525003 [0,0,1,0,0,0|3,0,0]=4 2840 B16R0.274 NC(=O)CCCNCCCCCCCCCO 34a_100000739312_100009813782 [0,0,1,0,0,0|3,0,0]=4 2841 B16R0.274 NC(=O)CCCOCCCCCCCCCBr 34a_100009813782_100102525003 [0,0,1,0,0,0|3,0,0]=4 2842 B16R0.274 NC(=O)CCCOCCCCCCCCCBr 7a_100009813782_100102525003 [0,0,1,0,0,0|3,0,0]=4 2843 B16R0.274 NC(=O)CCCOCCCCCCCCCCl 34a_100009868337_100102525003 [0,0,1,0,0,0|3,0,0]=4 2844 B16R0.274 NC(=O)CCCOCCCCCCCCCCl 7a_100009868337_100102525003 [0,0,1,0,0,0|3,0,0]=4 2845 B16R0.274 NC(=O)CCCSCCCCCCCCCO 62a_100009813782_100102525003 [0,0,1,0,0,0|3,0,0]=4 2846 B16R0.274 NC(=O)CCCSCCCCCCCCCO 62a_100102525003_100009813782 [0,0,1,0,0,0|3,0,0]=4 2847 B16R0.274 NC(=O)CCNCCCCCCCCCCO 2230a_100000066964_100000744528 [0,0,1,0,0,0|3,0,0]=4 2848 B16R0.274 NC(=O)CCNCCCCCCCCCCO 34a_100000066964_100000731001 [0,0,1,0,0,0|3,0,0]=4 2849 B16R0.274 NC(=O)CCOCCCCCCCCCCBr 34a_100009813290_100000731001 [0,0,1,0,0,0|3,0,0]=4 2850 B16R0.274 NC(=O)CCOCCCCCCCCCCBr 7a_100009813290_100000744528 [0,0,1,0,0,0|3,0,0]=4 2851 B16R0.274 NC(=O)CCOCCCCCCCCCCCl 34a_200000033068_100000731001 [0,0,1,0,0,0|3,0,0]=4 2852 B16R0.274 NC(=O)CCOCCCCCCCCCCCl 7a_200000033068_100000744528 [0,0,1,0,0,0|3,0,0]=4 2853 B16R0.274 NC(=O)CCOCCCCCCCCCCO 34a_100000757172_100009813290 [0,0,1,0,0,0|3,0,0]=4 2854 B16R0.274 NC(=O)CCOCCCCCCCCCCO 7a_100000757172_100009813290 [0,0,1,0,0,0|3,0,0]=4 2855 B16R0.274 NC(=O)CCSCCCCCCCCCCO 62a_100000744528_200000033068 [0,0,1,0,0,0|3,0,0]=4 2856 B16R0.274 NC(=O)CCSCCCCCCCCCCO 62a_100009813290_100000744528 [0,0,1,0,0,0|3,0,0]=4 2857 B16R0.274 NC(=O)CNCCCCCCCCCCCO 2230a_100000711301_100009812471 [0,0,1,0,0,0|3,0,0]=4 2858 B16R0.274 NC(=O)COCCCCCCCCCCCBr 34a_100009812471_100000187820 [0,0,1,0,0,0|3,0,0]=4 2859 B16R0.274 NC(=O)COCCCCCCCCCCCBr 7a_100009812471_100000187820 [0,0,1,0,0,0|3,0,0]=4 2860 B16R0.274 NC(=O)CSCCCCCCCCCCCO 62a_100009812471_100000747473 [0,0,1,0,0,0|3,0,0]=4 2861 B16R0.274 NC(=O)OCCNCCCCCCCCCO 34a_100000078944_200011214921 [0,0,1,0,0,0|3,0,0]=4 2862 B16R0.274 NC(=O)OCCOCCCCCCCCCBr 34a_100009813782_200011214921 [0,0,1,0,0,0|3,0,0]=4 2863 B16R0.274 NC(=O)OCCOCCCCCCCCCBr 7a_100009813782_200011214921 [0,0,1,0,0,0|3,0,0]=4 2864 B16R0.274 NC(=O)OCCOCCCCCCCCCCl 34a_100009868337_200011214921 [0,0,1,0,0,0|3,0,0]=4 2865 B16R0.274 NC(=O)OCCOCCCCCCCCCCl 7a_100009868337_200011214921 [0,0,1,0,0,0|3,0,0]=4 2866 B16R0.274 NC(=O)OCCOCCCCCCCCCO 7a_100000766696_100009813782 [0,0,1,0,0,0|3,0,0]=4 2867 B16R0.274 NC(=O)OCCSCCCCCCCCCO 62a_100009813782_200011214921 [0,0,1,0,0,0|3,0,0]=4 2868 B16R0.274 NC(=O)OCCSCCCCCCCCCO 62a_200011214921_100009813782 [0,0,1,0,0,0|3,0,0]=4 2869 B16R0.274 NCCCCCCCCCCOCCC(=O)N 34a_100000066964_100000731001 [0,0,1,0,0,0|3,0,0]=4 2870 B16R0.274 NCCCCCCCCCOCCCC(=O)N 34a_100000078944_100102525003 [0,0,1,0,0,0|3,0,0]=4 2871 B16R0.274 NCCCCCCCCCOCCOC(=O)N 34a_100000078944_200011214921 [0,0,1,0,0,0|3,0,0]=4 2872 B16R0.274 NCCCCCCCOCCCCCC(=O)N 34a_100011996573_100009817443 [0,0,1,0,0,0|3,0,0]=4 2873 B16R0.274 NCCOCCCCCCCCCCC(=O)N 34a_100000210304_200010167045 [0,0,1,0,0,0|3,0,0]=4 2874 B16R0.274 O=C(O)CNCCCCCCCCCCCO 269956a_100016091260_100009812471 [0,0,1,0,0,0|2,0,0]=3 2875 B16R0.274 O=C(O)COCCNCCCCCCCCO 269956a_100000700818_100000033203 [0,0,1,0,0,0|3,0,0]=4 2876 B16R0.274 O=C(O)CONCCCCCCCCCCO 269956a_100000106656_100009813290 [0,0,1,0,0,0|3,0,0]=4 2877 B16R0.274 O=C([O-])CCCCCOCCCCCCCO 7a_100102619762_100000760002 [0,0,1,0,0,0|2,0,1]=4 2878 B16R0.274 O=C([O-])COCCCCCCCCCCCBr 34a_100009812471_100020667443 [0,0,1,0,0,0|2,0,1]=4 2879 B16R0.274 O=C([O-])CSCCCCCCCCCCCO 62a_100009812471_100020667443 [0,0,1,0,0,0|2,0,1]=4 2880 B16R0.303 C#CCCCCCCCCCCOCCCO 34a_100000054667_100000230001 [0,0,1,0,0,0|2,0,1]=4 2881 B16R0.303 C#CCCCCCCCCCCOCCCO 7a_100000054667_100011215043 [0,0,1,0,0,0|2,0,1]=4 2882 B16R0.303 C#CCCCCCCCCCOCCCC=O 7a_100000034437_200011292268 [0,0,1,0,0,0|2,0,1]=4 2883 B16R0.303 C#CCCCCCCCCCOCCCCO 34a_100000034437_100011216708 [0,0,1,0,0,0|2,0,1]=4 2884 B16R0.303 C#CCCCCCCCCCOCCCCO 7a_100000034437_100000210776 [0,0,1,0,0,0|2,0,1]=4 2885 B16R0.303 C#CCCCCCCCCOCCCCC=O 7a_100000065265_100000139335 [0,0,1,0,0,0|2,0,1]=4 2886 B16R0.303 C#CCCCCCCCCOCCCCCO 34a_100000065265_100000746330 [0,0,1,0,0,0|2,0,1]=4 2887 B16R0.303 C#CCCCCCCCCOCCCCCO 7a_100000065265_100000746330 [0,0,1,0,0,0|2,0,1]=4 2888 B16R0.303 C#CCCCCCCCNCCCCCCO 2230a_100000686447_100153394163 [0,0,1,0,0,0|2,0,1]=4 2889 B16R0.303 C#CCCCCCCCNCCCCCCO 34a_100000686447_100153394163 [0,0,1,0,0,0|2,0,1]=4 2890 B16R0.303 C#CCCCCCCCOCCCCCC=O 7a_100000054614_100000139337 [0,0,1,0,0,0|2,0,1]=4 2891 B16R0.303 C#CCCCCCCCOCCCCCCO 34a_100000054614_100000766143 [0,0,1,0,0,0|2,0,1]=4 2892 B16R0.303 C#CCCCCCCCOCCCCCCO 7a_100000054614_100000766143 [0,0,1,0,0,0|2,0,1]=4 2893 B16R0.303 C#CCCCCCCCSCCCCCC=O 62a_100000139337_100153394163 [0,0,1,0,0,0|2,0,1]=4 2894 B16R0.303 C#CCCCCCCCSCCCCCC=O 62a_100153394163_100000139337 [0,0,1,0,0,0|2,0,1]=4 2895 B16R0.303 C#CCCCCCCCSCCCCCCO 62a_100000766143_100153394163 [0,0,1,0,0,0|2,0,1]=4 2896 B16R0.303 C#CCCCCCCCSCCCCCCO 62a_100153394163_100000766143 [0,0,1,0,0,0|2,0,1]=4 2897 B16R0.303 C#CCCCCCCNCCCCCCCO 2230a_100011996573_100012276617 [0,0,1,0,0,0|2,0,1]=4 2898 B16R0.303 C#CCCCCCCNCCCCCCCO 34a_100011996573_100012276617 [0,0,1,0,0,0|2,0,1]=4 2899 B16R0.303 C#CCCCCCCOCCCCCCCO 34a_100011217361_100000760002 [0,0,1,0,0,0|2,0,1]=4 2900 B16R0.303 C#CCCCCCCOCCCCCCCO 7a_100011217361_100000760002 [0,0,1,0,0,0|2,0,1]=4 2901 B16R0.303 C#CCCCCCCSCCCCCCCO 62a_100000760002_100012276617 [0,0,1,0,0,0|2,0,1]=4 2902 B16R0.303 C#CCCCCCCSCCCCCCCO 62a_100012276617_100000760002 [0,0,1,0,0,0|2,0,1]=4 2903 B16R0.303 C#CCCCCCNCCCCCCCCO 2230a_102515433106_100012094781 [0,0,1,0,0,0|2,0,1]=4 2904 B16R0.303 C#CCCCCCNCCCCCCCCO 34a_102515433106_100012094781 [0,0,1,0,0,0|2,0,1]=4 2905 B16R0.303 C#CCCCCCOCCCCCCCCO 34a_100000766912_100000033203 [0,0,1,0,0,0|2,0,1]=4 2906 B16R0.303 C#CCCCCCOCCCCCCCCO 7a_100000766912_100000033203 [0,0,1,0,0,0|2,0,1]=4 2907 B16R0.303 C#CCCCCCSCCCCCCCCO 62a_100000033203_100012094781 [0,0,1,0,0,0|2,0,1]=4 2908 B16R0.303 C#CCCCCCSCCCCCCCCO 62a_100012094781_100000033203 [0,0,1,0,0,0|2,0,1]=4 2909 B16R0.303 C#CCCCCNCCCCCCCCCO 2230a_100000078944_100010269958 [0,0,1,0,0,0|2,0,1]=4 2910 B16R0.303 C#CCCCCNCCCCCCCCCO 2230a_100000706060_100009813782 [0,0,1,0,0,0|2,0,1]=4 2911 B16R0.303 C#CCCCCNCCCCCCCCCO 34a_100000078944_100010269958 [0,0,1,0,0,0|2,0,1]=4 2912 B16R0.303 C#CCCCCNCCCCCCCCCO 34a_100000706060_100009813782 [0,0,1,0,0,0|2,0,1]=4 2913 B16R0.303 C#CCCCCOCCCCCCCCCO 34a_100000766709_100009813782 [0,0,1,0,0,0|2,0,1]=4 2914 B16R0.303 C#CCCCCOCCCCCCCCCO 7a_100000766709_100009813782 [0,0,1,0,0,0|2,0,1]=4 2915 B16R0.303 C#CCCCCSCCCCCCCCCO 62a_100009813782_100010269958 [0,0,1,0,0,0|2,0,1]=4 2916 B16R0.303 C#CCCCCSCCCCCCCCCO 62a_100010269958_100009813782 [0,0,1,0,0,0|2,0,1]=4 2917 B16R0.303 C#CCCCNCCCCCCCCCCO 2230a_100000066964_100000731252 [0,0,1,0,0,0|2,0,1]=4 2918 B16R0.303 C#CCCCNCCCCCCCCCCO 34a_100000066964_100000695029 [0,0,1,0,0,0|2,0,1]=4 2919 B16R0.303 C#CCCCNCCCCCCCCCCO 34a_100000718082_100009813290 [0,0,1,0,0,0|2,0,1]=4 2920 B16R0.303 C#CCCCOCCCCCCCCCCO 34a_100000215630_100009813290 [0,0,1,0,0,0|2,0,1]=4 2921 B16R0.303 C#CCCCOCCCCCCCCCCO 7a_100000215630_100009813290 [0,0,1,0,0,0|2,0,1]=4 2922 B16R0.303 C#CCCCSCCCCCCCCCCO 62a_100009813290_100011215417 [0,0,1,0,0,0|2,0,1]=4 2923 B16R0.303 C#CCCCSCCCCCCCCCCO 62a_100011215417_200000033068 [0,0,1,0,0,0|2,0,1]=4 2924 B16R0.303 C#CCCNCCCCCCCCCCCO 34a_100000755551_100009812471 [0,0,1,0,0,0|2,0,1]=4 2925 B16R0.303 C#CCCOCCCCCCCCCCCO 34a_100011215631_100009812471 [0,0,1,0,0,0|2,0,1]=4 2926 B16R0.303 C#CCCSCCCCCCCCCCCO 62a_100009812471_100000688953 [0,0,1,0,0,0|2,0,1]=4 2927 B16R0.303 C#CCNCCCCCCCCCCCCO 2230a_100000066677_100000038162 [0,0,1,0,0,0|2,0,1]=4 2928 B16R0.303 C#CCNCCCCCCCCCCCCO 34a_100000066677_100000184674 [0,0,1,0,0,0|2,0,1]=4 2929 B16R0.303 C#CCNCCCCCCCCCCCCO 34a_100000212058_100009813331 [0,0,1,0,0,0|2,0,1]=4 2930 B16R0.303 C#CCOCCCCCCCCCCCCO 34a_100000210247_100009813331 [0,0,1,0,0,0|2,0,1]=4 2931 B16R0.303 C/C=C/CCOCCCCCCCCCCC 34a_100016278192_100011215454 [0,0,1,0,0,0|3,0,0]=4 2932 B16R0.303 C/C=C/CCOCCCCCCCCCCO 34a_100016278192_100009813290 [0,0,1,0,0,0|2,0,1]=4 2933 B16R0.303 C/C=C/CNCCCCCCCCCCCC 34a_100000210451_100102629194 [0,0,1,0,0,0|3,0,0]=4 2934 B16R0.303 C/C=C/COCCCCCCCCCCCC 34a_100000210810_100102629194 [0,0,1,0,0,0|3,0,0]=4 2935 B16R0.303 C/C=C/COCCCCCCCCCCCC 34a_100016270725_100000759014 [0,0,1,0,0,0|3,0,0]=4 2936 B16R0.303 C/C=C/COCCCCCCCCCCCC 7a_100000210810_100102629194 [0,0,1,0,0,0|3,0,0]=4 2937 B16R0.303 C/C=C/COCCCCCCCCCCCO 34a_100016270725_100009812471 [0,0,1,0,0,0|2,0,1]=4 2938 B16R0.303 C/C=C/CSCCCCCCCCCCCO 62a_100009812471_100102629194 [0,0,1,0,0,0|2,0,1]=4 2939 B16R0.303 C=CCCCCCCCCCCCCCNC 2230a_106832991635_102495333938 [0,0,1,0,0,0|3,0,0]=4 2940 B16R0.303 C=CCCCCCCCCCCCCCNC 34a_100102657272_102495333938 [0,0,1,0,0,0|3,0,0]=4 2941 B16R0.303 C=CCCCCCCCCCCCCCNC 7a_106832991635_102495333938 [0,0,1,0,0,0|3,0,0]=4 2942 B16R0.303 C=CCCCCCCCCCCCCCOC 34a_100138415774_102495333938 [0,0,1,0,0,0|3,0,0]=4 2943 B16R0.303 C=CCCCCCCCCCCCNCCF 34a_100000724931_102130925996 [0,0,1,0,0,0|3,0,0]=4 2944 B16R0.303 C=CCCCCCCCCCCCNCCO 2230a_100016997473_102130925996 [0,0,1,0,0,0|2,0,0]=3 2945 B16R0.303 C=CCCCCCCCCCCCNCCO 34a_100016990907_102130925996 [0,0,1,0,0,0|2,0,0]=3 2946 B16R0.303 C=CCCCCCCCCCCCOCCBr 34a_100000211926_102130925996 [0,0,1,0,0,0|3,0,0]=4 2947 B16R0.303 C=CCCCCCCCCCCCOCCC 34a_100000210258_102130925996 [0,0,1,0,0,0|3,0,0]=4 2948 B16R0.303 C=CCCCCCCCCCCCOCCN 34a_100000210304_102130925996 [0,0,1,0,0,0|3,0,0]=4 2949 B16R0.303 C=CCCCCCCCCCCCSCC=O 62a_102130925996_200015260668 [0,0,1,0,0,0|2,0,1]=4 2950 B16R0.303 C=CCCCCCCCCCCCSCC=O 62a_200015260668_102130925996 [0,0,1,0,0,0|2,0,1]=4 2951 B16R0.303 C=CCCCCCCCCCCCSCCF 62a_100011217306_102130925996 [0,0,1,0,0,0|3,0,0]=4 2952 B16R0.303 C=CCCCCCCCCCCCSCCF 62a_102130925996_100011217306 [0,0,1,0,0,0|3,0,0]=4 2953 B16R0.303 C=CCCCCCCCCCCCSCCO 62a_100000211926_102130925996 [0,0,1,0,0,0|2,0,0]=3 2954 B16R0.303 C=CCCCCCCCCCCCSCCO 62a_102130925996_100000211926 [0,0,1,0,0,0|2,0,0]=3 2955 B16R0.303 C=CCCCCCCCCCCNCCCC 2230a_100000102301_100011093070 [0,0,1,0,0,0|3,0,0]=4 2956 B16R0.303 C=CCCCCCCCCCCNCCCC 7a_106832991798_100011093070 [0,0,1,0,0,0|3,0,0]=4 2957 B16R0.303 C=CCCCCCCCCCCNCCCF 2230a_100015189416_100011093070 [0,0,1,0,0,0|3,0,0]=4 2958 B16R0.303 C=CCCCCCCCCCCNCCCF 34a_100015189416_100011093070 [0,0,1,0,0,0|3,0,0]=4 2959 B16R0.303 C=CCCCCCCCCCCOCCCBr 34a_100011217188_100011093070 [0,0,1,0,0,0|3,0,0]=4 2960 B16R0.303 C=CCCCCCCCCCCOCCCC 34a_100000210227_100011093070 [0,0,1,0,0,0|3,0,0]=4 2961 B16R0.303 C=CCCCCCCCCCCOCCCC 7a_100000210227_100011093070 [0,0,1,0,0,0|3,0,0]=4 2962 B16R0.303 C=CCCCCCCCCCCOCCCCl 34a_100000230001_100011093070 [0,0,1,0,0,0|3,0,0]=4 2963 B16R0.303 C=CCCCCCCCCCCOCCCF 34a_100000759539_100011093070 [0,0,1,0,0,0|3,0,0]=4 2964 B16R0.303 C=CCCCCCCCCCCOCCCN 34a_100000182051_100011093070 [0,0,1,0,0,0|3,0,0]=4 2965 B16R0.303 C=CCCCCCCCCCCSCCCF 62a_100011093070_100011934791 [0,0,1,0,0,0|3,0,0]=4 2966 B16R0.303 C=CCCCCCCCCCCSCCCF 62a_100011934791_100011093070 [0,0,1,0,0,0|3,0,0]=4 2967 B16R0.303 C=CCCCCCCCCCCSCCCO 62a_100011093070_100011215043 [0,0,1,0,0,0|2,0,0]=3 2968 B16R0.303 C=CCCCCCCCCCCSCCCO 62a_100011215043_100011093070 [0,0,1,0,0,0|2,0,0]=3 2969 B16R0.303 C=CCCCCCCCCCNCCCC=O 2230a_100000081888_200011292268 [0,0,1,0,0,0|2,0,1]=4 2970 B16R0.303 C=CCCCCCCCCCNCCCCC 2230a_100000081888_100000210326 [0,0,1,0,0,0|3,0,0]=4 2971 B16R0.303 C=CCCCCCCCCCNCCCCC 2230a_100000209983_100009814027 [0,0,1,0,0,0|3,0,0]=4 2972 B16R0.303 C=CCCCCCCCCCNCCCCC 34a_100000081888_100000718602 [0,0,1,0,0,0|3,0,0]=4 2973 B16R0.303 C=CCCCCCCCCCNCCCCF 2230a_100000081888_100000729493 [0,0,1,0,0,0|3,0,0]=4 2974 B16R0.303 C=CCCCCCCCCCNCCCCF 34a_100000081888_100000729493 [0,0,1,0,0,0|3,0,0]=4 2975 B16R0.303 C=CCCCCCCCCCNCCCCO 2230a_100000081888_100000210776 [0,0,1,0,0,0|2,0,0]=3 2976 B16R0.303 C=CCCCCCCCCCNCCCCO 2230a_100000750430_100009814027 [0,0,1,0,0,0|2,0,0]=3 2977 B16R0.303 C=CCCCCCCCCCNCCCCO 34a_100000081888_100011216708 [0,0,1,0,0,0|2,0,0]=3 2978 B16R0.303 C=CCCCCCCCCCNCCCCO 34a_100000750430_100009814027 [0,0,1,0,0,0|2,0,0]=3 2979 B16R0.303 C=CCCCCCCCCCOCCCC=O 7a_100000038209_200011292268 [0,0,1,0,0,0|2,0,1]=4 2980 B16R0.303 C=CCCCCCCCCCOCCCCBr 34a_100011216708_100009814027 [0,0,1,0,0,0|3,0,0]=4 2981 B16R0.303 C=CCCCCCCCCCOCCCCC 34a_100000038209_100000718602 [0,0,1,0,0,0|3,0,0]=4 2982 B16R0.303 C=CCCCCCCCCCOCCCCC 34a_100000210253_100009814027 [0,0,1,0,0,0|3,0,0]=4 2983 B16R0.303 C=CCCCCCCCCCOCCCCC 7a_100000038209_100000210326 [0,0,1,0,0,0|3,0,0]=4 2984 B16R0.303 C=CCCCCCCCCCOCCCCC 7a_100000210253_100009814027 [0,0,1,0,0,0|3,0,0]=4 2985 B16R0.303 C=CCCCCCCCCCOCCCCCl 34a_100000210776_100009814027 [0,0,1,0,0,0|3,0,0]=4 2986 B16R0.303 C=CCCCCCCCCCOCCCCCl 7a_100000210776_100009814027 [0,0,1,0,0,0|3,0,0]=4 2987 B16R0.303 C=CCCCCCCCCCOCCCCF 34a_100000038209_100000729493 [0,0,1,0,0,0|3,0,0]=4 2988 B16R0.303 C=CCCCCCCCCCOCCCCF 34a_100011995726_100009814027 [0,0,1,0,0,0|3,0,0]=4 2989 B16R0.303 C=CCCCCCCCCCOCCCCF 7a_100000038209_100000729493 [0,0,1,0,0,0|3,0,0]=4 2990 B16R0.303 C=CCCCCCCCCCOCCCCF 7a_100011995726_100009814027 [0,0,1,0,0,0|3,0,0]=4 2991 B16R0.303 C=CCCCCCCCCCOCCCCI 34a_200012148704_100009814027 [0,0,1,0,0,0|3,0,0]=4 2992 B16R0.303 C=CCCCCCCCCCOCCCCN 34a_100000750430_100009814027 [0,0,1,0,0,0|3,0,0]=4 2993 B16R0.303 C=CCCCCCCCCCOCCCCO 34a_100000038209_100011216708 [0,0,1,0,0,0|2,0,0]=3 2994 B16R0.303 C=CCCCCCCCCCOCCCCO 7a_100000038209_100000210776 [0,0,1,0,0,0|2,0,0]=3 2995 B16R0.303 C=CCCCCCCCCCSCCCC=O 62a_100009814027_200011292268 [0,0,1,0,0,0|2,0,1]=4 2996 B16R0.303 C=CCCCCCCCCCSCCCC=O 62a_200011292268_100009814027 [0,0,1,0,0,0|2,0,1]=4 2997 B16R0.303 C=CCCCCCCCCCSCCCCF 62a_100000729493_100009814027 [0,0,1,0,0,0|3,0,0]=4 2998 B16R0.303 C=CCCCCCCCCCSCCCCF 62a_100009814027_100000729493 [0,0,1,0,0,0|3,0,0]=4 2999 B16R0.303 C=CCCCCCCCCCSCCCCO 62a_100000210776_100009814027 [0,0,1,0,0,0|2,0,0]=3 3000 B16R0.303 C=CCCCCCCCCCSCCCCO 62a_100009814027_100000210776 [0,0,1,0,0,0|2,0,0]=3 3001 B16R0.303 C=CCCCCCCCCNCCCCCC 2230a_100000210581_100011933949 [0,0,1,0,0,0|3,0,0]=4 3002 B16R0.303 C=CCCCCCCCCNCCCCCO 2230a_100000762737_100011933949 [0,0,1,0,0,0|2,0,0]=3 3003 B16R0.303 C=CCCCCCCCCNCCCCCO 34a_100000762737_100011933949 [0,0,1,0,0,0|2,0,0]=3 3004 B16R0.303 C=CCCCCCCCCNCCOCCO 2230a_100000211614_100011933949 [0,0,1,0,0,0|3,0,0]=4 3005 B16R0.303 C=CCCCCCCCCNCCOCCO 34a_100000211614_100011933949 [0,0,1,0,0,0|3,0,0]=4 3006 B16R0.303 C=CCCCCCCCCNCCSCCO 2230a_100011219999_100011933949 [0,0,1,0,0,0|3,0,0]=4 3007 B16R0.303 C=CCCCCCCCCOCCCCC=O 7a_100011215194_100000139335 [0,0,1,0,0,0|2,0,1]=4 3008 B16R0.303 C=CCCCCCCCCOCCCCCBr 34a_100000746331_100011933949 [0,0,1,0,0,0|3,0,0]=4 3009 B16R0.303 C=CCCCCCCCCOCCCCCBr 7a_100000746331_100011933949 [0,0,1,0,0,0|3,0,0]=4 3010 B16R0.303 C=CCCCCCCCCOCCCCCC 34a_100000210259_100011933949 [0,0,1,0,0,0|3,0,0]=4 3011 B16R0.303 C=CCCCCCCCCOCCCCCC 34a_100011215194_100000210314 [0,0,1,0,0,0|3,0,0]=4 3012 B16R0.303 C=CCCCCCCCCOCCCCCC 7a_100000210259_100011933949 [0,0,1,0,0,0|3,0,0]=4 3013 B16R0.303 C=CCCCCCCCCOCCCCCC 7a_100011215194_100000210314 [0,0,1,0,0,0|3,0,0]=4 3014 B16R0.303 C=CCCCCCCCCOCCCCCCl 34a_100000746330_100011933949 [0,0,1,0,0,0|3,0,0]=4 3015 B16R0.303 C=CCCCCCCCCOCCCCCCl 7a_100000746330_100011933949 [0,0,1,0,0,0|3,0,0]=4 3016 B16R0.303 C=CCCCCCCCCOCCCCCF 34a_100011215194_100000729378 [0,0,1,0,0,0|3,0,0]=4 3017 B16R0.303 C=CCCCCCCCCOCCCCCF 7a_100011215194_100000729378 [0,0,1,0,0,0|3,0,0]=4 3018 B16R0.303 C=CCCCCCCCCOCCCCCI 34a_200012148887_100011933949 [0,0,1,0,0,0|3,0,0]=4 3019 B16R0.303 C=CCCCCCCCCOCCCCCI 7a_200012148887_100011933949 [0,0,1,0,0,0|3,0,0]=4 3020 B16R0.303 C=CCCCCCCCCOCCCCCN 34a_100000762737_100011933949 [0,0,1,0,0,0|3,0,0]=4 3021 B16R0.303 C=CCCCCCCCCOCCCCCO 34a_100011215194_100000746330 [0,0,1,0,0,0|2,0,0]=3 3022 B16R0.303 C=CCCCCCCCCOCCCCCO 7a_100011215194_100000746330 [0,0,1,0,0,0|2,0,0]=3 3023 B16R0.303 C=CCCCCCCCCOCCOCCO 34a_100011215194_100000692535 [0,0,1,0,0,0|3,0,0]=4 3024 B16R0.303 C=CCCCCCCCCOCCOCCO 7a_100011215194_100011215305 [0,0,1,0,0,0|3,0,0]=4 3025 B16R0.303 C=CCCCCCCCCSCCCCC=O 62a_100000139335_100011933949 [0,0,1,0,0,0|2,0,1]=4 3026 B16R0.303 C=CCCCCCCCCSCCCCC=O 62a_100011933949_100000139335 [0,0,1,0,0,0|2,0,1]=4 3027 B16R0.303 C=CCCCCCCCCSCCCCCF 62a_100000729378_100011933949 [0,0,1,0,0,0|3,0,0]=4 3028 B16R0.303 C=CCCCCCCCCSCCCCCF 62a_100011933949_100000729378 [0,0,1,0,0,0|3,0,0]=4 3029 B16R0.303 C=CCCCCCCCCSCCCCCO 62a_100000746330_100011933949 [0,0,1,0,0,0|2,0,0]=3 3030 B16R0.303 C=CCCCCCCCCSCCCCCO 62a_100011933949_100000746330 [0,0,1,0,0,0|2,0,0]=3 3031 B16R0.303 C=CCCCCCCCCSCCOCCO 62a_100011215305_100011933949 [0,0,1,0,0,0|3,0,0]=4 3032 B16R0.303 C=CCCCCCCCCSCCOCCO 62a_100011933949_100011215305 [0,0,1,0,0,0|3,0,0]=4 3033 B16R0.303 C=CCCCCCCCNCCCCCCC 2230a_100000229938_100012355270 [0,0,1,0,0,0|3,0,0]=4 3034 B16R0.303 C=CCCCCCCCNCCCCCCO 2230a_100000686447_100012355270 [0,0,1,0,0,0|2,0,0]=3 3035 B16R0.303 C=CCCCCCCCNCCCCCCO 34a_100000686447_100012355270 [0,0,1,0,0,0|2,0,0]=3 3036 B16R0.303 C=CCCCCCCCOCCCCCC=O 7a_100000730831_100000139337 [0,0,1,0,0,0|2,0,1]=4 3037 B16R0.303 C=CCCCCCCCOCCCCCCBr 34a_100011215345_100012355270 [0,0,1,0,0,0|3,0,0]=4 3038 B16R0.303 C=CCCCCCCCOCCCCCCBr 7a_100011215345_100012355270 [0,0,1,0,0,0|3,0,0]=4 3039 B16R0.303 C=CCCCCCCCOCCCCCCC 34a_100000210272_100012355270 [0,0,1,0,0,0|3,0,0]=4 3040 B16R0.303 C=CCCCCCCCOCCCCCCC 34a_100000730831_100000210614 [0,0,1,0,0,0|3,0,0]=4 3041 B16R0.303 C=CCCCCCCCOCCCCCCC 7a_100000210272_100012355270 [0,0,1,0,0,0|3,0,0]=4 3042 B16R0.303 C=CCCCCCCCOCCCCCCC 7a_100000730831_100000210614 [0,0,1,0,0,0|3,0,0]=4 3043 B16R0.303 C=CCCCCCCCOCCCCCCCl 34a_100000766143_100012355270 [0,0,1,0,0,0|3,0,0]=4 3044 B16R0.303 C=CCCCCCCCOCCCCCCCl 7a_100000766143_100012355270 [0,0,1,0,0,0|3,0,0]=4 3045 B16R0.303 C=CCCCCCCCOCCCCCCF 34a_100000730831_100015922095 [0,0,1,0,0,0|3,0,0]=4 3046 B16R0.303 C=CCCCCCCCOCCCCCCF 34a_100000732779_100012355270 [0,0,1,0,0,0|3,0,0]=4 3047 B16R0.303 C=CCCCCCCCOCCCCCCF 7a_100000730831_100015922095 [0,0,1,0,0,0|3,0,0]=4 3048 B16R0.303 C=CCCCCCCCOCCCCCCF 7a_100000732779_100012355270 [0,0,1,0,0,0|3,0,0]=4 3049 B16R0.303 C=CCCCCCCCOCCCCCCN 34a_100000686447_100012355270 [0,0,1,0,0,0|3,0,0]=4 3050 B16R0.303 C=CCCCCCCCOCCCCCCO 34a_100000730831_100000766143 [0,0,1,0,0,0|2,0,0]=3 3051 B16R0.303 C=CCCCCCCCOCCCCCCO 7a_100000730831_100000766143 [0,0,1,0,0,0|2,0,0]=3 3052 B16R0.303 C=CCCCCCCCSCCCCCC=O 62a_100000139337_100012355270 [0,0,1,0,0,0|2,0,1]=4 3053 B16R0.303 C=CCCCCCCCSCCCCCC=O 62a_100012355270_100000139337 [0,0,1,0,0,0|2,0,1]=4 3054 B16R0.303 C=CCCCCCCCSCCCCCCF 62a_100012355270_100015922095 [0,0,1,0,0,0|3,0,0]=4 3055 B16R0.303 C=CCCCCCCCSCCCCCCF 62a_100015922095_100012355270 [0,0,1,0,0,0|3,0,0]=4 3056 B16R0.303 C=CCCCCCCCSCCCCCCO 62a_100000766143_100012355270 [0,0,1,0,0,0|2,0,0]=3 3057 B16R0.303 C=CCCCCCCCSCCCCCCO 62a_100012355270_100000766143 [0,0,1,0,0,0|2,0,0]=3 3058 B16R0.303 C=CCCCCCCNCCCCCCCC 2230a_100000229939_100011215473 [0,0,1,0,0,0|3,0,0]=4 3059 B16R0.303 C=CCCCCCCNCCCCCCCC 34a_100000229939_100011215473 [0,0,1,0,0,0|3,0,0]=4 3060 B16R0.303 C=CCCCCCCNCCCCCCCO 2230a_100011996573_100011215473 [0,0,1,0,0,0|2,0,0]=3 3061 B16R0.303 C=CCCCCCCNCCCCCCCO 34a_100011996573_100011215473 [0,0,1,0,0,0|2,0,0]=3 3062 B16R0.303 C=CCCCCCCNCCCOCCCO 2230a_100011310245_100011215473 [0,0,1,0,0,0|3,0,0]=4 3063 B16R0.303 C=CCCCCCCNCCCOCCCO 34a_100011310245_100011215473 [0,0,1,0,0,0|3,0,0]=4 3064 B16R0.303 C=CCCCCCCOCCCCCCCBr 34a_100000760002_100011215473 [0,0,1,0,0,0|3,0,0]=4 3065 B16R0.303 C=CCCCCCCOCCCCCCCBr 7a_100000760002_100011215473 [0,0,1,0,0,0|3,0,0]=4 3066 B16R0.303 C=CCCCCCCOCCCCCCCC 34a_100000210232_100011215473 [0,0,1,0,0,0|3,0,0]=4 3067 B16R0.303 C=CCCCCCCOCCCCCCCC 34a_200011216477_100000210759 [0,0,1,0,0,0|3,0,0]=4 3068 B16R0.303 C=CCCCCCCOCCCCCCCC 7a_100000210232_100011215473 [0,0,1,0,0,0|3,0,0]=4 3069 B16R0.303 C=CCCCCCCOCCCCCCCC 7a_200011216477_100000210759 [0,0,1,0,0,0|3,0,0]=4 3070 B16R0.303 C=CCCCCCCOCCCCCCCN 34a_100011996573_100011215473 [0,0,1,0,0,0|3,0,0]=4 3071 B16R0.303 C=CCCCCCCOCCCCCCCO 34a_200011216477_100000760002 [0,0,1,0,0,0|2,0,0]=3 3072 B16R0.303 C=CCCCCCCOCCCCCCCO 7a_200011216477_100000760002 [0,0,1,0,0,0|2,0,0]=3 3073 B16R0.303 C=CCCCCCCSCCCCCCCO 62a_100000760002_100011215473 [0,0,1,0,0,0|2,0,0]=3 3074 B16R0.303 C=CCCCCCCSCCCCCCCO 62a_100011215473_100000760002 [0,0,1,0,0,0|2,0,0]=3 3075 B16R0.303 C=CCCCCCNCCCCCCCCC 2230a_100000212291_100000700193 [0,0,1,0,0,0|3,0,0]=4 3076 B16R0.303 C=CCCCCCNCCCCCCCCC 34a_100000212291_100000700193 [0,0,1,0,0,0|3,0,0]=4 3077 B16R0.303 C=CCCCCCNCCCCCCCCO 2230a_102515433106_100000700193 [0,0,1,0,0,0|2,0,0]=3 3078 B16R0.303 C=CCCCCCNCCCCCCCCO 34a_102515433106_100000700193 [0,0,1,0,0,0|2,0,0]=3 3079 B16R0.303 C=CCCCCCOCCCCCCCCBr 34a_100009813846_100000700193 [0,0,1,0,0,0|3,0,0]=4 3080 B16R0.303 C=CCCCCCOCCCCCCCCBr 7a_100009813846_100000700193 [0,0,1,0,0,0|3,0,0]=4 3081 B16R0.303 C=CCCCCCOCCCCCCCCC 34a_100000210712_100000700193 [0,0,1,0,0,0|3,0,0]=4 3082 B16R0.303 C=CCCCCCOCCCCCCCCC 34a_100011216702_100011214924 [0,0,1,0,0,0|3,0,0]=4 3083 B16R0.303 C=CCCCCCOCCCCCCCCC 7a_100000210712_100000700193 [0,0,1,0,0,0|3,0,0]=4 3084 B16R0.303 C=CCCCCCOCCCCCCCCC 7a_100011216702_100000210328 [0,0,1,0,0,0|3,0,0]=4 3085 B16R0.303 C=CCCCCCOCCCCCCCCCl 34a_100000033203_100000700193 [0,0,1,0,0,0|3,0,0]=4 3086 B16R0.303 C=CCCCCCOCCCCCCCCCl 7a_100000033203_100000700193 [0,0,1,0,0,0|3,0,0]=4 3087 B16R0.303 C=CCCCCCOCCCCCCCCN 34a_102515433106_100000700193 [0,0,1,0,0,0|3,0,0]=4 3088 B16R0.303 C=CCCCCCOCCCCCCCCO 34a_100011216702_100000033203 [0,0,1,0,0,0|2,0,0]=3 3089 B16R0.303 C=CCCCCCOCCCCCCCCO 7a_100011216702_100000033203 [0,0,1,0,0,0|2,0,0]=3 3090 B16R0.303 C=CCCCCCSCCCCCCCCO 62a_100000033203_100000700193 [0,0,1,0,0,0|2,0,0]=3 3091 B16R0.303 C=CCCCCCSCCCCCCCCO 62a_100000700193_100000033203 [0,0,1,0,0,0|2,0,0]=3 3092 B16R0.303 C=CCCCCNCCCCCCCCCC 2230a_100000684558_100011215482 [0,0,1,0,0,0|3,0,0]=4 3093 B16R0.303 C=CCCCCNCCCCCCCCCC 2230a_100000703577_100000210320 [0,0,1,0,0,0|3,0,0]=4 3094 B16R0.303 C=CCCCCNCCCCCCCCCC 34a_100000684558_100011215482 [0,0,1,0,0,0|3,0,0]=4 3095 B16R0.303 C=CCCCCNCCCCCCCCCC 34a_100000703577_100000210320 [0,0,1,0,0,0|3,0,0]=4 3096 B16R0.303 C=CCCCCNCCCCCCCCCO 2230a_100000078944_100011215482 [0,0,1,0,0,0|2,0,0]=3 3097 B16R0.303 C=CCCCCNCCCCCCCCCO 2230a_100000703577_100009813782 [0,0,1,0,0,0|2,0,0]=3 3098 B16R0.303 C=CCCCCNCCCCCCCCCO 34a_100000078944_100011215482 [0,0,1,0,0,0|2,0,0]=3 3099 B16R0.303 C=CCCCCNCCCCCCCCCO 34a_100000703577_100009813782 [0,0,1,0,0,0|2,0,0]=3 3100 B16R0.303 C=CCCCCOCCCCCCCCCBr 34a_100009813782_100011215482 [0,0,1,0,0,0|3,0,0]=4 3101 B16R0.303 C=CCCCCOCCCCCCCCCBr 7a_100009813782_100011215482 [0,0,1,0,0,0|3,0,0]=4 3102 B16R0.303 C=CCCCCOCCCCCCCCCC 34a_100000210711_100011215482 [0,0,1,0,0,0|3,0,0]=4 3103 B16R0.303 C=CCCCCOCCCCCCCCCC 34a_100000766645_100000210320 [0,0,1,0,0,0|3,0,0]=4 3104 B16R0.303 C=CCCCCOCCCCCCCCCC 7a_100000210711_100011215482 [0,0,1,0,0,0|3,0,0]=4 3105 B16R0.303 C=CCCCCOCCCCCCCCCC 7a_100000766645_100000210320 [0,0,1,0,0,0|3,0,0]=4 3106 B16R0.303 C=CCCCCOCCCCCCCCCCl 34a_100009868337_100011215482 [0,0,1,0,0,0|3,0,0]=4 3107 B16R0.303 C=CCCCCOCCCCCCCCCCl 7a_100009868337_100011215482 [0,0,1,0,0,0|3,0,0]=4 3108 B16R0.303 C=CCCCCOCCCCCCCCCN 34a_100000078944_100011215482 [0,0,1,0,0,0|3,0,0]=4 3109 B16R0.303 C=CCCCCOCCCCCCCCCO 34a_100000766645_100009813782 [0,0,1,0,0,0|2,0,0]=3 3110 B16R0.303 C=CCCCCOCCCCCCCCCO 7a_100000766645_100009813782 [0,0,1,0,0,0|2,0,0]=3 3111 B16R0.303 C=CCCCCSCCCCCCCCCO 62a_100009813782_100011215482 [0,0,1,0,0,0|2,0,0]=3 3112 B16R0.303 C=CCCCCSCCCCCCCCCO 62a_100011215482_100009813782 [0,0,1,0,0,0|2,0,0]=3 3113 B16R0.303 C=CCCCNCCCCCCCCCCC 2230a_100000700776_100011215454 [0,0,1,0,0,0|3,0,0]=4 3114 B16R0.303 C=CCCCNCCCCCCCCCCC 2230a_200011215754_100011713584 [0,0,1,0,0,0|3,0,0]=4 3115 B16R0.303 C=CCCCNCCCCCCCCCCC 34a_100000700776_100011215454 [0,0,1,0,0,0|3,0,0]=4 3116 B16R0.303 C=CCCCNCCCCCCCCCCC 34a_200011215754_100000757094 [0,0,1,0,0,0|3,0,0]=4 3117 B16R0.303 C=CCCCNCCCCCCCCCCO 2230a_100000066964_100011713584 [0,0,1,0,0,0|2,0,0]=3 3118 B16R0.303 C=CCCCNCCCCCCCCCCO 2230a_100000700776_100009813290 [0,0,1,0,0,0|2,0,0]=3 3119 B16R0.303 C=CCCCNCCCCCCCCCCO 34a_100000066964_100000757094 [0,0,1,0,0,0|2,0,0]=3 3120 B16R0.303 C=CCCCNCCCCCCCCCCO 34a_100000700776_100009813290 [0,0,1,0,0,0|2,0,0]=3 3121 B16R0.303 C=CCCCOCCCCCCCCCCBr 34a_100009813290_100000757094 [0,0,1,0,0,0|3,0,0]=4 3122 B16R0.303 C=CCCCOCCCCCCCCCCBr 7a_100009813290_100000757094 [0,0,1,0,0,0|3,0,0]=4 3123 B16R0.303 C=CCCCOCCCCCCCCCCC 34a_100000210809_100000757094 [0,0,1,0,0,0|3,0,0]=4 3124 B16R0.303 C=CCCCOCCCCCCCCCCC 34a_100000758997_100011215454 [0,0,1,0,0,0|3,0,0]=4 3125 B16R0.303 C=CCCCOCCCCCCCCCCC 7a_100000210809_100000757094 [0,0,1,0,0,0|3,0,0]=4 3126 B16R0.303 C=CCCCOCCCCCCCCCCC 7a_100000758997_100011215454 [0,0,1,0,0,0|3,0,0]=4 3127 B16R0.303 C=CCCCOCCCCCCCCCCCl 34a_200000033068_100000757094 [0,0,1,0,0,0|3,0,0]=4 3128 B16R0.303 C=CCCCOCCCCCCCCCCCl 7a_200000033068_100000757094 [0,0,1,0,0,0|3,0,0]=4 3129 B16R0.303 C=CCCCOCCCCCCCCCCN 34a_100000066964_100000757094 [0,0,1,0,0,0|3,0,0]=4 3130 B16R0.303 C=CCCCOCCCCCCCCCCO 34a_100000758997_100009813290 [0,0,1,0,0,0|2,0,0]=3 3131 B16R0.303 C=CCCCOCCCCCCCCCCO 7a_100000758997_100009813290 [0,0,1,0,0,0|2,0,0]=3 3132 B16R0.303 C=CCCCSCCCCCCCCCCO 62a_100009813290_100000757094 [0,0,1,0,0,0|2,0,0]=3 3133 B16R0.303 C=CCCCSCCCCCCCCCCO 62a_100011713584_200000033068 [0,0,1,0,0,0|2,0,0]=3 3134 B16R0.303 C=CCCNCCCCCCCCCCCC 2230a_100000210451_100000754431 [0,0,1,0,0,0|3,0,0]=4 3135 B16R0.303 C=CCCNCCCCCCCCCCCC 2230a_100015191253_100011215052 [0,0,1,0,0,0|3,0,0]=4 3136 B16R0.303 C=CCCNCCCCCCCCCCCC 270004a_100015191253_100011218549 [0,0,1,0,0,0|3,0,0]=4 3137 B16R0.303 C=CCCNCCCCCCCCCCCC 34a_100000210451_100000754431 [0,0,1,0,0,0|3,0,0]=4 3138 B16R0.303 C=CCCNCCCCCCCCCCCO 2230a_100015191253_100009812471 [0,0,1,0,0,0|2,0,0]=3 3139 B16R0.303 C=CCCOCCCCCCCCCCCBr 34a_100009812471_100000754431 [0,0,1,0,0,0|3,0,0]=4 3140 B16R0.303 C=CCCOCCCCCCCCCCCBr 7a_100009812471_100000754431 [0,0,1,0,0,0|3,0,0]=4 3141 B16R0.303 C=CCCOCCCCCCCCCCCC 34a_100000210810_100000754431 [0,0,1,0,0,0|3,0,0]=4 3142 B16R0.303 C=CCCOCCCCCCCCCCCC 34a_100011205117_100000759014 [0,0,1,0,0,0|3,0,0]=4 3143 B16R0.303 C=CCCOCCCCCCCCCCCC 7a_100000210810_100000754431 [0,0,1,0,0,0|3,0,0]=4 3144 B16R0.303 C=CCCOCCCCCCCCCCCO 34a_100011205117_100009812471 [0,0,1,0,0,0|2,0,0]=3 3145 B16R0.303 C=CCCSCCCCCCCCCCCO 62a_100009812471_100000754431 [0,0,1,0,0,0|2,0,0]=3 3146 B16R0.303 C=CCNCCCCCCCCCCCCC 2230a_100011215765_100000210623 [0,0,1,0,0,0|3,0,0]=4 3147 B16R0.303 C=CCNCCCCCCCCCCCCC 2230a_100020586998_100000210684 [0,0,1,0,0,0|3,0,0]=4 3148 B16R0.303 C=CCNCCCCCCCCCCCCC 270004a_100020586998_200011215488 [0,0,1,0,0,0|3,0,0]=4 3149 B16R0.303 C=CCNCCCCCCCCCCCCC 34a_100011215765_100015514636 [0,0,1,0,0,0|3,0,0]=4 3150 B16R0.303 C=CCNCCCCCCCCCCCCO 2230a_100000066677_100000210623 [0,0,1,0,0,0|2,0,0]=3 3151 B16R0.303 C=CCNCCCCCCCCCCCCO 2230a_100020586998_100009813331 [0,0,1,0,0,0|2,0,0]=3 3152 B16R0.303 C=CCNCCCCCCCCCCCCO 34a_100000066677_100015514636 [0,0,1,0,0,0|2,0,0]=3 3153 B16R0.303 C=CCNCCCCCCOCCCCCO 2230a_100020586998_200132310570 [0,0,1,0,0,0|3,0,0]=4 3154 B16R0.303 C=CCOCCCCCCCCCCCCBr 34a_100009813331_100015514636 [0,0,1,0,0,0|3,0,0]=4 3155 B16R0.303 C=CCOCCCCCCCCCCCCBr 7a_100009813331_100015514636 [0,0,1,0,0,0|3,0,0]=4 3156 B16R0.303 C=CCOCCCCCCCCCCCCC 34a_100000185773_100015514636 [0,0,1,0,0,0|3,0,0]=4 3157 B16R0.303 C=CCOCCCCCCCCCCCCC 34a_200000210373_100000210684 [0,0,1,0,0,0|3,0,0]=4 3158 B16R0.303 C=CCOCCCCCCCCCCCCC 7a_100000185773_100015514636 [0,0,1,0,0,0|3,0,0]=4 3159 B16R0.303 C=CCOCCCCCCCCCCCCN 34a_100000066677_100015514636 [0,0,1,0,0,0|3,0,0]=4 3160 B16R0.303 C=CCOCCCCCCCCCCCCO 34a_200000210373_100009813331 [0,0,1,0,0,0|2,0,0]=3 3161 B16R0.303 C=CCOCCCCCCOCCCCCO 34a_200000210373_200132310570 [0,0,1,0,0,0|3,0,0]=4 3162 B16R0.303 C=CCOCCOCCCCCCCCCO 34a_100000037705_100009813782 [0,0,1,0,0,0|3,0,0]=4 3163 B16R0.303 C=CCOCCOCCCCCCCCCO 7a_100000037705_100009813782 [0,0,1,0,0,0|3,0,0]=4 3164 B16R0.303 C=CCSCCCCCCCCCCCCO 62a_100009813331_100000210623 [0,0,1,0,0,0|2,0,0]=3 3165 B16R0.303 C=CCSCCCCCCOCCCCCO 62a_100000210623_200132310570 [0,0,1,0,0,0|3,0,0]=4 3166 B16R0.303 C=CCSCCCCCCOCCCCCO 62a_200132310570_100000210623 [0,0,1,0,0,0|3,0,0]=4 3167 B16R0.303 C=COCCCCOCCCCCCCCC 34a_100000031558_100011214924 [0,0,1,0,0,0|2,0,0]=3 3168 B16R0.303 C=COCCCCOCCCCCCCCC 7a_100000031558_100000210328 [0,0,1,0,0,0|2,0,0]=3 3169 B16R0.303 C=COCCCCOCCCCCCCCO 34a_100000031558_100000033203 [0,0,1,0,0,0|3,0,0]=4 3170 B16R0.303 C=COCCCCOCCCCCCCCO 7a_100000031558_100000033203 [0,0,1,0,0,0|3,0,0]=4 3171 B16R0.303 C=COCCCNCCCCCCCCCC 2230a_100000210767_100000210320 [0,0,1,0,0,0|2,0,0]=3 3172 B16R0.303 C=COCCCNCCCCCCCCCC 34a_100000210767_100000210320 [0,0,1,0,0,0|2,0,0]=3 3173 B16R0.303 C=COCCCNCCCCCCCCCO 2230a_100000210767_100009813782 [0,0,1,0,0,0|3,0,0]=4 3174 B16R0.303 C=COCCCNCCCCCCCCCO 34a_100000210767_100009813782 [0,0,1,0,0,0|3,0,0]=4 3175 B16R0.303 C=COCCNCCCCCCCCCCC 2230a_200011215754_100000039644 [0,0,1,0,0,0|2,0,0]=3 3176 B16R0.303 C=COCCNCCCCCCCCCCC 34a_200011215754_100000039644 [0,0,1,0,0,0|2,0,0]=3 3177 B16R0.303 C=COCCNCCCCCCCCCCO 2230a_100000066964_100000039644 [0,0,1,0,0,0|3,0,0]=4 3178 B16R0.303 C=COCCNCCCCCCCCCCO 34a_100000066964_100000039644 [0,0,1,0,0,0|3,0,0]=4 3179 B16R0.303 C=COCCOCCCCCCCCCCBr 34a_100009813290_100000039644 [0,0,1,0,0,0|3,0,0]=4 3180 B16R0.303 C=COCCOCCCCCCCCCCBr 7a_100009813290_100000039644 [0,0,1,0,0,0|3,0,0]=4 3181 B16R0.303 C=COCCOCCCCCCCCCCC 34a_100000033082_100011215454 [0,0,1,0,0,0|2,0,0]=3 3182 B16R0.303 C=COCCOCCCCCCCCCCC 34a_100000210809_100000039644 [0,0,1,0,0,0|2,0,0]=3 3183 B16R0.303 C=COCCOCCCCCCCCCCC 7a_100000210809_100000039644 [0,0,1,0,0,0|2,0,0]=3 3184 B16R0.303 C=COCCOCCCCCCCCCCCl 34a_200000033068_100000039644 [0,0,1,0,0,0|3,0,0]=4 3185 B16R0.303 C=COCCOCCCCCCCCCCCl 7a_200000033068_100000039644 [0,0,1,0,0,0|3,0,0]=4 3186 B16R0.303 C=COCCOCCCCCCCCCCN 34a_100000066964_100000039644 [0,0,1,0,0,0|3,0,0]=4 3187 B16R0.303 C=COCCOCCCCCCCCCCO 34a_100000033082_100009813290 [0,0,1,0,0,0|3,0,0]=4 3188 B16R0.303 C=COCCOCCOCCCCCCCC 34a_100000039918_100000210759 [0,0,1,0,0,0|3,0,0]=4 3189 B16R0.303 C=COCCOCCOCCCCCCCC 7a_100000039918_100000210759 [0,0,1,0,0,0|3,0,0]=4 3190 B16R0.303 C=COCCSCCCCCCCCCCC 62a_100000039644_100011215454 [0,0,1,0,0,0|2,0,0]=3 3191 B16R0.303 C=COCCSCCCCCCCCCCO 62a_100000039644_200000033068 [0,0,1,0,0,0|3,0,0]=4 3192 B16R0.303 C=COCCSCCCCCCCCCCO 62a_100009813290_100000039644 [0,0,1,0,0,0|3,0,0]=4 3193 B16R0.303 CC=CCCCOCCCCCCCCCC 34a_100020645299_100000210320 [0,0,1,0,0,0|3,0,0]=4 3194 B16R0.303 CC=CCCCOCCCCCCCCCO 34a_100020645299_100009813782 [0,0,1,0,0,0|2,0,1]=4 3195 B16R0.303 CC=CCNCCCCCCCCCCCC 2230a_100000210451_100000070051 [0,0,1,0,0,0|3,0,0]=4 3196 B16R0.303 CC=CCNCCCCCCCCCCCC 34a_100000210451_100000070051 [0,0,1,0,0,0|3,0,0]=4 3197 B16R0.303 CC=CCOCCCCCCCCCCCC 34a_100000210810_100000070051 [0,0,1,0,0,0|3,0,0]=4 3198 B16R0.303 CC=CCOCCCCCCCCCCCC 7a_100000210810_100000070051 [0,0,1,0,0,0|3,0,0]=4 3199 B16R0.303 CC=CCSCCCCCCCCCCCO 62a_100009812471_100000070051 [0,0,1,0,0,0|2,0,1]=4 3200 B16R0.303 CCCCCCCCCCCCCCCNC 2230a_106832991635_100000210322 [0,0,1,0,0,0|3,0,0]=4 3201 B16R0.303 CCCCCCCCCCCCCCCNC 2230a_200000297553_200000210301 [0,0,1,0,0,0|3,0,0]=4 3202 B16R0.303 CCCCCCCCCCCCCCCNC 270004a_106832991635_100012088177 [0,0,1,0,0,0|3,0,0]=4 3203 B16R0.303 CCCCCCCCCCCCCCCNC 34a_100102657272_100000210322 [0,0,1,0,0,0|3,0,0]=4 3204 B16R0.303 CCCCCCCCCCCCCCCNC 34a_200000297553_200000210301 [0,0,1,0,0,0|3,0,0]=4 3205 B16R0.303 CCCCCCCCCCCCCCCNC 7a_106832991635_100000210322 [0,0,1,0,0,0|3,0,0]=4 3206 B16R0.303 CCCCCCCCCCCCCCCN[13CH3] 2230a_200000297553_200025704644 [0,0,1,0,0,0|3,0,0]=4 3207 B16R0.303 CCCCCCCCCCCCCCCN[13CH3] 34a_200000297553_200025704644 [0,0,1,0,0,0|3,0,0]=4 3208 B16R0.303 CCCCCCCCCCCCCCCOC 34a_100000272386_200000210301 [0,0,1,0,0,0|3,0,0]=4 3209 B16R0.303 CCCCCCCCCCCCCCCOC 34a_100138415774_100000210322 [0,0,1,0,0,0|3,0,0]=4 3210 B16R0.303 CCCCCCCCCCCCCCCOC 7a_100000272386_200000210301 [0,0,1,0,0,0|3,0,0]=4 3211 B16R0.303 CCCCCCCCCCCCCCCO[13CH3] 34a_100000272386_200025704644 [0,0,1,0,0,0|3,0,0]=4 3212 B16R0.303 CCCCCCCCCCCCCCCO[13CH3] 7a_100000272386_200025704644 [0,0,1,0,0,0|3,0,0]=4 3213 B16R0.303 CCCCCCCCCCCCCCNCC 2230a_100011217771_100000210202 [0,0,1,0,0,0|2,0,1]=4 3214 B16R0.303 CCCCCCCCCCCCCCNCC 2230a_100015525214_100011215471 [0,0,1,0,0,0|2,0,1]=4 3215 B16R0.303 CCCCCCCCCCCCCCNCC 270004a_100015525214_200011216147 [0,0,1,0,0,0|2,0,1]=4 3216 B16R0.303 CCCCCCCCCCCCCCNCC 34a_100011217771_100000210202 [0,0,1,0,0,0|2,0,1]=4 3217 B16R0.303 CCCCCCCCCCCCCCNCF 34a_100011217771_100015361967 [0,0,1,0,0,0|2,0,1]=4 3218 B16R0.303 CCCCCCCCCCCCCCOCC 34a_100000210739_100000210202 [0,0,1,0,0,0|1,0,1]=3 3219 B16R0.303 CCCCCCCCCCCCCCOCC 34a_100121572206_100011215471 [0,0,1,0,0,0|1,0,1]=3 3220 B16R0.303 CCCCCCCCCCCCCCOCC 7a_100000210739_100000210202 [0,0,1,0,0,0|1,0,1]=3 3221 B16R0.303 CCCCCCCCCCCCCCOCF 34a_100000210739_100015361967 [0,0,1,0,0,0|1,0,1]=3 3222 B16R0.303 CCCCCCCCCCCCCCOCF 7a_100000210739_100015361967 [0,0,1,0,0,0|1,0,1]=3 3223 B16R0.303 CCCCCCCCCCCCCNCC=O 2230a_100011215765_200015260668 [0,0,1,0,0,0|2,0,0]=3 3224 B16R0.303 CCCCCCCCCCCCCNCC=O 34a_100011215765_200009817547 [0,0,1,0,0,0|2,0,0]=3 3225 B16R0.303 CCCCCCCCCCCCCNCCO 2230a_100011215765_100000211926 [0,0,1,0,0,0|2,0,1]=4 3226 B16R0.303 CCCCCCCCCCCCCNCCO 2230a_100016997473_100000210684 [0,0,1,0,0,0|2,0,1]=4 3227 B16R0.303 CCCCCCCCCCCCCNCCO 270004a_100000210304_200011215488 [0,0,1,0,0,0|2,0,1]=4 3228 B16R0.303 CCCCCCCCCCCCCNCCO 34a_100011215765_100000211926 [0,0,1,0,0,0|2,0,1]=4 3229 B16R0.303 CCCCCCCCCCCCCNCCO 34a_100016990907_100000210684 [0,0,1,0,0,0|2,0,1]=4 3230 B16R0.303 CCCCCCCCCCCCCOCC=O 34a_100000185773_200009817547 [0,0,1,0,0,0|2,0,0]=3 3231 B16R0.303 CCCCCCCCCCCCCOCC=O 7a_100000185773_200015260668 [0,0,1,0,0,0|2,0,0]=3 3232 B16R0.303 CCCCCCCCCCCCCOCCO 34a_100000185773_100000211926 [0,0,1,0,0,0|2,0,1]=4 3233 B16R0.303 CCCCCCCCCCCCCOCCO 7a_100000185773_100000211926 [0,0,1,0,0,0|2,0,1]=4 3234 B16R0.303 CCCCCCCCCCCCCSCC=O 62a_200015260668_100011934334 [0,0,1,0,0,0|2,0,0]=3 3235 B16R0.303 CCCCCCCCCCCCCSCCO 62a_100000211926_100011934334 [0,0,1,0,0,0|2,0,1]=4 3236 B16R0.303 CCCCCCCCCCCCNCCCO 2230a_100000210451_100000230001 [0,0,1,0,0,0|2,0,1]=4 3237 B16R0.303 CCCCCCCCCCCCNCCCO 270004a_100000182051_100011218549 [0,0,1,0,0,0|2,0,1]=4 3238 B16R0.303 CCCCCCCCCCCCNCCCO 34a_100000210451_100000230001 [0,0,1,0,0,0|2,0,1]=4 3239 B16R0.303 CCCCCCCCCCCCOCCCO 34a_100000210810_100000230001 [0,0,1,0,0,0|2,0,1]=4 3240 B16R0.303 CCCCCCCCCCCCOCCCO 7a_100000210810_100011215043 [0,0,1,0,0,0|2,0,1]=4 3241 B16R0.303 CCCCCCCCCCCCSCCCO 62a_100011215043_100000759014 [0,0,1,0,0,0|2,0,1]=4 3242 B16R0.303 CCCCCCCCCCCCSCOCC 62a_100000739092_100000759014 [0,0,1,0,0,0|2,0,1]=4 3243 B16R0.303 CCCCCCCCCCCNCCCC=O 2230a_200011215754_200011292268 [0,0,1,0,0,0|2,0,0]=3 3244 B16R0.303 CCCCCCCCCCCNCCCCO 2230a_100000750430_100011215454 [0,0,1,0,0,0|2,0,1]=4 3245 B16R0.303 CCCCCCCCCCCNCCCCO 2230a_200011215754_100000210776 [0,0,1,0,0,0|2,0,1]=4 3246 B16R0.303 CCCCCCCCCCCNCCCCO 34a_100000750430_100011215454 [0,0,1,0,0,0|2,0,1]=4 3247 B16R0.303 CCCCCCCCCCCNCCCCO 34a_200011215754_100011216708 [0,0,1,0,0,0|2,0,1]=4 3248 B16R0.303 CCCCCCCCCCCNCCOCC 2230a_102516460346_100011215454 [0,0,1,0,0,0|2,0,1]=4 3249 B16R0.303 CCCCCCCCCCCNCCOCC 2230a_200011215754_100011215890 [0,0,1,0,0,0|2,0,1]=4 3250 B16R0.303 CCCCCCCCCCCNCCOCC 34a_102516460346_100011215454 [0,0,1,0,0,0|2,0,1]=4 3251 B16R0.303 CCCCCCCCCCCNCCOCC 34a_200011215754_100000210147 [0,0,1,0,0,0|2,0,1]=4 3252 B16R0.303 CCCCCCCCCCCOCCCC=O 7a_100000210809_200011292268 [0,0,1,0,0,0|2,0,0]=3 3253 B16R0.303 CCCCCCCCCCCOCCCCO 34a_100000210809_100011216708 [0,0,1,0,0,0|2,0,1]=4 3254 B16R0.303 CCCCCCCCCCCOCCCCO 7a_100000210809_100000210776 [0,0,1,0,0,0|2,0,1]=4 3255 B16R0.303 CCCCCCCCCCCOCCOCC 34a_100000210136_100011215454 [0,0,1,0,0,0|2,0,1]=4 3256 B16R0.303 CCCCCCCCCCCOCCOCC 34a_100000210809_100000210147 [0,0,1,0,0,0|2,0,1]=4 3257 B16R0.303 CCCCCCCCCCCOCCOCC 34a_100010166600_100000210202 [0,0,1,0,0,0|2,0,1]=4 3258 B16R0.303 CCCCCCCCCCCOCCOCC 7a_100000210136_100011215454 [0,0,1,0,0,0|2,0,1]=4 3259 B16R0.303 CCCCCCCCCCCOCCOCC 7a_100000210809_100011215890 [0,0,1,0,0,0|2,0,1]=4 3260 B16R0.303 CCCCCCCCCCCOCCOCC 7a_100010166600_100000210202 [0,0,1,0,0,0|2,0,1]=4 3261 B16R0.303 CCCCCCCCCCCOCCOCF 34a_100010166600_100015361967 [0,0,1,0,0,0|2,0,1]=4 3262 B16R0.303 CCCCCCCCCCCOCCOCF 7a_100010166600_100015361967 [0,0,1,0,0,0|2,0,1]=4 3263 B16R0.303 CCCCCCCCCCCSCCCC=O 62a_200011292268_100011215454 [0,0,1,0,0,0|2,0,0]=3 3264 B16R0.303 CCCCCCCCCCCSCCCCO 62a_100000210776_100011215454 [0,0,1,0,0,0|2,0,1]=4 3265 B16R0.303 CCCCCCCCCCCSCCOCC 62a_100000210147_100011215454 [0,0,1,0,0,0|2,0,1]=4 3266 B16R0.303 CCCCCCCCCCNCCCCC=O 2230a_100000684558_100000139335 [0,0,1,0,0,0|2,0,0]=3 3267 B16R0.303 CCCCCCCCCCNCCCCCO 2230a_100000684558_100000746330 [0,0,1,0,0,0|2,0,1]=4 3268 B16R0.303 CCCCCCCCCCNCCCCCO 2230a_100000762737_100000210320 [0,0,1,0,0,0|2,0,1]=4 3269 B16R0.303 CCCCCCCCCCNCCCCCO 34a_100000684558_100000746330 [0,0,1,0,0,0|2,0,1]=4 3270 B16R0.303 CCCCCCCCCCNCCCCCO 34a_100000762737_100000210320 [0,0,1,0,0,0|2,0,1]=4 3271 B16R0.303 CCCCCCCCCCNCCCOCC 2230a_100000210961_100000210320 [0,0,1,0,0,0|2,0,1]=4 3272 B16R0.303 CCCCCCCCCCNCCCOCC 2230a_100000684558_100012232248 [0,0,1,0,0,0|2,0,1]=4 3273 B16R0.303 CCCCCCCCCCNCCCOCC 34a_100000210961_100000210320 [0,0,1,0,0,0|2,0,1]=4 3274 B16R0.303 CCCCCCCCCCNCCCOCC 34a_100000684558_100012232248 [0,0,1,0,0,0|2,0,1]=4 3275 B16R0.303 CCCCCCCCCCOCCCCC=O 7a_100000210711_100000139335 [0,0,1,0,0,0|2,0,0]=3 3276 B16R0.303 CCCCCCCCCCOCCCCCO 34a_100000210711_100000746330 [0,0,1,0,0,0|2,0,1]=4 3277 B16R0.303 CCCCCCCCCCOCCCCCO 7a_100000210711_100000746330 [0,0,1,0,0,0|2,0,1]=4 3278 B16R0.303 CCCCCCCCCCOCCCOCC 34a_100000210711_100012232248 [0,0,1,0,0,0|2,0,1]=4 3279 B16R0.303 CCCCCCCCCCOCCCOCC 34a_100000757476_100000210320 [0,0,1,0,0,0|2,0,1]=4 3280 B16R0.303 CCCCCCCCCCOCCCOCC 7a_100000210711_100012232248 [0,0,1,0,0,0|2,0,1]=4 3281 B16R0.303 CCCCCCCCCCOCCCOCC 7a_100000757476_100000210320 [0,0,1,0,0,0|2,0,1]=4 3282 B16R0.303 CCCCCCCCCCSCCCCC=O 62a_100000139335_100000210320 [0,0,1,0,0,0|2,0,0]=3 3283 B16R0.303 CCCCCCCCCCSCCCCCO 62a_100000746330_100000210320 [0,0,1,0,0,0|2,0,1]=4 3284 B16R0.303 CCCCCCCCCCSCCCOCC 62a_100012232248_100000210320 [0,0,1,0,0,0|2,0,1]=4 3285 B16R0.303 CCCCCCCCCCSCCOCC=O 34a_100011628728_200009817547 [0,0,1,0,0,0|3,0,0]=4 3286 B16R0.303 CCCCCCCCCCSCCOCC=O 7a_100011628728_200015260668 [0,0,1,0,0,0|3,0,0]=4 3287 B16R0.303 CCCCCCCCCNCCCCCC=O 2230a_100000212291_100000139337 [0,0,1,0,0,0|2,0,0]=3 3288 B16R0.303 CCCCCCCCCNCCCCCCO 2230a_100000212291_100000766143 [0,0,1,0,0,0|2,0,1]=4 3289 B16R0.303 CCCCCCCCCNCCCCCCO 2230a_100000686447_100011214924 [0,0,1,0,0,0|2,0,1]=4 3290 B16R0.303 CCCCCCCCCNCCCCCCO 34a_100000212291_100000766143 [0,0,1,0,0,0|2,0,1]=4 3291 B16R0.303 CCCCCCCCCNCCCCCCO 34a_100000686447_100011214924 [0,0,1,0,0,0|2,0,1]=4 3292 B16R0.303 CCCCCCCCCOCCCCCC=O 7a_100000210712_100000139337 [0,0,1,0,0,0|2,0,0]=3 3293 B16R0.303 CCCCCCCCCOCCCCCCO 34a_100000210712_100000766143 [0,0,1,0,0,0|2,0,1]=4 3294 B16R0.303 CCCCCCCCCOCCCCCCO 7a_100000210712_100000766143 [0,0,1,0,0,0|2,0,1]=4 3295 B16R0.303 CCCCCCCCCSCCCCCC=O 62a_100000139337_100000210670 [0,0,1,0,0,0|2,0,0]=3 3296 B16R0.303 CCCCCCCCCSCCCCCCO 62a_100000766143_100000210670 [0,0,1,0,0,0|2,0,1]=4 3297 B16R0.303 CCCCCCCCNCCCCCCCO 2230a_100000229939_100000760002 [0,0,1,0,0,0|2,0,1]=4 3298 B16R0.303 CCCCCCCCNCCCCCCCO 2230a_100011996573_100000210759 [0,0,1,0,0,0|2,0,1]=4 3299 B16R0.303 CCCCCCCCNCCCCCCCO 34a_100000229939_100000760002 [0,0,1,0,0,0|2,0,1]=4 3300 B16R0.303 CCCCCCCCNCCCCCCCO 34a_100011996573_100000210759 [0,0,1,0,0,0|2,0,1]=4 3301 B16R0.303 CCCCCCCCOCCCCCCCO 34a_100000210232_100000760002 [0,0,1,0,0,0|2,0,1]=4 3302 B16R0.303 CCCCCCCCOCCCCCCCO 7a_100000210232_100000760002 [0,0,1,0,0,0|2,0,1]=4 3303 B16R0.303 CCCCCCCCSCCCCCCCO 62a_100000210759_100000760002 [0,0,1,0,0,0|2,0,1]=4 3304 B16R0.303 CCCCCCCCSCCCCCCCO 62a_100000760002_100000210317 [0,0,1,0,0,0|2,0,1]=4 3305 B16R0.303 CCCCCCCNCCCCCCCCO 2230a_100000229938_100000033203 [0,0,1,0,0,0|2,0,1]=4 3306 B16R0.303 CCCCCCCNCCCCCCCCO 2230a_102515433106_100000210681 [0,0,1,0,0,0|2,0,1]=4 3307 B16R0.303 CCCCCCCNCCCCCCCCO 34a_102515433106_100000210614 [0,0,1,0,0,0|2,0,1]=4 3308 B16R0.303 CCCCCCCOCCCCCCCCO 34a_100000210272_100000033203 [0,0,1,0,0,0|2,0,1]=4 3309 B16R0.303 CCCCCCCOCCCCCCCCO 7a_100000210272_100000033203 [0,0,1,0,0,0|2,0,1]=4 3310 B16R0.303 CCCCCCCSCCCCCCCCO 62a_100000033203_100000210316 [0,0,1,0,0,0|2,0,1]=4 3311 B16R0.303 CCCCCCCSCCCCCCCCO 62a_100000210614_100000033203 [0,0,1,0,0,0|2,0,1]=4 3312 B16R0.303 CCCCCCNCCCCCCCCCO 2230a_100000078944_100000210314 [0,0,1,0,0,0|2,0,1]=4 3313 B16R0.303 CCCCCCNCCCCCCCCCO 2230a_100000210581_100009813782 [0,0,1,0,0,0|2,0,1]=4 3314 B16R0.303 CCCCCCNCCCCCCCCCO 34a_100000078944_100000210314 [0,0,1,0,0,0|2,0,1]=4 3315 B16R0.303 CCCCCCOCCCCCCCCCO 34a_100000210259_100009813782 [0,0,1,0,0,0|2,0,1]=4 3316 B16R0.303 CCCCCCOCCCCCCCCCO 7a_100000210259_100009813782 [0,0,1,0,0,0|2,0,1]=4 3317 B16R0.303 CCCCCCOCCOCCCCCC=O 7a_100000691444_100000139337 [0,0,1,0,0,0|3,0,0]=4 3318 B16R0.303 CCCCCCSCCCCCCCCCO 62a_100000210314_100009813782 [0,0,1,0,0,0|2,0,1]=4 3319 B16R0.303 CCCCCCSCCCCCCCCCO 62a_100009813782_100000210757 [0,0,1,0,0,0|2,0,1]=4 3320 B16R0.303 CCCCCNCCCCCCCCCCO 2230a_100000066964_100000210326 [0,0,1,0,0,0|2,0,1]=4 3321 B16R0.303 CCCCCNCCCCCCCCCCO 2230a_100000209983_100009813290 [0,0,1,0,0,0|2,0,1]=4 3322 B16R0.303 CCCCCNCCCCCCCCCCO 34a_100000066964_100000718602 [0,0,1,0,0,0|2,0,1]=4 3323 B16R0.303 CCCCCOCCCCCCCCCCO 34a_100000210253_100009813290 [0,0,1,0,0,0|2,0,1]=4 3324 B16R0.303 CCCCCOCCCCCCCCCCO 7a_100000210253_100009813290 [0,0,1,0,0,0|2,0,1]=4 3325 B16R0.303 CCCCCSCCCCCCCCCCO 62a_100000210326_200000033068 [0,0,1,0,0,0|2,0,1]=4 3326 B16R0.303 CCCCCSCCCCCCCCCCO 62a_100009813290_100000210326 [0,0,1,0,0,0|2,0,1]=4 3327 B16R0.303 CCCCNCCCCCCCCCCCO 2230a_100000102301_100009812471 [0,0,1,0,0,0|2,0,1]=4 3328 B16R0.303 CCCCNCCCCCCCCCCCO 7a_106832991798_100009812471 [0,0,1,0,0,0|2,0,1]=4 3329 B16R0.303 CCCCOCCCCCCCCCCCO 34a_100000210227_100009812471 [0,0,1,0,0,0|2,0,1]=4 3330 B16R0.303 CCCCOCCCCCCCCCCCO 7a_100000210227_100009812471 [0,0,1,0,0,0|2,0,1]=4 3331 B16R0.303 CCCCOCCCCCCCCCOCC 34a_100009875440_100000210210 [0,0,1,0,0,0|2,0,1]=4 3332 B16R0.303 CCCCOCCCCCCCCCOCC 7a_100009875440_100000210211 [0,0,1,0,0,0|2,0,1]=4 3333 B16R0.303 CCCCOCCCCOCCCCCC=O 7a_200000760531_100000139337 [0,0,1,0,0,0|3,0,0]=4 3334 B16R0.303 CCCCSCCCCCCCCCCCO 62a_100009812471_100000210210 [0,0,1,0,0,0|2,0,1]=4 3335 B16R0.303 CCCNCCCCCCCCCCCCO 2230a_100000066677_100000210303 [0,0,1,0,0,0|2,0,1]=4 3336 B16R0.303 CCCNCCCCCCCCCCCCO 34a_100000066677_100000210303 [0,0,1,0,0,0|2,0,1]=4 3337 B16R0.303 CCCOCCCCCCCCCCCCO 34a_100000210258_100009813331 [0,0,1,0,0,0|2,0,1]=4 3338 B16R0.303 CCCSCCCCCCCCCCCCO 62a_100009813331_100000210303 [0,0,1,0,0,0|2,0,1]=4 3339 B16R0.303 CCNCCCCCCCCCCCCCO 2230a_100015525214_100009812470 [0,0,1,0,0,0|2,0,1]=4 3340 B16R0.303 CCOCCCCCCCCCCCCCBr 34a_100009812470_100000210202 [0,0,1,0,0,0|2,0,1]=4 3341 B16R0.303 CCOCCCCCCCCCCCCCBr 7a_100009812470_100000210202 [0,0,1,0,0,0|2,0,1]=4 3342 B16R0.303 CCOCCCCCCCCCCCCCO 34a_100121572206_100009812470 [0,0,1,0,0,0|2,0,1]=4 3343 B16R0.303 CCSCCCCCCCCCCCCCO 62a_100009812470_100000210202 [0,0,1,0,0,0|2,0,1]=4 3344 B16R0.303 CNCCCCCCCCCCCCCCO 2230a_106832991635_100009828009 [0,0,1,0,0,0|2,0,0]=3 3345 B16R0.303 CNCCCCCCCCCCCCCCO 34a_100102657272_100009828009 [0,0,1,0,0,0|2,0,0]=3 3346 B16R0.303 CNCCCCCCCCCCCCCCO 7a_106832991635_100009828009 [0,0,1,0,0,0|2,0,0]=3 3347 B16R0.303 CNCCCCCOCCCCCCCCO 34a_100000722520_100000033203 [0,0,1,0,0,0|3,0,0]=4 3348 B16R0.303 CNCCCOCCCCCCCCCCO 34a_100000213112_100009813290 [0,0,1,0,0,0|3,0,0]=4 3349 B16R0.303 COCCCCCCCCCCCCCCBr 34a_100009828009_200000210301 [0,0,1,0,0,0|3,0,0]=4 3350 B16R0.303 COCCCCCCCCCCCCCCBr 7a_100009828009_200000210301 [0,0,1,0,0,0|3,0,0]=4 3351 B16R0.303 COCCCCCCCCCCCCCCO 34a_100138415774_100009828009 [0,0,1,0,0,0|2,0,0]=3 3352 B16R0.303 COCCCCCCNCCCCCCCO 2230a_100011996573_100011998445 [0,0,1,0,0,0|3,0,0]=4 3353 B16R0.303 COCCCCCCNCCCCCCCO 34a_100011996573_100011998445 [0,0,1,0,0,0|3,0,0]=4 3354 B16R0.303 COCCCCCCOCCCCCCCO 34a_200012092642_100000760002 [0,0,1,0,0,0|3,0,0]=4 3355 B16R0.303 COCCCCCCOCCCCCCCO 7a_200012092642_100000760002 [0,0,1,0,0,0|3,0,0]=4 3356 B16R0.303 COCCCCCCSCCCCCCCO 62a_100000760002_100011998445 [0,0,1,0,0,0|3,0,0]=4 3357 B16R0.303 COCCCCCCSCCCCCCCO 62a_100011998445_100000760002 [0,0,1,0,0,0|3,0,0]=4 3358 B16R0.303 COCCCCCNCCCCCCCCO 2230a_100000747528_100000033203 [0,0,1,0,0,0|3,0,0]=4 3359 B16R0.303 COCCCCCNCCCCCCCCO 34a_100000747528_100000033203 [0,0,1,0,0,0|3,0,0]=4 3360 B16R0.303 COCCCCNCCCCCCCCCO 2230a_100000078944_100000730899 [0,0,1,0,0,0|3,0,0]=4 3361 B16R0.303 COCCCCNCCCCCCCCCO 34a_100000078944_100000755781 [0,0,1,0,0,0|3,0,0]=4 3362 B16R0.303 COCCCCOCCCCCCCCCO 34a_100000740925_100009813782 [0,0,1,0,0,0|3,0,0]=4 3363 B16R0.303 COCCCCSCCCCCCCCCO 62a_100000730899_100009813782 [0,0,1,0,0,0|3,0,0]=4 3364 B16R0.303 COCCCCSCCCCCCCCCO 62a_100009813782_100000730899 [0,0,1,0,0,0|3,0,0]=4 3365 B16R0.303 COCCCNCCCCCCCCCCO 2230a_100000066964_100000740836 [0,0,1,0,0,0|3,0,0]=4 3366 B16R0.303 COCCCNCCCCCCCCCCO 34a_100000066964_100000740836 [0,0,1,0,0,0|3,0,0]=4 3367 B16R0.303 COCCCNCCCCCCCCCCO 34a_100150723488_100009813290 [0,0,1,0,0,0|3,0,0]=4 3368 B16R0.303 COCCCOCCCCCCCCCCO 34a_100000740835_100009813290 [0,0,1,0,0,0|3,0,0]=4 3369 B16R0.303 COCCCSCCCCCCCCCCO 62a_100000709357_200000033068 [0,0,1,0,0,0|3,0,0]=4 3370 B16R0.303 COCCCSCCCCCCCCCCO 62a_100009813290_100000709357 [0,0,1,0,0,0|3,0,0]=4 3371 B16R0.303 COCCNCCCCCCCCCCCO 2230a_100000209980_100009812471 [0,0,1,0,0,0|3,0,0]=4 3372 B16R0.303 COCCOCCCCCCCCCCCO 34a_100000210237_100009812471 [0,0,1,0,0,0|3,0,0]=4 3373 B16R0.303 COCCSCCCCCCCCCCCO 62a_100009812471_100000233755 [0,0,1,0,0,0|3,0,0]=4 3374 B16R0.303 COCNCCCCCCCCCCCCO 2230a_100000066677_100000766300 [0,0,1,0,0,0|3,0,0]=4 3375 B16R0.303 COCSCCCCCCCCCCCCO 62a_100009813331_100000766300 [0,0,1,0,0,0|3,0,0]=4 3376 B16R0.303 CSCCCCOCCCCCCCCCO 34a_100011217163_100009813782 [0,0,1,0,0,0|3,0,0]=4 3377 B16R0.303 CSCCCCOCCCCCCCCCO 7a_100011217163_100009813782 [0,0,1,0,0,0|3,0,0]=4 3378 B16R0.303 CSCCCNCCCCCCCCCCO 2230a_100000749238_100009813290 [0,0,1,0,0,0|3,0,0]=4 3379 B16R0.303 CSCCCOCCCCCCCCCCO 34a_100000690336_100009813290 [0,0,1,0,0,0|3,0,0]=4 3380 B16R0.303 CSCCCOCCCCCCCCCCO 7a_100000690336_100009813290 [0,0,1,0,0,0|3,0,0]=4 3381 B16R0.303 CSCCNCCCCCCCCCCCO 2230a_100020590264_100009812471 [0,0,1,0,0,0|3,0,0]=4 3382 B16R0.303 CSCCOCCCCCCCCCCCO 34a_100000230434_100009812471 [0,0,1,0,0,0|3,0,0]=4 3383 B16R0.303 CSCCOCCCCCCCCCCCO 7a_100000230434_100009812471 [0,0,1,0,0,0|3,0,0]=4 3384 B16R0.303 CSCCSCCCCCCCCCCCO 62a_100009812471_100000751147 [0,0,1,0,0,0|3,0,0]=4 3385 B16R0.303 CSCNCCCCCCCCCCCCO 2230a_100000066677_100011218213 [0,0,1,0,0,0|3,0,0]=4 3386 B16R0.303 CSCNCCCCCCCCCCCCO 34a_100000066677_100011218213 [0,0,1,0,0,0|3,0,0]=4 3387 B16R0.303 CSCSCCCCCCCCCCCCO 62a_100009813331_100011218213 [0,0,1,0,0,0|3,0,0]=4 3388 B16R0.303 FCOCCCCCCCCCCCCCBr 34a_100009812470_100015361967 [0,0,1,0,0,0|2,0,1]=4 3389 B16R0.303 FCOCCCCCCCCCCCCCBr 7a_100009812470_100015361967 [0,0,1,0,0,0|2,0,1]=4 3390 B16R0.303 N#CCCCCCCNCCCCCCCO 2230a_100011996573_100009813337 [0,0,1,0,0,0|2,0,1]=4 3391 B16R0.303 N#CCCCCCCSCCCCCCCO 62a_100000760002_100009813337 [0,0,1,0,0,0|2,0,1]=4 3392 B16R0.303 N#CCCCCCCSCCCCCCCO 62a_100009813337_100000760002 [0,0,1,0,0,0|2,0,1]=4 3393 B16R0.303 N#CCCCCCNCCCCCCCCO 2230a_102515433106_100009813376 [0,0,1,0,0,0|2,0,1]=4 3394 B16R0.303 N#CCCCCCSCCCCCCCCO 62a_100000033203_100009813376 [0,0,1,0,0,0|2,0,1]=4 3395 B16R0.303 N#CCCCCCSCCCCCCCCO 62a_100009813376_100000033203 [0,0,1,0,0,0|2,0,1]=4 3396 B16R0.303 N#CCCCCNCCCCCCCCCO 2230a_100000078944_100000211819 [0,0,1,0,0,0|2,0,1]=4 3397 B16R0.303 N#CCCCCSCCCCCCCCCO 62a_100009813782_100000211819 [0,0,1,0,0,0|2,0,1]=4 3398 B16R0.303 N#CCCCCSCCCCCCCCCO 62a_100011219923_100009813782 [0,0,1,0,0,0|2,0,1]=4 3399 B16R0.303 N#CCCCNCCCCCCCCCCO 2230a_100000066964_100000687738 [0,0,1,0,0,0|2,0,1]=4 3400 B16R0.303 N#CCCCSCCCCCCCCCCO 62a_100000687738_200000033068 [0,0,1,0,0,0|2,0,1]=4 3401 B16R0.303 N#CCCCSCCCCCCCCCCO 62a_100009813290_100000687738 [0,0,1,0,0,0|2,0,1]=4 3402 B16R0.303 N#CCCSCCCCCCCCCCCO 62a_100009812471_100011215226 [0,0,1,0,0,0|2,0,1]=4 3403 B16R0.303 N#CCNCCCCCCCCCCCCO 2230a_100000066677_100011215382 [0,0,1,0,0,0|2,0,1]=4 3404 B16R0.303 N#CCSCCCCCCCCCCCCO 62a_100009813331_100011215382 [0,0,1,0,0,0|2,0,1]=4 3405 B16R0.303 NCCCCCCCCCCCCOCC=O 34a_100000066677_200009817547 [0,0,1,0,0,0|2,0,0]=3 3406 B16R0.303 NCCCCCCCCCCCCOCCO 34a_100000066677_100000211926 [0,0,1,0,0,0|2,0,1]=4 3407 B16R0.303 NCCCCCCCCCCOCCCCO 34a_100000066964_100011216708 [0,0,1,0,0,0|2,0,1]=4 3408 B16R0.303 NCCCCCCCCCOCCCCCO 34a_100000078944_100000746330 [0,0,1,0,0,0|2,0,1]=4 3409 B16R0.303 NCCCCCCCCOCCCCCCO 34a_102515433106_100000766143 [0,0,1,0,0,0|2,0,1]=4 3410 B16R0.303 NCCCCCCCOCCCCCCCO 34a_100011996573_100000760002 [0,0,1,0,0,0|2,0,1]=4 3411 B16R0.303 NCCCCCCOCCCCCCCCO 34a_100000686447_100000033203 [0,0,1,0,0,0|2,0,1]=4 3412 B16R0.303 NCCCCCOCCCCCCCCCO 34a_100000762737_100009813782 [0,0,1,0,0,0|2,0,1]=4 3413 B16R0.303 NCCCCOCCCCCCCCCCO 34a_100000750430_100009813290 [0,0,1,0,0,0|2,0,1]=4 3414 B16R0.303 NCCCOCCCCCCCCCCCO 34a_100000182051_100009812471 [0,0,1,0,0,0|2,0,1]=4 3415 B16R0.303 NCCOCCCCCCCCCCCCO 34a_100000210304_100009813331 [0,0,1,0,0,0|2,0,1]=4 3416 B16R0.303 NOCCOCCCCCCCCCCCO 34a_100000700252_100009812471 [0,0,1,0,0,0|3,0,0]=4 3417 B16R0.303 O=CCCCCCNCCCCCCCCO 2230a_102515433106_100000139337 [0,0,1,0,0,0|1,0,0]=2 3418 B16R0.303 O=CCCCCCNCCOCCOCCO 2230a_100011998139_100000139337 [0,0,1,0,0,0|3,0,0]=4 3419 B16R0.303 O=CCCCCCOCCCCCCCCBr 7a_100009813846_100000139337 [0,0,1,0,0,0|2,0,0]=3 3420 B16R0.303 O=CCCCCCOCCCCCCCCCl 7a_100000033203_100000139337 [0,0,1,0,0,0|2,0,0]=3 3421 B16R0.303 O=CCCCCCSCCCCCCCCO 62a_100000033203_100000139337 [0,0,1,0,0,0|1,0,0]=2 3422 B16R0.303 O=CCCCCCSCCCCCCCCO 62a_100000139337_100000033203 [0,0,1,0,0,0|1,0,0]=2 3423 B16R0.303 O=CCCCCCSCCOCCOCCO 62a_100000032323_100000139337 [0,0,1,0,0,0|3,0,0]=4 3424 B16R0.303 O=CCCCCCSCCOCCOCCO 62a_100000139337_100000032323 [0,0,1,0,0,0|3,0,0]=4 3425 B16R0.303 O=CCCCCNCCCCCCCCCO 2230a_100000078944_100000139335 [0,0,1,0,0,0|1,0,0]=2 3426 B16R0.303 O=CCCCCNCCCOCCOCCO 2230a_100011996194_100000139335 [0,0,1,0,0,0|3,0,0]=4 3427 B16R0.303 O=CCCCCOCCCCCCCCCBr 7a_100009813782_100000139335 [0,0,1,0,0,0|2,0,0]=3 3428 B16R0.303 O=CCCCCOCCCCCCCCCCl 7a_100009868337_100000139335 [0,0,1,0,0,0|2,0,0]=3 3429 B16R0.303 O=CCCCCSCCCCCCCCCO 62a_100000139335_100009813782 [0,0,1,0,0,0|1,0,0]=2 3430 B16R0.303 O=CCCCCSCCCCCCCCCO 62a_100009813782_100000139335 [0,0,1,0,0,0|1,0,0]=2 3431 B16R0.303 O=CCCCNCCCCCCCCCCO 2230a_100000066964_200011292268 [0,0,1,0,0,0|1,0,0]=2 3432 B16R0.303 O=CCCCOCCCCCCCCCCBr 7a_100009813290_200011292268 [0,0,1,0,0,0|2,0,0]=3 3433 B16R0.303 O=CCCCOCCCCCCCCCCCl 7a_200000033068_200011292268 [0,0,1,0,0,0|2,0,0]=3 3434 B16R0.303 O=CCCCSCCCCCCCCCCO 62a_100009813290_200011292268 [0,0,1,0,0,0|1,0,0]=2 3435 B16R0.303 O=CCCCSCCCCCCCCCCO 62a_200011292268_200000033068 [0,0,1,0,0,0|1,0,0]=2 3436 B16R0.303 O=CCNCCCCCCCCCCCCO 2230a_100000066677_200015260668 [0,0,1,0,0,0|1,0,0]=2 3437 B16R0.303 O=CCNCCCCCCCCCCCCO 34a_100000066677_200009817547 [0,0,1,0,0,0|1,0,0]=2 3438 B16R0.303 O=CCOCCCCCCCCCCCCBr 34a_100009813331_200009817547 [0,0,1,0,0,0|2,0,0]=3 3439 B16R0.303 O=CCOCCCCCCCCCCCCBr 7a_100009813331_200015260668 [0,0,1,0,0,0|2,0,0]=3 3440 B16R0.303 O=CCOCCCCCOCCCCCCCl 34a_200132310570_200009817547 [0,0,1,0,0,0|3,0,0]=4 3441 B16R0.303 O=CCOCCCCCOCCCCCCCl 7a_200132310570_200015260668 [0,0,1,0,0,0|3,0,0]=4 3442 B16R0.303 O=CCSCCCCCCCCCCCCO 62a_100009813331_200015260668 [0,0,1,0,0,0|1,0,0]=2 3443 B16R0.303 O=CCSCCCCCCOCCCCCO 62a_200015260668_200132310570 [0,0,1,0,0,0|2,0,0]=3 3444 B16R0.303 O=CCSCCCCCCOCCCCCO 62a_200132310570_200015260668 [0,0,1,0,0,0|2,0,0]=3 3445 B16R0.303 OCCCCCCCCCCCCCSCF 62a_100009812470_100015361967 [0,0,1,0,0,0|2,0,1]=4 3446 B16R0.303 OCCCCCCCCCCCCNCCF 2230a_100000066677_100011217306 [0,0,1,0,0,0|2,0,1]=4 3447 B16R0.303 OCCCCCCCCCCCCNCCF 34a_100000066677_100011217306 [0,0,1,0,0,0|2,0,1]=4 3448 B16R0.303 OCCCCCCCCCCCCNCCF 34a_100000724931_100009813331 [0,0,1,0,0,0|2,0,1]=4 3449 B16R0.303 OCCCCCCCCCCCCNCCO 2230a_100000066677_100000211926 [0,0,1,0,0,0|1,0,2]=4 3450 B16R0.303 OCCCCCCCCCCCCNCCO 2230a_100016997473_100009813331 [0,0,1,0,0,0|1,0,2]=4 3451 B16R0.303 OCCCCCCCCCCCCNCCO 34a_100000066677_100000211926 [0,0,1,0,0,0|1,0,2]=4 3452 B16R0.303 OCCCCCCCCCCCCNCCO 34a_100016990907_100009813331 [0,0,1,0,0,0|1,0,2]=4 3453 B16R0.303 OCCCCCCCCCCCCOCCBr 34a_100000211926_100009813331 [0,0,1,0,0,0|2,0,1]=4 3454 B16R0.303 OCCCCCCCCCCCCSCCF 62a_100009813331_100011217306 [0,0,1,0,0,0|2,0,1]=4 3455 B16R0.303 OCCCCCCCCCCCCSCCO 62a_100009813331_100000211926 [0,0,1,0,0,0|1,0,2]=4 3456 B16R0.303 OCCCCCCCCCCCNCCCF 2230a_100015189416_100009812471 [0,0,1,0,0,0|2,0,1]=4 3457 B16R0.303 OCCCCCCCCCCCNCCCF 34a_100015189416_100009812471 [0,0,1,0,0,0|2,0,1]=4 3458 B16R0.303 OCCCCCCCCCCCOCCCBr 34a_100011217188_100009812471 [0,0,1,0,0,0|2,0,1]=4 3459 B16R0.303 OCCCCCCCCCCCOCCCCl 34a_100000230001_100009812471 [0,0,1,0,0,0|2,0,1]=4 3460 B16R0.303 OCCCCCCCCCCCOCCCF 34a_100000759539_100009812471 [0,0,1,0,0,0|2,0,1]=4 3461 B16R0.303 OCCCCCCCCCCCSCCCF 62a_100009812471_100011934791 [0,0,1,0,0,0|2,0,1]=4 3462 B16R0.303 OCCCCCCCCCCCSCCCO 62a_100009812471_100011215043 [0,0,1,0,0,0|1,0,2]=4 3463 B16R0.303 OCCCCCCCCCCNCCCCF 2230a_100000066964_100000729493 [0,0,1,0,0,0|2,0,1]=4 3464 B16R0.303 OCCCCCCCCCCNCCCCF 34a_100000066964_100000729493 [0,0,1,0,0,0|2,0,1]=4 3465 B16R0.303 OCCCCCCCCCCNCCCCO 2230a_100000066964_100000210776 [0,0,1,0,0,0|1,0,2]=4 3466 B16R0.303 OCCCCCCCCCCNCCCCO 2230a_100000750430_100009813290 [0,0,1,0,0,0|1,0,2]=4 3467 B16R0.303 OCCCCCCCCCCNCCCCO 34a_100000066964_100011216708 [0,0,1,0,0,0|1,0,2]=4 3468 B16R0.303 OCCCCCCCCCCNCCCCO 34a_100000750430_100009813290 [0,0,1,0,0,0|1,0,2]=4 3469 B16R0.303 OCCCCCCCCCCOCCCCBr 34a_100011216708_100009813290 [0,0,1,0,0,0|2,0,1]=4 3470 B16R0.303 OCCCCCCCCCCOCCCCCl 34a_100000210776_100009813290 [0,0,1,0,0,0|2,0,1]=4 3471 B16R0.303 OCCCCCCCCCCOCCCCCl 7a_100000210776_100009813290 [0,0,1,0,0,0|2,0,1]=4 3472 B16R0.303 OCCCCCCCCCCOCCCCF 34a_100011995726_100009813290 [0,0,1,0,0,0|2,0,1]=4 3473 B16R0.303 OCCCCCCCCCCOCCCCF 7a_100011995726_100009813290 [0,0,1,0,0,0|2,0,1]=4 3474 B16R0.303 OCCCCCCCCCCOCCCCI 34a_200012148704_100009813290 [0,0,1,0,0,0|2,0,1]=4 3475 B16R0.303 OCCCCCCCCCCSCCCCF 62a_100000729493_200000033068 [0,0,1,0,0,0|2,0,1]=4 3476 B16R0.303 OCCCCCCCCCCSCCCCF 62a_100009813290_100000729493 [0,0,1,0,0,0|2,0,1]=4 3477 B16R0.303 OCCCCCCCCCCSCCCCO 62a_100000210776_200000033068 [0,0,1,0,0,0|1,0,2]=4 3478 B16R0.303 OCCCCCCCCCCSCCCCO 62a_100009813290_100000210776 [0,0,1,0,0,0|1,0,2]=4 3479 B16R0.303 OCCCCCCCCCNCCCCCF 2230a_100000078944_100000729378 [0,0,1,0,0,0|2,0,1]=4 3480 B16R0.303 OCCCCCCCCCNCCCCCF 34a_100000078944_100000729378 [0,0,1,0,0,0|2,0,1]=4 3481 B16R0.303 OCCCCCCCCCNCCCCCO 2230a_100000078944_100000746330 [0,0,1,0,0,0|1,0,2]=4 3482 B16R0.303 OCCCCCCCCCNCCCCCO 2230a_100000762737_100009813782 [0,0,1,0,0,0|1,0,2]=4 3483 B16R0.303 OCCCCCCCCCNCCCCCO 34a_100000078944_100000746330 [0,0,1,0,0,0|1,0,2]=4 3484 B16R0.303 OCCCCCCCCCNCCCCCO 34a_100000762737_100009813782 [0,0,1,0,0,0|1,0,2]=4 3485 B16R0.303 OCCCCCCCCCOCCCCCBr 34a_100000746331_100009813782 [0,0,1,0,0,0|2,0,1]=4 3486 B16R0.303 OCCCCCCCCCOCCCCCBr 7a_100000746331_100009813782 [0,0,1,0,0,0|2,0,1]=4 3487 B16R0.303 OCCCCCCCCCOCCCCCCl 34a_100000746330_100009813782 [0,0,1,0,0,0|2,0,1]=4 3488 B16R0.303 OCCCCCCCCCOCCCCCCl 7a_100000746330_100009813782 [0,0,1,0,0,0|2,0,1]=4 3489 B16R0.303 OCCCCCCCCCOCCCCCI 34a_200012148887_100009813782 [0,0,1,0,0,0|2,0,1]=4 3490 B16R0.303 OCCCCCCCCCOCCCCCI 7a_200012148887_100009813782 [0,0,1,0,0,0|2,0,1]=4 3491 B16R0.303 OCCCCCCCCCSCCCCCF 62a_100000729378_100009813782 [0,0,1,0,0,0|2,0,1]=4 3492 B16R0.303 OCCCCCCCCCSCCCCCF 62a_100009813782_100000729378 [0,0,1,0,0,0|2,0,1]=4 3493 B16R0.303 OCCCCCCCCCSCCCCCO 62a_100000746330_100009813782 [0,0,1,0,0,0|1,0,2]=4 3494 B16R0.303 OCCCCCCCCCSCCCCCO 62a_100009813782_100000746330 [0,0,1,0,0,0|1,0,2]=4 3495 B16R0.303 OCCCCCCCCNCCCCCCF 2230a_102515433106_100015922095 [0,0,1,0,0,0|2,0,1]=4 3496 B16R0.303 OCCCCCCCCNCCCCCCF 34a_102515433106_100015922095 [0,0,1,0,0,0|2,0,1]=4 3497 B16R0.303 OCCCCCCCCNCCCCCCO 2230a_100000686447_100000033203 [0,0,1,0,0,0|1,0,2]=4 3498 B16R0.303 OCCCCCCCCNCCCCCCO 2230a_102515433106_100000766143 [0,0,1,0,0,0|1,0,2]=4 3499 B16R0.303 OCCCCCCCCNCCCCCCO 34a_100000686447_100000033203 [0,0,1,0,0,0|1,0,2]=4 3500 B16R0.303 OCCCCCCCCNCCCCCCO 34a_102515433106_100000766143 [0,0,1,0,0,0|1,0,2]=4 3501 B16R0.303 OCCCCCCCCOCCCCCCBr 34a_100011215345_100000033203 [0,0,1,0,0,0|2,0,1]=4 3502 B16R0.303 OCCCCCCCCOCCCCCCBr 7a_100011215345_100000033203 [0,0,1,0,0,0|2,0,1]=4 3503 B16R0.303 OCCCCCCCCOCCCCCCCl 34a_100000766143_100000033203 [0,0,1,0,0,0|2,0,1]=4 3504 B16R0.303 OCCCCCCCCOCCCCCCCl 7a_100000766143_100000033203 [0,0,1,0,0,0|2,0,1]=4 3505 B16R0.303 OCCCCCCCCOCCCCCCF 34a_100000732779_100000033203 [0,0,1,0,0,0|2,0,1]=4 3506 B16R0.303 OCCCCCCCCOCCCCCCF 7a_100000732779_100000033203 [0,0,1,0,0,0|2,0,1]=4 3507 B16R0.303 OCCCCCCCCSCCCCCCF 62a_100000033203_100015922095 [0,0,1,0,0,0|2,0,1]=4 3508 B16R0.303 OCCCCCCCCSCCCCCCF 62a_100015922095_100000033203 [0,0,1,0,0,0|2,0,1]=4 3509 B16R0.303 OCCCCCCCCSCCCCCCO 62a_100000033203_100000766143 [0,0,1,0,0,0|1,0,2]=4 3510 B16R0.303 OCCCCCCCCSCCCCCCO 62a_100000766143_100000033203 [0,0,1,0,0,0|1,0,2]=4 3511 B16R0.303 OCCCCCCCNCCCCCCCO 2230a_100011996573_100000760002 [0,0,1,0,0,0|1,0,2]=4 3512 B16R0.303 OCCCCCCCNCCCCCCCO 34a_100011996573_100000760002 [0,0,1,0,0,0|1,0,2]=4 3513 B16R0.303 OCCCCCCCOCCCCCCCBr 34a_100000760002_100000760002 [0,0,1,0,0,0|2,0,1]=4 3514 B16R0.303 OCCCCCCCOCCCCCCCBr 7a_100000760002_100000760002 [0,0,1,0,0,0|2,0,1]=4 3515 B16R0.303 OCCCCCCCSCCCCCCCO 62a_100000760002_100000760002 [0,0,1,0,0,0|1,0,2]=4 3516 B16R0.303 OCCCCCCOCCCCCCCCBr 34a_100009813846_100000766143 [0,0,1,0,0,0|2,0,1]=4 3517 B16R0.303 OCCCCCCOCCCCCCCCBr 7a_100009813846_100000766143 [0,0,1,0,0,0|2,0,1]=4 3518 B16R0.303 OCCCCCCOCCCCCCCCCl 34a_100000033203_100000766143 [0,0,1,0,0,0|2,0,1]=4 3519 B16R0.303 OCCCCCCOCCCCCCCCCl 7a_100000033203_100000766143 [0,0,1,0,0,0|2,0,1]=4 3520 B16R0.303 OCCCCCOCCCCCCCCCBr 34a_100009813782_100000746330 [0,0,1,0,0,0|2,0,1]=4 3521 B16R0.303 OCCCCCOCCCCCCCCCBr 7a_100009813782_100000746330 [0,0,1,0,0,0|2,0,1]=4 3522 B16R0.303 OCCCCCOCCCCCCCCCCl 34a_100009868337_100000746330 [0,0,1,0,0,0|2,0,1]=4 3523 B16R0.303 OCCCCCOCCCCCCCCCCl 7a_100009868337_100000746330 [0,0,1,0,0,0|2,0,1]=4 3524 B16R0.303 OCCCCOCCCCCCCCCCBr 34a_100009813290_100011216708 [0,0,1,0,0,0|2,0,1]=4 3525 B16R0.303 OCCCCOCCCCCCCCCCBr 7a_100009813290_100000210776 [0,0,1,0,0,0|2,0,1]=4 3526 B16R0.303 OCCCCOCCCCCCCCCCCl 34a_200000033068_100011216708 [0,0,1,0,0,0|2,0,1]=4 3527 B16R0.303 OCCCCOCCCCCCCCCCCl 7a_200000033068_100000210776 [0,0,1,0,0,0|2,0,1]=4 3528 B16R0.303 OCCCOCCCCCCCCCCCBr 34a_100009812471_100000230001 [0,0,1,0,0,0|2,0,1]=4 3529 B16R0.303 OCCCOCCCCCCCCCCCBr 7a_100009812471_100011215043 [0,0,1,0,0,0|2,0,1]=4 3530 B16R0.303 OCCOCCCCCCCCCCCCBr 34a_100009813331_100000211926 [0,0,1,0,0,0|2,0,1]=4 3531 B16R0.303 OCCOCCCCCCCCCCCCBr 7a_100009813331_100000211926 [0,0,1,0,0,0|2,0,1]=4 3532 B16R0.303 [13CH3]OCCCCCCCCCCCCCCBr 34a_100009828009_200025704644 [0,0,1,0,0,0|3,0,0]=4 3533 B16R0.303 [13CH3]OCCCCCCCCCCCCCCBr 7a_100009828009_200025704644 [0,0,1,0,0,0|3,0,0]=4 3534 B16R0.661 C#CCCC(=O)CCCCCCCCCCC 1458a_100000210736_100000753159 [0,0,1,0,0,0|1,0,2]=4 3535 B16R0.661 C#CCCC(=O)CCCCCCCCCCC 1458a_100000692101_100011215454 [0,0,1,0,0,0|1,0,2]=4 3536 B16R0.661 C#CCCC(=O)NCCCCCCCCCC 11a_100000684558_100000692101 [0,0,1,0,0,0|1,0,2]=4 3537 B16R0.661 C#CCCC(=O)NCCCCCCCCCC 1626a_100000684558_100000692101 [0,0,1,0,0,0|1,0,2]=4 3538 B16R0.661 C#CCCC(=O)NCCCCCCCCCC 240690a_100000684558_100000692101 [0,0,1,0,0,0|1,0,2]=4 3539 B16R0.661 C#CCCC(=O)NCCCCCCCCCC 527a_100000684558_100000692101 [0,0,1,0,0,0|1,0,2]=4 3540 B16R0.661 C#CCCCCCCCOCC(=O)OCCC 34a_100000054614_200011215008 [0,0,1,0,0,0|1,0,2]=4 3541 B16R0.661 C#CCCCCCCCOCC(=O)OCCC 7a_100000054614_200011215008 [0,0,1,0,0,0|1,0,2]=4 3542 B16R0.661 C#CCCCCCCCSCC(=O)OCCC 62a_100153394163_200011215008 [0,0,1,0,0,0|1,0,2]=4 3543 B16R0.661 C#CCCCCCCCSCC(=O)OCCC 62a_200011215008_100153394163 [0,0,1,0,0,0|1,0,2]=4 3544 B16R0.661 C#CCNC(=O)CCCCCCCCCCC 11a_100000212058_100000210736 [0,0,1,0,0,0|1,0,2]=4 3545 B16R0.661 C#CCNC(=O)CCCCCCCCCCC 1626a_100000212058_100000210736 [0,0,1,0,0,0|1,0,2]=4 3546 B16R0.661 C#CCNC(=O)CCCCCCCCCCC 240690a_100000212058_100000210736 [0,0,1,0,0,0|1,0,2]=4 3547 B16R0.661 C/C=C/CC(=O)CCCCCCCCCCC 1458a_100000210736_100102629194 [0,0,1,0,0,0|1,0,2]=4 3548 B16R0.661 C=C(CNCCCCCCCCC)OCOC 34a_100000212291_100000042856 [0,0,1,0,0,0|3,0,0]=4 3549 B16R0.661 C=C(COCCCCCCCCC)OCOC 34a_100000210712_100000042856 [0,0,1,0,0,0|3,0,0]=4 3550 B16R0.661 C=C(CSCCCCCCCCC)OCOC 62a_100000042856_100000210670 [0,0,1,0,0,0|3,0,0]=4 3551 B16R0.661 C=CCCC(=O)CCCCCCCCCCC 1458a_100000210736_100000754431 [0,0,1,0,0,0|1,0,2]=4 3552 B16R0.661 C=CCCC(=O)CCCCCCCCCCC 1458a_100000749702_100011215454 [0,0,1,0,0,0|1,0,2]=4 3553 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 11a_100000684558_100000749702 [0,0,1,0,0,0|1,0,2]=4 3554 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 1626a_100000684558_100000749702 [0,0,1,0,0,0|1,0,2]=4 3555 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 240690a_100000684558_100000749702 [0,0,1,0,0,0|1,0,2]=4 3556 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 527a_100000684558_100000749702 [0,0,1,0,0,0|1,0,2]=4 3557 B16R0.661 C=CCCCCCCCCCC(=O)CCCC 1458a_100000210183_100009814027 [0,0,1,0,0,0|1,0,2]=4 3558 B16R0.661 C=CCCCCCCCOCC(=O)OCCC 34a_100000730831_200011215008 [0,0,1,0,0,0|1,0,2]=4 3559 B16R0.661 C=CCCCCCCCOCC(=O)OCCC 7a_100000730831_200011215008 [0,0,1,0,0,0|1,0,2]=4 3560 B16R0.661 C=CCCCCCCCSCC(=O)OCCC 62a_100012355270_200011215008 [0,0,1,0,0,0|1,0,2]=4 3561 B16R0.661 C=CCCCCCCCSCC(=O)OCCC 62a_200011215008_100012355270 [0,0,1,0,0,0|1,0,2]=4 3562 B16R0.661 C=CCNC(=O)CCCCCCCCCCC 1626a_100020586998_100000210736 [0,0,1,0,0,0|1,0,2]=4 3563 B16R0.661 C=CCNC(=O)CCCCCCCCCCC 240690a_100020586998_100000210736 [0,0,1,0,0,0|1,0,2]=4 3564 B16R0.661 C=CCOC(=O)CNCCCCCCCCC 2230a_100000212291_100000033060 [0,0,1,0,0,0|1,0,2]=4 3565 B16R0.661 C=CCOC(=O)CNCCCCCCCCC 34a_100000212291_100000033060 [0,0,1,0,0,0|1,0,2]=4 3566 B16R0.661 C=CCOC(=O)COCCCCCCCCC 34a_100000210712_100000033060 [0,0,1,0,0,0|1,0,2]=4 3567 B16R0.661 C=CCOC(=O)COCCCCCCCCC 7a_100000210712_100000033060 [0,0,1,0,0,0|1,0,2]=4 3568 B16R0.661 C=CCOC(=O)CSCCCCCCCCC 62a_100000033060_100000210670 [0,0,1,0,0,0|1,0,2]=4 3569 B16R0.661 CC#CCC(=O)CCCCCCCCCCC 1458a_100000210736_100000748600 [0,0,1,0,0,0|1,0,2]=4 3570 B16R0.661 CC/C=C\CCCCCOCC(=O)OCCC 34a_100016268722_200011215008 [0,0,1,0,0,0|1,0,2]=4 3571 B16R0.661 CC/C=C\CCCCCOCC(=O)OCCC 7a_100016268722_200011215008 [0,0,1,0,0,0|1,0,2]=4 3572 B16R0.661 CC=CCC(=O)CCCCCCCCCCC 1458a_100000210736_100000070051 [0,0,1,0,0,0|1,0,2]=4 3573 B16R0.661 CC=CCC(=O)CCCCCCCCCCC 1458a_100121576822_100011215454 [0,0,1,0,0,0|1,0,2]=4 3574 B16R0.661 CC=CCC(=O)NCCCCCCCCCC 11a_100000684558_100121576822 [0,0,1,0,0,0|1,0,2]=4 3575 B16R0.661 CC=CCC(=O)NCCCCCCCCCC 1626a_100000684558_100121576822 [0,0,1,0,0,0|1,0,2]=4 3576 B16R0.661 CC=CCC(=O)NCCCCCCCCCC 240690a_100000684558_100121576822 [0,0,1,0,0,0|1,0,2]=4 3577 B16R0.661 CC=CCC(=O)NCCCCCCCCCC 527a_100000684558_100121576822 [0,0,1,0,0,0|1,0,2]=4 3578 B16R0.661 CC=NNC(=O)CCCCCCCCCCC 4a_200011219152_200000210099 [0,0,1,0,0,0|2,0,1]=4 3579 B16R0.661 CCC#CC(=O)CCCCCCCCCCC 1458a_100011827653_100011215454 [0,0,1,0,0,0|1,0,1]=3 3580 B16R0.661 CCC#CC(=O)CCCCCCCCCCO 1458a_100011827653_100009813290 [0,0,1,0,0,0|2,0,1]=4 3581 B16R0.661 CCC=CC(=O)CCCCCCCCCCC 1458a_100000212282_100011215454 [0,0,1,0,0,0|1,0,1]=3 3582 B16R0.661 CCC=CC(=O)CCCCCCCCCCO 1458a_100000212282_100009813290 [0,0,1,0,0,0|2,0,1]=4 3583 B16R0.661 CCC=CC(=O)NCCCCCCCCCC 11a_100000684558_100000212282 [0,0,1,0,0,0|1,0,2]=4 3584 B16R0.661 CCC=CC(=O)NCCCCCCCCCC 1626a_100000684558_100000212282 [0,0,1,0,0,0|1,0,2]=4 3585 B16R0.661 CCC=CC(=O)NCCCCCCCCCC 240690a_100000684558_100000212282 [0,0,1,0,0,0|1,0,2]=4 3586 B16R0.661 CCCCC#CCCCSCC(=O)OCCC 62a_200000047210_200011215008 [0,0,1,0,0,0|1,0,2]=4 3587 B16R0.661 CCCCC#CCCCSCC(=O)OCCC 62a_200011215008_200000047210 [0,0,1,0,0,0|1,0,2]=4 3588 B16R0.661 CCCCC(=O)CCCCCCCCCCO 1458a_100000210183_100009813290 [0,0,1,0,0,0|2,0,0]=3 3589 B16R0.661 CCCCC(=O)NCCCCCCCCCO 240690a_100000078944_100000210183 [0,0,1,0,0,0|2,0,0]=3 3590 B16R0.661 CCCCC(C)OCCCCCCCCCBr 34a_100009813782_200011215066 [0,0,1,0,0,0|2,0,1]=4 3591 B16R0.661 CCCCC(C)OCCCCCCCCCBr 7a_100009813782_200011215066 [0,0,1,0,0,0|2,0,1]=4 3592 B16R0.661 CCCCC(C)OCCCCCCCCCCl 34a_100009868337_200011215066 [0,0,1,0,0,0|2,0,1]=4 3593 B16R0.661 CCCCC(C)OCCCCCCCCCCl 7a_100009868337_200011215066 [0,0,1,0,0,0|2,0,1]=4 3594 B16R0.661 CCCCC(C)OCCCCCCCCCN 34a_100000078944_200011215066 [0,0,1,0,0,0|2,0,1]=4 3595 B16R0.661 CCCCC(C)OCCCCCCCCCO 34a_100000687866_100009813782 [0,0,1,0,0,0|2,0,1]=4 3596 B16R0.661 CCCCC(C)OCCCCCCCCCO 7a_100000687866_100009813782 [0,0,1,0,0,0|2,0,1]=4 3597 B16R0.661 CCCCC/C=C\CCOCC(=O)OCCC 34a_100016277358_200011215008 [0,0,1,0,0,0|1,0,2]=4 3598 B16R0.661 CCCCC/C=C\CCOCC(=O)OCCC 7a_100016277358_200011215008 [0,0,1,0,0,0|1,0,2]=4 3599 B16R0.661 CCCCCC#CCCOCC(=O)OCCC 34a_200000042877_200011215008 [0,0,1,0,0,0|1,0,2]=4 3600 B16R0.661 CCCCCC#CCCOCC(=O)OCCC 7a_200000042877_200011215008 [0,0,1,0,0,0|1,0,2]=4 3601 B16R0.661 CCCCCC/C=C/COCC(=O)OCCC 34a_200016276170_200011215008 [0,0,1,0,0,0|1,0,2]=4 3602 B16R0.661 CCCCCC/C=C/COCC(=O)OCCC 7a_200016276170_200011215008 [0,0,1,0,0,0|1,0,2]=4 3603 B16R0.661 CCCCCCC#CCOCC(=O)OCCC 34a_200000037284_200011215008 [0,0,1,0,0,0|1,0,2]=4 3604 B16R0.661 CCCCCCC#CCOCC(=O)OCCC 7a_200000037284_200011215008 [0,0,1,0,0,0|1,0,2]=4 3605 B16R0.661 CCCCCCCCC=NNC(=O)CCCC 4a_100000189769_100011218696 [0,0,1,0,0,0|2,0,1]=4 3606 B16R0.661 CCCCCCCCCC=CC(=O)CCCC 1458a_200015352897_100000210211 [0,0,1,0,0,0|1,0,1]=3 3607 B16R0.661 CCCCCCCCCC=CC(=O)CCCF 1458a_200015352897_100011934791 [0,0,1,0,0,0|2,0,1]=4 3608 B16R0.661 CCCCCCCCCC=CC(=O)CCCO 1458a_200015352897_100011215043 [0,0,1,0,0,0|2,0,1]=4 3609 B16R0.661 CCCCCCCCCC=CC(=O)CCOC 1458a_200015352897_100000233755 [0,0,1,0,0,0|2,0,1]=4 3610 B16R0.661 CCCCCCCCCC=CC(=O)CCSC 1458a_200015352897_100000751147 [0,0,1,0,0,0|2,0,1]=4 3611 B16R0.661 CCCCCCCCCC=CC(=O)NCCC 11a_100020643023_200015352897 [0,0,1,0,0,0|1,0,2]=4 3612 B16R0.661 CCCCCCCCCC=CC(=O)NCCC 1626a_100020643023_200015352897 [0,0,1,0,0,0|1,0,2]=4 3613 B16R0.661 CCCCCCCCCC=CC(=O)NCCC 240690a_100020643023_200015352897 [0,0,1,0,0,0|1,0,2]=4 3614 B16R0.661 CCCCCCCCCCCC(=NNCC)C 4a_100000756455_100011216755 [0,0,1,0,0,0|3,0,0]=4 3615 B16R0.661 CCCCCCCCCCCC(=O)C#CCO 1458a_100000049017_100011215454 [0,0,1,0,0,0|2,0,1]=4 3616 B16R0.661 CCCCCCCCCCCC(=O)C=COC 1458a_100016268678_100011215454 [0,0,1,0,0,0|2,0,1]=4 3617 B16R0.661 CCCCCCCCCCCC(=O)CCC#N 1458a_100000210736_100011215226 [0,0,1,0,0,0|2,0,1]=4 3618 B16R0.661 CCCCCCCCCCCC(=O)CCC#N 1458a_100011934036_100011215454 [0,0,1,0,0,0|2,0,1]=4 3619 B16R0.661 CCCCCCCCCCCC(=O)CCCC 1458a_100000210183_100011215454 [0,0,1,0,0,0|1,0,0]=2 3620 B16R0.661 CCCCCCCCCCCC(=O)CCCC 1458a_100000210736_100000210211 [0,0,1,0,0,0|1,0,0]=2 3621 B16R0.661 CCCCCCCCCCCC(=O)CCCF 1458a_100000210736_100011934791 [0,0,1,0,0,0|2,0,0]=3 3622 B16R0.661 CCCCCCCCCCCC(=O)CCCO 1458a_100000210736_100011215043 [0,0,1,0,0,0|2,0,0]=3 3623 B16R0.661 CCCCCCCCCCCC(=O)CCOC 1458a_100000210736_100000233755 [0,0,1,0,0,0|2,0,0]=3 3624 B16R0.661 CCCCCCCCCCCC(=O)CCOC 1458a_100000749529_100011215454 [0,0,1,0,0,0|2,0,0]=3 3625 B16R0.661 CCCCCCCCCCCC(=O)CCSC 1458a_100000174002_100011215454 [0,0,1,0,0,0|2,0,0]=3 3626 B16R0.661 CCCCCCCCCCCC(=O)CCSC 1458a_100000210736_100000751147 [0,0,1,0,0,0|2,0,0]=3 3627 B16R0.661 CCCCCCCCCCCC(=O)COCC 1458a_100000211967_100011215454 [0,0,1,0,0,0|2,0,0]=3 3628 B16R0.661 CCCCCCCCCCCC(=O)CSCC 1458a_100000230394_100011215454 [0,0,1,0,0,0|2,0,0]=3 3629 B16R0.661 CCCCCCCCCCCC(=O)NCC#N 1626a_100000734998_100000210736 [0,0,1,0,0,0|2,0,1]=4 3630 B16R0.661 CCCCCCCCCCCC(=O)NCCC 11a_100020643023_100000210736 [0,0,1,0,0,0|1,0,0]=2 3631 B16R0.661 CCCCCCCCCCCC(=O)NCCC 1626a_100020643023_100000210736 [0,0,1,0,0,0|1,0,0]=2 3632 B16R0.661 CCCCCCCCCCCC(=O)NCCC 240690a_100020643023_100000210736 [0,0,1,0,0,0|1,0,0]=2 3633 B16R0.661 CCCCCCCCCCCC(=O)NCCF 11a_100000724931_100000210736 [0,0,1,0,0,0|2,0,0]=3 3634 B16R0.661 CCCCCCCCCCCC(=O)NCCF 1626a_100000724931_100000210736 [0,0,1,0,0,0|2,0,0]=3 3635 B16R0.661 CCCCCCCCCCCC(=O)NCCF 240690a_100000724931_100000210736 [0,0,1,0,0,0|2,0,0]=3 3636 B16R0.661 CCCCCCCCCCCC(=O)NCCO 240690a_100000210304_100000210736 [0,0,1,0,0,0|2,0,0]=3 3637 B16R0.661 CCCCCCCCCCCC(=O)NNCC 22a_100000756455_100000210736 [0,0,1,0,0,0|2,0,0]=3 3638 B16R0.661 CCCCCCCCCCCC(=O)OCNC 2230a_106832991635_100020644155 [0,0,1,0,0,0|1,0,0]=2 3639 B16R0.661 CCCCCCCCCCCC(=O)OCNC 34a_100102657272_100020644155 [0,0,1,0,0,0|1,0,0]=2 3640 B16R0.661 CCCCCCCCCCCC(=O)OCNC 7a_106832991635_100020644155 [0,0,1,0,0,0|1,0,0]=2 3641 B16R0.661 CCCCCCCCCCCC(=O)OCOC 34a_100138415774_100020644155 [0,0,1,0,0,0|1,0,0]=2 3642 B16R0.661 CCCCCCCCCCCC(=O)OCSC 62a_200000210301_100020644155 [0,0,1,0,0,0|1,0,0]=2 3643 B16R0.661 CCCCCCCCCCCC(=O)OCS[13CH3] 62a_200025704644_100020644155 [0,0,1,0,0,0|1,0,0]=2 3644 B16R0.661 CCCCCCCCCCCC(C)NCCC 270004a_100020643023_100011216755 [0,0,1,0,0,0|2,0,1]=4 3645 B16R0.661 CCCCCCCCCCCC(C)OCCC 34a_100011217895_100000210303 [0,0,1,0,0,0|1,0,1]=3 3646 B16R0.661 CCCCCCCCCCCC(C)OCCC 7a_100011217895_100000210303 [0,0,1,0,0,0|1,0,1]=3 3647 B16R0.661 CCCCCCCCCCCC(C)OCCF 34a_100011217895_100011217306 [0,0,1,0,0,0|2,0,1]=4 3648 B16R0.661 CCCCCCCCCCCC(C)OCCF 7a_100011217895_100011217306 [0,0,1,0,0,0|2,0,1]=4 3649 B16R0.661 CCCCCCCCCCCC(C)OCCO 34a_100011217895_100000211926 [0,0,1,0,0,0|2,0,1]=4 3650 B16R0.661 CCCCCCCCCCCC(C)OCCO 7a_100011217895_100000211926 [0,0,1,0,0,0|2,0,1]=4 3651 B16R0.661 CCCCCCCCCCCC(C)OCSC 34a_100011217895_100011218213 [0,0,1,0,0,0|2,0,1]=4 3652 B16R0.661 CCCCCCCCCCCN(C)CCCC 2230a_100000207549_100011215454 [0,0,1,0,0,0|3,0,0]=4 3653 B16R0.661 CCCCCCCCCCCN(C)CCCC 269982a_100000207549_100011215454 [0,0,1,0,0,0|3,0,0]=4 3654 B16R0.661 CCCCCCCCCCNC(=O)CCC#N 11a_100000684558_100011934036 [0,0,1,0,0,0|2,0,1]=4 3655 B16R0.661 CCCCCCCCCCNC(=O)CCC#N 1626a_100000684558_100011934036 [0,0,1,0,0,0|2,0,1]=4 3656 B16R0.661 CCCCCCCCCCNC(=O)CCC#N 240690a_100000684558_100011934036 [0,0,1,0,0,0|2,0,1]=4 3657 B16R0.661 CCCCCCCCCCNC(=O)CCC#N 527a_100000684558_100011934036 [0,0,1,0,0,0|2,0,1]=4 3658 B16R0.661 CCCCCCCCCCNC(=O)CCCC 11a_100000684558_100000210183 [0,0,1,0,0,0|1,0,0]=2 3659 B16R0.661 CCCCCCCCCCNC(=O)CCCC 1626a_100000684558_100000210183 [0,0,1,0,0,0|1,0,0]=2 3660 B16R0.661 CCCCCCCCCCNC(=O)CCCC 240690a_100000684558_100000210183 [0,0,1,0,0,0|1,0,0]=2 3661 B16R0.661 CCCCCCCCCCNC(=O)CCCC 527a_100000684558_100000210183 [0,0,1,0,0,0|1,0,0]=2 3662 B16R0.661 CCCCCCCCCCNC(=O)CCOC 11a_100000684558_100000749529 [0,0,1,0,0,0|2,0,0]=3 3663 B16R0.661 CCCCCCCCCCNC(=O)CCOC 1626a_100000684558_100000749529 [0,0,1,0,0,0|2,0,0]=3 3664 B16R0.661 CCCCCCCCCCNC(=O)CCOC 240690a_100000684558_100000749529 [0,0,1,0,0,0|2,0,0]=3 3665 B16R0.661 CCCCCCCCCCNC(=O)CCOC 527a_100000684558_100000749529 [0,0,1,0,0,0|2,0,0]=3 3666 B16R0.661 CCCCCCCCCCNC(=O)CCSC 11a_100000684558_100000174002 [0,0,1,0,0,0|2,0,0]=3 3667 B16R0.661 CCCCCCCCCCNC(=O)CCSC 1626a_100000684558_100000174002 [0,0,1,0,0,0|2,0,0]=3 3668 B16R0.661 CCCCCCCCCCNC(=O)CCSC 240690a_100000684558_100000174002 [0,0,1,0,0,0|2,0,0]=3 3669 B16R0.661 CCCCCCCCCCNC(=O)CCSC 527a_100000684558_100000174002 [0,0,1,0,0,0|2,0,0]=3 3670 B16R0.661 CCCCCCCCCCNC(=O)COCC 11a_100000684558_100000211967 [0,0,1,0,0,0|2,0,0]=3 3671 B16R0.661 CCCCCCCCCCNC(=O)COCC 1626a_100000684558_100000211967 [0,0,1,0,0,0|2,0,0]=3 3672 B16R0.661 CCCCCCCCCCNC(=O)COCC 240690a_100000684558_100000211967 [0,0,1,0,0,0|2,0,0]=3 3673 B16R0.661 CCCCCCCCCCNC(=O)COCC 527a_100000684558_100000211967 [0,0,1,0,0,0|2,0,0]=3 3674 B16R0.661 CCCCCCCCCCNC(=O)CSCC 11a_100000684558_100000230394 [0,0,1,0,0,0|2,0,0]=3 3675 B16R0.661 CCCCCCCCCCNC(=O)CSCC 1626a_100000684558_100000230394 [0,0,1,0,0,0|2,0,0]=3 3676 B16R0.661 CCCCCCCCCCNC(=O)CSCC 240690a_100000684558_100000230394 [0,0,1,0,0,0|2,0,0]=3 3677 B16R0.661 CCCCCCCCCCNC(=O)CSCC 527a_100000684558_100000230394 [0,0,1,0,0,0|2,0,0]=3 3678 B16R0.661 CCCCCCCCCCNC(=O)NCCC 2708a_100000684558_100020643023 [0,0,1,0,0,0|2,0,0]=3 3679 B16R0.661 CCCCCCCCCCNC(=O)NCCC 2708a_100020643023_100000684558 [0,0,1,0,0,0|2,0,0]=3 3680 B16R0.661 CCCCCCCCCCNC(=O)NCCC 273464a_100000684558_100020643023 [0,0,1,0,0,0|2,0,0]=3 3681 B16R0.661 CCCCCCCCCCNC(=O)NCCC 273464a_100020643023_100000684558 [0,0,1,0,0,0|2,0,0]=3 3682 B16R0.661 CCCCCCCCCCNC(=O)NCCC 512a_100000684558_100020643023 [0,0,1,0,0,0|2,0,0]=3 3683 B16R0.661 CCCCCCCCCCNC(=O)NCCC 512a_100020643023_100000684558 [0,0,1,0,0,0|2,0,0]=3 3684 B16R0.661 CCCCCCCCCCNC(=O)NCCF 2708a_100000684558_100000724931 [0,0,1,0,0,0|3,0,0]=4 3685 B16R0.661 CCCCCCCCCCNC(=O)NCCF 273464a_100000684558_100000724931 [0,0,1,0,0,0|3,0,0]=4 3686 B16R0.661 CCCCCCCCCCNC(=O)NCCF 273464a_100000724931_100000684558 [0,0,1,0,0,0|3,0,0]=4 3687 B16R0.661 CCCCCCCCCCNC(=O)NCCF 512a_100000684558_100000724931 [0,0,1,0,0,0|3,0,0]=4 3688 B16R0.661 CCCCCCCCCCNC(=O)NCCO 2708a_100000684558_100000210304 [0,0,1,0,0,0|3,0,0]=4 3689 B16R0.661 CCCCCCCCCCNC(=O)NCCO 273464a_100000210304_100000684558 [0,0,1,0,0,0|3,0,0]=4 3690 B16R0.661 CCCCCCCCCCNC(=O)NCCO 273464a_100000684558_100000210304 [0,0,1,0,0,0|3,0,0]=4 3691 B16R0.661 CCCCCCCCCCNC(=O)NCCO 512a_100000684558_100000210304 [0,0,1,0,0,0|3,0,0]=4 3692 B16R0.661 CCCCCCCCCCNC(=O)NNCC 273464a_100000684558_100000756455 [0,0,1,0,0,0|3,0,0]=4 3693 B16R0.661 CCCCCCCCCCNC(=O)NNCC 512a_100000684558_100000756455 [0,0,1,0,0,0|3,0,0]=4 3694 B16R0.661 CCCCCCCCCCNC(=O)NNCC 512a_100000756455_100000684558 [0,0,1,0,0,0|3,0,0]=4 3695 B16R0.661 CCCCCCCCCCNC(C)CCCC 2230a_100000126638_100000210320 [0,0,1,0,0,0|2,0,1]=4 3696 B16R0.661 CCCCCCCCCCNC(C)CCCC 2230a_100000684558_200011215066 [0,0,1,0,0,0|2,0,1]=4 3697 B16R0.661 CCCCCCCCCCNC(C)CCCC 270004a_100000684558_100000210087 [0,0,1,0,0,0|2,0,1]=4 3698 B16R0.661 CCCCCCCCCCNC(C)CCCC 34a_100000684558_200011215066 [0,0,1,0,0,0|2,0,1]=4 3699 B16R0.661 CCCCCCCCCCOC(=O)CNCC 2230a_100015525214_100000210668 [0,0,1,0,0,0|1,0,0]=2 3700 B16R0.661 CCCCCCCCCCOC(=O)COCC 34a_100121572206_100000210668 [0,0,1,0,0,0|1,0,0]=2 3701 B16R0.661 CCCCCCCCCCOC(=O)CSCC 62a_100000210202_100000680656 [0,0,1,0,0,0|1,0,0]=2 3702 B16R0.661 CCCCCCCCCCOC(=O)CSCC 62a_100000680656_100000210202 [0,0,1,0,0,0|1,0,0]=2 3703 B16R0.661 CCCCCCCCCCOC(=O)CSCF 62a_100000680656_100015361967 [0,0,1,0,0,0|2,0,0]=3 3704 B16R0.661 CCCCCCCCCCOC(=O)CSCF 62a_100015361967_100000680656 [0,0,1,0,0,0|2,0,0]=3 3705 B16R0.661 CCCCCCCCCCOC(C)CCCC 34a_100000210711_200011215066 [0,0,1,0,0,0|1,0,1]=3 3706 B16R0.661 CCCCCCCCCCOC(C)CCCC 34a_100000687866_100000210320 [0,0,1,0,0,0|1,0,1]=3 3707 B16R0.661 CCCCCCCCCCOC(C)CCCC 7a_100000210711_200011215066 [0,0,1,0,0,0|1,0,1]=3 3708 B16R0.661 CCCCCCCCCCOC(C)CCCC 7a_100000687866_100000210320 [0,0,1,0,0,0|1,0,1]=3 3709 B16R0.661 CCCCCCCCCCOC(C)CCCCl 34a_200000718107_100000210320 [0,0,1,0,0,0|2,0,1]=4 3710 B16R0.661 CCCCCCCCCCOC(C)CCCCl 7a_200000718107_100000210320 [0,0,1,0,0,0|2,0,1]=4 3711 B16R0.661 CCCCCCCCCCOC(C)COCC 34a_100000718985_100000210320 [0,0,1,0,0,0|2,0,1]=4 3712 B16R0.661 CCCCCCCCCCOC(C)COCC 7a_100000718985_100000210320 [0,0,1,0,0,0|2,0,1]=4 3713 B16R0.661 CCCCCCCCCNCC(=O)NCCC 2230a_100000174927_100011214924 [0,0,1,0,0,0|2,0,0]=3 3714 B16R0.661 CCCCCCCCCNCC(=O)NCCC 2230a_100000212291_100000183358 [0,0,1,0,0,0|2,0,0]=3 3715 B16R0.661 CCCCCCCCCNCC(=O)NCCC 34a_100000212291_100000183358 [0,0,1,0,0,0|2,0,0]=3 3716 B16R0.661 CCCCCCCCCNCC(=O)NCCF 2230a_100000725713_100011214924 [0,0,1,0,0,0|3,0,0]=4 3717 B16R0.661 CCCCCCCCCNCC(=O)OCCC 2230a_100000212291_200011215008 [0,0,1,0,0,0|1,0,0]=2 3718 B16R0.661 CCCCCCCCCNCC(=O)OCCC 34a_100000212291_200011215008 [0,0,1,0,0,0|1,0,0]=2 3719 B16R0.661 CCCCCCCCCNCC(C)OCCC 2230a_100015185124_100011214924 [0,0,1,0,0,0|2,0,1]=4 3720 B16R0.661 CCCCCCCCCNCC(C)OCCC 34a_100015185124_100011214924 [0,0,1,0,0,0|2,0,1]=4 3721 B16R0.661 CCCCCCCCCOCC(=O)NCCC 34a_100000210712_100000183358 [0,0,1,0,0,0|2,0,0]=3 3722 B16R0.661 CCCCCCCCCOCC(=O)NCCC 7a_100000210712_100000183358 [0,0,1,0,0,0|2,0,0]=3 3723 B16R0.661 CCCCCCCCCOCC(=O)OCCC 34a_100000210712_200011215008 [0,0,1,0,0,0|1,0,0]=2 3724 B16R0.661 CCCCCCCCCOCC(=O)OCCC 7a_100000210712_200011215008 [0,0,1,0,0,0|1,0,0]=2 3725 B16R0.661 CCCCCCCCCSCC(=O)NCCC 62a_100000183358_100000210670 [0,0,1,0,0,0|2,0,0]=3 3726 B16R0.661 CCCCCCCCCSCC(=O)OCCC 62a_200011215008_100000210670 [0,0,1,0,0,0|1,0,0]=2 3727 B16R0.661 CCCCCCCCNCOC(=O)OCCC 34a_100000229939_200000139673 [0,0,1,0,0,0|2,0,0]=3 3728 B16R0.661 CCCCCCCCOCOC(=O)OCCC 34a_100000210232_200000139673 [0,0,1,0,0,0|2,0,0]=3 3729 B16R0.661 CCCCCCCCOCOC(=O)OCCC 7a_100000210232_200000139673 [0,0,1,0,0,0|2,0,0]=3 3730 B16R0.661 CCCCCCCCSCOC(=O)OCCC 62a_100000210759_200000139673 [0,0,1,0,0,0|2,0,0]=3 3731 B16R0.661 CCCCCCCNCCCC(=O)NCCC 2230a_100000229938_100011194427 [0,0,1,0,0,0|2,0,0]=3 3732 B16R0.661 CCCCCCCOCCCC(=O)NCCC 7a_100000210272_100011194427 [0,0,1,0,0,0|2,0,0]=3 3733 B16R0.661 CCCCCCCSCCCC(=O)NCCC 62a_100000210614_100011194427 [0,0,1,0,0,0|2,0,0]=3 3734 B16R0.661 CCCCCCCSCCCC(=O)NCCC 62a_100011194427_100000210316 [0,0,1,0,0,0|2,0,0]=3 3735 B16R0.661 CCCCCCOCCOCC(=O)NCCC 34a_100000691444_100000183358 [0,0,1,0,0,0|3,0,0]=4 3736 B16R0.661 CCCCCCOCCOCC(=O)NCCC 7a_100000691444_100000183358 [0,0,1,0,0,0|3,0,0]=4 3737 B16R0.661 CCCCCCOCCOCC(=O)OCCC 34a_100000691444_200011215008 [0,0,1,0,0,0|2,0,0]=3 3738 B16R0.661 CCCCCCOCCOCC(=O)OCCC 7a_100000691444_200011215008 [0,0,1,0,0,0|2,0,0]=3 3739 B16R0.661 CCCCCNCCOCOC(=O)OCCC 34a_100000224656_200000139673 [0,0,1,0,0,0|3,0,0]=4 3740 B16R0.661 CCCCCOCCOCOC(=O)OCCC 34a_100011215259_200000139673 [0,0,1,0,0,0|3,0,0]=4 3741 B16R0.661 CCCCCOCCOCOC(=O)OCCC 7a_100011215259_200000139673 [0,0,1,0,0,0|3,0,0]=4 3742 B16R0.661 CCCCNCCCCOCC(=O)NCCC 34a_200011216965_100000183358 [0,0,1,0,0,0|3,0,0]=4 3743 B16R0.661 CCCCNCCCCOCC(=O)OCCC 34a_200011216965_200011215008 [0,0,1,0,0,0|2,0,0]=3 3744 B16R0.661 CCCCOCCCCOCC(=O)NCCC 34a_200000760531_100000183358 [0,0,1,0,0,0|3,0,0]=4 3745 B16R0.661 CCCCOCCCCOCC(=O)NCCC 7a_200000760531_100000183358 [0,0,1,0,0,0|3,0,0]=4 3746 B16R0.661 CCCCOCCCCOCC(=O)OCCC 34a_200000760531_200011215008 [0,0,1,0,0,0|2,0,0]=3 3747 B16R0.661 CCCCOCCCCOCC(=O)OCCC 7a_200000760531_200011215008 [0,0,1,0,0,0|2,0,0]=3 3748 B16R0.661 CCCCOCCCNCOC(=O)OCCC 34a_200000211371_200000139673 [0,0,1,0,0,0|3,0,0]=4 3749 B16R0.661 CCCCOCCCOCOC(=O)OCCC 34a_200011215613_200000139673 [0,0,1,0,0,0|3,0,0]=4 3750 B16R0.661 CCCCOCCCOCOC(=O)OCCC 7a_200011215613_200000139673 [0,0,1,0,0,0|3,0,0]=4 3751 B16R0.661 CCCCOCCOCCCC(=O)NCCC 7a_100000210238_100011194427 [0,0,1,0,0,0|3,0,0]=4 3752 B16R0.661 CCCCOCCSCCCC(=O)NCCC 62a_100000743108_100011194427 [0,0,1,0,0,0|3,0,0]=4 3753 B16R0.661 CCCCOCCSCCCC(=O)NCCC 62a_100011194427_100000743108 [0,0,1,0,0,0|3,0,0]=4 3754 B16R0.661 CCCCSCCNCCCC(=O)NCCC 2230a_100025743550_100011194427 [0,0,1,0,0,0|3,0,0]=4 3755 B16R0.661 CCCCSCCOCCCC(=O)NCCC 7a_200000230436_100011194427 [0,0,1,0,0,0|3,0,0]=4 3756 B16R0.661 CCCNC(=O)CCCCCCCCCCO 240690a_100020643023_200000016029 [0,0,1,0,0,0|2,0,0]=3 3757 B16R0.661 CCCNC(=O)CCCNCCCCCCO 2230a_100000686447_100011194427 [0,0,1,0,0,0|3,0,0]=4 3758 B16R0.661 CCCNC(=O)CCCNCCCCCOC 2230a_100000747528_100011194427 [0,0,1,0,0,0|3,0,0]=4 3759 B16R0.661 CCCNC(=O)CCCNCCCOCCC 2230a_100011217757_100011194427 [0,0,1,0,0,0|3,0,0]=4 3760 B16R0.661 CCCNC(=O)CCCOCCCCCCBr 7a_100011215345_100011194427 [0,0,1,0,0,0|3,0,0]=4 3761 B16R0.661 CCCNC(=O)CCCOCCCCCCCl 7a_100000766143_100011194427 [0,0,1,0,0,0|3,0,0]=4 3762 B16R0.661 CCCNC(=O)CCCOCCCCCCF 7a_100000732779_100011194427 [0,0,1,0,0,0|3,0,0]=4 3763 B16R0.661 CCCNC(=O)CCCSCCCCCCF 62a_100011194427_100015922095 [0,0,1,0,0,0|3,0,0]=4 3764 B16R0.661 CCCNC(=O)CCCSCCCCCCF 62a_100015922095_100011194427 [0,0,1,0,0,0|3,0,0]=4 3765 B16R0.661 CCCNC(=O)CCCSCCCCCCO 62a_100000766143_100011194427 [0,0,1,0,0,0|3,0,0]=4 3766 B16R0.661 CCCNC(=O)CCCSCCCCCCO 62a_100011194427_100000766143 [0,0,1,0,0,0|3,0,0]=4 3767 B16R0.661 CCCNC(=O)CNCCCCCCCCO 2230a_100000174927_100000033203 [0,0,1,0,0,0|3,0,0]=4 3768 B16R0.661 CCCNC(=O)CNCCCCCCCCO 2230a_102515433106_100000183358 [0,0,1,0,0,0|3,0,0]=4 3769 B16R0.661 CCCNC(=O)CNCCCCCCCCO 34a_102515433106_100000183358 [0,0,1,0,0,0|3,0,0]=4 3770 B16R0.661 CCCNC(=O)COCCCCCCCCBr 34a_100009813846_100000183358 [0,0,1,0,0,0|3,0,0]=4 3771 B16R0.661 CCCNC(=O)COCCCCCCCCBr 7a_100009813846_100000183358 [0,0,1,0,0,0|3,0,0]=4 3772 B16R0.661 CCCNC(=O)COCCCCCCCCCl 34a_100000033203_100000183358 [0,0,1,0,0,0|3,0,0]=4 3773 B16R0.661 CCCNC(=O)COCCCCCCCCCl 7a_100000033203_100000183358 [0,0,1,0,0,0|3,0,0]=4 3774 B16R0.661 CCCNC(=O)COCCCCCCCCN 34a_102515433106_100000183358 [0,0,1,0,0,0|3,0,0]=4 3775 B16R0.661 CCCNC(=O)CSCCCCCCCCO 62a_100000033203_100000183358 [0,0,1,0,0,0|3,0,0]=4 3776 B16R0.661 CCCNC(=O)CSCCCCCCCCO 62a_100000183358_100000033203 [0,0,1,0,0,0|3,0,0]=4 3777 B16R0.661 CCCNC(=O)NCCCCCCCCCO 2708a_100000078944_100020643023 [0,0,1,0,0,0|3,0,0]=4 3778 B16R0.661 CCCNC(=O)NCCCCCCCCCO 2708a_100020643023_100000078944 [0,0,1,0,0,0|3,0,0]=4 3779 B16R0.661 CCCNC(=O)NCCCCCCCCCO 273464a_100000078944_100020643023 [0,0,1,0,0,0|3,0,0]=4 3780 B16R0.661 CCCNC(=O)NCCCCCCCCCO 273464a_100020643023_100000078944 [0,0,1,0,0,0|3,0,0]=4 3781 B16R0.661 CCCNC(=O)NCCCCCCCCCO 512a_100000078944_100020643023 [0,0,1,0,0,0|3,0,0]=4 3782 B16R0.661 CCCNC(=O)NCCCCCCCCCO 512a_100020643023_100000078944 [0,0,1,0,0,0|3,0,0]=4 3783 B16R0.661 CCCOC(=O)CNCCCCCCCCO 2230a_102515433106_200011215008 [0,0,1,0,0,0|2,0,0]=3 3784 B16R0.661 CCCOC(=O)CNCCCCCCCCO 34a_102515433106_200011215008 [0,0,1,0,0,0|2,0,0]=3 3785 B16R0.661 CCCOC(=O)COCCCCCCCCBr 34a_100009813846_200011215008 [0,0,1,0,0,0|2,0,0]=3 3786 B16R0.661 CCCOC(=O)COCCCCCCCCBr 7a_100009813846_200011215008 [0,0,1,0,0,0|2,0,0]=3 3787 B16R0.661 CCCOC(=O)COCCCCCCCCCl 34a_100000033203_200011215008 [0,0,1,0,0,0|2,0,0]=3 3788 B16R0.661 CCCOC(=O)COCCCCCCCCCl 7a_100000033203_200011215008 [0,0,1,0,0,0|2,0,0]=3 3789 B16R0.661 CCCOC(=O)COCCCCCCCCN 34a_102515433106_200011215008 [0,0,1,0,0,0|2,0,0]=3 3790 B16R0.661 CCCOC(=O)COCCCCCNCCN 34a_103619048469_200011215008 [0,0,1,0,0,0|3,0,0]=4 3791 B16R0.661 CCCOC(=O)COCCCOCCCOC 34a_200011215475_200011215008 [0,0,1,0,0,0|3,0,0]=4 3792 B16R0.661 CCCOC(=O)COCCCOCCCOC 7a_200011215475_200011215008 [0,0,1,0,0,0|3,0,0]=4 3793 B16R0.661 CCCOC(=O)CSCCCCCCCCO 62a_100000033203_200011215008 [0,0,1,0,0,0|2,0,0]=3 3794 B16R0.661 CCCOC(=O)CSCCCCCCCCO 62a_200011215008_100000033203 [0,0,1,0,0,0|2,0,0]=3 3795 B16R0.661 CCCOC(=O)OCNCCCCCCCO 34a_100011996573_200000139673 [0,0,1,0,0,0|3,0,0]=4 3796 B16R0.661 CCCOC(=O)OCOCCCCCCCBr 34a_100000760002_200000139673 [0,0,1,0,0,0|3,0,0]=4 3797 B16R0.661 CCCOC(=O)OCOCCCCCCCBr 7a_100000760002_200000139673 [0,0,1,0,0,0|3,0,0]=4 3798 B16R0.661 CCCOC(=O)OCOCCCCCCCN 34a_100011996573_200000139673 [0,0,1,0,0,0|3,0,0]=4 3799 B16R0.661 CCCOC(=O)OCOCCCCCCOC 34a_200012092642_200000139673 [0,0,1,0,0,0|3,0,0]=4 3800 B16R0.661 CCCOC(=O)OCOCCCCCCOC 7a_200012092642_200000139673 [0,0,1,0,0,0|3,0,0]=4 3801 B16R0.661 CCCOC(=O)OCSCCCCCCCO 62a_100000760002_200000139673 [0,0,1,0,0,0|3,0,0]=4 3802 B16R0.661 CCCOC(=O)OCSCCCCCCOC 62a_100011998445_200000139673 [0,0,1,0,0,0|3,0,0]=4 3803 B16R0.661 CCCOCCOCCNCC(=O)OCCC 2230a_200011904461_200011215008 [0,0,1,0,0,0|3,0,0]=4 3804 B16R0.661 CCCOCCOCCNCC(=O)OCCC 34a_200011904461_200011215008 [0,0,1,0,0,0|3,0,0]=4 3805 B16R0.661 CCNNC(=O)CCCCCCCCCCO 22a_100000756455_200000016029 [0,0,1,0,0,0|3,0,0]=4 3806 B16R0.661 CCOCC(=O)CCCCCCCCCCO 1458a_100000211967_100009813290 [0,0,1,0,0,0|3,0,0]=4 3807 B16R0.661 CCOCC(=O)NCCCCCCCCCO 240690a_100000078944_100000211967 [0,0,1,0,0,0|3,0,0]=4 3808 B16R0.661 CCSCC(=O)CCCCCCCCCCO 1458a_100000230394_100009813290 [0,0,1,0,0,0|3,0,0]=4 3809 B16R0.661 CCSCC(=O)NCCCCCCCCCO 240690a_100000078944_100000230394 [0,0,1,0,0,0|3,0,0]=4 3810 B16R0.661 COCCC(=O)CCCCCCCCCCO 1458a_100000749529_100009813290 [0,0,1,0,0,0|3,0,0]=4 3811 B16R0.661 COCCC(=O)NCCCCCCCCCO 240690a_100000078944_100000749529 [0,0,1,0,0,0|3,0,0]=4 3812 B16R0.661 CSCCC(=O)CCCCCCCCCCO 1458a_100000174002_100009813290 [0,0,1,0,0,0|3,0,0]=4 3813 B16R0.661 CSCCC(=O)NCCCCCCCCCO 240690a_100000078944_100000174002 [0,0,1,0,0,0|3,0,0]=4 3814 B16R0.661 O=C(CCCCCCCCCCO)NCCF 240690a_100000724931_200000016029 [0,0,1,0,0,0|3,0,0]=4 3815 B16R0.661 O=C(CCCCCCCCCCO)NCCO 240690a_100000210304_200000016029 [0,0,1,0,0,0|3,0,0]=4 3816 B16R0.6603 C#CCCCCC(=O)CCCCCCCCC 1458a_100000210558_100010269958 [0,0,1,0,0,0|1,0,2]=4 3817 B16R0.6603 C#CCCCCC(=O)CCCCCCCCC 1458a_100000696528_100000210670 [0,0,1,0,0,0|1,0,2]=4 3818 B16R0.6603 C#CCCCCC(=O)NCCCCCCCC 11a_100000229939_100000696528 [0,0,1,0,0,0|1,0,2]=4 3819 B16R0.6603 C#CCCCCC(=O)NCCCCCCCC 1626a_100000229939_100000696528 [0,0,1,0,0,0|1,0,2]=4 3820 B16R0.6603 C#CCCCCC(=O)NCCCCCCCC 240690a_100000229939_100000696528 [0,0,1,0,0,0|1,0,2]=4 3821 B16R0.6603 C#CCCCCC(=O)NCCCCCCCC 527a_100000229939_100000696528 [0,0,1,0,0,0|1,0,2]=4 3822 B16R0.6603 C#CCCCCCCCC(=O)CCCCCC 1458a_100000087357_100000210757 [0,0,1,0,0,0|1,0,2]=4 3823 B16R0.6603 C#CCCCCCCCC(=O)CCCCCC 1458a_100102632555_100153394163 [0,0,1,0,0,0|1,0,2]=4 3824 B16R0.6603 C#CCCCCCCCC(=O)NCCCCC 11a_100000209983_100000087357 [0,0,1,0,0,0|1,0,2]=4 3825 B16R0.6603 C#CCCCCCCCC(=O)NCCCCC 1626a_100000209983_100000087357 [0,0,1,0,0,0|1,0,2]=4 3826 B16R0.6603 C#CCCCCCCCC(=O)NCCCCC 240690a_100000209983_100000087357 [0,0,1,0,0,0|1,0,2]=4 3827 B16R0.6603 C#CCCCCCCCC(=O)NCCCCC 527a_100000209983_100000087357 [0,0,1,0,0,0|1,0,2]=4 3828 B16R0.6603 C#CCCCNC(=O)CCCCCCCCC 11a_100000718082_100000210558 [0,0,1,0,0,0|1,0,2]=4 3829 B16R0.6603 C#CCCCNC(=O)CCCCCCCCC 1626a_100000718082_100000210558 [0,0,1,0,0,0|1,0,2]=4 3830 B16R0.6603 C#CCCCNC(=O)CCCCCCCCC 240690a_100000718082_100000210558 [0,0,1,0,0,0|1,0,2]=4 3831 B16R0.6603 C#CCCCNC(=O)CCCCCCCCC 527a_100000718082_100000210558 [0,0,1,0,0,0|1,0,2]=4 3832 B16R0.6603 C#CCNCOC(=O)CCCCCCCCC 34a_100000212058_200010990708 [0,0,1,0,0,0|1,0,2]=4 3833 B16R0.6603 C#CCOCOC(=O)CCCCCCCCC 34a_100000210247_200010990708 [0,0,1,0,0,0|1,0,2]=4 3834 B16R0.6603 C#CCSCOC(=O)CCCCCCCCC 62a_100000038162_200010990708 [0,0,1,0,0,0|1,0,2]=4 3835 B16R0.6603 C=CCCCCC(=O)CCCCCCCCC 1458a_100000210558_100011215482 [0,0,1,0,0,0|1,0,2]=4 3836 B16R0.6603 C=CCCCCC(=O)CCCCCCCCC 1458a_100011215552_100000210670 [0,0,1,0,0,0|1,0,2]=4 3837 B16R0.6603 C=CCCCCC(=O)NCCCCCCCC 11a_100000229939_100011215552 [0,0,1,0,0,0|1,0,2]=4 3838 B16R0.6603 C=CCCCCC(=O)NCCCCCCCC 1626a_100000229939_100011215552 [0,0,1,0,0,0|1,0,2]=4 3839 B16R0.6603 C=CCCCCC(=O)NCCCCCCCC 240690a_100000229939_100011215552 [0,0,1,0,0,0|1,0,2]=4 3840 B16R0.6603 C=CCCCCC(=O)NCCCCCCCC 527a_100000229939_100011215552 [0,0,1,0,0,0|1,0,2]=4 3841 B16R0.6603 C=CCCCCCCCC(=O)CCCCCC 1458a_100011216160_100000210757 [0,0,1,0,0,0|1,0,2]=4 3842 B16R0.6603 C=CCCCCCCCC(=O)CCCCCC 1458a_100102632555_100012355270 [0,0,1,0,0,0|1,0,2]=4 3843 B16R0.6603 C=CCCCCCCCC(=O)NCCCCC 11a_100000209983_100011216160 [0,0,1,0,0,0|1,0,2]=4 3844 B16R0.6603 C=CCCCCCCCC(=O)NCCCCC 1626a_100000209983_100011216160 [0,0,1,0,0,0|1,0,2]=4 3845 B16R0.6603 C=CCCCCCCCC(=O)NCCCCC 240690a_100000209983_100011216160 [0,0,1,0,0,0|1,0,2]=4 3846 B16R0.6603 C=CCCCCCCCC(=O)NCCCCC 527a_100000209983_100011216160 [0,0,1,0,0,0|1,0,2]=4 3847 B16R0.6603 C=CCCCNC(=O)CCCCCCCCC 11a_100000700776_100000210558 [0,0,1,0,0,0|1,0,2]=4 3848 B16R0.6603 C=CCCCNC(=O)CCCCCCCCC 1626a_100000700776_100000210558 [0,0,1,0,0,0|1,0,2]=4 3849 B16R0.6603 C=CCCCNC(=O)CCCCCCCCC 240690a_100000700776_100000210558 [0,0,1,0,0,0|1,0,2]=4 3850 B16R0.6603 C=CCCCNC(=O)CCCCCCCCC 527a_100000700776_100000210558 [0,0,1,0,0,0|1,0,2]=4 3851 B16R0.6603 C=CCNCOC(=O)CCCCCCCCC 2230a_100020586998_200010990708 [0,0,1,0,0,0|1,0,2]=4 3852 B16R0.6603 C=CCOCOC(=O)CCCCCCCCC 34a_200000210373_200010990708 [0,0,1,0,0,0|1,0,2]=4 3853 B16R0.6603 C=CCSCOC(=O)CCCCCCCCC 62a_100000210623_200010990708 [0,0,1,0,0,0|1,0,2]=4 3854 B16R0.6603 CC/C=C\CCC(=O)CCCCCCCCC 1458a_100000210558_100015370543 [0,0,1,0,0,0|1,0,2]=4 3855 B16R0.6603 CCC/C=C/CC(=O)CCCCCCCCC 1458a_200016266809_100000210670 [0,0,1,0,0,0|1,0,2]=4 3856 B16R0.6603 CCC/C=C/CC(=O)NCCCCCCCC 11a_100000229939_200016266809 [0,0,1,0,0,0|1,0,2]=4 3857 B16R0.6603 CCC/C=C/CC(=O)NCCCCCCCC 1626a_100000229939_200016266809 [0,0,1,0,0,0|1,0,2]=4 3858 B16R0.6603 CCC/C=C/CC(=O)NCCCCCCCC 240690a_100000229939_200016266809 [0,0,1,0,0,0|1,0,2]=4 3859 B16R0.6603 CCC/C=C/CC(=O)NCCCCCCCC 527a_100000229939_200016266809 [0,0,1,0,0,0|1,0,2]=4 3860 B16R0.6603 CCCC=NNC(=O)CCCCCCCCC 4a_100011221126_100000185831 [0,0,1,0,0,0|2,0,1]=4 3861 B16R0.6603 CCCCC#CCCCC(=O)CCCCCC 1458a_100102632555_200000047210 [0,0,1,0,0,0|1,0,2]=4 3862 B16R0.6603 CCCCC/C=C/CCC(=O)CCCCCC 1458a_200015255902_100000210757 [0,0,1,0,0,0|1,0,2]=4 3863 B16R0.6603 CCCCC/C=C/CCC(=O)NCCCCC 11a_100000209983_200015255902 [0,0,1,0,0,0|1,0,2]=4 3864 B16R0.6603 CCCCC/C=C/CCC(=O)NCCCCC 1626a_100000209983_200015255902 [0,0,1,0,0,0|1,0,2]=4 3865 B16R0.6603 CCCCC/C=C/CCC(=O)NCCCCC 240690a_100000209983_200015255902 [0,0,1,0,0,0|1,0,2]=4 3866 B16R0.6603 CCCCC/C=C/CCC(=O)NCCCCC 527a_100000209983_200015255902 [0,0,1,0,0,0|1,0,2]=4 3867 B16R0.6603 CCCCC=CC(=O)CCCCCCCCC 1458a_100016266645_100000210670 [0,0,1,0,0,0|1,0,1]=3 3868 B16R0.6603 CCCCC=CC(=O)CCCCCCCCO 1458a_100016266645_100000033203 [0,0,1,0,0,0|2,0,1]=4 3869 B16R0.6603 CCCCC=CC(=O)NCCCCCCCC 11a_100000229939_100016266645 [0,0,1,0,0,0|1,0,2]=4 3870 B16R0.6603 CCCCC=CC(=O)NCCCCCCCC 1626a_100000229939_100016266645 [0,0,1,0,0,0|1,0,2]=4 3871 B16R0.6603 CCCCC=CC(=O)NCCCCCCCC 240690a_100000229939_100016266645 [0,0,1,0,0,0|1,0,2]=4 3872 B16R0.6603 CCCCCC/C=C/CC(=O)CCCCCC 1458a_100020681715_100000210757 [0,0,1,0,0,0|1,0,2]=4 3873 B16R0.6603 CCCCCC/C=C/CC(=O)NCCCCC 11a_100000209983_100020681715 [0,0,1,0,0,0|1,0,2]=4 3874 B16R0.6603 CCCCCC/C=C/CC(=O)NCCCCC 1626a_100000209983_100020681715 [0,0,1,0,0,0|1,0,2]=4 3875 B16R0.6603 CCCCCC/C=C/CC(=O)NCCCCC 240690a_100000209983_100020681715 [0,0,1,0,0,0|1,0,2]=4 3876 B16R0.6603 CCCCCCC(=O)CCCCCCCCO 1458a_100102632555_100000033203 [0,0,1,0,0,0|2,0,0]=3 3877 B16R0.6603 CCCCCCC(=O)COCCOCCCC 1458a_100011216887_100000210757 [0,0,1,0,0,0|3,0,0]=4 3878 B16R0.6603 CCCCCCC(=O)NCCCCCCCO 240690a_100011996573_100102632555 [0,0,1,0,0,0|2,0,0]=3 3879 B16R0.6603 CCCCCCC(=O)NCCCOCCCC 1626a_200000211371_100102632555 [0,0,1,0,0,0|2,0,0]=3 3880 B16R0.6603 CCCCCCC(=O)NCCCOCCCC 240690a_200000211371_100102632555 [0,0,1,0,0,0|2,0,0]=3 3881 B16R0.6603 CCCCCCC(=O)NCCCOCCCC 527a_200000211371_100102632555 [0,0,1,0,0,0|2,0,0]=3 3882 B16R0.6603 CCCCCCC(=O)NCCCOCCCO 240690a_100011310245_100102632555 [0,0,1,0,0,0|3,0,0]=4 3883 B16R0.6603 CCCCCCC(=O)NCCCOCCOC 1626a_100000206027_100102632555 [0,0,1,0,0,0|3,0,0]=4 3884 B16R0.6603 CCCCCCC(=O)NCCCOCCOC 240690a_100000206027_100102632555 [0,0,1,0,0,0|3,0,0]=4 3885 B16R0.6603 CCCCCCC(=O)NCCOCCOCC 11a_100102712874_100102632555 [0,0,1,0,0,0|3,0,0]=4 3886 B16R0.6603 CCCCCCC(=O)NCCOCCOCC 1626a_100102712874_100102632555 [0,0,1,0,0,0|3,0,0]=4 3887 B16R0.6603 CCCCCCC(=O)NCCOCCOCC 240690a_100102712874_100102632555 [0,0,1,0,0,0|3,0,0]=4 3888 B16R0.6603 CCCCCCC(=O)NCCOCCOCC 527a_100102712874_100102632555 [0,0,1,0,0,0|3,0,0]=4 3889 B16R0.6603 CCCCCCC(C)OCCCCCCCBr 34a_100000760002_100011215978 [0,0,1,0,0,0|2,0,1]=4 3890 B16R0.6603 CCCCCCC(C)OCCCCCCCBr 7a_100000760002_100011215978 [0,0,1,0,0,0|2,0,1]=4 3891 B16R0.6603 CCCCCCC(C)OCCCCCCCN 34a_100011996573_100011215978 [0,0,1,0,0,0|2,0,1]=4 3892 B16R0.6603 CCCCCCC(C)OCCCCCCCO 34a_100000210265_100000760002 [0,0,1,0,0,0|2,0,1]=4 3893 B16R0.6603 CCCCCCC(C)OCCCCCCCO 7a_100000210265_100000760002 [0,0,1,0,0,0|2,0,1]=4 3894 B16R0.6603 CCCCCCC(C)OCCCCCCOC 34a_100000210265_100011998445 [0,0,1,0,0,0|2,0,1]=4 3895 B16R0.6603 CCCCCCC(C)OCCCCCCOC 34a_200012092642_100011215978 [0,0,1,0,0,0|2,0,1]=4 3896 B16R0.6603 CCCCCCC(C)OCCCCCCOC 7a_100000210265_100011998445 [0,0,1,0,0,0|2,0,1]=4 3897 B16R0.6603 CCCCCCC(C)OCCCCCCOC 7a_200012092642_100011215978 [0,0,1,0,0,0|2,0,1]=4 3898 B16R0.6603 CCCCCCC(C)OCCCOCCCC 34a_200011215613_100011215978 [0,0,1,0,0,0|2,0,1]=4 3899 B16R0.6603 CCCCCCC(C)OCCCOCCCC 7a_200011215613_100011215978 [0,0,1,0,0,0|2,0,1]=4 3900 B16R0.6603 CCCCCCC(C)OCCNCCCCC 34a_100000224656_100011215978 [0,0,1,0,0,0|2,0,1]=4 3901 B16R0.6603 CCCCCCC(C)OCCOCCCCC 34a_100011215259_100011215978 [0,0,1,0,0,0|2,0,1]=4 3902 B16R0.6603 CCCCCCC(C)OCCOCCCCC 7a_100011215259_100011215978 [0,0,1,0,0,0|2,0,1]=4 3903 B16R0.6603 CCCCCCC=NNC(=O)CCCCCC 4a_100011221127_100000234349 [0,0,1,0,0,0|2,0,1]=4 3904 B16R0.6603 CCCCCCCC=CC(=O)CCCCCC 1458a_200015332781_100000210757 [0,0,1,0,0,0|1,0,1]=3 3905 B16R0.6603 CCCCCCCC=CC(=O)CCCCCF 1458a_200015332781_100000729378 [0,0,1,0,0,0|2,0,1]=4 3906 B16R0.6603 CCCCCCCC=CC(=O)CCCCCO 1458a_200015332781_100000746330 [0,0,1,0,0,0|2,0,1]=4 3907 B16R0.6603 CCCCCCCC=CC(=O)CCCCOC 1458a_200015332781_100000755781 [0,0,1,0,0,0|2,0,1]=4 3908 B16R0.6603 CCCCCCCC=CC(=O)CCCOCC 1458a_200015332781_100012232248 [0,0,1,0,0,0|2,0,1]=4 3909 B16R0.6603 CCCCCCCC=CC(=O)CCOCCC 1458a_200015332781_100011215938 [0,0,1,0,0,0|2,0,1]=4 3910 B16R0.6603 CCCCCCCC=CC(=O)COCCCC 1458a_200015332781_100011995733 [0,0,1,0,0,0|2,0,1]=4 3911 B16R0.6603 CCCCCCCC=CC(=O)NCCCCC 11a_100000209983_200015332781 [0,0,1,0,0,0|1,0,2]=4 3912 B16R0.6603 CCCCCCCC=CC(=O)NCCCCC 1626a_100000209983_200015332781 [0,0,1,0,0,0|1,0,2]=4 3913 B16R0.6603 CCCCCCCC=CC(=O)NCCCCC 240690a_100000209983_200015332781 [0,0,1,0,0,0|1,0,2]=4 3914 B16R0.6603 CCCCCCCCCC(=NNCCCC)C 4a_100025702795_100011215753 [0,0,1,0,0,0|3,0,0]=4 3915 B16R0.6603 CCCCCCCCCC(=O)CCCCC#N 1458a_100000210558_100000211819 [0,0,1,0,0,0|2,0,1]=4 3916 B16R0.6603 CCCCCCCCCC(=O)CCCCCC 1458a_100000210558_100000210757 [0,0,1,0,0,0|1,0,0]=2 3917 B16R0.6603 CCCCCCCCCC(=O)CCCCCC 1458a_100102632555_100000210670 [0,0,1,0,0,0|1,0,0]=2 3918 B16R0.6603 CCCCCCCCCC(=O)CCCCCF 1458a_100000210558_100000729378 [0,0,1,0,0,0|2,0,0]=3 3919 B16R0.6603 CCCCCCCCCC(=O)CCCCCO 1458a_100000210558_100000746330 [0,0,1,0,0,0|2,0,0]=3 3920 B16R0.6603 CCCCCCCCCC(=O)CCCCCO 1458a_100102619762_100000210670 [0,0,1,0,0,0|2,0,0]=3 3921 B16R0.6603 CCCCCCCCCC(=O)CCCCOC 1458a_100000210558_100000755781 [0,0,1,0,0,0|2,0,0]=3 3922 B16R0.6603 CCCCCCCCCC(=O)CCCOCC 1458a_100000210558_100012232248 [0,0,1,0,0,0|2,0,0]=3 3923 B16R0.6603 CCCCCCCCCC(=O)CCOCCC 1458a_100000210558_100011215938 [0,0,1,0,0,0|2,0,0]=3 3924 B16R0.6603 CCCCCCCCCC(=O)CCOCCO 1458a_100000210558_100011215305 [0,0,1,0,0,0|3,0,0]=4 3925 B16R0.6603 CCCCCCCCCC(=O)CCOCCO 1458a_100011229844_100000210670 [0,0,1,0,0,0|3,0,0]=4 3926 B16R0.6603 CCCCCCCCCC(=O)COCCCC 1458a_100000210558_100011995733 [0,0,1,0,0,0|2,0,0]=3 3927 B16R0.6603 CCCCCCCCCC(=O)COCCCC 1458a_100000757543_100000210670 [0,0,1,0,0,0|2,0,0]=3 3928 B16R0.6603 CCCCCCCCCC(=O)COCCOC 1458a_100000211095_100000210670 [0,0,1,0,0,0|3,0,0]=4 3929 B16R0.6603 CCCCCCCCCC(=O)CSCCCC 1458a_100000191162_100000210670 [0,0,1,0,0,0|2,0,0]=3 3930 B16R0.6603 CCCCCCCCCC(=O)NCCCCC 11a_100000209983_100000210558 [0,0,1,0,0,0|1,0,0]=2 3931 B16R0.6603 CCCCCCCCCC(=O)NCCCCC 1626a_100000209983_100000210558 [0,0,1,0,0,0|1,0,0]=2 3932 B16R0.6603 CCCCCCCCCC(=O)NCCCCC 240690a_100000209983_100000210558 [0,0,1,0,0,0|1,0,0]=2 3933 B16R0.6603 CCCCCCCCCC(=O)NCCCCC 527a_100000209983_100000210558 [0,0,1,0,0,0|1,0,0]=2 3934 B16R0.6603 CCCCCCCCCC(=O)NCCCCO 240690a_100000750430_100000210558 [0,0,1,0,0,0|2,0,0]=3 3935 B16R0.6603 CCCCCCCCCC(=O)NCCCCO 527a_100000750430_100000210558 [0,0,1,0,0,0|2,0,0]=3 3936 B16R0.6603 CCCCCCCCCC(=O)NCCCOC 1626a_100150723488_100000210558 [0,0,1,0,0,0|2,0,0]=3 3937 B16R0.6603 CCCCCCCCCC(=O)NCCCOC 240690a_100150723488_100000210558 [0,0,1,0,0,0|2,0,0]=3 3938 B16R0.6603 CCCCCCCCCC(=O)NCCCOC 527a_100150723488_100000210558 [0,0,1,0,0,0|2,0,0]=3 3939 B16R0.6603 CCCCCCCCCC(=O)NCCCSC 11a_100000749238_100000210558 [0,0,1,0,0,0|2,0,0]=3 3940 B16R0.6603 CCCCCCCCCC(=O)NCCCSC 1626a_100000749238_100000210558 [0,0,1,0,0,0|2,0,0]=3 3941 B16R0.6603 CCCCCCCCCC(=O)NCCCSC 240690a_100000749238_100000210558 [0,0,1,0,0,0|2,0,0]=3 3942 B16R0.6603 CCCCCCCCCC(=O)NCCCSC 527a_100000749238_100000210558 [0,0,1,0,0,0|2,0,0]=3 3943 B16R0.6603 CCCCCCCCCC(=O)NCCOCC 11a_100011200944_100000210558 [0,0,1,0,0,0|2,0,0]=3 3944 B16R0.6603 CCCCCCCCCC(=O)NCCOCC 1626a_102516460346_100000210558 [0,0,1,0,0,0|2,0,0]=3 3945 B16R0.6603 CCCCCCCCCC(=O)NCCOCC 240690a_100011200944_100000210558 [0,0,1,0,0,0|2,0,0]=3 3946 B16R0.6603 CCCCCCCCCC(=O)NCCOCC 527a_100011200944_100000210558 [0,0,1,0,0,0|2,0,0]=3 3947 B16R0.6603 CCCCCCCCCC(=O)NCCSCC 11a_100000106463_100000210558 [0,0,1,0,0,0|2,0,0]=3 3948 B16R0.6603 CCCCCCCCCC(=O)NCCSCC 1626a_100000106463_100000210558 [0,0,1,0,0,0|2,0,0]=3 3949 B16R0.6603 CCCCCCCCCC(=O)NCCSCC 240690a_100000106463_100000210558 [0,0,1,0,0,0|2,0,0]=3 3950 B16R0.6603 CCCCCCCCCC(=O)NCCSCC 527a_100000106463_100000210558 [0,0,1,0,0,0|2,0,0]=3 3951 B16R0.6603 CCCCCCCCCC(=O)NNCCCC 22a_100025702795_100000210558 [0,0,1,0,0,0|2,0,0]=3 3952 B16R0.6603 CCCCCCCCCC(=O)NNCCOC 22a_100000741390_100000210558 [0,0,1,0,0,0|3,0,0]=4 3953 B16R0.6603 CCCCCCCCCC(=O)OCNCCF 34a_100000724931_200010990708 [0,0,1,0,0,0|2,0,0]=3 3954 B16R0.6603 CCCCCCCCCC(=O)OCNCCO 2230a_100016997473_200010990708 [0,0,1,0,0,0|2,0,0]=3 3955 B16R0.6603 CCCCCCCCCC(=O)OCNCCO 34a_100016990907_200010990708 [0,0,1,0,0,0|2,0,0]=3 3956 B16R0.6603 CCCCCCCCCC(=O)OCOCCBr 34a_100000211926_200010990708 [0,0,1,0,0,0|2,0,0]=3 3957 B16R0.6603 CCCCCCCCCC(=O)OCOCCC 34a_100000210258_200010990708 [0,0,1,0,0,0|1,0,0]=2 3958 B16R0.6603 CCCCCCCCCC(=O)OCOCCN 34a_100000210304_200010990708 [0,0,1,0,0,0|2,0,0]=3 3959 B16R0.6603 CCCCCCCCCC(=O)OCSCC#N 62a_100011215382_200010990708 [0,0,1,0,0,0|2,0,1]=4 3960 B16R0.6603 CCCCCCCCCC(=O)OCSCC=O 62a_200015260668_200010990708 [0,0,1,0,0,0|2,0,1]=4 3961 B16R0.6603 CCCCCCCCCC(=O)OCSCCC 62a_100000210303_200010990708 [0,0,1,0,0,0|1,0,0]=2 3962 B16R0.6603 CCCCCCCCCC(=O)OCSCCF 62a_100011217306_200010990708 [0,0,1,0,0,0|2,0,0]=3 3963 B16R0.6603 CCCCCCCCCC(=O)OCSCCO 62a_100000211926_200010990708 [0,0,1,0,0,0|2,0,0]=3 3964 B16R0.6603 CCCCCCCCCC(=O)OCSCOC 62a_100000766300_200010990708 [0,0,1,0,0,0|2,0,0]=3 3965 B16R0.6603 CCCCCCCCCC(=O)OCSCSC 62a_100011218213_200010990708 [0,0,1,0,0,0|2,0,0]=3 3966 B16R0.6603 CCCCCCCCCC(C)NCCCCC 270004a_100000209983_100011215753 [0,0,1,0,0,0|2,0,1]=4 3967 B16R0.6603 CCCCCCCCCC(C)OCCCCC 34a_100011218016_100000718602 [0,0,1,0,0,0|1,0,1]=3 3968 B16R0.6603 CCCCCCCCCC(C)OCCCCC 7a_100011218016_100000210326 [0,0,1,0,0,0|1,0,1]=3 3969 B16R0.6603 CCCCCCCCCC(C)OCCCCF 34a_100011218016_100000729493 [0,0,1,0,0,0|2,0,1]=4 3970 B16R0.6603 CCCCCCCCCC(C)OCCCCF 7a_100011218016_100000729493 [0,0,1,0,0,0|2,0,1]=4 3971 B16R0.6603 CCCCCCCCCC(C)OCCCCO 34a_100011218016_100011216708 [0,0,1,0,0,0|2,0,1]=4 3972 B16R0.6603 CCCCCCCCCC(C)OCCCCO 7a_100011218016_100000210776 [0,0,1,0,0,0|2,0,1]=4 3973 B16R0.6603 CCCCCCCCCC(C)OCCCOC 34a_100011218016_100000740836 [0,0,1,0,0,0|2,0,1]=4 3974 B16R0.6603 CCCCCCCCCC(C)OCCCOC 7a_100011218016_100000740836 [0,0,1,0,0,0|2,0,1]=4 3975 B16R0.6603 CCCCCCCCCC(C)OCCOCC 34a_100011218016_100000210147 [0,0,1,0,0,0|2,0,1]=4 3976 B16R0.6603 CCCCCCCCCC(C)OCCOCC 7a_100011218016_100011215890 [0,0,1,0,0,0|2,0,1]=4 3977 B16R0.6603 CCCCCCCCCC(C)OCCSCC 34a_100011218016_100000757381 [0,0,1,0,0,0|2,0,1]=4 3978 B16R0.6603 CCCCCCCCCC(C)OCCSCC 7a_100011218016_100000757381 [0,0,1,0,0,0|2,0,1]=4 3979 B16R0.6603 CCCCCCCCCN(C)CCCCCC 2230a_100000232482_100000210314 [0,0,1,0,0,0|3,0,0]=4 3980 B16R0.6603 CCCCCCCCCN(C)CCCCCC 2230a_106256046315_100011214924 [0,0,1,0,0,0|3,0,0]=4 3981 B16R0.6603 CCCCCCCCCN(C)CCCCCC 269982a_100000232482_100000210757 [0,0,1,0,0,0|3,0,0]=4 3982 B16R0.6603 CCCCCCCCCN(C)CCCCCC 269982a_106256046315_100000210670 [0,0,1,0,0,0|3,0,0]=4 3983 B16R0.6603 CCCCCCCCNC(=O)CCCCCC 11a_100000229939_100102632555 [0,0,1,0,0,0|1,0,0]=2 3984 B16R0.6603 CCCCCCCCNC(=O)CCCCCC 1626a_100000229939_100102632555 [0,0,1,0,0,0|1,0,0]=2 3985 B16R0.6603 CCCCCCCCNC(=O)CCCCCC 240690a_100000229939_100102632555 [0,0,1,0,0,0|1,0,0]=2 3986 B16R0.6603 CCCCCCCCNC(=O)CCCCCC 527a_100000229939_100102632555 [0,0,1,0,0,0|1,0,0]=2 3987 B16R0.6603 CCCCCCCCNC(=O)CCCCCO 240690a_100000229939_100102619762 [0,0,1,0,0,0|2,0,0]=3 3988 B16R0.6603 CCCCCCCCNC(=O)CCOCCO 1626a_100000229939_100011229844 [0,0,1,0,0,0|3,0,0]=4 3989 B16R0.6603 CCCCCCCCNC(=O)CCOCCO 240690a_100000229939_100011229844 [0,0,1,0,0,0|3,0,0]=4 3990 B16R0.6603 CCCCCCCCNC(=O)COCCCC 11a_100000229939_100000757543 [0,0,1,0,0,0|2,0,0]=3 3991 B16R0.6603 CCCCCCCCNC(=O)COCCCC 1626a_100000229939_100000757543 [0,0,1,0,0,0|2,0,0]=3 3992 B16R0.6603 CCCCCCCCNC(=O)COCCCC 240690a_100000229939_100000757543 [0,0,1,0,0,0|2,0,0]=3 3993 B16R0.6603 CCCCCCCCNC(=O)COCCCC 527a_100000229939_100000757543 [0,0,1,0,0,0|2,0,0]=3 3994 B16R0.6603 CCCCCCCCNC(=O)COCCOC 11a_100000229939_100000211095 [0,0,1,0,0,0|3,0,0]=4 3995 B16R0.6603 CCCCCCCCNC(=O)COCCOC 1626a_100000229939_100000211095 [0,0,1,0,0,0|3,0,0]=4 3996 B16R0.6603 CCCCCCCCNC(=O)COCCOC 240690a_100000229939_100000211095 [0,0,1,0,0,0|3,0,0]=4 3997 B16R0.6603 CCCCCCCCNC(=O)COCCOC 527a_100000229939_100000211095 [0,0,1,0,0,0|3,0,0]=4 3998 B16R0.6603 CCCCCCCCNC(=O)CSCCCC 11a_100000229939_100000191162 [0,0,1,0,0,0|2,0,0]=3 3999 B16R0.6603 CCCCCCCCNC(=O)CSCCCC 1626a_100000229939_100000191162 [0,0,1,0,0,0|2,0,0]=3 4000 B16R0.6603 CCCCCCCCNC(=O)CSCCCC 240690a_100000229939_100000191162 [0,0,1,0,0,0|2,0,0]=3 4001 B16R0.6603 CCCCCCCCNC(=O)CSCCCC 527a_100000229939_100000191162 [0,0,1,0,0,0|2,0,0]=3 4002 B16R0.6603 CCCCCCCCNC(=O)NCCCCC 2708a_100000209983_100000229939 [0,0,1,0,0,0|2,0,0]=3 4003 B16R0.6603 CCCCCCCCNC(=O)NCCCCC 2708a_100000229939_100000209983 [0,0,1,0,0,0|2,0,0]=3 4004 B16R0.6603 CCCCCCCCNC(=O)NCCCCC 273464a_100000209983_100000229939 [0,0,1,0,0,0|2,0,0]=3 4005 B16R0.6603 CCCCCCCCNC(=O)NCCCCC 273464a_100000229939_100000209983 [0,0,1,0,0,0|2,0,0]=3 4006 B16R0.6603 CCCCCCCCNC(=O)NCCCCC 512a_100000209983_100000229939 [0,0,1,0,0,0|2,0,0]=3 4007 B16R0.6603 CCCCCCCCNC(=O)NCCCCC 512a_100000229939_100000209983 [0,0,1,0,0,0|2,0,0]=3 4008 B16R0.6603 CCCCCCCCNC(=O)NCCCCO 2708a_100000229939_100000750430 [0,0,1,0,0,0|3,0,0]=4 4009 B16R0.6603 CCCCCCCCNC(=O)NCCCCO 2708a_100000750430_100000229939 [0,0,1,0,0,0|3,0,0]=4 4010 B16R0.6603 CCCCCCCCNC(=O)NCCCCO 273464a_100000229939_100000750430 [0,0,1,0,0,0|3,0,0]=4 4011 B16R0.6603 CCCCCCCCNC(=O)NCCCCO 273464a_100000750430_100000229939 [0,0,1,0,0,0|3,0,0]=4 4012 B16R0.6603 CCCCCCCCNC(=O)NCCCCO 512a_100000229939_100000750430 [0,0,1,0,0,0|3,0,0]=4 4013 B16R0.6603 CCCCCCCCNC(=O)NCCCCO 512a_100000750430_100000229939 [0,0,1,0,0,0|3,0,0]=4 4014 B16R0.6603 CCCCCCCCNC(=O)NCCCOC 2708a_100000229939_100150723488 [0,0,1,0,0,0|3,0,0]=4 4015 B16R0.6603 CCCCCCCCNC(=O)NCCCOC 2708a_100150723488_100000229939 [0,0,1,0,0,0|3,0,0]=4 4016 B16R0.6603 CCCCCCCCNC(=O)NCCCOC 273464a_100000229939_100150723488 [0,0,1,0,0,0|3,0,0]=4 4017 B16R0.6603 CCCCCCCCNC(=O)NCCCOC 273464a_100150723488_100000229939 [0,0,1,0,0,0|3,0,0]=4 4018 B16R0.6603 CCCCCCCCNC(=O)NCCCOC 512a_100000229939_100150723488 [0,0,1,0,0,0|3,0,0]=4 4019 B16R0.6603 CCCCCCCCNC(=O)NCCCSC 2708a_100000229939_100000749238 [0,0,1,0,0,0|3,0,0]=4 4020 B16R0.6603 CCCCCCCCNC(=O)NCCCSC 2708a_100000749238_100000229939 [0,0,1,0,0,0|3,0,0]=4 4021 B16R0.6603 CCCCCCCCNC(=O)NCCCSC 273464a_100000229939_100000749238 [0,0,1,0,0,0|3,0,0]=4 4022 B16R0.6603 CCCCCCCCNC(=O)NCCCSC 273464a_100000749238_100000229939 [0,0,1,0,0,0|3,0,0]=4 4023 B16R0.6603 CCCCCCCCNC(=O)NCCCSC 512a_100000229939_100000749238 [0,0,1,0,0,0|3,0,0]=4 4024 B16R0.6603 CCCCCCCCNC(=O)NCCCSC 512a_100000749238_100000229939 [0,0,1,0,0,0|3,0,0]=4 4025 B16R0.6603 CCCCCCCCNC(=O)NCCOCC 2708a_100000229939_100011200944 [0,0,1,0,0,0|3,0,0]=4 4026 B16R0.6603 CCCCCCCCNC(=O)NCCOCC 2708a_100011200944_100000229939 [0,0,1,0,0,0|3,0,0]=4 4027 B16R0.6603 CCCCCCCCNC(=O)NCCOCC 273464a_100000229939_102516460346 [0,0,1,0,0,0|3,0,0]=4 4028 B16R0.6603 CCCCCCCCNC(=O)NCCOCC 273464a_102516460346_100000229939 [0,0,1,0,0,0|3,0,0]=4 4029 B16R0.6603 CCCCCCCCNC(=O)NCCOCC 512a_100000229939_100011200944 [0,0,1,0,0,0|3,0,0]=4 4030 B16R0.6603 CCCCCCCCNC(=O)NCCOCC 512a_100011200944_100000229939 [0,0,1,0,0,0|3,0,0]=4 4031 B16R0.6603 CCCCCCCCNC(=O)NCCSCC 2708a_100000106463_100000229939 [0,0,1,0,0,0|3,0,0]=4 4032 B16R0.6603 CCCCCCCCNC(=O)NCCSCC 2708a_100000229939_100000106463 [0,0,1,0,0,0|3,0,0]=4 4033 B16R0.6603 CCCCCCCCNC(=O)NCCSCC 273464a_100000106463_100000229939 [0,0,1,0,0,0|3,0,0]=4 4034 B16R0.6603 CCCCCCCCNC(=O)NCCSCC 273464a_100000229939_100000106463 [0,0,1,0,0,0|3,0,0]=4 4035 B16R0.6603 CCCCCCCCNC(=O)NCCSCC 512a_100000106463_100000229939 [0,0,1,0,0,0|3,0,0]=4 4036 B16R0.6603 CCCCCCCCNC(=O)NCCSCC 512a_100000229939_100000106463 [0,0,1,0,0,0|3,0,0]=4 4037 B16R0.6603 CCCCCCCCNC(=O)NNCCCC 273464a_100000229939_100025702795 [0,0,1,0,0,0|3,0,0]=4 4038 B16R0.6603 CCCCCCCCNC(=O)NNCCCC 512a_100000229939_100025702795 [0,0,1,0,0,0|3,0,0]=4 4039 B16R0.6603 CCCCCCCCNC(=O)NNCCCC 512a_100025702795_100000229939 [0,0,1,0,0,0|3,0,0]=4 4040 B16R0.6603 CCCCCCCCNC(C)CCCCCC 2230a_100000210919_100000210759 [0,0,1,0,0,0|2,0,1]=4 4041 B16R0.6603 CCCCCCCCNC(C)CCCCCC 2230a_100000229939_100011215978 [0,0,1,0,0,0|2,0,1]=4 4042 B16R0.6603 CCCCCCCCNC(C)CCCCCC 270004a_100000229939_100000210826 [0,0,1,0,0,0|2,0,1]=4 4043 B16R0.6603 CCCCCCCCNC(C)CCCCCC 34a_100000210919_100000210759 [0,0,1,0,0,0|2,0,1]=4 4044 B16R0.6603 CCCCCCCCNC(C)CCCCCC 34a_100000229939_100011215978 [0,0,1,0,0,0|2,0,1]=4 4045 B16R0.6603 CCCCCCCCOC(C)CCCCCC 34a_100000210232_100011215978 [0,0,1,0,0,0|1,0,1]=3 4046 B16R0.6603 CCCCCCCCOC(C)CCCCCC 34a_100000210265_100000210759 [0,0,1,0,0,0|1,0,1]=3 4047 B16R0.6603 CCCCCCCCOC(C)CCCCCC 7a_100000210232_100011215978 [0,0,1,0,0,0|1,0,1]=3 4048 B16R0.6603 CCCCCCCCOC(C)CCCCCC 7a_100000210265_100000210759 [0,0,1,0,0,0|1,0,1]=3 4049 B16R0.6603 CCCCCCCCOC(C)COCCCC 34a_100011217071_100000210759 [0,0,1,0,0,0|2,0,1]=4 4050 B16R0.6603 CCCCCCCCOC(C)COCCCC 7a_100011217071_100000210759 [0,0,1,0,0,0|2,0,1]=4 4051 B16R0.6603 CCCCCCCNCC(=O)NCCCCC 2230a_100000229938_100000230301 [0,0,1,0,0,0|2,0,0]=3 4052 B16R0.6603 CCCCCCCNCC(=O)NCCCOC 2230a_100000229938_100000183178 [0,0,1,0,0,0|3,0,0]=4 4053 B16R0.6603 CCCCCCCNCC(=O)OCCOCC 2230a_100000229938_200000101388 [0,0,1,0,0,0|2,0,0]=3 4054 B16R0.6603 CCCCCCCOCC(=O)NCCCCC 34a_100000210272_100000230301 [0,0,1,0,0,0|2,0,0]=3 4055 B16R0.6603 CCCCCCCOCC(=O)NCCCCC 7a_100000210272_100000230301 [0,0,1,0,0,0|2,0,0]=3 4056 B16R0.6603 CCCCCCCOCC(=O)NCCCOC 34a_100000210272_100000183178 [0,0,1,0,0,0|3,0,0]=4 4057 B16R0.6603 CCCCCCCOCC(=O)NCCCOC 7a_100000210272_100000183178 [0,0,1,0,0,0|3,0,0]=4 4058 B16R0.6603 CCCCCCCOCC(=O)OCCOCC 34a_100000210272_200000101388 [0,0,1,0,0,0|2,0,0]=3 4059 B16R0.6603 CCCCCCCOCC(=O)OCCOCC 7a_100000210272_200000101388 [0,0,1,0,0,0|2,0,0]=3 4060 B16R0.6603 CCCCCCCSCC(=O)NCCCCC 62a_100000210614_100000230301 [0,0,1,0,0,0|2,0,0]=3 4061 B16R0.6603 CCCCCCCSCC(=O)NCCCCC 62a_100000230301_100000210316 [0,0,1,0,0,0|2,0,0]=3 4062 B16R0.6603 CCCCCCCSCC(=O)NCCCOC 62a_100000183178_100000210316 [0,0,1,0,0,0|3,0,0]=4 4063 B16R0.6603 CCCCCCCSCC(=O)OCCOCC 62a_100000210614_200000101388 [0,0,1,0,0,0|2,0,0]=3 4064 B16R0.6603 CCCCCCCSCC(=O)OCCOCC 62a_200000101388_100000210316 [0,0,1,0,0,0|2,0,0]=3 4065 B16R0.6603 CCCCCNC(=O)CCCCCCCCO 240690a_100000209983_100000015970 [0,0,1,0,0,0|2,0,0]=3 4066 B16R0.6603 CCCCCNC(=O)CNCCCCCCO 2230a_100000686447_100000230301 [0,0,1,0,0,0|3,0,0]=4 4067 B16R0.6603 CCCCCNC(=O)CNCCCCCCO 34a_100000686447_100000230301 [0,0,1,0,0,0|3,0,0]=4 4068 B16R0.6603 CCCCCNC(=O)CNCCCCCOC 2230a_100000747528_100000230301 [0,0,1,0,0,0|3,0,0]=4 4069 B16R0.6603 CCCCCNC(=O)CNCCCCCOC 34a_100000747528_100000230301 [0,0,1,0,0,0|3,0,0]=4 4070 B16R0.6603 CCCCCNC(=O)CNCCCOCCC 2230a_100011217757_100000230301 [0,0,1,0,0,0|3,0,0]=4 4071 B16R0.6603 CCCCCNC(=O)CNCCCOCCC 34a_100011217757_100000230301 [0,0,1,0,0,0|3,0,0]=4 4072 B16R0.6603 CCCCCNC(=O)CNCCSCCCC 2230a_100025743550_100000230301 [0,0,1,0,0,0|3,0,0]=4 4073 B16R0.6603 CCCCCNC(=O)COCCCCCCBr 34a_100011215345_100000230301 [0,0,1,0,0,0|3,0,0]=4 4074 B16R0.6603 CCCCCNC(=O)COCCCCCCBr 7a_100011215345_100000230301 [0,0,1,0,0,0|3,0,0]=4 4075 B16R0.6603 CCCCCNC(=O)COCCCCCCCl 34a_100000766143_100000230301 [0,0,1,0,0,0|3,0,0]=4 4076 B16R0.6603 CCCCCNC(=O)COCCCCCCCl 7a_100000766143_100000230301 [0,0,1,0,0,0|3,0,0]=4 4077 B16R0.6603 CCCCCNC(=O)COCCCCCCF 34a_100000732779_100000230301 [0,0,1,0,0,0|3,0,0]=4 4078 B16R0.6603 CCCCCNC(=O)COCCCCCCF 7a_100000732779_100000230301 [0,0,1,0,0,0|3,0,0]=4 4079 B16R0.6603 CCCCCNC(=O)COCCCCCCN 34a_100000686447_100000230301 [0,0,1,0,0,0|3,0,0]=4 4080 B16R0.6603 CCCCCNC(=O)COCCCCCNC 34a_100000722520_100000230301 [0,0,1,0,0,0|3,0,0]=4 4081 B16R0.6603 CCCCCNC(=O)COCCOCCCC 11a_100000209983_100011216887 [0,0,1,0,0,0|3,0,0]=4 4082 B16R0.6603 CCCCCNC(=O)COCCOCCCC 1626a_100000209983_100011216887 [0,0,1,0,0,0|3,0,0]=4 4083 B16R0.6603 CCCCCNC(=O)COCCOCCCC 240690a_100000209983_100011216887 [0,0,1,0,0,0|3,0,0]=4 4084 B16R0.6603 CCCCCNC(=O)COCCOCCCC 34a_100000210238_100000230301 [0,0,1,0,0,0|3,0,0]=4 4085 B16R0.6603 CCCCCNC(=O)COCCOCCCC 527a_100000209983_100011216887 [0,0,1,0,0,0|3,0,0]=4 4086 B16R0.6603 CCCCCNC(=O)COCCOCCCC 7a_100000210238_100000230301 [0,0,1,0,0,0|3,0,0]=4 4087 B16R0.6603 CCCCCNC(=O)COCCSCCCC 34a_200000230436_100000230301 [0,0,1,0,0,0|3,0,0]=4 4088 B16R0.6603 CCCCCNC(=O)COCCSCCCC 7a_200000230436_100000230301 [0,0,1,0,0,0|3,0,0]=4 4089 B16R0.6603 CCCCCNC(=O)CSCCCCCCF 62a_100000230301_100015922095 [0,0,1,0,0,0|3,0,0]=4 4090 B16R0.6603 CCCCCNC(=O)CSCCCCCCF 62a_100015922095_100000230301 [0,0,1,0,0,0|3,0,0]=4 4091 B16R0.6603 CCCCCNC(=O)CSCCCCCCO 62a_100000230301_100000766143 [0,0,1,0,0,0|3,0,0]=4 4092 B16R0.6603 CCCCCNC(=O)CSCCCCCCO 62a_100000766143_100000230301 [0,0,1,0,0,0|3,0,0]=4 4093 B16R0.6603 CCCCCNC(=O)CSCCOCCCC 62a_100000230301_100000743108 [0,0,1,0,0,0|3,0,0]=4 4094 B16R0.6603 CCCCCNC(=O)CSCCOCCCC 62a_100000743108_100000230301 [0,0,1,0,0,0|3,0,0]=4 4095 B16R0.6603 CCCCCNC(=O)NCCCCCCCO 2708a_100000209983_100011996573 [0,0,1,0,0,0|3,0,0]=4 4096 B16R0.6603 CCCCCNC(=O)NCCCCCCCO 2708a_100011996573_100000209983 [0,0,1,0,0,0|3,0,0]=4 4097 B16R0.6603 CCCCCNC(=O)NCCCCCCCO 273464a_100000209983_100011996573 [0,0,1,0,0,0|3,0,0]=4 4098 B16R0.6603 CCCCCNC(=O)NCCCCCCCO 273464a_100011996573_100000209983 [0,0,1,0,0,0|3,0,0]=4 4099 B16R0.6603 CCCCCNC(=O)NCCCCCCCO 512a_100000209983_100011996573 [0,0,1,0,0,0|3,0,0]=4 4100 B16R0.6603 CCCCCNC(=O)NCCCCCCCO 512a_100011996573_100000209983 [0,0,1,0,0,0|3,0,0]=4 4101 B16R0.6603 CCCCCNC(=O)NCCCOCCCC 2708a_100000209983_200000211371 [0,0,1,0,0,0|3,0,0]=4 4102 B16R0.6603 CCCCCNC(=O)NCCCOCCCC 2708a_200000211371_100000209983 [0,0,1,0,0,0|3,0,0]=4 4103 B16R0.6603 CCCCCNC(=O)NCCCOCCCC 273464a_100000209983_200000211371 [0,0,1,0,0,0|3,0,0]=4 4104 B16R0.6603 CCCCCNC(=O)NCCCOCCCC 273464a_200000211371_100000209983 [0,0,1,0,0,0|3,0,0]=4 4105 B16R0.6603 CCCCCNC(=O)NCCCOCCCC 512a_100000209983_200000211371 [0,0,1,0,0,0|3,0,0]=4 4106 B16R0.6603 CCCCCNC(=O)NCCCOCCCC 512a_200000211371_100000209983 [0,0,1,0,0,0|3,0,0]=4 4107 B16R0.6603 CCCCNNC(=O)CCCCCCCCO 22a_100025702795_100000015970 [0,0,1,0,0,0|3,0,0]=4 4108 B16R0.6603 CCCCOCC(=O)CCCCCCCCO 1458a_100000757543_100000033203 [0,0,1,0,0,0|3,0,0]=4 4109 B16R0.6603 CCCCOCC(=O)NCCCCCCCO 240690a_100011996573_100000757543 [0,0,1,0,0,0|3,0,0]=4 4110 B16R0.6603 CCCCOCCCNC(=O)CCCCCO 240690a_200000211371_100102619762 [0,0,1,0,0,0|3,0,0]=4 4111 B16R0.6603 CCCCOCCCNC(=O)COCCCC 1626a_200000211371_100000757543 [0,0,1,0,0,0|3,0,0]=4 4112 B16R0.6603 CCCCOCCCNC(=O)COCCCC 240690a_200000211371_100000757543 [0,0,1,0,0,0|3,0,0]=4 4113 B16R0.6603 CCCCOCCCNC(=O)COCCCC 527a_200000211371_100000757543 [0,0,1,0,0,0|3,0,0]=4 4114 B16R0.6603 CCCCOCCCNC(=O)CSCCCC 1626a_200000211371_100000191162 [0,0,1,0,0,0|3,0,0]=4 4115 B16R0.6603 CCCCOCCCNC(=O)CSCCCC 240690a_200000211371_100000191162 [0,0,1,0,0,0|3,0,0]=4 4116 B16R0.6603 CCCCOCCCNC(=O)CSCCCC 527a_200000211371_100000191162 [0,0,1,0,0,0|3,0,0]=4 4117 B16R0.6603 CCCCOCCOCC(=O)OCCOCC 34a_100000210238_200000101388 [0,0,1,0,0,0|3,0,0]=4 4118 B16R0.6603 CCCCOCCOCC(=O)OCCOCC 7a_100000210238_200000101388 [0,0,1,0,0,0|3,0,0]=4 4119 B16R0.6603 CCCCOCCSCC(=O)OCCOCC 62a_100000743108_200000101388 [0,0,1,0,0,0|3,0,0]=4 4120 B16R0.6603 CCCCOCCSCC(=O)OCCOCC 62a_200000101388_100000743108 [0,0,1,0,0,0|3,0,0]=4 4121 B16R0.6603 CCCCSCC(=O)CCCCCCCCO 1458a_100000191162_100000033203 [0,0,1,0,0,0|3,0,0]=4 4122 B16R0.6603 CCCCSCC(=O)NCCCCCCCO 240690a_100011996573_100000191162 [0,0,1,0,0,0|3,0,0]=4 4123 B16R0.6603 CCCCSCCNCC(=O)OCCOCC 2230a_100025743550_200000101388 [0,0,1,0,0,0|3,0,0]=4 4124 B16R0.6603 CCCCSCCOCC(=O)OCCOCC 34a_200000230436_200000101388 [0,0,1,0,0,0|3,0,0]=4 4125 B16R0.6603 CCCCSCCOCC(=O)OCCOCC 7a_200000230436_200000101388 [0,0,1,0,0,0|3,0,0]=4 4126 B16R0.6603 CCCOCCCNCC(=O)OCCOCC 2230a_100011217757_200000101388 [0,0,1,0,0,0|3,0,0]=4 4127 B16R0.6603 CCCOCCCNCC(=O)OCCOCC 34a_100011217757_200000101388 [0,0,1,0,0,0|3,0,0]=4 4128 B16R0.6603 CCOCCNC(=O)CCCCCCCCO 240690a_100011200944_100000015970 [0,0,1,0,0,0|3,0,0]=4 4129 B16R0.6603 CCOCCOC(=O)CNCCCCCCO 2230a_100000686447_200000101388 [0,0,1,0,0,0|3,0,0]=4 4130 B16R0.6603 CCOCCOC(=O)CNCCCCCCO 34a_100000686447_200000101388 [0,0,1,0,0,0|3,0,0]=4 4131 B16R0.6603 CCOCCOC(=O)CNCCCCCOC 2230a_100000747528_200000101388 [0,0,1,0,0,0|3,0,0]=4 4132 B16R0.6603 CCOCCOC(=O)CNCCCCCOC 34a_100000747528_200000101388 [0,0,1,0,0,0|3,0,0]=4 4133 B16R0.6603 CCOCCOC(=O)COCCCCCCBr 34a_100011215345_200000101388 [0,0,1,0,0,0|3,0,0]=4 4134 B16R0.6603 CCOCCOC(=O)COCCCCCCBr 7a_100011215345_200000101388 [0,0,1,0,0,0|3,0,0]=4 4135 B16R0.6603 CCOCCOC(=O)COCCCCCCCl 34a_100000766143_200000101388 [0,0,1,0,0,0|3,0,0]=4 4136 B16R0.6603 CCOCCOC(=O)COCCCCCCCl 7a_100000766143_200000101388 [0,0,1,0,0,0|3,0,0]=4 4137 B16R0.6603 CCOCCOC(=O)COCCCCCCF 34a_100000732779_200000101388 [0,0,1,0,0,0|3,0,0]=4 4138 B16R0.6603 CCOCCOC(=O)COCCCCCCF 7a_100000732779_200000101388 [0,0,1,0,0,0|3,0,0]=4 4139 B16R0.6603 CCOCCOC(=O)COCCCCCCN 34a_100000686447_200000101388 [0,0,1,0,0,0|3,0,0]=4 4140 B16R0.6603 CCOCCOC(=O)COCCCCCNC 34a_100000722520_200000101388 [0,0,1,0,0,0|3,0,0]=4 4141 B16R0.6603 CCOCCOC(=O)CSCCCCCCF 62a_100015922095_200000101388 [0,0,1,0,0,0|3,0,0]=4 4142 B16R0.6603 CCOCCOC(=O)CSCCCCCCF 62a_200000101388_100015922095 [0,0,1,0,0,0|3,0,0]=4 4143 B16R0.6603 CCOCCOC(=O)CSCCCCCCO 62a_100000766143_200000101388 [0,0,1,0,0,0|3,0,0]=4 4144 B16R0.6603 CCOCCOC(=O)CSCCCCCCO 62a_200000101388_100000766143 [0,0,1,0,0,0|3,0,0]=4 4145 B16R0.6603 CCSCCNC(=O)CCCCCCCCO 240690a_100000106463_100000015970 [0,0,1,0,0,0|3,0,0]=4 4146 B16R0.6603 COCCCNC(=O)CCCCCCCCO 240690a_100150723488_100000015970 [0,0,1,0,0,0|3,0,0]=4 4147 B16R0.6603 CSCCCNC(=O)CCCCCCCCO 240690a_100000749238_100000015970 [0,0,1,0,0,0|3,0,0]=4 4148 B16R0.6603 O=C(CCCCCCCCO)NCCCCO 240690a_100000750430_100000015970 [0,0,1,0,0,0|3,0,0]=4 4149 B16R0.6603 O=C(CCCCCO)CCCCCCCCO 1458a_100102619762_100000033203 [0,0,1,0,0,0|3,0,0]=4 4150 B16R0.6603 O=C(CCCCCO)NCCCCCCCO 240690a_100011996573_100102619762 [0,0,1,0,0,0|3,0,0]=4 4151 B15R0.70 C/C=C/CCOCCCCCCCCCC 34a_100016278192_100000210320 [1,0,1,0,0,0|2,0,0]=4 4152 B15R0.70 C/C=C/CNCCCCCCCCCCC 34a_200011215754_100102629194 [1,0,1,0,0,0|2,0,0]=4 4153 B15R0.70 C/C=C/COCCCCCCCCCCC 34a_100000210809_100102629194 [1,0,1,0,0,0|2,0,0]=4 4154 B15R0.70 C/C=C/COCCCCCCCCCCC 34a_100016270725_100011215454 [1,0,1,0,0,0|2,0,0]=4 4155 B15R0.70 C/C=C/COCCCCCCCCCCC 7a_100000210809_100102629194 [1,0,1,0,0,0|2,0,0]=4 4156 B15R0.70 C/C=C/CSCCCCCCCCCCC 62a_100102629194_100011215454 [1,0,1,0,0,0|2,0,0]=4 4157 B15R0.70 C=CCCCCCCCCCCCNCC 2230a_100015525214_102130925996 [1,0,1,0,0,0|2,0,0]=4 4158 B15R0.70 C=CCCCCCCCCCCCOCC 34a_100121572206_102130925996 [1,0,1,0,0,0|2,0,0]=4 4159 B15R0.70 C=CCCCCCCCCCCCSCC 62a_100000210202_102130925996 [1,0,1,0,0,0|2,0,0]=4 4160 B15R0.70 C=CCCCCCCCCCCCSCC 62a_102130925996_100000210202 [1,0,1,0,0,0|2,0,0]=4 4161 B15R0.70 C=CCCCCCCCCCCNCCO 2230a_100016997473_100011093070 [1,0,1,0,0,0|1,0,1]=4 4162 B15R0.70 C=CCCCCCCCCCCNCCO 34a_100016990907_100011093070 [1,0,1,0,0,0|1,0,1]=4 4163 B15R0.70 C=CCCCCCCCCCCOCCC 34a_100000210258_100011093070 [1,0,1,0,0,0|2,0,0]=4 4164 B15R0.70 C=CCCCCCCCCCCSCCC 62a_100000210303_100011093070 [1,0,1,0,0,0|2,0,0]=4 4165 B15R0.70 C=CCCCCCCCCCCSCCC 62a_100011093070_100000210303 [1,0,1,0,0,0|2,0,0]=4 4166 B15R0.70 C=CCCCCCCCCCCSCCO 62a_100000211926_100011093070 [1,0,1,0,0,0|1,0,1]=4 4167 B15R0.70 C=CCCCCCCCCCCSCCO 62a_100011093070_100000211926 [1,0,1,0,0,0|1,0,1]=4 4168 B15R0.70 C=CCCCCCCCCCNCCCC 2230a_100000081888_100000210211 [1,0,1,0,0,0|2,0,0]=4 4169 B15R0.70 C=CCCCCCCCCCNCCCC 2230a_100000102301_100009814027 [1,0,1,0,0,0|2,0,0]=4 4170 B15R0.70 C=CCCCCCCCCCNCCCC 34a_100000081888_100000210210 [1,0,1,0,0,0|2,0,0]=4 4171 B15R0.70 C=CCCCCCCCCCNCCCC 7a_106832991798_100009814027 [1,0,1,0,0,0|2,0,0]=4 4172 B15R0.70 C=CCCCCCCCCCNCCCO 2230a_100000081888_100000230001 [1,0,1,0,0,0|1,0,1]=4 4173 B15R0.70 C=CCCCCCCCCCNCCCO 34a_100000081888_100000230001 [1,0,1,0,0,0|1,0,1]=4 4174 B15R0.70 C=CCCCCCCCCCOCCCC 34a_100000038209_100000210210 [1,0,1,0,0,0|2,0,0]=4 4175 B15R0.70 C=CCCCCCCCCCOCCCC 34a_100000210227_100009814027 [1,0,1,0,0,0|2,0,0]=4 4176 B15R0.70 C=CCCCCCCCCCOCCCC 7a_100000038209_100000210211 [1,0,1,0,0,0|2,0,0]=4 4177 B15R0.70 C=CCCCCCCCCCOCCCC 7a_100000210227_100009814027 [1,0,1,0,0,0|2,0,0]=4 4178 B15R0.70 C=CCCCCCCCCCOCCCO 34a_100000038209_100000230001 [1,0,1,0,0,0|1,0,1]=4 4179 B15R0.70 C=CCCCCCCCCCOCCCO 7a_100000038209_100011215043 [1,0,1,0,0,0|1,0,1]=4 4180 B15R0.70 C=CCCCCCCCCCSCCCC 62a_100000210211_100009814027 [1,0,1,0,0,0|2,0,0]=4 4181 B15R0.70 C=CCCCCCCCCCSCCCC 62a_100009814027_100000210210 [1,0,1,0,0,0|2,0,0]=4 4182 B15R0.70 C=CCCCCCCCCCSCCCO 62a_100009814027_100011215043 [1,0,1,0,0,0|1,0,1]=4 4183 B15R0.70 C=CCCCCCCCCCSCCCO 62a_100011215043_100009814027 [1,0,1,0,0,0|1,0,1]=4 4184 B15R0.70 C=CCCCCCCCCNCCCCC 2230a_100000209983_100011933949 [1,0,1,0,0,0|2,0,0]=4 4185 B15R0.70 C=CCCCCCCCCNCCCCO 2230a_100000750430_100011933949 [1,0,1,0,0,0|1,0,1]=4 4186 B15R0.70 C=CCCCCCCCCNCCCCO 34a_100000750430_100011933949 [1,0,1,0,0,0|1,0,1]=4 4187 B15R0.70 C=CCCCCCCCCOCCCCC 34a_100000210253_100011933949 [1,0,1,0,0,0|2,0,0]=4 4188 B15R0.70 C=CCCCCCCCCOCCCCC 34a_100011215194_100000718602 [1,0,1,0,0,0|2,0,0]=4 4189 B15R0.70 C=CCCCCCCCCOCCCCC 7a_100000210253_100011933949 [1,0,1,0,0,0|2,0,0]=4 4190 B15R0.70 C=CCCCCCCCCOCCCCC 7a_100011215194_100000210326 [1,0,1,0,0,0|2,0,0]=4 4191 B15R0.70 C=CCCCCCCCCOCCCCO 34a_100011215194_100011216708 [1,0,1,0,0,0|1,0,1]=4 4192 B15R0.70 C=CCCCCCCCCOCCCCO 7a_100011215194_100000210776 [1,0,1,0,0,0|1,0,1]=4 4193 B15R0.70 C=CCCCCCCCCSCCCCC 62a_100000210326_100011933949 [1,0,1,0,0,0|2,0,0]=4 4194 B15R0.70 C=CCCCCCCCCSCCCCC 62a_100011933949_100000210326 [1,0,1,0,0,0|2,0,0]=4 4195 B15R0.70 C=CCCCCCCCCSCCCCO 62a_100000210776_100011933949 [1,0,1,0,0,0|1,0,1]=4 4196 B15R0.70 C=CCCCCCCCCSCCCCO 62a_100011933949_100000210776 [1,0,1,0,0,0|1,0,1]=4 4197 B15R0.70 C=CCCCCCCCNCCCCCC 2230a_100000210581_100012355270 [1,0,1,0,0,0|2,0,0]=4 4198 B15R0.70 C=CCCCCCCCNCCCCCO 2230a_100000762737_100012355270 [1,0,1,0,0,0|1,0,1]=4 4199 B15R0.70 C=CCCCCCCCNCCCCCO 34a_100000762737_100012355270 [1,0,1,0,0,0|1,0,1]=4 4200 B15R0.70 C=CCCCCCCCOCCCCCC 34a_100000210259_100012355270 [1,0,1,0,0,0|2,0,0]=4 4201 B15R0.70 C=CCCCCCCCOCCCCCC 34a_100000730831_100000210314 [1,0,1,0,0,0|2,0,0]=4 4202 B15R0.70 C=CCCCCCCCOCCCCCC 7a_100000210259_100012355270 [1,0,1,0,0,0|2,0,0]=4 4203 B15R0.70 C=CCCCCCCCOCCCCCC 7a_100000730831_100000210314 [1,0,1,0,0,0|2,0,0]=4 4204 B15R0.70 C=CCCCCCCCOCCCCCO 34a_100000730831_100000746330 [1,0,1,0,0,0|1,0,1]=4 4205 B15R0.70 C=CCCCCCCCOCCCCCO 7a_100000730831_100000746330 [1,0,1,0,0,0|1,0,1]=4 4206 B15R0.70 C=CCCCCCCCSCCCCCC 62a_100000210314_100012355270 [1,0,1,0,0,0|2,0,0]=4 4207 B15R0.70 C=CCCCCCCCSCCCCCC 62a_100012355270_100000210757 [1,0,1,0,0,0|2,0,0]=4 4208 B15R0.70 C=CCCCCCCCSCCCCCO 62a_100000746330_100012355270 [1,0,1,0,0,0|1,0,1]=4 4209 B15R0.70 C=CCCCCCCCSCCCCCO 62a_100012355270_100000746330 [1,0,1,0,0,0|1,0,1]=4 4210 B15R0.70 C=CCCCCCCNCCCCCCC 2230a_100000229938_100011215473 [1,0,1,0,0,0|2,0,0]=4 4211 B15R0.70 C=CCCCCCCNCCCCCCO 2230a_100000686447_100011215473 [1,0,1,0,0,0|1,0,1]=4 4212 B15R0.70 C=CCCCCCCNCCCCCCO 34a_100000686447_100011215473 [1,0,1,0,0,0|1,0,1]=4 4213 B15R0.70 C=CCCCCCCOCCCCCCC 34a_100000210272_100011215473 [1,0,1,0,0,0|2,0,0]=4 4214 B15R0.70 C=CCCCCCCOCCCCCCC 34a_200011216477_100000210614 [1,0,1,0,0,0|2,0,0]=4 4215 B15R0.70 C=CCCCCCCOCCCCCCC 7a_100000210272_100011215473 [1,0,1,0,0,0|2,0,0]=4 4216 B15R0.70 C=CCCCCCCOCCCCCCC 7a_200011216477_100000210614 [1,0,1,0,0,0|2,0,0]=4 4217 B15R0.70 C=CCCCCCCOCCCCCCO 34a_200011216477_100000766143 [1,0,1,0,0,0|1,0,1]=4 4218 B15R0.70 C=CCCCCCCOCCCCCCO 7a_200011216477_100000766143 [1,0,1,0,0,0|1,0,1]=4 4219 B15R0.70 C=CCCCCCCSCCCCCCC 62a_100000210614_100011215473 [1,0,1,0,0,0|2,0,0]=4 4220 B15R0.70 C=CCCCCCCSCCCCCCC 62a_100011215473_100000210316 [1,0,1,0,0,0|2,0,0]=4 4221 B15R0.70 C=CCCCCCCSCCCCCCO 62a_100000766143_100011215473 [1,0,1,0,0,0|1,0,1]=4 4222 B15R0.70 C=CCCCCCCSCCCCCCO 62a_100011215473_100000766143 [1,0,1,0,0,0|1,0,1]=4 4223 B15R0.70 C=CCCCCCNCCCCCCCC 2230a_100000229939_100000700193 [1,0,1,0,0,0|2,0,0]=4 4224 B15R0.70 C=CCCCCCNCCCCCCCC 34a_100000229939_100000700193 [1,0,1,0,0,0|2,0,0]=4 4225 B15R0.70 C=CCCCCCNCCCCCCCO 2230a_100011996573_100000700193 [1,0,1,0,0,0|1,0,1]=4 4226 B15R0.70 C=CCCCCCNCCCCCCCO 34a_100011996573_100000700193 [1,0,1,0,0,0|1,0,1]=4 4227 B15R0.70 C=CCCCCCOCCCCCCCC 34a_100000210232_100000700193 [1,0,1,0,0,0|2,0,0]=4 4228 B15R0.70 C=CCCCCCOCCCCCCCC 34a_100011216702_100000210759 [1,0,1,0,0,0|2,0,0]=4 4229 B15R0.70 C=CCCCCCOCCCCCCCC 7a_100000210232_100000700193 [1,0,1,0,0,0|2,0,0]=4 4230 B15R0.70 C=CCCCCCOCCCCCCCC 7a_100011216702_100000210759 [1,0,1,0,0,0|2,0,0]=4 4231 B15R0.70 C=CCCCCCOCCCCCCCO 34a_100011216702_100000760002 [1,0,1,0,0,0|1,0,1]=4 4232 B15R0.70 C=CCCCCCOCCCCCCCO 7a_100011216702_100000760002 [1,0,1,0,0,0|1,0,1]=4 4233 B15R0.70 C=CCCCCCSCCCCCCCC 62a_100000210759_100000700193 [1,0,1,0,0,0|2,0,0]=4 4234 B15R0.70 C=CCCCCCSCCCCCCCC 62a_100000700193_100000210317 [1,0,1,0,0,0|2,0,0]=4 4235 B15R0.70 C=CCCCCCSCCCCCCCO 62a_100000700193_100000760002 [1,0,1,0,0,0|1,0,1]=4 4236 B15R0.70 C=CCCCCCSCCCCCCCO 62a_100000760002_100000700193 [1,0,1,0,0,0|1,0,1]=4 4237 B15R0.70 C=CCCCCNCCCCCCCCC 2230a_100000212291_100011215482 [1,0,1,0,0,0|2,0,0]=4 4238 B15R0.70 C=CCCCCNCCCCCCCCC 2230a_100000703577_100011214924 [1,0,1,0,0,0|2,0,0]=4 4239 B15R0.70 C=CCCCCNCCCCCCCCC 34a_100000212291_100011215482 [1,0,1,0,0,0|2,0,0]=4 4240 B15R0.70 C=CCCCCNCCCCCCCCC 34a_100000703577_100011214924 [1,0,1,0,0,0|2,0,0]=4 4241 B15R0.70 C=CCCCCNCCCCCCCCO 2230a_100000703577_100000033203 [1,0,1,0,0,0|1,0,1]=4 4242 B15R0.70 C=CCCCCNCCCCCCCCO 2230a_102515433106_100011215482 [1,0,1,0,0,0|1,0,1]=4 4243 B15R0.70 C=CCCCCNCCCCCCCCO 34a_100000703577_100000033203 [1,0,1,0,0,0|1,0,1]=4 4244 B15R0.70 C=CCCCCNCCCCCCCCO 34a_102515433106_100011215482 [1,0,1,0,0,0|1,0,1]=4 4245 B15R0.70 C=CCCCCOCCCCCCCCC 34a_100000210712_100011215482 [1,0,1,0,0,0|2,0,0]=4 4246 B15R0.70 C=CCCCCOCCCCCCCCC 34a_100000766645_100011214924 [1,0,1,0,0,0|2,0,0]=4 4247 B15R0.70 C=CCCCCOCCCCCCCCC 7a_100000210712_100011215482 [1,0,1,0,0,0|2,0,0]=4 4248 B15R0.70 C=CCCCCOCCCCCCCCC 7a_100000766645_100000210328 [1,0,1,0,0,0|2,0,0]=4 4249 B15R0.70 C=CCCCCOCCCCCCCCO 34a_100000766645_100000033203 [1,0,1,0,0,0|1,0,1]=4 4250 B15R0.70 C=CCCCCOCCCCCCCCO 7a_100000766645_100000033203 [1,0,1,0,0,0|1,0,1]=4 4251 B15R0.70 C=CCCCCSCCCCCCCCC 62a_100011215482_100000210670 [1,0,1,0,0,0|2,0,0]=4 4252 B15R0.70 C=CCCCCSCCCCCCCCO 62a_100000033203_100011215482 [1,0,1,0,0,0|1,0,1]=4 4253 B15R0.70 C=CCCCCSCCCCCCCCO 62a_100011215482_100000033203 [1,0,1,0,0,0|1,0,1]=4 4254 B15R0.70 C=CCCCNCCCCCCCCCC 2230a_100000684558_100011713584 [1,0,1,0,0,0|2,0,0]=4 4255 B15R0.70 C=CCCCNCCCCCCCCCC 2230a_100000700776_100000210320 [1,0,1,0,0,0|2,0,0]=4 4256 B15R0.70 C=CCCCNCCCCCCCCCC 34a_100000684558_100000757094 [1,0,1,0,0,0|2,0,0]=4 4257 B15R0.70 C=CCCCNCCCCCCCCCC 34a_100000700776_100000210320 [1,0,1,0,0,0|2,0,0]=4 4258 B15R0.70 C=CCCCNCCCCCCCCCO 2230a_100000078944_100011713584 [1,0,1,0,0,0|1,0,1]=4 4259 B15R0.70 C=CCCCNCCCCCCCCCO 2230a_100000700776_100009813782 [1,0,1,0,0,0|1,0,1]=4 4260 B15R0.70 C=CCCCNCCCCCCCCCO 34a_100000078944_100000757094 [1,0,1,0,0,0|1,0,1]=4 4261 B15R0.70 C=CCCCNCCCCCCCCCO 34a_100000700776_100009813782 [1,0,1,0,0,0|1,0,1]=4 4262 B15R0.70 C=CCCCOCCCCCCCCCC 34a_100000210711_100000757094 [1,0,1,0,0,0|2,0,0]=4 4263 B15R0.70 C=CCCCOCCCCCCCCCC 34a_100000758997_100000210320 [1,0,1,0,0,0|2,0,0]=4 4264 B15R0.70 C=CCCCOCCCCCCCCCC 7a_100000210711_100000757094 [1,0,1,0,0,0|2,0,0]=4 4265 B15R0.70 C=CCCCOCCCCCCCCCC 7a_100000758997_100000210320 [1,0,1,0,0,0|2,0,0]=4 4266 B15R0.70 C=CCCCOCCCCCCCCCO 34a_100000758997_100009813782 [1,0,1,0,0,0|1,0,1]=4 4267 B15R0.70 C=CCCCOCCCCCCCCCO 7a_100000758997_100009813782 [1,0,1,0,0,0|1,0,1]=4 4268 B15R0.70 C=CCCCSCCCCCCCCCC 62a_100011713584_100000210320 [1,0,1,0,0,0|2,0,0]=4 4269 B15R0.70 C=CCCCSCCCCCCCCCO 62a_100009813782_100000757094 [1,0,1,0,0,0|1,0,1]=4 4270 B15R0.70 C=CCCCSCCCCCCCCCO 62a_100011713584_100009813782 [1,0,1,0,0,0|1,0,1]=4 4271 B15R0.70 C=CCCNCCCCCCCCCCC 2230a_100015191253_100011215454 [1,0,1,0,0,0|2,0,0]=4 4272 B15R0.70 C=CCCNCCCCCCCCCCC 2230a_200011215754_100000754431 [1,0,1,0,0,0|2,0,0]=4 4273 B15R0.70 C=CCCNCCCCCCCCCCC 34a_200011215754_100000754431 [1,0,1,0,0,0|2,0,0]=4 4274 B15R0.70 C=CCCNCCCCCCCCCCO 2230a_100000066964_100000754431 [1,0,1,0,0,0|1,0,1]=4 4275 B15R0.70 C=CCCNCCCCCCCCCCO 2230a_100015191253_100009813290 [1,0,1,0,0,0|1,0,1]=4 4276 B15R0.70 C=CCCNCCCCCCCCCCO 34a_100000066964_100000754431 [1,0,1,0,0,0|1,0,1]=4 4277 B15R0.70 C=CCCOCCCCCCCCCCC 34a_100000210809_100000754431 [1,0,1,0,0,0|2,0,0]=4 4278 B15R0.70 C=CCCOCCCCCCCCCCC 34a_100011205117_100011215454 [1,0,1,0,0,0|2,0,0]=4 4279 B15R0.70 C=CCCOCCCCCCCCCCC 7a_100000210809_100000754431 [1,0,1,0,0,0|2,0,0]=4 4280 B15R0.70 C=CCCOCCCCCCCCCCO 34a_100011205117_100009813290 [1,0,1,0,0,0|1,0,1]=4 4281 B15R0.70 C=CCCSCCCCCCCCCCC 62a_100000754431_100011215454 [1,0,1,0,0,0|2,0,0]=4 4282 B15R0.70 C=CCCSCCCCCCCCCCO 62a_100000754431_200000033068 [1,0,1,0,0,0|1,0,1]=4 4283 B15R0.70 C=CCCSCCCCCCCCCCO 62a_100009813290_100000754431 [1,0,1,0,0,0|1,0,1]=4 4284 B15R0.70 C=CCNCCCCCCCCCCCC 2230a_100000210451_100000210623 [1,0,1,0,0,0|2,0,0]=4 4285 B15R0.70 C=CCNCCCCCCCCCCCC 2230a_100020586998_100011215052 [1,0,1,0,0,0|2,0,0]=4 4286 B15R0.70 C=CCNCCCCCCCCCCCC 270004a_100020586998_100011218549 [1,0,1,0,0,0|2,0,0]=4 4287 B15R0.70 C=CCNCCCCCCCCCCCC 34a_100000210451_100015514636 [1,0,1,0,0,0|2,0,0]=4 4288 B15R0.70 C=CCNCCCCCCCCCCCO 2230a_100020586998_100009812471 [1,0,1,0,0,0|1,0,1]=4 4289 B15R0.70 C=CCOCCCCCCCCCCCC 34a_100000210810_100015514636 [1,0,1,0,0,0|2,0,0]=4 4290 B15R0.70 C=CCOCCCCCCCCCCCC 34a_200000210373_100000759014 [1,0,1,0,0,0|2,0,0]=4 4291 B15R0.70 C=CCOCCCCCCCCCCCC 7a_100000210810_100015514636 [1,0,1,0,0,0|2,0,0]=4 4292 B15R0.70 C=CCOCCCCCCCCCCCO 34a_200000210373_100009812471 [1,0,1,0,0,0|1,0,1]=4 4293 B15R0.70 C=CCSCCCCCCCCCCCC 62a_100000210623_100000759014 [1,0,1,0,0,0|2,0,0]=4 4294 B15R0.70 C=CCSCCCCCCCCCCCO 62a_100009812471_100000210623 [1,0,1,0,0,0|1,0,1]=4 4295 B15R0.70 C=COCCCCOCCCCCCCC 34a_100000031558_100000210759 [1,0,1,0,0,0|1,0,1]=4 4296 B15R0.70 C=COCCCCOCCCCCCCC 7a_100000031558_100000210759 [1,0,1,0,0,0|1,0,1]=4 4297 B15R0.70 C=COCCCNCCCCCCCCC 2230a_100000210767_100011214924 [1,0,1,0,0,0|1,0,1]=4 4298 B15R0.70 C=COCCCNCCCCCCCCC 34a_100000210767_100011214924 [1,0,1,0,0,0|1,0,1]=4 4299 B15R0.70 C=COCCNCCCCCCCCCC 2230a_100000684558_100000039644 [1,0,1,0,0,0|1,0,1]=4 4300 B15R0.70 C=COCCNCCCCCCCCCC 34a_100000684558_100000039644 [1,0,1,0,0,0|1,0,1]=4 4301 B15R0.70 C=COCCOCCCCCCCCCC 34a_100000033082_100000210320 [1,0,1,0,0,0|1,0,1]=4 4302 B15R0.70 C=COCCOCCCCCCCCCC 34a_100000210711_100000039644 [1,0,1,0,0,0|1,0,1]=4 4303 B15R0.70 C=COCCOCCCCCCCCCC 7a_100000210711_100000039644 [1,0,1,0,0,0|1,0,1]=4 4304 B15R0.70 C=COCCSCCCCCCCCCC 62a_100000039644_100000210320 [1,0,1,0,0,0|1,0,1]=4 4305 B15R0.70 CC/C=C/CCCCCCCCCCOC 34a_200025759790_200000210301 [1,0,1,0,0,0|2,0,0]=4 4306 B15R0.70 CC/C=C/CCCCCCCCCCOC 7a_200025759790_200000210301 [1,0,1,0,0,0|2,0,0]=4 4307 B15R0.70 CC/C=C/CCCCCCCCCCO[13CH3] 34a_200025759790_200025704644 [1,0,1,0,0,0|2,0,0]=4 4308 B15R0.70 CC/C=C/CCCCCCCCCCO[13CH3] 7a_200025759790_200025704644 [1,0,1,0,0,0|2,0,0]=4 4309 B15R0.70 CC/C=C/CCCOCCCCCCCC 34a_100016287902_100000210759 [1,0,1,0,0,0|2,0,0]=4 4310 B15R0.70 CC/C=C/CCCOCCCCCCCC 7a_100016287902_100000210759 [1,0,1,0,0,0|2,0,0]=4 4311 B15R0.70 CC/C=C\CCCCCCCNCCCC 269862a_100000102301_200025770492 [1,0,1,0,0,0|2,0,0]=4 4312 B15R0.70 CC/C=C\CCCCCNCCCCCC 269862a_100000210581_100016288537 [1,0,1,0,0,0|2,0,0]=4 4313 B15R0.70 CC/C=C\CCCCCOCCCCCC 34a_100016268722_100000210314 [1,0,1,0,0,0|2,0,0]=4 4314 B15R0.70 CC/C=C\CCCCCOCCCCCC 7a_100016268722_100000210314 [1,0,1,0,0,0|2,0,0]=4 4315 B15R0.70 CC/C=C\CCCCOCCCCCCC 34a_100016287862_100000210614 [1,0,1,0,0,0|2,0,0]=4 4316 B15R0.70 CC/C=C\CCCCOCCCCCCC 7a_100016287862_100000210614 [1,0,1,0,0,0|2,0,0]=4 4317 B15R0.70 CC/C=C\CCNCCCCCCCCC 2230a_100000212291_100015370543 [1,0,1,0,0,0|2,0,0]=4 4318 B15R0.70 CC/C=C\CCNCCCCCCCCC 34a_100000212291_100015370543 [1,0,1,0,0,0|2,0,0]=4 4319 B15R0.70 CC/C=C\CCOCCCCCCCCC 34a_100000210712_100015370543 [1,0,1,0,0,0|2,0,0]=4 4320 B15R0.70 CC/C=C\CCOCCCCCCCCC 34a_100016288707_100011214924 [1,0,1,0,0,0|2,0,0]=4 4321 B15R0.70 CC/C=C\CCOCCCCCCCCC 7a_100000210712_100015370543 [1,0,1,0,0,0|2,0,0]=4 4322 B15R0.70 CC/C=C\CCOCCCCCCCCC 7a_100016288707_100000210328 [1,0,1,0,0,0|2,0,0]=4 4323 B15R0.70 CC/C=C\CCSCCCCCCCCC 62a_100015370543_100000210670 [1,0,1,0,0,0|2,0,0]=4 4324 B15R0.70 CC/C=C\CNCCCCCCCCCC 2230a_100000684558_100103147603 [1,0,1,0,0,0|2,0,0]=4 4325 B15R0.70 CC/C=C\CNCCCCCCCCCC 34a_100000684558_100103147603 [1,0,1,0,0,0|2,0,0]=4 4326 B15R0.70 CC/C=C\COCCCCCCCCCC 34a_100000210711_100103147603 [1,0,1,0,0,0|2,0,0]=4 4327 B15R0.70 CC/C=C\COCCCCCCCCCC 34a_100016268518_100000210320 [1,0,1,0,0,0|2,0,0]=4 4328 B15R0.70 CC/C=C\COCCCCCCCCCC 7a_100000210711_100103147603 [1,0,1,0,0,0|2,0,0]=4 4329 B15R0.70 CC/C=C\CSCCCCCCCCCC 62a_100103147603_100000210320 [1,0,1,0,0,0|2,0,0]=4 4330 B15R0.70 CC=CCCCOCCCCCCCCC 34a_100020645299_100011214924 [1,0,1,0,0,0|2,0,0]=4 4331 B15R0.70 CC=CCNCCCCCCCCCCC 2230a_200011215754_100000070051 [1,0,1,0,0,0|2,0,0]=4 4332 B15R0.70 CC=CCNCCCCCCCCCCC 34a_200011215754_100000070051 [1,0,1,0,0,0|2,0,0]=4 4333 B15R0.70 CC=CCOCCCCCCCCCCC 34a_100000210809_100000070051 [1,0,1,0,0,0|2,0,0]=4 4334 B15R0.70 CC=CCOCCCCCCCCCCC 7a_100000210809_100000070051 [1,0,1,0,0,0|2,0,0]=4 4335 B15R0.70 CC=CCSCCCCCCCCCCC 62a_100000070051_100011215454 [1,0,1,0,0,0|2,0,0]=4 4336 B15R0.70 CCC/C=C/COCCCCCCCCC 34a_100016278788_100011214924 [1,0,1,0,0,0|2,0,0]=4 4337 B15R0.70 CCC/C=C/COCCCCCCCCC 7a_100016278788_100000210328 [1,0,1,0,0,0|2,0,0]=4 4338 B15R0.70 CCCC/C=C/CCCCOCCCCC 34a_200020645093_100000718602 [1,0,1,0,0,0|2,0,0]=4 4339 B15R0.70 CCCC/C=C/CCCCOCCCCC 7a_200020645093_100000210326 [1,0,1,0,0,0|2,0,0]=4 4340 B15R0.70 CCCC/C=C/COCCCCCCCC 34a_200016272032_100000210759 [1,0,1,0,0,0|2,0,0]=4 4341 B15R0.70 CCCC/C=C/COCCCCCCCC 7a_200016272032_100000210759 [1,0,1,0,0,0|2,0,0]=4 4342 B15R0.70 CCCC/C=C\CCCCCCCCOC 34a_100020587526_200000210301 [1,0,1,0,0,0|2,0,0]=4 4343 B15R0.70 CCCC/C=C\CCCCCCCCOC 7a_100020587526_200000210301 [1,0,1,0,0,0|2,0,0]=4 4344 B15R0.70 CCCC/C=C\CCCCCCCCO[13CH3] 34a_100020587526_200025704644 [1,0,1,0,0,0|2,0,0]=4 4345 B15R0.70 CCCC/C=C\CCCCCCCCO[13CH3] 7a_100020587526_200025704644 [1,0,1,0,0,0|2,0,0]=4 4346 B15R0.70 CCCC/C=C\CCOCCCCCCC 34a_200016286491_100000210614 [1,0,1,0,0,0|2,0,0]=4 4347 B15R0.70 CCCC/C=C\CCOCCCCCCC 7a_200016286491_100000210614 [1,0,1,0,0,0|2,0,0]=4 4348 B15R0.70 CCCCC/C=C/COCCCCCCC 34a_100016258190_100000210614 [1,0,1,0,0,0|2,0,0]=4 4349 B15R0.70 CCCCC/C=C/COCCCCCCC 7a_100016258190_100000210614 [1,0,1,0,0,0|2,0,0]=4 4350 B15R0.70 CCCCC/C=C\CCCOCCCCC 34a_100020655193_100000718602 [1,0,1,0,0,0|2,0,0]=4 4351 B15R0.70 CCCCC/C=C\CCCOCCCCC 7a_100020655193_100000210326 [1,0,1,0,0,0|2,0,0]=4 4352 B15R0.70 CCCCC/C=C\CCOCCCCCC 34a_100016277358_100000210314 [1,0,1,0,0,0|2,0,0]=4 4353 B15R0.70 CCCCC/C=C\CCOCCCCCC 7a_100016277358_100000210314 [1,0,1,0,0,0|2,0,0]=4 4354 B15R0.70 CCCCCC/C=C/COCCCCCC 34a_200016276170_100000210314 [1,0,1,0,0,0|2,0,0]=4 4355 B15R0.70 CCCCCC/C=C/COCCCCCC 7a_200016276170_100000210314 [1,0,1,0,0,0|2,0,0]=4 4356 B15R0.70 CCCCCCCC/C=C/COCCCC 34a_200020667288_100000210210 [1,0,1,0,0,0|2,0,0]=4 4357 B15R0.70 CCCCCCCC/C=C/COCCCC 7a_200020667288_100000210211 [1,0,1,0,0,0|2,0,0]=4 4358 B15R0.70 CCCCCCCCC/C=C/COCCC 34a_100015232335_100000210303 [1,0,1,0,0,0|2,0,0]=4 4359 B15R0.70 CCCCCCCCC/C=C/COCCC 7a_100015232335_100000210303 [1,0,1,0,0,0|2,0,0]=4 4360 B15R0.70 CCCCCCCCC=NNCCCCC 4a_100000694160_100011218696 [1,0,1,0,0,0|2,0,0]=4 4361 B15R0.70 CCCCCCCCCC/C=C/COCC 34a_200025761149_100000210202 [1,0,1,0,0,0|2,0,0]=4 4362 B15R0.70 CCCCCCCCCC/C=C/COCC 7a_200025761149_100000210202 [1,0,1,0,0,0|2,0,0]=4 4363 B15R0.70 CCCCCCCCCC=NNCCCC 4a_100025702795_100000210895 [1,0,1,0,0,0|2,0,0]=4 4364 B15R0.70 CCCCCCCCCCC=NNCCC 4a_100000740057_100011218819 [1,0,1,0,0,0|2,0,0]=4 4365 B15R0.70 CCCCCCCCCCCC=NNCC 4a_100000756455_100011218549 [1,0,1,0,0,0|2,0,0]=4 4366 B15R0.70 CCCCCCCCCCCCCCNC 2230a_100011217771_200000210301 [1,0,1,0,0,0|1,0,1]=4 4367 B15R0.70 CCCCCCCCCCCCCCNC 2230a_106832991635_100011215471 [1,0,1,0,0,0|1,0,1]=4 4368 B15R0.70 CCCCCCCCCCCCCCNC 270004a_106832991635_200011216147 [1,0,1,0,0,0|1,0,1]=4 4369 B15R0.70 CCCCCCCCCCCCCCNC 34a_100011217771_200000210301 [1,0,1,0,0,0|1,0,1]=4 4370 B15R0.70 CCCCCCCCCCCCCCNC 34a_100102657272_100011215471 [1,0,1,0,0,0|1,0,1]=4 4371 B15R0.70 CCCCCCCCCCCCCCNC 7a_106832991635_100011215471 [1,0,1,0,0,0|1,0,1]=4 4372 B15R0.70 CCCCCCCCCCCCCCN[13CH3] 2230a_100011217771_200025704644 [1,0,1,0,0,0|1,0,1]=4 4373 B15R0.70 CCCCCCCCCCCCCCN[13CH3] 34a_100011217771_200025704644 [1,0,1,0,0,0|1,0,1]=4 4374 B15R0.70 CCCCCCCCCCCCCCOC 34a_100000210739_200000210301 [1,0,1,0,0,0|0,0,1]=3 4375 B15R0.70 CCCCCCCCCCCCCCOC 34a_100138415774_100011215471 [1,0,1,0,0,0|0,0,1]=3 4376 B15R0.70 CCCCCCCCCCCCCCOC 7a_100000210739_200000210301 [1,0,1,0,0,0|0,0,1]=3 4377 B15R0.70 CCCCCCCCCCCCCCO[13CH3] 34a_100000210739_200025704644 [1,0,1,0,0,0|0,0,1]=3 4378 B15R0.70 CCCCCCCCCCCCCCO[13CH3] 7a_100000210739_200025704644 [1,0,1,0,0,0|0,0,1]=3 4379 B15R0.70 CCCCCCCCCCCCCNCC 2230a_100011215765_100000210202 [1,0,1,0,0,0|1,0,1]=4 4380 B15R0.70 CCCCCCCCCCCCCNCC 2230a_100015525214_100000210684 [1,0,1,0,0,0|1,0,1]=4 4381 B15R0.70 CCCCCCCCCCCCCNCC 270004a_100015525214_200011215488 [1,0,1,0,0,0|1,0,1]=4 4382 B15R0.70 CCCCCCCCCCCCCNCC 34a_100011215765_100000210202 [1,0,1,0,0,0|1,0,1]=4 4383 B15R0.70 CCCCCCCCCCCCCOCC 34a_100000185773_100000210202 [1,0,1,0,0,0|0,0,1]=3 4384 B15R0.70 CCCCCCCCCCCCCOCC 34a_100121572206_100000210684 [1,0,1,0,0,0|0,0,1]=3 4385 B15R0.70 CCCCCCCCCCCCCOCC 7a_100000185773_100000210202 [1,0,1,0,0,0|0,0,1]=3 4386 B15R0.70 CCCCCCCCCCCCCOCF 34a_100000185773_100015361967 [1,0,1,0,0,0|1,0,1]=4 4387 B15R0.70 CCCCCCCCCCCCCOCF 7a_100000185773_100015361967 [1,0,1,0,0,0|1,0,1]=4 4388 B15R0.70 CCCCCCCCCCCCNCC=O 2230a_100000210451_200015260668 [1,0,1,0,0,0|1,0,0]=3 4389 B15R0.70 CCCCCCCCCCCCNCC=O 34a_100000210451_200009817547 [1,0,1,0,0,0|1,0,0]=3 4390 B15R0.70 CCCCCCCCCCCCNCCC 2230a_100000210451_100000210303 [1,0,1,0,0,0|1,0,1]=4 4391 B15R0.70 CCCCCCCCCCCCNCCC 270004a_100020643023_100011218549 [1,0,1,0,0,0|1,0,1]=4 4392 B15R0.70 CCCCCCCCCCCCNCCC 34a_100000210451_100000210303 [1,0,1,0,0,0|1,0,1]=4 4393 B15R0.70 CCCCCCCCCCCCNCCO 2230a_100000210451_100000211926 [1,0,1,0,0,0|1,0,1]=4 4394 B15R0.70 CCCCCCCCCCCCNCCO 2230a_100016997473_100011215052 [1,0,1,0,0,0|1,0,1]=4 4395 B15R0.70 CCCCCCCCCCCCNCCO 270004a_100000210304_100011218549 [1,0,1,0,0,0|1,0,1]=4 4396 B15R0.70 CCCCCCCCCCCCNCCO 34a_100000210451_100000211926 [1,0,1,0,0,0|1,0,1]=4 4397 B15R0.70 CCCCCCCCCCCCNCCO 34a_100016990907_100000759014 [1,0,1,0,0,0|1,0,1]=4 4398 B15R0.70 CCCCCCCCCCCCNCOC 2230a_100000210451_100000766300 [1,0,1,0,0,0|1,0,1]=4 4399 B15R0.70 CCCCCCCCCCCCOCC=O 34a_100000210810_200009817547 [1,0,1,0,0,0|1,0,0]=3 4400 B15R0.70 CCCCCCCCCCCCOCC=O 7a_100000210810_200015260668 [1,0,1,0,0,0|1,0,0]=3 4401 B15R0.70 CCCCCCCCCCCCOCCBr 34a_100000211926_100000759014 [1,0,1,0,0,0|1,0,1]=4 4402 B15R0.70 CCCCCCCCCCCCOCCC 34a_100000210258_100000759014 [1,0,1,0,0,0|0,0,1]=3 4403 B15R0.70 CCCCCCCCCCCCOCCC 34a_100000210810_100000210303 [1,0,1,0,0,0|0,0,1]=3 4404 B15R0.70 CCCCCCCCCCCCOCCC 7a_100000210810_100000210303 [1,0,1,0,0,0|0,0,1]=3 4405 B15R0.70 CCCCCCCCCCCCOCCF 34a_100000210810_100011217306 [1,0,1,0,0,0|1,0,1]=4 4406 B15R0.70 CCCCCCCCCCCCOCCF 7a_100000210810_100011217306 [1,0,1,0,0,0|1,0,1]=4 4407 B15R0.70 CCCCCCCCCCCCOCCN 34a_100000210304_100000759014 [1,0,1,0,0,0|1,0,1]=4 4408 B15R0.70 CCCCCCCCCCCCOCCO 34a_100000210810_100000211926 [1,0,1,0,0,0|1,0,1]=4 4409 B15R0.70 CCCCCCCCCCCCOCCO 7a_100000210810_100000211926 [1,0,1,0,0,0|1,0,1]=4 4410 B15R0.70 CCCCCCCCCCCCOCSC 34a_100000210810_100011218213 [1,0,1,0,0,0|1,0,1]=4 4411 B15R0.70 CCCCCCCCCCCCSCC=O 62a_200015260668_100000759014 [1,0,1,0,0,0|1,0,0]=3 4412 B15R0.70 CCCCCCCCCCCCSCCO 62a_100000211926_100000759014 [1,0,1,0,0,0|1,0,1]=4 4413 B15R0.70 CCCCCCCCCCCCSCOC 62a_100000766300_100000759014 [1,0,1,0,0,0|1,0,1]=4 4414 B15R0.70 CCCCCCCCCCCNCCCC 2230a_100000102301_100011215454 [1,0,1,0,0,0|1,0,1]=4 4415 B15R0.70 CCCCCCCCCCCNCCCC 2230a_200011215754_100000210211 [1,0,1,0,0,0|1,0,1]=4 4416 B15R0.70 CCCCCCCCCCCNCCCC 34a_200011215754_100000210210 [1,0,1,0,0,0|1,0,1]=4 4417 B15R0.70 CCCCCCCCCCCNCCCC 7a_106832991798_100011215454 [1,0,1,0,0,0|1,0,1]=4 4418 B15R0.70 CCCCCCCCCCCNCCCO 2230a_200011215754_100000230001 [1,0,1,0,0,0|1,0,1]=4 4419 B15R0.70 CCCCCCCCCCCNCCCO 34a_200011215754_100000230001 [1,0,1,0,0,0|1,0,1]=4 4420 B15R0.70 CCCCCCCCCCCNCCOC 2230a_100000209980_100011215454 [1,0,1,0,0,0|1,0,1]=4 4421 B15R0.70 CCCCCCCCCCCNCCOC 2230a_200011215754_100011201679 [1,0,1,0,0,0|1,0,1]=4 4422 B15R0.70 CCCCCCCCCCCNCCOC 34a_200011215754_100011201679 [1,0,1,0,0,0|1,0,1]=4 4423 B15R0.70 CCCCCCCCCCCOCCCBr 34a_100011217188_100011215454 [1,0,1,0,0,0|1,0,1]=4 4424 B15R0.70 CCCCCCCCCCCOCCCC 34a_100000210227_100011215454 [1,0,1,0,0,0|0,0,1]=3 4425 B15R0.70 CCCCCCCCCCCOCCCC 34a_100000210809_100000210210 [1,0,1,0,0,0|0,0,1]=3 4426 B15R0.70 CCCCCCCCCCCOCCCC 7a_100000210227_100011215454 [1,0,1,0,0,0|0,0,1]=3 4427 B15R0.70 CCCCCCCCCCCOCCCC 7a_100000210809_100000210211 [1,0,1,0,0,0|0,0,1]=3 4428 B15R0.70 CCCCCCCCCCCOCCCCl 34a_100000230001_100011215454 [1,0,1,0,0,0|1,0,1]=4 4429 B15R0.70 CCCCCCCCCCCOCCCF 34a_100000210809_100011934791 [1,0,1,0,0,0|1,0,1]=4 4430 B15R0.70 CCCCCCCCCCCOCCCF 34a_100000759539_100011215454 [1,0,1,0,0,0|1,0,1]=4 4431 B15R0.70 CCCCCCCCCCCOCCCF 7a_100000210809_100011934791 [1,0,1,0,0,0|1,0,1]=4 4432 B15R0.70 CCCCCCCCCCCOCCCN 34a_100000182051_100011215454 [1,0,1,0,0,0|1,0,1]=4 4433 B15R0.70 CCCCCCCCCCCOCCCO 34a_100000210809_100000230001 [1,0,1,0,0,0|1,0,1]=4 4434 B15R0.70 CCCCCCCCCCCOCCCO 7a_100000210809_100011215043 [1,0,1,0,0,0|1,0,1]=4 4435 B15R0.70 CCCCCCCCCCCOCCOC 34a_100000210237_100011215454 [1,0,1,0,0,0|1,0,1]=4 4436 B15R0.70 CCCCCCCCCCCOCCOC 34a_100000210809_100011201679 [1,0,1,0,0,0|1,0,1]=4 4437 B15R0.70 CCCCCCCCCCCOCCOC 34a_100010166600_200000210301 [1,0,1,0,0,0|1,0,1]=4 4438 B15R0.70 CCCCCCCCCCCOCCOC 7a_100000210809_100000233755 [1,0,1,0,0,0|1,0,1]=4 4439 B15R0.70 CCCCCCCCCCCOCCOC 7a_100010166600_200000210301 [1,0,1,0,0,0|1,0,1]=4 4440 B15R0.70 CCCCCCCCCCCOCCON 34a_100000700252_100011215454 [1,0,1,0,0,0|2,0,0]=4 4441 B15R0.70 CCCCCCCCCCCOCCO[13CH3] 34a_100010166600_200025704644 [1,0,1,0,0,0|1,0,1]=4 4442 B15R0.70 CCCCCCCCCCCOCCO[13CH3] 7a_100010166600_200025704644 [1,0,1,0,0,0|1,0,1]=4 4443 B15R0.70 CCCCCCCCCCCOCCSC 34a_100000210809_100000212216 [1,0,1,0,0,0|1,0,1]=4 4444 B15R0.70 CCCCCCCCCCCOCCSC 34a_100000230434_100011215454 [1,0,1,0,0,0|1,0,1]=4 4445 B15R0.70 CCCCCCCCCCCOCCSC 7a_100000210809_100000212216 [1,0,1,0,0,0|1,0,1]=4 4446 B15R0.70 CCCCCCCCCCCOCCSC 7a_100000230434_100011215454 [1,0,1,0,0,0|1,0,1]=4 4447 B15R0.70 CCCCCCCCCCCSCCCO 62a_100011215043_100011215454 [1,0,1,0,0,0|1,0,1]=4 4448 B15R0.70 CCCCCCCCCCCSCCOC 62a_100000233755_100011215454 [1,0,1,0,0,0|1,0,1]=4 4449 B15R0.70 CCCCCCCCCCCSCOCC 62a_100000739092_100011215454 [1,0,1,0,0,0|1,0,1]=4 4450 B15R0.70 CCCCCCCCCCNCCCC=O 2230a_100000684558_200011292268 [1,0,1,0,0,0|1,0,0]=3 4451 B15R0.70 CCCCCCCCCCNCCCCC 2230a_100000209983_100000210320 [1,0,1,0,0,0|1,0,1]=4 4452 B15R0.70 CCCCCCCCCCNCCCCC 2230a_100000684558_100000210326 [1,0,1,0,0,0|1,0,1]=4 4453 B15R0.70 CCCCCCCCCCNCCCCC 34a_100000684558_100000718602 [1,0,1,0,0,0|1,0,1]=4 4454 B15R0.70 CCCCCCCCCCNCCCCO 2230a_100000684558_100000210776 [1,0,1,0,0,0|1,0,1]=4 4455 B15R0.70 CCCCCCCCCCNCCCCO 2230a_100000750430_100000210320 [1,0,1,0,0,0|1,0,1]=4 4456 B15R0.70 CCCCCCCCCCNCCCCO 34a_100000684558_100011216708 [1,0,1,0,0,0|1,0,1]=4 4457 B15R0.70 CCCCCCCCCCNCCCCO 34a_100000750430_100000210320 [1,0,1,0,0,0|1,0,1]=4 4458 B15R0.70 CCCCCCCCCCNCCCOC 2230a_100000684558_100000740836 [1,0,1,0,0,0|1,0,1]=4 4459 B15R0.70 CCCCCCCCCCNCCCOC 34a_100000684558_100000740836 [1,0,1,0,0,0|1,0,1]=4 4460 B15R0.70 CCCCCCCCCCNCCCOC 34a_100150723488_100000210320 [1,0,1,0,0,0|1,0,1]=4 4461 B15R0.70 CCCCCCCCCCNCCOCC 2230a_100000684558_100011215890 [1,0,1,0,0,0|1,0,1]=4 4462 B15R0.70 CCCCCCCCCCNCCOCC 2230a_102516460346_100000210320 [1,0,1,0,0,0|1,0,1]=4 4463 B15R0.70 CCCCCCCCCCNCCOCC 34a_100000684558_100000210147 [1,0,1,0,0,0|1,0,1]=4 4464 B15R0.70 CCCCCCCCCCNCCOCC 34a_102516460346_100000210320 [1,0,1,0,0,0|1,0,1]=4 4465 B15R0.70 CCCCCCCCCCOCCCC=O 7a_100000210711_200011292268 [1,0,1,0,0,0|1,0,0]=3 4466 B15R0.70 CCCCCCCCCCOCCCCBr 34a_100011216708_100000210320 [1,0,1,0,0,0|1,0,1]=4 4467 B15R0.70 CCCCCCCCCCOCCCCC 34a_100000210253_100000210320 [1,0,1,0,0,0|0,0,1]=3 4468 B15R0.70 CCCCCCCCCCOCCCCC 34a_100000210711_100000718602 [1,0,1,0,0,0|0,0,1]=3 4469 B15R0.70 CCCCCCCCCCOCCCCC 7a_100000210253_100000210320 [1,0,1,0,0,0|0,0,1]=3 4470 B15R0.70 CCCCCCCCCCOCCCCC 7a_100000210711_100000210326 [1,0,1,0,0,0|0,0,1]=3 4471 B15R0.70 CCCCCCCCCCOCCCCCl 34a_100000210776_100000210320 [1,0,1,0,0,0|1,0,1]=4 4472 B15R0.70 CCCCCCCCCCOCCCCCl 7a_100000210776_100000210320 [1,0,1,0,0,0|1,0,1]=4 4473 B15R0.70 CCCCCCCCCCOCCCCF 34a_100000210711_100000729493 [1,0,1,0,0,0|1,0,1]=4 4474 B15R0.70 CCCCCCCCCCOCCCCF 34a_100011995726_100000210320 [1,0,1,0,0,0|1,0,1]=4 4475 B15R0.70 CCCCCCCCCCOCCCCF 7a_100000210711_100000729493 [1,0,1,0,0,0|1,0,1]=4 4476 B15R0.70 CCCCCCCCCCOCCCCF 7a_100011995726_100000210320 [1,0,1,0,0,0|1,0,1]=4 4477 B15R0.70 CCCCCCCCCCOCCCCI 34a_200012148704_100000210320 [1,0,1,0,0,0|1,0,1]=4 4478 B15R0.70 CCCCCCCCCCOCCCCN 34a_100000750430_100000210320 [1,0,1,0,0,0|1,0,1]=4 4479 B15R0.70 CCCCCCCCCCOCCCCO 34a_100000210711_100011216708 [1,0,1,0,0,0|1,0,1]=4 4480 B15R0.70 CCCCCCCCCCOCCCCO 7a_100000210711_100000210776 [1,0,1,0,0,0|1,0,1]=4 4481 B15R0.70 CCCCCCCCCCOCCCNC 34a_100000213112_100000210320 [1,0,1,0,0,0|1,0,1]=4 4482 B15R0.70 CCCCCCCCCCOCCCOC 34a_100000210711_100000740836 [1,0,1,0,0,0|1,0,1]=4 4483 B15R0.70 CCCCCCCCCCOCCCOC 34a_100000740835_100000210320 [1,0,1,0,0,0|1,0,1]=4 4484 B15R0.70 CCCCCCCCCCOCCCOC 7a_100000210711_100000740836 [1,0,1,0,0,0|1,0,1]=4 4485 B15R0.70 CCCCCCCCCCOCCCSC 34a_100000690336_100000210320 [1,0,1,0,0,0|1,0,1]=4 4486 B15R0.70 CCCCCCCCCCOCCCSC 7a_100000690336_100000210320 [1,0,1,0,0,0|1,0,1]=4 4487 B15R0.70 CCCCCCCCCCOCCOCC 34a_100000210136_100000210320 [1,0,1,0,0,0|1,0,1]=4 4488 B15R0.70 CCCCCCCCCCOCCOCC 34a_100000210711_100000210147 [1,0,1,0,0,0|1,0,1]=4 4489 B15R0.70 CCCCCCCCCCOCCOCC 7a_100000210136_100000210320 [1,0,1,0,0,0|1,0,1]=4 4490 B15R0.70 CCCCCCCCCCOCCOCC 7a_100000210711_100011215890 [1,0,1,0,0,0|1,0,1]=4 4491 B15R0.70 CCCCCCCCCCOCCSCC 34a_100000210711_100000757381 [1,0,1,0,0,0|1,0,1]=4 4492 B15R0.70 CCCCCCCCCCOCCSCC 34a_100000212035_100000210320 [1,0,1,0,0,0|1,0,1]=4 4493 B15R0.70 CCCCCCCCCCOCCSCC 7a_100000210711_100000757381 [1,0,1,0,0,0|1,0,1]=4 4494 B15R0.70 CCCCCCCCCCOCCSCC 7a_100000212035_100000210320 [1,0,1,0,0,0|1,0,1]=4 4495 B15R0.70 CCCCCCCCCCSCCCC=O 62a_200011292268_100000210320 [1,0,1,0,0,0|1,0,0]=3 4496 B15R0.70 CCCCCCCCCCSCCCCO 62a_100000210776_100000210320 [1,0,1,0,0,0|1,0,1]=4 4497 B15R0.70 CCCCCCCCCCSCCCOC 62a_100000709357_100000210320 [1,0,1,0,0,0|1,0,1]=4 4498 B15R0.70 CCCCCCCCCCSCCOCC 34a_100011628728_100000210202 [1,0,1,0,0,0|1,0,1]=4 4499 B15R0.70 CCCCCCCCCCSCCOCC 62a_100000210147_100000210320 [1,0,1,0,0,0|1,0,1]=4 4500 B15R0.70 CCCCCCCCCCSCCOCC 7a_100011628728_100000210202 [1,0,1,0,0,0|1,0,1]=4 4501 B15R0.70 CCCCCCCCCNCCCCC=O 2230a_100000212291_100000139335 [1,0,1,0,0,0|1,0,0]=3 4502 B15R0.70 CCCCCCCCCNCCCCCC 2230a_100000210581_100011214924 [1,0,1,0,0,0|1,0,1]=4 4503 B15R0.70 CCCCCCCCCNCCCCCC 2230a_100000212291_100000210314 [1,0,1,0,0,0|1,0,1]=4 4504 B15R0.70 CCCCCCCCCNCCCCCC 34a_100000212291_100000210314 [1,0,1,0,0,0|1,0,1]=4 4505 B15R0.70 CCCCCCCCCNCCCCCO 2230a_100000212291_100000746330 [1,0,1,0,0,0|1,0,1]=4 4506 B15R0.70 CCCCCCCCCNCCCCCO 2230a_100000762737_100011214924 [1,0,1,0,0,0|1,0,1]=4 4507 B15R0.70 CCCCCCCCCNCCCCCO 34a_100000212291_100000746330 [1,0,1,0,0,0|1,0,1]=4 4508 B15R0.70 CCCCCCCCCNCCCCCO 34a_100000762737_100011214924 [1,0,1,0,0,0|1,0,1]=4 4509 B15R0.70 CCCCCCCCCNCCCCOC 2230a_100000212291_100000730899 [1,0,1,0,0,0|1,0,1]=4 4510 B15R0.70 CCCCCCCCCNCCCCOC 34a_100000212291_100000755781 [1,0,1,0,0,0|1,0,1]=4 4511 B15R0.70 CCCCCCCCCNCCCOCC 2230a_100000210961_100011214924 [1,0,1,0,0,0|1,0,1]=4 4512 B15R0.70 CCCCCCCCCNCCCOCC 2230a_100000212291_100012232248 [1,0,1,0,0,0|1,0,1]=4 4513 B15R0.70 CCCCCCCCCNCCCOCC 34a_100000210961_100011214924 [1,0,1,0,0,0|1,0,1]=4 4514 B15R0.70 CCCCCCCCCNCCCOCC 34a_100000212291_100012232248 [1,0,1,0,0,0|1,0,1]=4 4515 B15R0.70 CCCCCCCCCNCCOCCC 2230a_100000212291_100011215938 [1,0,1,0,0,0|1,0,1]=4 4516 B15R0.70 CCCCCCCCCNCCOCCC 2230a_100161115042_100011214924 [1,0,1,0,0,0|1,0,1]=4 4517 B15R0.70 CCCCCCCCCNCCOCCC 34a_100000212291_100011215938 [1,0,1,0,0,0|1,0,1]=4 4518 B15R0.70 CCCCCCCCCNCCOCCC 34a_100161115042_100011214924 [1,0,1,0,0,0|1,0,1]=4 4519 B15R0.70 CCCCCCCCCNCOCCCC 2230a_100000212291_100011995733 [1,0,1,0,0,0|1,0,1]=4 4520 B15R0.70 CCCCCCCCCNCOCCCC 34a_100000212291_100011995733 [1,0,1,0,0,0|1,0,1]=4 4521 B15R0.70 CCCCCCCCCOCCCCC=O 7a_100000210712_100000139335 [1,0,1,0,0,0|1,0,0]=3 4522 B15R0.70 CCCCCCCCCOCCCCCBr 34a_100000746331_100011214924 [1,0,1,0,0,0|1,0,1]=4 4523 B15R0.70 CCCCCCCCCOCCCCCBr 7a_100000746331_100000210328 [1,0,1,0,0,0|1,0,1]=4 4524 B15R0.70 CCCCCCCCCOCCCCCC 34a_100000210259_100011214924 [1,0,1,0,0,0|0,0,1]=3 4525 B15R0.70 CCCCCCCCCOCCCCCC 34a_100000210712_100000210314 [1,0,1,0,0,0|0,0,1]=3 4526 B15R0.70 CCCCCCCCCOCCCCCC 7a_100000210259_100000210328 [1,0,1,0,0,0|0,0,1]=3 4527 B15R0.70 CCCCCCCCCOCCCCCC 7a_100000210712_100000210314 [1,0,1,0,0,0|0,0,1]=3 4528 B15R0.70 CCCCCCCCCOCCCCCCl 34a_100000746330_100011214924 [1,0,1,0,0,0|1,0,1]=4 4529 B15R0.70 CCCCCCCCCOCCCCCCl 7a_100000746330_100000210328 [1,0,1,0,0,0|1,0,1]=4 4530 B15R0.70 CCCCCCCCCOCCCCCF 34a_100000210712_100000729378 [1,0,1,0,0,0|1,0,1]=4 4531 B15R0.70 CCCCCCCCCOCCCCCF 7a_100000210712_100000729378 [1,0,1,0,0,0|1,0,1]=4 4532 B15R0.70 CCCCCCCCCOCCCCCI 34a_200012148887_100011214924 [1,0,1,0,0,0|1,0,1]=4 4533 B15R0.70 CCCCCCCCCOCCCCCI 7a_200012148887_100000210328 [1,0,1,0,0,0|1,0,1]=4 4534 B15R0.70 CCCCCCCCCOCCCCCN 34a_100000762737_100011214924 [1,0,1,0,0,0|1,0,1]=4 4535 B15R0.70 CCCCCCCCCOCCCCCO 34a_100000210712_100000746330 [1,0,1,0,0,0|1,0,1]=4 4536 B15R0.70 CCCCCCCCCOCCCCCO 7a_100000210712_100000746330 [1,0,1,0,0,0|1,0,1]=4 4537 B15R0.70 CCCCCCCCCOCCCCOC 34a_100000210712_100000755781 [1,0,1,0,0,0|1,0,1]=4 4538 B15R0.70 CCCCCCCCCOCCCCOC 34a_100000740925_100011214924 [1,0,1,0,0,0|1,0,1]=4 4539 B15R0.70 CCCCCCCCCOCCCCOC 7a_100000210712_100000730899 [1,0,1,0,0,0|1,0,1]=4 4540 B15R0.70 CCCCCCCCCOCCCCSC 34a_100011217163_100011214924 [1,0,1,0,0,0|1,0,1]=4 4541 B15R0.70 CCCCCCCCCOCCCCSC 7a_100011217163_100000210328 [1,0,1,0,0,0|1,0,1]=4 4542 B15R0.70 CCCCCCCCCOCCCOCC 34a_100000210712_100012232248 [1,0,1,0,0,0|1,0,1]=4 4543 B15R0.70 CCCCCCCCCOCCCOCC 34a_100000757476_100011214924 [1,0,1,0,0,0|1,0,1]=4 4544 B15R0.70 CCCCCCCCCOCCCOCC 7a_100000210712_100012232248 [1,0,1,0,0,0|1,0,1]=4 4545 B15R0.70 CCCCCCCCCOCCCOCC 7a_100000757476_100000210328 [1,0,1,0,0,0|1,0,1]=4 4546 B15R0.70 CCCCCCCCCOCCCSCC 34a_100011216438_100011214924 [1,0,1,0,0,0|1,0,1]=4 4547 B15R0.70 CCCCCCCCCOCCCSCC 7a_100011216438_100000210328 [1,0,1,0,0,0|1,0,1]=4 4548 B15R0.70 CCCCCCCCCOCCOCCC 34a_100000210712_100011215938 [1,0,1,0,0,0|1,0,1]=4 4549 B15R0.70 CCCCCCCCCOCCOCCC 34a_100000752267_100011214924 [1,0,1,0,0,0|1,0,1]=4 4550 B15R0.70 CCCCCCCCCOCCOCCC 7a_100000210712_100011215938 [1,0,1,0,0,0|1,0,1]=4 4551 B15R0.70 CCCCCCCCCOCCOCCC 7a_100000752267_100000210328 [1,0,1,0,0,0|1,0,1]=4 4552 B15R0.70 CCCCCCCCCOCCSCCC 34a_200000230433_100011214924 [1,0,1,0,0,0|1,0,1]=4 4553 B15R0.70 CCCCCCCCCOCCSCCC 7a_200000230433_100000210328 [1,0,1,0,0,0|1,0,1]=4 4554 B15R0.70 CCCCCCCCCOCOCCCC 34a_100000210712_100011995733 [1,0,1,0,0,0|1,0,1]=4 4555 B15R0.70 CCCCCCCCCSCCCCC=O 62a_100000139335_100000210670 [1,0,1,0,0,0|1,0,0]=3 4556 B15R0.70 CCCCCCCCCSCCCCCO 62a_100000746330_100000210670 [1,0,1,0,0,0|1,0,1]=4 4557 B15R0.70 CCCCCCCCCSCCCCOC 62a_100000730899_100000210670 [1,0,1,0,0,0|1,0,1]=4 4558 B15R0.70 CCCCCCCCCSCCCOCC 62a_100012232248_100000210670 [1,0,1,0,0,0|1,0,1]=4 4559 B15R0.70 CCCCCCCCCSCCOCCC 62a_100011215938_100000210670 [1,0,1,0,0,0|1,0,1]=4 4560 B15R0.70 CCCCCCCCCSCOCCCC 62a_100011995733_100000210670 [1,0,1,0,0,0|1,0,1]=4 4561 B15R0.70 CCCCCCCCNCCCCCC=O 2230a_100000229939_100000139337 [1,0,1,0,0,0|1,0,0]=3 4562 B15R0.70 CCCCCCCCNCCCCCCC 2230a_100000229938_100000210759 [1,0,1,0,0,0|1,0,1]=4 4563 B15R0.70 CCCCCCCCNCCCCCCC 2230a_100000229939_100000210681 [1,0,1,0,0,0|1,0,1]=4 4564 B15R0.70 CCCCCCCCNCCCCCCC 34a_100000229939_100000210614 [1,0,1,0,0,0|1,0,1]=4 4565 B15R0.70 CCCCCCCCNCCCCCCO 2230a_100000229939_100000766143 [1,0,1,0,0,0|1,0,1]=4 4566 B15R0.70 CCCCCCCCNCCCCCCO 2230a_100000686447_100000210759 [1,0,1,0,0,0|1,0,1]=4 4567 B15R0.70 CCCCCCCCNCCCCCCO 34a_100000229939_100000766143 [1,0,1,0,0,0|1,0,1]=4 4568 B15R0.70 CCCCCCCCNCCCCCCO 34a_100000686447_100000210759 [1,0,1,0,0,0|1,0,1]=4 4569 B15R0.70 CCCCCCCCNCCCCCOC 2230a_100000747528_100000210759 [1,0,1,0,0,0|1,0,1]=4 4570 B15R0.70 CCCCCCCCNCCCCCOC 34a_100000747528_100000210759 [1,0,1,0,0,0|1,0,1]=4 4571 B15R0.70 CCCCCCCCNCCCOCCC 2230a_100011217757_100000210759 [1,0,1,0,0,0|1,0,1]=4 4572 B15R0.70 CCCCCCCCNCCCOCCC 34a_100011217757_100000210759 [1,0,1,0,0,0|1,0,1]=4 4573 B15R0.70 CCCCCCCCNCCOCCCC 2230a_100000229939_100000743108 [1,0,1,0,0,0|1,0,1]=4 4574 B15R0.70 CCCCCCCCNCCOCCCC 34a_100000229939_100000743108 [1,0,1,0,0,0|1,0,1]=4 4575 B15R0.70 CCCCCCCCOCCCCCC=O 7a_100000210232_100000139337 [1,0,1,0,0,0|1,0,0]=3 4576 B15R0.70 CCCCCCCCOCCCCCCBr 34a_100011215345_100000210759 [1,0,1,0,0,0|1,0,1]=4 4577 B15R0.70 CCCCCCCCOCCCCCCBr 7a_100011215345_100000210759 [1,0,1,0,0,0|1,0,1]=4 4578 B15R0.70 CCCCCCCCOCCCCCCC 34a_100000210232_100000210614 [1,0,1,0,0,0|0,0,1]=3 4579 B15R0.70 CCCCCCCCOCCCCCCC 34a_100000210272_100000210759 [1,0,1,0,0,0|0,0,1]=3 4580 B15R0.70 CCCCCCCCOCCCCCCC 7a_100000210232_100000210614 [1,0,1,0,0,0|0,0,1]=3 4581 B15R0.70 CCCCCCCCOCCCCCCC 7a_100000210272_100000210759 [1,0,1,0,0,0|0,0,1]=3 4582 B15R0.70 CCCCCCCCOCCCCCCCl 34a_100000766143_100000210759 [1,0,1,0,0,0|1,0,1]=4 4583 B15R0.70 CCCCCCCCOCCCCCCCl 7a_100000766143_100000210759 [1,0,1,0,0,0|1,0,1]=4 4584 B15R0.70 CCCCCCCCOCCCCCCF 34a_100000210232_100015922095 [1,0,1,0,0,0|1,0,1]=4 4585 B15R0.70 CCCCCCCCOCCCCCCF 34a_100000732779_100000210759 [1,0,1,0,0,0|1,0,1]=4 4586 B15R0.70 CCCCCCCCOCCCCCCF 7a_100000210232_100015922095 [1,0,1,0,0,0|1,0,1]=4 4587 B15R0.70 CCCCCCCCOCCCCCCF 7a_100000732779_100000210759 [1,0,1,0,0,0|1,0,1]=4 4588 B15R0.70 CCCCCCCCOCCCCCCN 34a_100000686447_100000210759 [1,0,1,0,0,0|1,0,1]=4 4589 B15R0.70 CCCCCCCCOCCCCCCO 34a_100000210232_100000766143 [1,0,1,0,0,0|1,0,1]=4 4590 B15R0.70 CCCCCCCCOCCCCCCO 7a_100000210232_100000766143 [1,0,1,0,0,0|1,0,1]=4 4591 B15R0.70 CCCCCCCCOCCCCCNC 34a_100000722520_100000210759 [1,0,1,0,0,0|1,0,1]=4 4592 B15R0.70 CCCCCCCCOCCOCCCC 34a_100000210232_100000743108 [1,0,1,0,0,0|1,0,1]=4 4593 B15R0.70 CCCCCCCCOCCOCCCC 34a_100000210238_100000210759 [1,0,1,0,0,0|1,0,1]=4 4594 B15R0.70 CCCCCCCCOCCOCCCC 7a_100000210232_100000743108 [1,0,1,0,0,0|1,0,1]=4 4595 B15R0.70 CCCCCCCCOCCOCCCC 7a_100000210238_100000210759 [1,0,1,0,0,0|1,0,1]=4 4596 B15R0.70 CCCCCCCCOCCSCCCC 34a_200000230436_100000210759 [1,0,1,0,0,0|1,0,1]=4 4597 B15R0.70 CCCCCCCCOCCSCCCC 7a_200000230436_100000210759 [1,0,1,0,0,0|1,0,1]=4 4598 B15R0.70 CCCCCCCCSCCCCCC=O 62a_100000139337_100000210317 [1,0,1,0,0,0|1,0,0]=3 4599 B15R0.70 CCCCCCCCSCCCCCC=O 62a_100000210759_100000139337 [1,0,1,0,0,0|1,0,0]=3 4600 B15R0.70 CCCCCCCCSCCCCCCO 62a_100000210759_100000766143 [1,0,1,0,0,0|1,0,1]=4 4601 B15R0.70 CCCCCCCCSCCCCCCO 62a_100000766143_100000210317 [1,0,1,0,0,0|1,0,1]=4 4602 B15R0.70 CCCCCCCCSCCOCCCC 62a_100000210759_100000743108 [1,0,1,0,0,0|1,0,1]=4 4603 B15R0.70 CCCCCCCCSCCOCCCC 62a_100000743108_100000210317 [1,0,1,0,0,0|1,0,1]=4 4604 B15R0.70 CCCCCCCNCCCCCCCO 2230a_100000229938_100000760002 [1,0,1,0,0,0|1,0,1]=4 4605 B15R0.70 CCCCCCCNCCCCCCCO 2230a_100011996573_100000210681 [1,0,1,0,0,0|1,0,1]=4 4606 B15R0.70 CCCCCCCNCCCCCCCO 34a_100011996573_100000210614 [1,0,1,0,0,0|1,0,1]=4 4607 B15R0.70 CCCCCCCNCCCCCCOC 2230a_100000229938_100011998445 [1,0,1,0,0,0|1,0,1]=4 4608 B15R0.70 CCCCCCCNCCCOCCCC 2230a_200000211371_100000210681 [1,0,1,0,0,0|1,0,1]=4 4609 B15R0.70 CCCCCCCNCCCOCCCC 34a_200000211371_100000210614 [1,0,1,0,0,0|1,0,1]=4 4610 B15R0.70 CCCCCCCOCCCCCCCBr 34a_100000760002_100000210614 [1,0,1,0,0,0|1,0,1]=4 4611 B15R0.70 CCCCCCCOCCCCCCCBr 7a_100000760002_100000210614 [1,0,1,0,0,0|1,0,1]=4 4612 B15R0.70 CCCCCCCOCCCCCCCN 34a_100011996573_100000210614 [1,0,1,0,0,0|1,0,1]=4 4613 B15R0.70 CCCCCCCOCCCCCCCO 34a_100000210272_100000760002 [1,0,1,0,0,0|1,0,1]=4 4614 B15R0.70 CCCCCCCOCCCCCCCO 7a_100000210272_100000760002 [1,0,1,0,0,0|1,0,1]=4 4615 B15R0.70 CCCCCCCOCCCCCCOC 34a_100000210272_100011998445 [1,0,1,0,0,0|1,0,1]=4 4616 B15R0.70 CCCCCCCOCCCCCCOC 34a_200012092642_100000210614 [1,0,1,0,0,0|1,0,1]=4 4617 B15R0.70 CCCCCCCOCCCCCCOC 7a_100000210272_100011998445 [1,0,1,0,0,0|1,0,1]=4 4618 B15R0.70 CCCCCCCOCCCCCCOC 7a_200012092642_100000210614 [1,0,1,0,0,0|1,0,1]=4 4619 B15R0.70 CCCCCCCOCCCOCCCC 34a_200011215613_100000210614 [1,0,1,0,0,0|1,0,1]=4 4620 B15R0.70 CCCCCCCOCCCOCCCC 7a_200011215613_100000210614 [1,0,1,0,0,0|1,0,1]=4 4621 B15R0.70 CCCCCCCOCCNCCCCC 34a_100000224656_100000210614 [1,0,1,0,0,0|1,0,1]=4 4622 B15R0.70 CCCCCCCOCCOCCCCC 34a_100011215259_100000210614 [1,0,1,0,0,0|1,0,1]=4 4623 B15R0.70 CCCCCCCOCCOCCCCC 7a_100011215259_100000210614 [1,0,1,0,0,0|1,0,1]=4 4624 B15R0.70 CCCCCCCSCCCCCCCO 62a_100000210614_100000760002 [1,0,1,0,0,0|1,0,1]=4 4625 B15R0.70 CCCCCCCSCCCCCCCO 62a_100000760002_100000210316 [1,0,1,0,0,0|1,0,1]=4 4626 B15R0.70 CCCCCCCSCCCCCCOC 62a_100000210614_100011998445 [1,0,1,0,0,0|1,0,1]=4 4627 B15R0.70 CCCCCCCSCCCCCCOC 62a_100011998445_100000210316 [1,0,1,0,0,0|1,0,1]=4 4628 B15R0.70 CCCCCCNCCCCCCCCO 2230a_100000210581_100000033203 [1,0,1,0,0,0|1,0,1]=4 4629 B15R0.70 CCCCCCNCCCCCCCCO 2230a_102515433106_100000210314 [1,0,1,0,0,0|1,0,1]=4 4630 B15R0.70 CCCCCCNCCCCCCCCO 34a_102515433106_100000210314 [1,0,1,0,0,0|1,0,1]=4 4631 B15R0.70 CCCCCCOCCCCCCCCBr 34a_100009813846_100000210314 [1,0,1,0,0,0|1,0,1]=4 4632 B15R0.70 CCCCCCOCCCCCCCCBr 7a_100009813846_100000210314 [1,0,1,0,0,0|1,0,1]=4 4633 B15R0.70 CCCCCCOCCCCCCCCCl 34a_100000033203_100000210314 [1,0,1,0,0,0|1,0,1]=4 4634 B15R0.70 CCCCCCOCCCCCCCCCl 7a_100000033203_100000210314 [1,0,1,0,0,0|1,0,1]=4 4635 B15R0.70 CCCCCCOCCCCCCCCN 34a_102515433106_100000210314 [1,0,1,0,0,0|1,0,1]=4 4636 B15R0.70 CCCCCCOCCCCCCCCO 34a_100000210259_100000033203 [1,0,1,0,0,0|1,0,1]=4 4637 B15R0.70 CCCCCCOCCCCCCCCO 7a_100000210259_100000033203 [1,0,1,0,0,0|1,0,1]=4 4638 B15R0.70 CCCCCCOCCCCNCCCC 34a_200011216965_100000210314 [1,0,1,0,0,0|1,0,1]=4 4639 B15R0.70 CCCCCCOCCCCOCCCC 34a_200000760531_100000210314 [1,0,1,0,0,0|1,0,1]=4 4640 B15R0.70 CCCCCCOCCCCOCCCC 7a_200000760531_100000210314 [1,0,1,0,0,0|1,0,1]=4 4641 B15R0.70 CCCCCCOCCOCCCCC=O 7a_100000691444_100000139335 [1,0,1,0,0,0|2,0,0]=4 4642 B15R0.70 CCCCCCOCCOCCCCCC 34a_100000691444_100000210314 [1,0,1,0,0,0|1,0,1]=4 4643 B15R0.70 CCCCCCOCCOCCCCCC 7a_100000691444_100000210314 [1,0,1,0,0,0|1,0,1]=4 4644 B15R0.70 CCCCCCSCCCCCCCCO 62a_100000033203_100000210757 [1,0,1,0,0,0|1,0,1]=4 4645 B15R0.70 CCCCCCSCCCCCCCCO 62a_100000210314_100000033203 [1,0,1,0,0,0|1,0,1]=4 4646 B15R0.70 CCCCCNCCCCCCCCCO 2230a_100000078944_100000210326 [1,0,1,0,0,0|1,0,1]=4 4647 B15R0.70 CCCCCNCCCCCCCCCO 2230a_100000209983_100009813782 [1,0,1,0,0,0|1,0,1]=4 4648 B15R0.70 CCCCCNCCCCCCCCCO 34a_100000078944_100000718602 [1,0,1,0,0,0|1,0,1]=4 4649 B15R0.70 CCCCCOCCCCCCCCCBr 34a_100009813782_100000718602 [1,0,1,0,0,0|1,0,1]=4 4650 B15R0.70 CCCCCOCCCCCCCCCBr 7a_100009813782_100000210326 [1,0,1,0,0,0|1,0,1]=4 4651 B15R0.70 CCCCCOCCCCCCCCCCl 34a_100009868337_100000718602 [1,0,1,0,0,0|1,0,1]=4 4652 B15R0.70 CCCCCOCCCCCCCCCCl 7a_100009868337_100000210326 [1,0,1,0,0,0|1,0,1]=4 4653 B15R0.70 CCCCCOCCCCCCCCCN 34a_100000078944_100000718602 [1,0,1,0,0,0|1,0,1]=4 4654 B15R0.70 CCCCCOCCCCCCCCCO 34a_100000210253_100009813782 [1,0,1,0,0,0|1,0,1]=4 4655 B15R0.70 CCCCCOCCCCCCCCCO 7a_100000210253_100009813782 [1,0,1,0,0,0|1,0,1]=4 4656 B15R0.70 CCCCCOCCOCCCCCC=O 7a_100011215259_100000139337 [1,0,1,0,0,0|2,0,0]=4 4657 B15R0.70 CCCCCSCCCCCCCCCO 62a_100000210326_100009813782 [1,0,1,0,0,0|1,0,1]=4 4658 B15R0.70 CCCCCSCCCCCCCCCO 62a_100009813782_100000210326 [1,0,1,0,0,0|1,0,1]=4 4659 B15R0.70 CCCCNCCCCCCCCCCO 2230a_100000066964_100000210211 [1,0,1,0,0,0|1,0,1]=4 4660 B15R0.70 CCCCNCCCCCCCCCCO 2230a_100000102301_100009813290 [1,0,1,0,0,0|1,0,1]=4 4661 B15R0.70 CCCCNCCCCCCCCCCO 34a_100000066964_100000210210 [1,0,1,0,0,0|1,0,1]=4 4662 B15R0.70 CCCCNCCCCCCCCCCO 7a_106832991798_100009813290 [1,0,1,0,0,0|1,0,1]=4 4663 B15R0.70 CCCCOCCCCCCCCCCBr 34a_100009813290_100000210210 [1,0,1,0,0,0|1,0,1]=4 4664 B15R0.70 CCCCOCCCCCCCCCCBr 7a_100009813290_100000210211 [1,0,1,0,0,0|1,0,1]=4 4665 B15R0.70 CCCCOCCCCCCCCCCCl 34a_200000033068_100000210210 [1,0,1,0,0,0|1,0,1]=4 4666 B15R0.70 CCCCOCCCCCCCCCCCl 7a_200000033068_100000210211 [1,0,1,0,0,0|1,0,1]=4 4667 B15R0.70 CCCCOCCCCCCCCCCN 34a_100000066964_100000210210 [1,0,1,0,0,0|1,0,1]=4 4668 B15R0.70 CCCCOCCCCCCCCCCO 34a_100000210227_100009813290 [1,0,1,0,0,0|1,0,1]=4 4669 B15R0.70 CCCCOCCCCCCCCCCO 7a_100000210227_100009813290 [1,0,1,0,0,0|1,0,1]=4 4670 B15R0.70 CCCCOCCCCOCCCCC=O 7a_200000760531_100000139335 [1,0,1,0,0,0|2,0,0]=4 4671 B15R0.70 CCCCOCCCNCCCCCC=O 2230a_200000211371_100000139337 [1,0,1,0,0,0|2,0,0]=4 4672 B15R0.70 CCCCOCCCOCCCCCC=O 7a_200011215613_100000139337 [1,0,1,0,0,0|2,0,0]=4 4673 B15R0.70 CCCCSCCCCCCCCCCO 62a_100000210211_200000033068 [1,0,1,0,0,0|1,0,1]=4 4674 B15R0.70 CCCCSCCCCCCCCCCO 62a_100009813290_100000210210 [1,0,1,0,0,0|1,0,1]=4 4675 B15R0.70 CCCOCCCCCCCCCCCBr 34a_100009812471_100000210303 [1,0,1,0,0,0|1,0,1]=4 4676 B15R0.70 CCCOCCCCCCCCCCCBr 7a_100009812471_100000210303 [1,0,1,0,0,0|1,0,1]=4 4677 B15R0.70 CCCOCCCCCCCCCCCO 34a_100000210258_100009812471 [1,0,1,0,0,0|1,0,1]=4 4678 B15R0.70 CCCOCCCCCCCCCOCC 34a_100009875440_100000210303 [1,0,1,0,0,0|1,0,1]=4 4679 B15R0.70 CCCOCCCCCCCCCOCC 7a_100009875440_100000210303 [1,0,1,0,0,0|1,0,1]=4 4680 B15R0.70 CCCSCCCCCCCCCCCO 62a_100009812471_100000210303 [1,0,1,0,0,0|1,0,1]=4 4681 B15R0.70 CCNCCCCCCCCCCCCO 2230a_100000066677_100000210202 [1,0,1,0,0,0|1,0,1]=4 4682 B15R0.70 CCNCCCCCCCCCCCCO 2230a_100015525214_100009813331 [1,0,1,0,0,0|1,0,1]=4 4683 B15R0.70 CCNCCCCCCCCCCCCO 34a_100000066677_100000210202 [1,0,1,0,0,0|1,0,1]=4 4684 B15R0.70 CCOCCCCCCCCCCCCBr 34a_100009813331_100000210202 [1,0,1,0,0,0|1,0,1]=4 4685 B15R0.70 CCOCCCCCCCCCCCCBr 7a_100009813331_100000210202 [1,0,1,0,0,0|1,0,1]=4 4686 B15R0.70 CCOCCCCCCCCCCCCN 34a_100000066677_100000210202 [1,0,1,0,0,0|1,0,1]=4 4687 B15R0.70 CCOCCCCCCCCCCCCO 34a_100121572206_100009813331 [1,0,1,0,0,0|1,0,1]=4 4688 B15R0.70 CCOCCCCCCCCCOCC=O 34a_100009875440_200009817547 [1,0,1,0,0,0|2,0,0]=4 4689 B15R0.70 CCOCCCCCCCCCOCC=O 7a_100009875440_200015260668 [1,0,1,0,0,0|2,0,0]=4 4690 B15R0.70 CCSCCCCCCCCCCCCO 62a_100009813331_100000210202 [1,0,1,0,0,0|1,0,1]=4 4691 B15R0.70 CNCCCCCCCCCCCCCO 2230a_106832991635_100009812470 [1,0,1,0,0,0|1,0,1]=4 4692 B15R0.70 CNCCCCCCCCCCCCCO 34a_100102657272_100009812470 [1,0,1,0,0,0|1,0,1]=4 4693 B15R0.70 CNCCCCCCCCCCCCCO 7a_106832991635_100009812470 [1,0,1,0,0,0|1,0,1]=4 4694 B15R0.70 COCCCCCCCCCCCCCBr 34a_100009812470_200000210301 [1,0,1,0,0,0|1,0,1]=4 4695 B15R0.70 COCCCCCCCCCCCCCBr 7a_100009812470_200000210301 [1,0,1,0,0,0|1,0,1]=4 4696 B15R0.70 COCCCCCCCCCCCCCO 34a_100138415774_100009812470 [1,0,1,0,0,0|1,0,1]=4 4697 B15R0.70 COCCCCCCOCCCCCC=O 7a_200012092642_100000139337 [1,0,1,0,0,0|2,0,0]=4 4698 B15R0.70 COCCCCCCSCCCCCC=O 62a_100000139337_100011998445 [1,0,1,0,0,0|2,0,0]=4 4699 B15R0.70 COCCCCCCSCCCCCC=O 62a_100011998445_100000139337 [1,0,1,0,0,0|2,0,0]=4 4700 B15R0.70 CSCCCCCCCCCCCCCO 62a_100009812470_200000210301 [1,0,1,0,0,0|1,0,1]=4 4701 B15R0.70 NCCCCCCCCCCOCCCO 34a_100000066964_100000230001 [1,0,1,0,0,0|2,0,0]=4 4702 B15R0.70 NCCCCCCCCCOCCCCO 34a_100000078944_100011216708 [1,0,1,0,0,0|2,0,0]=4 4703 B15R0.70 NCCCCCCCCOCCCCCO 34a_102515433106_100000746330 [1,0,1,0,0,0|2,0,0]=4 4704 B15R0.70 NCCCCCCCOCCCCCCO 34a_100011996573_100000766143 [1,0,1,0,0,0|2,0,0]=4 4705 B15R0.70 NCCCCCCOCCCCCCCO 34a_100000686447_100000760002 [1,0,1,0,0,0|2,0,0]=4 4706 B15R0.70 NCCCCCOCCCCCCCCO 34a_100000762737_100000033203 [1,0,1,0,0,0|2,0,0]=4 4707 B15R0.70 NCCCCOCCCCCCCCCO 34a_100000750430_100009813782 [1,0,1,0,0,0|2,0,0]=4 4708 B15R0.70 NCCCOCCCCCCCCCCO 34a_100000182051_100009813290 [1,0,1,0,0,0|2,0,0]=4 4709 B15R0.70 NCCOCCCCCCCCCCCO 34a_100000210304_100009812471 [1,0,1,0,0,0|2,0,0]=4 4710 B15R0.70 O=CCCCCCNCCCCCCCO 2230a_100011996573_100000139337 [1,0,1,0,0,0|1,0,0]=3 4711 B15R0.70 O=CCCCCCNCCCOCCCO 2230a_100011310245_100000139337 [1,0,1,0,0,0|2,0,0]=4 4712 B15R0.70 O=CCCCCCOCCCCCCCBr 7a_100000760002_100000139337 [1,0,1,0,0,0|2,0,0]=4 4713 B15R0.70 O=CCCCCCSCCCCCCCO 62a_100000139337_100000760002 [1,0,1,0,0,0|1,0,0]=3 4714 B15R0.70 O=CCCCCCSCCCCCCCO 62a_100000760002_100000139337 [1,0,1,0,0,0|1,0,0]=3 4715 B15R0.70 O=CCCCCNCCCCCCCCO 2230a_102515433106_100000139335 [1,0,1,0,0,0|1,0,0]=3 4716 B15R0.70 O=CCCCCOCCCCCCCCBr 7a_100009813846_100000139335 [1,0,1,0,0,0|2,0,0]=4 4717 B15R0.70 O=CCCCCOCCCCCCCCCl 7a_100000033203_100000139335 [1,0,1,0,0,0|2,0,0]=4 4718 B15R0.70 O=CCCCCSCCCCCCCCO 62a_100000033203_100000139335 [1,0,1,0,0,0|1,0,0]=3 4719 B15R0.70 O=CCCCCSCCCCCCCCO 62a_100000139335_100000033203 [1,0,1,0,0,0|1,0,0]=3 4720 B15R0.70 O=CCCCNCCCCCCCCCO 2230a_100000078944_200011292268 [1,0,1,0,0,0|1,0,0]=3 4721 B15R0.70 O=CCCCOCCCCCCCCCBr 7a_100009813782_200011292268 [1,0,1,0,0,0|2,0,0]=4 4722 B15R0.70 O=CCCCOCCCCCCCCCCl 7a_100009868337_200011292268 [1,0,1,0,0,0|2,0,0]=4 4723 B15R0.70 O=CCCCSCCCCCCCCCO 62a_100009813782_200011292268 [1,0,1,0,0,0|1,0,0]=3 4724 B15R0.70 O=CCCCSCCCCCCCCCO 62a_200011292268_100009813782 [1,0,1,0,0,0|1,0,0]=3 4725 B15R0.70 O=CCOCCCCCCCCCCCBr 34a_100009812471_200009817547 [1,0,1,0,0,0|2,0,0]=4 4726 B15R0.70 O=CCOCCCCCCCCCCCBr 7a_100009812471_200015260668 [1,0,1,0,0,0|2,0,0]=4 4727 B15R0.70 O=CCSCCCCCCCCCCCO 62a_100009812471_200015260668 [1,0,1,0,0,0|1,0,0]=3 4728 B15R0.70 OCCCCCCCCCCCCNCF 34a_100000066677_100015361967 [1,0,1,0,0,0|2,0,0]=4 4729 B15R0.70 OCCCCCCCCCCCCSCF 62a_100009813331_100015361967 [1,0,1,0,0,0|2,0,0]=4 4730 B15R0.70 OCCCCCCCCCCCNCCF 34a_100000724931_100009812471 [1,0,1,0,0,0|2,0,0]=4 4731 B15R0.70 OCCCCCCCCCCCNCCO 2230a_100016997473_100009812471 [1,0,1,0,0,0|1,0,1]=4 4732 B15R0.70 OCCCCCCCCCCCNCCO 34a_100016990907_100009812471 [1,0,1,0,0,0|1,0,1]=4 4733 B15R0.70 OCCCCCCCCCCCOCCBr 34a_100000211926_100009812471 [1,0,1,0,0,0|2,0,0]=4 4734 B15R0.70 OCCCCCCCCCCCSCCF 62a_100009812471_100011217306 [1,0,1,0,0,0|2,0,0]=4 4735 B15R0.70 OCCCCCCCCCCCSCCO 62a_100009812471_100000211926 [1,0,1,0,0,0|1,0,1]=4 4736 B15R0.70 OCCCCCCCCCCNCCCF 2230a_100000066964_100011934791 [1,0,1,0,0,0|2,0,0]=4 4737 B15R0.70 OCCCCCCCCCCNCCCF 2230a_100015189416_100009813290 [1,0,1,0,0,0|2,0,0]=4 4738 B15R0.70 OCCCCCCCCCCNCCCF 34a_100000066964_100011934791 [1,0,1,0,0,0|2,0,0]=4 4739 B15R0.70 OCCCCCCCCCCNCCCF 34a_100015189416_100009813290 [1,0,1,0,0,0|2,0,0]=4 4740 B15R0.70 OCCCCCCCCCCNCCCO 2230a_100000066964_100000230001 [1,0,1,0,0,0|1,0,1]=4 4741 B15R0.70 OCCCCCCCCCCNCCCO 34a_100000066964_100000230001 [1,0,1,0,0,0|1,0,1]=4 4742 B15R0.70 OCCCCCCCCCCOCCCBr 34a_100011217188_100009813290 [1,0,1,0,0,0|2,0,0]=4 4743 B15R0.70 OCCCCCCCCCCOCCCCl 34a_100000230001_100009813290 [1,0,1,0,0,0|2,0,0]=4 4744 B15R0.70 OCCCCCCCCCCOCCCF 34a_100000759539_100009813290 [1,0,1,0,0,0|2,0,0]=4 4745 B15R0.70 OCCCCCCCCCCSCCCF 62a_100009813290_100011934791 [1,0,1,0,0,0|2,0,0]=4 4746 B15R0.70 OCCCCCCCCCCSCCCF 62a_100011934791_200000033068 [1,0,1,0,0,0|2,0,0]=4 4747 B15R0.70 OCCCCCCCCCCSCCCO 62a_100009813290_100011215043 [1,0,1,0,0,0|1,0,1]=4 4748 B15R0.70 OCCCCCCCCCCSCCCO 62a_100011215043_200000033068 [1,0,1,0,0,0|1,0,1]=4 4749 B15R0.70 OCCCCCCCCCNCCCCF 2230a_100000078944_100000729493 [1,0,1,0,0,0|2,0,0]=4 4750 B15R0.70 OCCCCCCCCCNCCCCF 34a_100000078944_100000729493 [1,0,1,0,0,0|2,0,0]=4 4751 B15R0.70 OCCCCCCCCCNCCCCO 2230a_100000078944_100000210776 [1,0,1,0,0,0|1,0,1]=4 4752 B15R0.70 OCCCCCCCCCNCCCCO 2230a_100000750430_100009813782 [1,0,1,0,0,0|1,0,1]=4 4753 B15R0.70 OCCCCCCCCCNCCCCO 34a_100000078944_100011216708 [1,0,1,0,0,0|1,0,1]=4 4754 B15R0.70 OCCCCCCCCCNCCCCO 34a_100000750430_100009813782 [1,0,1,0,0,0|1,0,1]=4 4755 B15R0.70 OCCCCCCCCCOCCCCBr 34a_100011216708_100009813782 [1,0,1,0,0,0|2,0,0]=4 4756 B15R0.70 OCCCCCCCCCOCCCCCl 34a_100000210776_100009813782 [1,0,1,0,0,0|2,0,0]=4 4757 B15R0.70 OCCCCCCCCCOCCCCCl 7a_100000210776_100009813782 [1,0,1,0,0,0|2,0,0]=4 4758 B15R0.70 OCCCCCCCCCOCCCCF 34a_100011995726_100009813782 [1,0,1,0,0,0|2,0,0]=4 4759 B15R0.70 OCCCCCCCCCOCCCCF 7a_100011995726_100009813782 [1,0,1,0,0,0|2,0,0]=4 4760 B15R0.70 OCCCCCCCCCOCCCCI 34a_200012148704_100009813782 [1,0,1,0,0,0|2,0,0]=4 4761 B15R0.70 OCCCCCCCCCSCCCCF 62a_100000729493_100009813782 [1,0,1,0,0,0|2,0,0]=4 4762 B15R0.70 OCCCCCCCCCSCCCCF 62a_100009813782_100000729493 [1,0,1,0,0,0|2,0,0]=4 4763 B15R0.70 OCCCCCCCCCSCCCCO 62a_100000210776_100009813782 [1,0,1,0,0,0|1,0,1]=4 4764 B15R0.70 OCCCCCCCCCSCCCCO 62a_100009813782_100000210776 [1,0,1,0,0,0|1,0,1]=4 4765 B15R0.70 OCCCCCCCCNCCCCCF 2230a_102515433106_100000729378 [1,0,1,0,0,0|2,0,0]=4 4766 B15R0.70 OCCCCCCCCNCCCCCF 34a_102515433106_100000729378 [1,0,1,0,0,0|2,0,0]=4 4767 B15R0.70 OCCCCCCCCNCCCCCO 2230a_100000762737_100000033203 [1,0,1,0,0,0|1,0,1]=4 4768 B15R0.70 OCCCCCCCCNCCCCCO 2230a_102515433106_100000746330 [1,0,1,0,0,0|1,0,1]=4 4769 B15R0.70 OCCCCCCCCNCCCCCO 34a_100000762737_100000033203 [1,0,1,0,0,0|1,0,1]=4 4770 B15R0.70 OCCCCCCCCNCCCCCO 34a_102515433106_100000746330 [1,0,1,0,0,0|1,0,1]=4 4771 B15R0.70 OCCCCCCCCOCCCCCBr 34a_100000746331_100000033203 [1,0,1,0,0,0|2,0,0]=4 4772 B15R0.70 OCCCCCCCCOCCCCCBr 7a_100000746331_100000033203 [1,0,1,0,0,0|2,0,0]=4 4773 B15R0.70 OCCCCCCCCOCCCCCCl 34a_100000746330_100000033203 [1,0,1,0,0,0|2,0,0]=4 4774 B15R0.70 OCCCCCCCCOCCCCCCl 7a_100000746330_100000033203 [1,0,1,0,0,0|2,0,0]=4 4775 B15R0.70 OCCCCCCCCOCCCCCI 34a_200012148887_100000033203 [1,0,1,0,0,0|2,0,0]=4 4776 B15R0.70 OCCCCCCCCOCCCCCI 7a_200012148887_100000033203 [1,0,1,0,0,0|2,0,0]=4 4777 B15R0.70 OCCCCCCCCSCCCCCF 62a_100000033203_100000729378 [1,0,1,0,0,0|2,0,0]=4 4778 B15R0.70 OCCCCCCCCSCCCCCF 62a_100000729378_100000033203 [1,0,1,0,0,0|2,0,0]=4 4779 B15R0.70 OCCCCCCCCSCCCCCO 62a_100000033203_100000746330 [1,0,1,0,0,0|1,0,1]=4 4780 B15R0.70 OCCCCCCCCSCCCCCO 62a_100000746330_100000033203 [1,0,1,0,0,0|1,0,1]=4 4781 B15R0.70 OCCCCCCCNCCCCCCF 2230a_100011996573_100015922095 [1,0,1,0,0,0|2,0,0]=4 4782 B15R0.70 OCCCCCCCNCCCCCCF 34a_100011996573_100015922095 [1,0,1,0,0,0|2,0,0]=4 4783 B15R0.70 OCCCCCCCNCCCCCCO 2230a_100000686447_100000760002 [1,0,1,0,0,0|1,0,1]=4 4784 B15R0.70 OCCCCCCCNCCCCCCO 2230a_100011996573_100000766143 [1,0,1,0,0,0|1,0,1]=4 4785 B15R0.70 OCCCCCCCNCCCCCCO 34a_100000686447_100000760002 [1,0,1,0,0,0|1,0,1]=4 4786 B15R0.70 OCCCCCCCNCCCCCCO 34a_100011996573_100000766143 [1,0,1,0,0,0|1,0,1]=4 4787 B15R0.70 OCCCCCCCOCCCCCCBr 34a_100011215345_100000760002 [1,0,1,0,0,0|2,0,0]=4 4788 B15R0.70 OCCCCCCCOCCCCCCBr 7a_100011215345_100000760002 [1,0,1,0,0,0|2,0,0]=4 4789 B15R0.70 OCCCCCCCOCCCCCCCl 34a_100000766143_100000760002 [1,0,1,0,0,0|2,0,0]=4 4790 B15R0.70 OCCCCCCCOCCCCCCCl 7a_100000766143_100000760002 [1,0,1,0,0,0|2,0,0]=4 4791 B15R0.70 OCCCCCCCOCCCCCCF 34a_100000732779_100000760002 [1,0,1,0,0,0|2,0,0]=4 4792 B15R0.70 OCCCCCCCOCCCCCCF 7a_100000732779_100000760002 [1,0,1,0,0,0|2,0,0]=4 4793 B15R0.70 OCCCCCCCSCCCCCCF 62a_100000760002_100015922095 [1,0,1,0,0,0|2,0,0]=4 4794 B15R0.70 OCCCCCCCSCCCCCCF 62a_100015922095_100000760002 [1,0,1,0,0,0|2,0,0]=4 4795 B15R0.70 OCCCCCCCSCCCCCCO 62a_100000760002_100000766143 [1,0,1,0,0,0|1,0,1]=4 4796 B15R0.70 OCCCCCCCSCCCCCCO 62a_100000766143_100000760002 [1,0,1,0,0,0|1,0,1]=4 4797 B15R0.70 OCCCCCCOCCCCCCCBr 34a_100000760002_100000766143 [1,0,1,0,0,0|2,0,0]=4 4798 B15R0.70 OCCCCCCOCCCCCCCBr 7a_100000760002_100000766143 [1,0,1,0,0,0|2,0,0]=4 4799 B15R0.70 OCCCCCOCCCCCCCCBr 34a_100009813846_100000746330 [1,0,1,0,0,0|2,0,0]=4 4800 B15R0.70 OCCCCCOCCCCCCCCBr 7a_100009813846_100000746330 [1,0,1,0,0,0|2,0,0]=4 4801 B15R0.70 OCCCCCOCCCCCCCCCl 34a_100000033203_100000746330 [1,0,1,0,0,0|2,0,0]=4 4802 B15R0.70 OCCCCCOCCCCCCCCCl 7a_100000033203_100000746330 [1,0,1,0,0,0|2,0,0]=4 4803 B15R0.70 OCCCCOCCCCCCCCCBr 34a_100009813782_100011216708 [1,0,1,0,0,0|2,0,0]=4 4804 B15R0.70 OCCCCOCCCCCCCCCBr 7a_100009813782_100000210776 [1,0,1,0,0,0|2,0,0]=4 4805 B15R0.70 OCCCCOCCCCCCCCCCl 34a_100009868337_100011216708 [1,0,1,0,0,0|2,0,0]=4 4806 B15R0.70 OCCCCOCCCCCCCCCCl 7a_100009868337_100000210776 [1,0,1,0,0,0|2,0,0]=4 4807 B15R0.70 OCCCOCCCCCCCCCCBr 34a_100009813290_100000230001 [1,0,1,0,0,0|2,0,0]=4 4808 B15R0.70 OCCCOCCCCCCCCCCBr 7a_100009813290_100011215043 [1,0,1,0,0,0|2,0,0]=4 4809 B15R0.70 OCCCOCCCCCCCCCCCl 34a_200000033068_100000230001 [1,0,1,0,0,0|2,0,0]=4 4810 B15R0.70 OCCCOCCCCCCCCCCCl 7a_200000033068_100011215043 [1,0,1,0,0,0|2,0,0]=4 4811 B15R0.70 OCCOCCCCCCCCCCCBr 34a_100009812471_100000211926 [1,0,1,0,0,0|2,0,0]=4 4812 B15R0.70 OCCOCCCCCCCCCCCBr 7a_100009812471_100000211926 [1,0,1,0,0,0|2,0,0]=4 4813 B15R0.70 [13CH3]OCCCCCCCCCCCCCBr 34a_100009812470_200025704644 [1,0,1,0,0,0|1,0,1]=4 4814 B15R0.70 [13CH3]OCCCCCCCCCCCCCBr 7a_100009812470_200025704644 [1,0,1,0,0,0|1,0,1]=4 4815 B15R0.70 [13CH3]SCCCCCCCCCCCCCO 62a_100009812470_200025704644 [1,0,1,0,0,0|1,0,1]=4 4816 B15R0.81 C#CC(=O)CCCCCCCCCCCC 1458a_100000211873_100000759014 [1,0,1,0,0,0|0,0,2]=4 4817 B15R0.81 C=CC(=O)CCCCCCCCCCCC 1458a_100000185746_100000759014 [1,0,1,0,0,0|0,0,2]=4 4818 B15R0.81 C=CCCCCCCCCCCC(=O)CC 1458a_100000210414_100011093070 [1,0,1,0,0,0|0,0,2]=4 4819 B15R0.81 CCC(=O)CCCCCCCCCCCO 1458a_100000210414_100009812471 [1,0,1,0,0,0|1,0,0]=3 4820 B15R0.81 CCC(=O)COCCCCCCCCCBr 7a_100009813782_100000747405 [1,0,1,0,0,0|2,0,0]=4 4821 B15R0.81 CCC(=O)COCCCCCCCCCCl 7a_100009868337_100000747405 [1,0,1,0,0,0|2,0,0]=4 4822 B15R0.81 CCC(=O)COCCCCCCCCCO 34a_100000725409_100009813782 [1,0,1,0,0,0|2,0,0]=4 4823 B15R0.81 CCC(=O)CSCCCCCCCCCO 62a_100000747405_100009813782 [1,0,1,0,0,0|2,0,0]=4 4824 B15R0.81 CCC(=O)CSCCCCCCCCCO 62a_100009813782_100000747405 [1,0,1,0,0,0|2,0,0]=4 4825 B15R0.81 CCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000210414 [1,0,1,0,0,0|2,0,0]=4 4826 B15R0.81 CCC(=O)OCCOCCCCCCCO 7a_200000031056_100000760002 [1,0,1,0,0,0|2,0,0]=4 4827 B15R0.81 CCC(=O)OCCOCCCCCCOC 7a_200000031056_100011998445 [1,0,1,0,0,0|2,0,0]=4 4828 B15R0.81 CCCCC#CCCCCCCC(=O)CC 1458a_100000210414_200000043322 [1,0,1,0,0,0|0,0,2]=4 4829 B15R0.81 CCCCCCCCCCCCC(=O)CC 1458a_100000210414_100000759014 [1,0,1,0,0,0|0,0,0]=2 4830 B15R0.81 CCCCCCCCCCCCC(=O)CC 1458a_100011215791_100000210202 [1,0,1,0,0,0|0,0,0]=2 4831 B15R0.81 CCCCCCCCCCCCC(=O)CF 1458a_100011215791_100015361967 [1,0,1,0,0,0|1,0,0]=3 4832 B15R0.81 CCCCCCCCCCCCC(=O)CO 1458a_100000210174_100000759014 [1,0,1,0,0,0|1,0,0]=3 4833 B15R0.81 CCCCCCCCCCCCC(=O)NC 11a_106832991635_100011215791 [1,0,1,0,0,0|1,0,0]=3 4834 B15R0.81 CCCCCCCCCCCCC(=O)NC 1626a_100102657272_100011215791 [1,0,1,0,0,0|1,0,0]=3 4835 B15R0.81 CCCCCCCCCCCCC(=O)NC 240690a_100102657272_100011215791 [1,0,1,0,0,0|1,0,0]=3 4836 B15R0.81 CCCCCCCCCCCCC(C)OC 34a_100138415774_200011217028 [1,0,1,0,0,0|1,0,1]=4 4837 B15R0.81 CCCCCCCCCCCCC(C)OC 34a_200011215752_200000210301 [1,0,1,0,0,0|1,0,1]=4 4838 B15R0.81 CCCCCCCCCCCCC(C)OC 7a_200011215752_200000210301 [1,0,1,0,0,0|1,0,1]=4 4839 B15R0.81 CCCCCCCCCCCCC(C)O[13CH3] 34a_200011215752_200025704644 [1,0,1,0,0,0|1,0,1]=4 4840 B15R0.81 CCCCCCCCCCCCC(C)O[13CH3] 7a_200011215752_200025704644 [1,0,1,0,0,0|1,0,1]=4 4841 B15R0.81 CCCCCCCCCCCCN(C)CC 2230a_100000225621_100011215052 [1,0,1,0,0,0|2,0,0]=4 4842 B15R0.81 CCCCCCCCCCCCN(C)CC 2230a_100000227908_100000210202 [1,0,1,0,0,0|2,0,0]=4 4843 B15R0.81 CCCCCCCCCCCCN(C)CC 269982a_100000225621_100000759014 [1,0,1,0,0,0|2,0,0]=4 4844 B15R0.81 CCCCCCCCCCCCN(C)CC 269982a_100000227908_100000204670 [1,0,1,0,0,0|2,0,0]=4 4845 B15R0.81 CCCCCCCCCCCNC(=O)CC 11a_200011215754_100000210414 [1,0,1,0,0,0|1,0,0]=3 4846 B15R0.81 CCCCCCCCCCCNC(=O)CC 1626a_200011215754_100000210414 [1,0,1,0,0,0|1,0,0]=3 4847 B15R0.81 CCCCCCCCCCCNC(=O)CC 240690a_200011215754_100000210414 [1,0,1,0,0,0|1,0,0]=3 4848 B15R0.81 CCCCCCCCCCCNC(=O)CC 527a_200011215754_100000210414 [1,0,1,0,0,0|1,0,0]=3 4849 B15R0.81 CCCCCCCCCCCNC(=O)CO 240690a_200011215754_100000210174 [1,0,1,0,0,0|2,0,0]=4 4850 B15R0.81 CCCCCCCCCCCNC(=O)CO 527a_200011215754_100000210174 [1,0,1,0,0,0|2,0,0]=4 4851 B15R0.81 CCCCCCCCCCCNC(=O)NC 2708a_100102657272_200011215754 [1,0,1,0,0,0|2,0,0]=4 4852 B15R0.81 CCCCCCCCCCCNC(=O)NC 2708a_200011215754_106832991635 [1,0,1,0,0,0|2,0,0]=4 4853 B15R0.81 CCCCCCCCCCCNC(=O)NC 273464a_100102657272_200011215754 [1,0,1,0,0,0|2,0,0]=4 4854 B15R0.81 CCCCCCCCCCCNC(=O)NC 273464a_200011215754_100102657272 [1,0,1,0,0,0|2,0,0]=4 4855 B15R0.81 CCCCCCCCCCCNC(=O)NC 512a_106832991638_200011215754 [1,0,1,0,0,0|2,0,0]=4 4856 B15R0.81 CCCCCCCCCCCNC(=O)NC 512a_200011215754_100102657272 [1,0,1,0,0,0|2,0,0]=4 4857 B15R0.81 CCCCCCCCCCCOC(C)CC 34a_100000210809_100011215416 [1,0,1,0,0,0|1,0,1]=4 4858 B15R0.81 CCCCCCCCCCCOC(C)CC 7a_100000210228_100011215454 [1,0,1,0,0,0|1,0,1]=4 4859 B15R0.81 CCCCCCCCCCCOC(C)CC 7a_100000210809_100000758301 [1,0,1,0,0,0|1,0,1]=4 4860 B15R0.81 CCCCCCCCCCNCC(=O)NC 2230a_100000684558_100000183359 [1,0,1,0,0,0|2,0,0]=4 4861 B15R0.81 CCCCCCCCCCNCC(=O)NC 2230a_100000693194_100000210320 [1,0,1,0,0,0|2,0,0]=4 4862 B15R0.81 CCCCCCCCCCNCC(=O)NC 34a_100000684558_100000183359 [1,0,1,0,0,0|2,0,0]=4 4863 B15R0.81 CCCCCCCCCCNCC(=O)OC 2230a_100000684558_100000747449 [1,0,1,0,0,0|1,0,0]=3 4864 B15R0.81 CCCCCCCCCCNCC(=O)OC 34a_100000684558_100000747449 [1,0,1,0,0,0|1,0,0]=3 4865 B15R0.81 CCCCCCCCCCOCC(=O)CC 34a_100000725409_100000210320 [1,0,1,0,0,0|1,0,0]=3 4866 B15R0.81 CCCCCCCCCCOCC(=O)CC 7a_100000210711_100000747405 [1,0,1,0,0,0|1,0,0]=3 4867 B15R0.81 CCCCCCCCCCOCC(=O)NC 34a_100000210711_100000183359 [1,0,1,0,0,0|2,0,0]=4 4868 B15R0.81 CCCCCCCCCCOCC(=O)NC 34a_100000750040_100000210320 [1,0,1,0,0,0|2,0,0]=4 4869 B15R0.81 CCCCCCCCCCOCC(=O)NC 7a_100000210711_100000183359 [1,0,1,0,0,0|2,0,0]=4 4870 B15R0.81 CCCCCCCCCCOCC(=O)OC 34a_100000210711_100000747449 [1,0,1,0,0,0|1,0,0]=3 4871 B15R0.81 CCCCCCCCCCOCC(=O)OC 7a_100000210711_100000747449 [1,0,1,0,0,0|1,0,0]=3 4872 B15R0.81 CCCCCCCCCCSCC(=O)CC 62a_100000747405_100000210320 [1,0,1,0,0,0|1,0,0]=3 4873 B15R0.81 CCCCCCCCCCSCC(=O)NC 62a_100000183359_100000210320 [1,0,1,0,0,0|2,0,0]=4 4874 B15R0.81 CCCCCCCCCCSCC(=O)OC 62a_100000747449_100000210320 [1,0,1,0,0,0|1,0,0]=3 4875 B15R0.81 CCCCCCCCCNCCC(=O)NC 2230a_100000212291_100000737683 [1,0,1,0,0,0|2,0,0]=4 4876 B15R0.81 CCCCCCCCCNCCC(=O)NC 2230a_100000738227_100011214924 [1,0,1,0,0,0|2,0,0]=4 4877 B15R0.81 CCCCCCCCCNCCC(=O)NC 34a_100000212291_100012179268 [1,0,1,0,0,0|2,0,0]=4 4878 B15R0.81 CCCCCCCCCNCCC(=O)NC 34a_100000738227_100011214924 [1,0,1,0,0,0|2,0,0]=4 4879 B15R0.81 CCCCCCCCCNCCC(=O)OC 2230a_100000212291_100000204255 [1,0,1,0,0,0|1,0,0]=3 4880 B15R0.81 CCCCCCCCCNCCC(=O)OC 34a_100000212291_100000742370 [1,0,1,0,0,0|1,0,0]=3 4881 B15R0.81 CCCCCCCCCOCCC(=O)NC 34a_100000210712_100012179268 [1,0,1,0,0,0|2,0,0]=4 4882 B15R0.81 CCCCCCCCCOCCC(=O)NC 34a_100000754576_100011214924 [1,0,1,0,0,0|2,0,0]=4 4883 B15R0.81 CCCCCCCCCOCCC(=O)NC 7a_100000210712_100000737683 [1,0,1,0,0,0|2,0,0]=4 4884 B15R0.81 CCCCCCCCCOCCC(=O)OC 34a_100000210712_100000742370 [1,0,1,0,0,0|1,0,0]=3 4885 B15R0.81 CCCCCCCCCOCCC(=O)OC 7a_100000210712_100000204255 [1,0,1,0,0,0|1,0,0]=3 4886 B15R0.81 CCCCCCCCCSCCC(=O)NC 62a_100000737683_100000210670 [1,0,1,0,0,0|2,0,0]=4 4887 B15R0.81 CCCCCCCCCSCCC(=O)OC 62a_100000204255_100000210670 [1,0,1,0,0,0|1,0,0]=3 4888 B15R0.81 CCCCCCCCNCCCC(=O)NC 2230a_100000229939_100000741757 [1,0,1,0,0,0|2,0,0]=4 4889 B15R0.81 CCCCCCCCNCCCC(=O)NC 2230a_100000740002_100000210759 [1,0,1,0,0,0|2,0,0]=4 4890 B15R0.81 CCCCCCCCNCCCC(=O)NC 34a_100000229939_100000741757 [1,0,1,0,0,0|2,0,0]=4 4891 B15R0.81 CCCCCCCCNCCCC(=O)NC 34a_100000740002_100000210759 [1,0,1,0,0,0|2,0,0]=4 4892 B15R0.81 CCCCCCCCNCCCC(=O)OC 2230a_100000229939_100011218270 [1,0,1,0,0,0|1,0,0]=3 4893 B15R0.81 CCCCCCCCNCCCC(=O)OC 34a_100000229939_100000742333 [1,0,1,0,0,0|1,0,0]=3 4894 B15R0.81 CCCCCCCCNCCNC(=O)CC 34a_100132302217_100000210759 [1,0,1,0,0,0|2,0,0]=4 4895 B15R0.81 CCCCCCCCNCCOC(=O)NC 34a_100000229939_200011997002 [1,0,1,0,0,0|2,0,0]=4 4896 B15R0.81 CCCCCCCCOCCCC(=O)NC 34a_100000210232_100000741757 [1,0,1,0,0,0|2,0,0]=4 4897 B15R0.81 CCCCCCCCOCCCC(=O)NC 7a_100000210232_100000741757 [1,0,1,0,0,0|2,0,0]=4 4898 B15R0.81 CCCCCCCCOCCCC(=O)OC 34a_100000210232_100000742333 [1,0,1,0,0,0|1,0,0]=3 4899 B15R0.81 CCCCCCCCOCCCC(=O)OC 7a_100000210232_100011218270 [1,0,1,0,0,0|1,0,0]=3 4900 B15R0.81 CCCCCCCCOCCNC(=O)CC 34a_200000158885_100000210759 [1,0,1,0,0,0|2,0,0]=4 4901 B15R0.81 CCCCCCCCOCCNC(=O)CC 7a_200000158885_100000210759 [1,0,1,0,0,0|2,0,0]=4 4902 B15R0.81 CCCCCCCCOCCNC(=O)OC 34a_100000757965_100000210759 [1,0,1,0,0,0|2,0,0]=4 4903 B15R0.81 CCCCCCCCOCCOC(=O)CC 7a_200000031056_100000210759 [1,0,1,0,0,0|1,0,0]=3 4904 B15R0.81 CCCCCCCCOCCOC(=O)NC 34a_100000210232_200011997002 [1,0,1,0,0,0|2,0,0]=4 4905 B15R0.81 CCCCCCCCOCCOC(=O)NC 7a_100000210232_200011997002 [1,0,1,0,0,0|2,0,0]=4 4906 B15R0.81 CCCCCCCCOCCOC(=O)OC 34a_100010262106_100000210759 [1,0,1,0,0,0|2,0,0]=4 4907 B15R0.81 CCCCCCCCSCCCC(=O)NC 62a_100000210759_100000741757 [1,0,1,0,0,0|2,0,0]=4 4908 B15R0.81 CCCCCCCCSCCCC(=O)NC 62a_100000741757_100000210317 [1,0,1,0,0,0|2,0,0]=4 4909 B15R0.81 CCCCCCCCSCCCC(=O)OC 62a_100000210759_100011218270 [1,0,1,0,0,0|1,0,0]=3 4910 B15R0.81 CCCCCCCCSCCCC(=O)OC 62a_100011218270_100000210317 [1,0,1,0,0,0|1,0,0]=3 4911 B15R0.81 CCCCCCCCSCCOC(=O)NC 62a_100000210759_200011997002 [1,0,1,0,0,0|2,0,0]=4 4912 B15R0.81 CCCCCCCCSCCOC(=O)NC 62a_200011997002_100000210317 [1,0,1,0,0,0|2,0,0]=4 4913 B15R0.81 CCCCCCCNCCCCC(=O)OC 2230a_100000229938_100000204269 [1,0,1,0,0,0|1,0,0]=3 4914 B15R0.81 CCCCCCCNCCOCC(=O)OC 2230a_100000229938_100000090808 [1,0,1,0,0,0|2,0,0]=4 4915 B15R0.81 CCCCCCCOCCCCC(=O)OC 34a_100000059025_100000210614 [1,0,1,0,0,0|1,0,0]=3 4916 B15R0.81 CCCCCCCOCCCCC(=O)OC 34a_100000210272_100000204269 [1,0,1,0,0,0|1,0,0]=3 4917 B15R0.81 CCCCCCCOCCCCC(=O)OC 7a_100000059025_100000210614 [1,0,1,0,0,0|1,0,0]=3 4918 B15R0.81 CCCCCCCOCCCCC(=O)OC 7a_100000210272_100000204269 [1,0,1,0,0,0|1,0,0]=3 4919 B15R0.81 CCCCCCCOCCOCC(=O)OC 34a_100000210272_100000090808 [1,0,1,0,0,0|2,0,0]=4 4920 B15R0.81 CCCCCCCOCCOCC(=O)OC 7a_100000210272_100000090808 [1,0,1,0,0,0|2,0,0]=4 4921 B15R0.81 CCCCCCCSCCCCC(=O)OC 62a_100000204269_100000210316 [1,0,1,0,0,0|1,0,0]=3 4922 B15R0.81 CCCCCCCSCCCCC(=O)OC 62a_100000210614_100000204269 [1,0,1,0,0,0|1,0,0]=3 4923 B15R0.81 CCCCCCCSCCOCC(=O)OC 62a_100000090808_100000210316 [1,0,1,0,0,0|2,0,0]=4 4924 B15R0.81 CCCCCCCSCCOCC(=O)OC 62a_100000210614_100000090808 [1,0,1,0,0,0|2,0,0]=4 4925 B15R0.81 CCCCCCNCCCCCC(=O)OC 2230a_100000210581_100009816466 [1,0,1,0,0,0|1,0,0]=3 4926 B15R0.81 CCCCCCOCCCCCC(=O)OC 34a_100000074720_100000210314 [1,0,1,0,0,0|1,0,0]=3 4927 B15R0.81 CCCCCCOCCCCCC(=O)OC 34a_100000210259_100009816466 [1,0,1,0,0,0|1,0,0]=3 4928 B15R0.81 CCCCCCOCCCCCC(=O)OC 7a_100000074720_100000210314 [1,0,1,0,0,0|1,0,0]=3 4929 B15R0.81 CCCCCCOCCCCCC(=O)OC 7a_100000210259_100009816466 [1,0,1,0,0,0|1,0,0]=3 4930 B15R0.81 CCCCCCOCCOCCC(=O)OC 34a_100000691444_100000742370 [1,0,1,0,0,0|2,0,0]=4 4931 B15R0.81 CCCCCCOCCOCCC(=O)OC 7a_100000691444_100000204255 [1,0,1,0,0,0|2,0,0]=4 4932 B15R0.81 CCCCCCSCCCCCC(=O)OC 62a_100000210314_100009816466 [1,0,1,0,0,0|1,0,0]=3 4933 B15R0.81 CCCCCCSCCCCCC(=O)OC 62a_100009816466_100000210757 [1,0,1,0,0,0|1,0,0]=3 4934 B15R0.81 CCCCCNCCCCCCC(=O)OC 2230a_100000209983_100009815986 [1,0,1,0,0,0|1,0,0]=3 4935 B15R0.81 CCCCCNCCOCCCC(=O)OC 34a_100000224656_100000742333 [1,0,1,0,0,0|2,0,0]=4 4936 B15R0.81 CCCCCOCCCCCCC(=O)OC 34a_100000210253_100009815986 [1,0,1,0,0,0|1,0,0]=3 4937 B15R0.81 CCCCCOCCCCCCC(=O)OC 34a_100009863599_100000718602 [1,0,1,0,0,0|1,0,0]=3 4938 B15R0.81 CCCCCOCCCCCCC(=O)OC 7a_100000210253_100009815986 [1,0,1,0,0,0|1,0,0]=3 4939 B15R0.81 CCCCCOCCCCCCC(=O)OC 7a_100009863599_100000210326 [1,0,1,0,0,0|1,0,0]=3 4940 B15R0.81 CCCCCOCCOCCCC(=O)OC 34a_100011215259_100000742333 [1,0,1,0,0,0|2,0,0]=4 4941 B15R0.81 CCCCCOCCOCCCC(=O)OC 7a_100011215259_100011218270 [1,0,1,0,0,0|2,0,0]=4 4942 B15R0.81 CCCCCSCCCCCCC(=O)OC 62a_100000210326_100009815986 [1,0,1,0,0,0|1,0,0]=3 4943 B15R0.81 CCCCCSCCCCCCC(=O)OC 62a_100009815986_100000210326 [1,0,1,0,0,0|1,0,0]=3 4944 B15R0.81 CCCCNCCCCCCCC(=O)OC 2230a_100000102301_100010004213 [1,0,1,0,0,0|1,0,0]=3 4945 B15R0.81 CCCCNCCCCCCCC(=O)OC 7a_106832991798_100010004213 [1,0,1,0,0,0|1,0,0]=3 4946 B15R0.81 CCCCNCCCCOCCC(=O)OC 34a_200011216965_100000742370 [1,0,1,0,0,0|2,0,0]=4 4947 B15R0.81 CCCCOCCCCCCCC(=O)OC 34a_100000210227_100010004213 [1,0,1,0,0,0|1,0,0]=3 4948 B15R0.81 CCCCOCCCCCCCC(=O)OC 34a_100011022521_100000210210 [1,0,1,0,0,0|1,0,0]=3 4949 B15R0.81 CCCCOCCCCCCCC(=O)OC 7a_100000210227_100010004213 [1,0,1,0,0,0|1,0,0]=3 4950 B15R0.81 CCCCOCCCCCCCC(=O)OC 7a_100011022521_100000210211 [1,0,1,0,0,0|1,0,0]=3 4951 B15R0.81 CCCCOCCCCOCCC(=O)OC 34a_200000760531_100000742370 [1,0,1,0,0,0|2,0,0]=4 4952 B15R0.81 CCCCOCCCCOCCC(=O)OC 7a_200000760531_100000204255 [1,0,1,0,0,0|2,0,0]=4 4953 B15R0.81 CCCCOCCCNCCCC(=O)OC 2230a_200000211371_100011218270 [1,0,1,0,0,0|2,0,0]=4 4954 B15R0.81 CCCCOCCCNCCCC(=O)OC 34a_200000211371_100000742333 [1,0,1,0,0,0|2,0,0]=4 4955 B15R0.81 CCCCOCCCOCCCC(=O)OC 34a_200011215613_100000742333 [1,0,1,0,0,0|2,0,0]=4 4956 B15R0.81 CCCCOCCCOCCCC(=O)OC 7a_200011215613_100011218270 [1,0,1,0,0,0|2,0,0]=4 4957 B15R0.81 CCCCOCCOCCCCC(=O)OC 34a_100000059025_100000743108 [1,0,1,0,0,0|2,0,0]=4 4958 B15R0.81 CCCCOCCOCCCCC(=O)OC 34a_100000210238_100000204269 [1,0,1,0,0,0|2,0,0]=4 4959 B15R0.81 CCCCOCCOCCCCC(=O)OC 7a_100000059025_100000743108 [1,0,1,0,0,0|2,0,0]=4 4960 B15R0.81 CCCCOCCOCCCCC(=O)OC 7a_100000210238_100000204269 [1,0,1,0,0,0|2,0,0]=4 4961 B15R0.81 CCCCOCCSCCCCC(=O)OC 62a_100000204269_100000743108 [1,0,1,0,0,0|2,0,0]=4 4962 B15R0.81 CCCCOCCSCCCCC(=O)OC 62a_100000743108_100000204269 [1,0,1,0,0,0|2,0,0]=4 4963 B15R0.81 CCCCOCOCCCCCC(=O)OC 34a_100000074720_100011995733 [1,0,1,0,0,0|2,0,0]=4 4964 B15R0.81 CCCCOCSCCCCCC(=O)OC 62a_100009816466_100011995733 [1,0,1,0,0,0|2,0,0]=4 4965 B15R0.81 CCCCOCSCCCCCC(=O)OC 62a_100011995733_100009816466 [1,0,1,0,0,0|2,0,0]=4 4966 B15R0.81 CCCCSCCCCCCCC(=O)OC 62a_100000210211_100010004213 [1,0,1,0,0,0|1,0,0]=3 4967 B15R0.81 CCCCSCCCCCCCC(=O)OC 62a_100010004213_100000210210 [1,0,1,0,0,0|1,0,0]=3 4968 B15R0.81 CCCCSCCNCCCCC(=O)OC 2230a_100025743550_100000204269 [1,0,1,0,0,0|2,0,0]=4 4969 B15R0.81 CCCCSCCOCCCCC(=O)OC 34a_200000230436_100000204269 [1,0,1,0,0,0|2,0,0]=4 4970 B15R0.81 CCCCSCCOCCCCC(=O)OC 7a_200000230436_100000204269 [1,0,1,0,0,0|2,0,0]=4 4971 B15R0.81 CCCOCCCCCCCCC(=O)OC 34a_100000035544_100000210303 [1,0,1,0,0,0|1,0,0]=3 4972 B15R0.81 CCCOCCCCCCCCC(=O)OC 34a_100000210258_100010282707 [1,0,1,0,0,0|1,0,0]=3 4973 B15R0.81 CCCOCCCCCCCCC(=O)OC 7a_100000035544_100000210303 [1,0,1,0,0,0|1,0,0]=3 4974 B15R0.81 CCCOCCCNCCCCC(=O)OC 2230a_100011217757_100000204269 [1,0,1,0,0,0|2,0,0]=4 4975 B15R0.81 CCCOCCCNCCCCC(=O)OC 34a_100011217757_100000204269 [1,0,1,0,0,0|2,0,0]=4 4976 B15R0.81 CCCOCCNCCCCCC(=O)OC 2230a_100161115042_100009816466 [1,0,1,0,0,0|2,0,0]=4 4977 B15R0.81 CCCOCCNCCCCCC(=O)OC 34a_100161115042_100009816466 [1,0,1,0,0,0|2,0,0]=4 4978 B15R0.81 CCCOCCOCCCCCC(=O)OC 34a_100000074720_100011215938 [1,0,1,0,0,0|2,0,0]=4 4979 B15R0.81 CCCOCCOCCCCCC(=O)OC 34a_100000752267_100009816466 [1,0,1,0,0,0|2,0,0]=4 4980 B15R0.81 CCCOCCOCCCCCC(=O)OC 7a_100000074720_100011215938 [1,0,1,0,0,0|2,0,0]=4 4981 B15R0.81 CCCOCCOCCCCCC(=O)OC 7a_100000752267_100009816466 [1,0,1,0,0,0|2,0,0]=4 4982 B15R0.81 CCCOCCSCCCCCC(=O)OC 62a_100009816466_100011215938 [1,0,1,0,0,0|2,0,0]=4 4983 B15R0.81 CCCOCCSCCCCCC(=O)OC 62a_100011215938_100009816466 [1,0,1,0,0,0|2,0,0]=4 4984 B15R0.81 CCCSCCCCCCCCC(=O)OC 62a_100000210303_100010282707 [1,0,1,0,0,0|1,0,0]=3 4985 B15R0.81 CCCSCCCCCCCCC(=O)OC 62a_100010282707_100000210303 [1,0,1,0,0,0|1,0,0]=3 4986 B15R0.81 CCCSCCNCCCCCC(=O)OC 2230a_100020603323_100009816466 [1,0,1,0,0,0|2,0,0]=4 4987 B15R0.81 CCCSCCOCCCCCC(=O)OC 34a_200000230433_100009816466 [1,0,1,0,0,0|2,0,0]=4 4988 B15R0.81 CCCSCCOCCCCCC(=O)OC 7a_200000230433_100009816466 [1,0,1,0,0,0|2,0,0]=4 4989 B15R0.81 CCNCCCCCCCCCC(=O)OC 2230a_100015525214_100009813843 [1,0,1,0,0,0|1,0,0]=3 4990 B15R0.81 CCOCCCCCCCCCC(=O)OC 34a_100121572206_100009813843 [1,0,1,0,0,0|1,0,0]=3 4991 B15R0.81 CCOCCCNCCCCCC(=O)OC 2230a_100000210961_100009816466 [1,0,1,0,0,0|2,0,0]=4 4992 B15R0.81 CCOCCCNCCCCCC(=O)OC 34a_100000210961_100009816466 [1,0,1,0,0,0|2,0,0]=4 4993 B15R0.81 CCOCCCOCCCCCC(=O)OC 34a_100000074720_100012232248 [1,0,1,0,0,0|2,0,0]=4 4994 B15R0.81 CCOCCCOCCCCCC(=O)OC 34a_100000757476_100009816466 [1,0,1,0,0,0|2,0,0]=4 4995 B15R0.81 CCOCCCOCCCCCC(=O)OC 7a_100000074720_100012232248 [1,0,1,0,0,0|2,0,0]=4 4996 B15R0.81 CCOCCCOCCCCCC(=O)OC 7a_100000757476_100009816466 [1,0,1,0,0,0|2,0,0]=4 4997 B15R0.81 CCOCCCSCCCCCC(=O)OC 62a_100009816466_100012232248 [1,0,1,0,0,0|2,0,0]=4 4998 B15R0.81 CCOCCCSCCCCCC(=O)OC 62a_100012232248_100009816466 [1,0,1,0,0,0|2,0,0]=4 4999 B15R0.81 CCOCCNCCCCCCC(=O)OC 2230a_102516460346_100009815986 [1,0,1,0,0,0|2,0,0]=4 5000 B15R0.81 CCOCCNCCCCCCC(=O)OC 34a_102516460346_100009815986 [1,0,1,0,0,0|2,0,0]=4 5001 B15R0.81 CCOCCOCCCCCCC(=O)OC 34a_100000210136_100009815986 [1,0,1,0,0,0|2,0,0]=4 5002 B15R0.81 CCOCCOCCCCCCC(=O)OC 34a_100009863599_100000210147 [1,0,1,0,0,0|2,0,0]=4 5003 B15R0.81 CCOCCOCCCCCCC(=O)OC 7a_100000210136_100009815986 [1,0,1,0,0,0|2,0,0]=4 5004 B15R0.81 CCOCCOCCCCCCC(=O)OC 7a_100009863599_100011215890 [1,0,1,0,0,0|2,0,0]=4 5005 B15R0.81 CCOCCSCCCCCCC(=O)OC 62a_100000210147_100009815986 [1,0,1,0,0,0|2,0,0]=4 5006 B15R0.81 CCOCCSCCCCCCC(=O)OC 62a_100009815986_100011215890 [1,0,1,0,0,0|2,0,0]=4 5007 B15R0.81 CCOCSCCCCCCCC(=O)OC 62a_100000739092_100010004213 [1,0,1,0,0,0|2,0,0]=4 5008 B15R0.81 CCOCSCCCCCCCC(=O)OC 62a_100010004213_100000739092 [1,0,1,0,0,0|2,0,0]=4 5009 B15R0.81 CCSCCCCCCCCCC(=O)OC 62a_100000210202_100009813843 [1,0,1,0,0,0|1,0,0]=3 5010 B15R0.81 CCSCCCOCCCCCC(=O)OC 34a_100011216438_100009816466 [1,0,1,0,0,0|2,0,0]=4 5011 B15R0.81 CCSCCCOCCCCCC(=O)OC 7a_100011216438_100009816466 [1,0,1,0,0,0|2,0,0]=4 5012 B15R0.81 CCSCCNCCCCCCC(=O)OC 2230a_100000106463_100009815986 [1,0,1,0,0,0|2,0,0]=4 5013 B15R0.81 CCSCCOCCCCCCC(=O)OC 34a_100000212035_100009815986 [1,0,1,0,0,0|2,0,0]=4 5014 B15R0.81 CCSCCOCCCCCCC(=O)OC 34a_100009863599_100000757381 [1,0,1,0,0,0|2,0,0]=4 5015 B15R0.81 CCSCCOCCCCCCC(=O)OC 7a_100000212035_100009815986 [1,0,1,0,0,0|2,0,0]=4 5016 B15R0.81 CCSCCOCCCCCCC(=O)OC 7a_100009863599_100000757381 [1,0,1,0,0,0|2,0,0]=4 5017 B15R0.81 CCSCCSCCCCCCC(=O)OC 62a_100000757381_100009815986 [1,0,1,0,0,0|2,0,0]=4 5018 B15R0.81 CCSCCSCCCCCCC(=O)OC 62a_100009815986_100000757381 [1,0,1,0,0,0|2,0,0]=4 5019 B15R0.81 CNC(=O)CCCCCCCCCCCO 240690a_100102657272_100000037981 [1,0,1,0,0,0|2,0,0]=4 5020 B15R0.81 CNCCCCCCCCCCC(=O)OC 2230a_106832991635_100009812566 [1,0,1,0,0,0|1,0,0]=3 5021 B15R0.81 CNCCCCCCCCCCC(=O)OC 34a_100102657272_100009812566 [1,0,1,0,0,0|1,0,0]=3 5022 B15R0.81 CNCCCCCCCCCCC(=O)OC 7a_106832991635_100009812566 [1,0,1,0,0,0|1,0,0]=3 5023 B15R0.81 CNCCCCCOCCCCC(=O)OC 34a_100000722520_100000204269 [1,0,1,0,0,0|2,0,0]=4 5024 B15R0.81 CNCCCOCCCCCCC(=O)OC 34a_100000213112_100009815986 [1,0,1,0,0,0|2,0,0]=4 5025 B15R0.81 COC(=O)CCCCCCCCCCO[13CH3] 34a_100011003013_200025704644 [1,0,1,0,0,0|1,0,0]=3 5026 B15R0.81 COC(=O)CCCCCCCCCCO[13CH3] 7a_100011003013_200025704644 [1,0,1,0,0,0|1,0,0]=3 5027 B15R0.81 COC(=O)CCCCCCCCCCSC 62a_200000210301_100009812566 [1,0,1,0,0,0|1,0,0]=3 5028 B15R0.81 COC(=O)CCCCCCCCCCS[13CH3] 62a_200025704644_100009812566 [1,0,1,0,0,0|1,0,0]=3 5029 B15R0.81 COC(=O)CCCCCCCCCSCF 62a_100015361967_100009813843 [1,0,1,0,0,0|2,0,0]=4 5030 B15R0.81 COC(=O)CCCCCCCCNCCF 34a_100000724931_100010282707 [1,0,1,0,0,0|2,0,0]=4 5031 B15R0.81 COC(=O)CCCCCCCCNCCO 2230a_100016997473_100010282707 [1,0,1,0,0,0|2,0,0]=4 5032 B15R0.81 COC(=O)CCCCCCCCNCCO 34a_100016990907_100010282707 [1,0,1,0,0,0|2,0,0]=4 5033 B15R0.81 COC(=O)CCCCCCCCOCCBr 34a_100000211926_100010282707 [1,0,1,0,0,0|2,0,0]=4 5034 B15R0.81 COC(=O)CCCCCCCCOCCF 34a_100000035544_100011217306 [1,0,1,0,0,0|2,0,0]=4 5035 B15R0.81 COC(=O)CCCCCCCCOCCF 7a_100000035544_100011217306 [1,0,1,0,0,0|2,0,0]=4 5036 B15R0.81 COC(=O)CCCCCCCCOCCN 34a_100000210304_100010282707 [1,0,1,0,0,0|2,0,0]=4 5037 B15R0.81 COC(=O)CCCCCCCCOCCO 34a_100000035544_100000211926 [1,0,1,0,0,0|2,0,0]=4 5038 B15R0.81 COC(=O)CCCCCCCCOCCO 7a_100000035544_100000211926 [1,0,1,0,0,0|2,0,0]=4 5039 B15R0.81 COC(=O)CCCCCCCCOCSC 34a_100000035544_100011218213 [1,0,1,0,0,0|2,0,0]=4 5040 B15R0.81 COC(=O)CCCCCCCCSCCF 62a_100010282707_100011217306 [1,0,1,0,0,0|2,0,0]=4 5041 B15R0.81 COC(=O)CCCCCCCCSCCF 62a_100011217306_100010282707 [1,0,1,0,0,0|2,0,0]=4 5042 B15R0.81 COC(=O)CCCCCCCCSCCO 62a_100000211926_100010282707 [1,0,1,0,0,0|2,0,0]=4 5043 B15R0.81 COC(=O)CCCCCCCCSCCO 62a_100010282707_100000211926 [1,0,1,0,0,0|2,0,0]=4 5044 B15R0.81 COC(=O)CCCCCCCCSCSC 62a_100010282707_100011218213 [1,0,1,0,0,0|2,0,0]=4 5045 B15R0.81 COC(=O)CCCCCCCCSCSC 62a_100011218213_100010282707 [1,0,1,0,0,0|2,0,0]=4 5046 B15R0.81 COC(=O)CCCCCCCNCCCF 2230a_100015189416_100010004213 [1,0,1,0,0,0|2,0,0]=4 5047 B15R0.81 COC(=O)CCCCCCCNCCCF 34a_100015189416_100010004213 [1,0,1,0,0,0|2,0,0]=4 5048 B15R0.81 COC(=O)CCCCCCCNCCSC 2230a_100020590264_100010004213 [1,0,1,0,0,0|2,0,0]=4 5049 B15R0.81 COC(=O)CCCCCCCOCCCBr 34a_100011217188_100010004213 [1,0,1,0,0,0|2,0,0]=4 5050 B15R0.81 COC(=O)CCCCCCCOCCCCl 34a_100000230001_100010004213 [1,0,1,0,0,0|2,0,0]=4 5051 B15R0.81 COC(=O)CCCCCCCOCCCF 34a_100000759539_100010004213 [1,0,1,0,0,0|2,0,0]=4 5052 B15R0.81 COC(=O)CCCCCCCOCCCF 34a_100011022521_100011934791 [1,0,1,0,0,0|2,0,0]=4 5053 B15R0.81 COC(=O)CCCCCCCOCCCF 7a_100011022521_100011934791 [1,0,1,0,0,0|2,0,0]=4 5054 B15R0.81 COC(=O)CCCCCCCOCCCN 34a_100000182051_100010004213 [1,0,1,0,0,0|2,0,0]=4 5055 B15R0.81 COC(=O)CCCCCCCOCCCO 34a_100011022521_100000230001 [1,0,1,0,0,0|2,0,0]=4 5056 B15R0.81 COC(=O)CCCCCCCOCCCO 7a_100011022521_100011215043 [1,0,1,0,0,0|2,0,0]=4 5057 B15R0.81 COC(=O)CCCCCCCOCCSC 34a_100000230434_100010004213 [1,0,1,0,0,0|2,0,0]=4 5058 B15R0.81 COC(=O)CCCCCCCOCCSC 34a_100011022521_100000212216 [1,0,1,0,0,0|2,0,0]=4 5059 B15R0.81 COC(=O)CCCCCCCOCCSC 7a_100000230434_100010004213 [1,0,1,0,0,0|2,0,0]=4 5060 B15R0.81 COC(=O)CCCCCCCOCCSC 7a_100011022521_100000212216 [1,0,1,0,0,0|2,0,0]=4 5061 B15R0.81 COC(=O)CCCCCCCSCCCF 62a_100010004213_100011934791 [1,0,1,0,0,0|2,0,0]=4 5062 B15R0.81 COC(=O)CCCCCCCSCCCF 62a_100011934791_100010004213 [1,0,1,0,0,0|2,0,0]=4 5063 B15R0.81 COC(=O)CCCCCCCSCCCO 62a_100010004213_100011215043 [1,0,1,0,0,0|2,0,0]=4 5064 B15R0.81 COC(=O)CCCCCCCSCCCO 62a_100011215043_100010004213 [1,0,1,0,0,0|2,0,0]=4 5065 B15R0.81 COC(=O)CCCCCCCSCCSC 62a_100000212216_100010004213 [1,0,1,0,0,0|2,0,0]=4 5066 B15R0.81 COC(=O)CCCCCCCSCCSC 62a_100010004213_100000751147 [1,0,1,0,0,0|2,0,0]=4 5067 B15R0.81 COC(=O)CCCCCCNCCCCO 2230a_100000750430_100009815986 [1,0,1,0,0,0|2,0,0]=4 5068 B15R0.81 COC(=O)CCCCCCNCCCCO 34a_100000750430_100009815986 [1,0,1,0,0,0|2,0,0]=4 5069 B15R0.81 COC(=O)CCCCCCNCCCSC 2230a_100000749238_100009815986 [1,0,1,0,0,0|2,0,0]=4 5070 B15R0.81 COC(=O)CCCCCCOCCCCBr 34a_100011216708_100009815986 [1,0,1,0,0,0|2,0,0]=4 5071 B15R0.81 COC(=O)CCCCCCOCCCCCl 34a_100000210776_100009815986 [1,0,1,0,0,0|2,0,0]=4 5072 B15R0.81 COC(=O)CCCCCCOCCCCCl 7a_100000210776_100009815986 [1,0,1,0,0,0|2,0,0]=4 5073 B15R0.81 COC(=O)CCCCCCOCCCCF 34a_100009863599_100000729493 [1,0,1,0,0,0|2,0,0]=4 5074 B15R0.81 COC(=O)CCCCCCOCCCCF 34a_100011995726_100009815986 [1,0,1,0,0,0|2,0,0]=4 5075 B15R0.81 COC(=O)CCCCCCOCCCCF 7a_100009863599_100000729493 [1,0,1,0,0,0|2,0,0]=4 5076 B15R0.81 COC(=O)CCCCCCOCCCCF 7a_100011995726_100009815986 [1,0,1,0,0,0|2,0,0]=4 5077 B15R0.81 COC(=O)CCCCCCOCCCCI 34a_200012148704_100009815986 [1,0,1,0,0,0|2,0,0]=4 5078 B15R0.81 COC(=O)CCCCCCOCCCCN 34a_100000750430_100009815986 [1,0,1,0,0,0|2,0,0]=4 5079 B15R0.81 COC(=O)CCCCCCOCCCCO 34a_100009863599_100011216708 [1,0,1,0,0,0|2,0,0]=4 5080 B15R0.81 COC(=O)CCCCCCOCCCCO 7a_100009863599_100000210776 [1,0,1,0,0,0|2,0,0]=4 5081 B15R0.81 COC(=O)CCCCCCOCCCSC 34a_100000690336_100009815986 [1,0,1,0,0,0|2,0,0]=4 5082 B15R0.81 COC(=O)CCCCCCOCCCSC 7a_100000690336_100009815986 [1,0,1,0,0,0|2,0,0]=4 5083 B15R0.81 COC(=O)CCCCCCSCCCCF 62a_100000729493_100009815986 [1,0,1,0,0,0|2,0,0]=4 5084 B15R0.81 COC(=O)CCCCCCSCCCCF 62a_100009815986_100000729493 [1,0,1,0,0,0|2,0,0]=4 5085 B15R0.81 COC(=O)CCCCCCSCCCCO 62a_100000210776_100009815986 [1,0,1,0,0,0|2,0,0]=4 5086 B15R0.81 COC(=O)CCCCCCSCCCCO 62a_100009815986_100000210776 [1,0,1,0,0,0|2,0,0]=4 5087 B15R0.81 COC(=O)CCCCCNCCCCCO 2230a_100000762737_100009816466 [1,0,1,0,0,0|2,0,0]=4 5088 B15R0.81 COC(=O)CCCCCNCCCCCO 34a_100000762737_100009816466 [1,0,1,0,0,0|2,0,0]=4 5089 B15R0.81 COC(=O)CCCCCOCCCCCBr 34a_100000746331_100009816466 [1,0,1,0,0,0|2,0,0]=4 5090 B15R0.81 COC(=O)CCCCCOCCCCCBr 7a_100000746331_100009816466 [1,0,1,0,0,0|2,0,0]=4 5091 B15R0.81 COC(=O)CCCCCOCCCCCCl 34a_100000746330_100009816466 [1,0,1,0,0,0|2,0,0]=4 5092 B15R0.81 COC(=O)CCCCCOCCCCCCl 7a_100000746330_100009816466 [1,0,1,0,0,0|2,0,0]=4 5093 B15R0.81 COC(=O)CCCCCOCCCCCF 34a_100000074720_100000729378 [1,0,1,0,0,0|2,0,0]=4 5094 B15R0.81 COC(=O)CCCCCOCCCCCF 7a_100000074720_100000729378 [1,0,1,0,0,0|2,0,0]=4 5095 B15R0.81 COC(=O)CCCCCOCCCCCI 34a_200012148887_100009816466 [1,0,1,0,0,0|2,0,0]=4 5096 B15R0.81 COC(=O)CCCCCOCCCCCI 7a_200012148887_100009816466 [1,0,1,0,0,0|2,0,0]=4 5097 B15R0.81 COC(=O)CCCCCOCCCCCN 34a_100000762737_100009816466 [1,0,1,0,0,0|2,0,0]=4 5098 B15R0.81 COC(=O)CCCCCOCCCCCO 34a_100000074720_100000746330 [1,0,1,0,0,0|2,0,0]=4 5099 B15R0.81 COC(=O)CCCCCOCCCCCO 7a_100000074720_100000746330 [1,0,1,0,0,0|2,0,0]=4 5100 B15R0.81 COC(=O)CCCCCOCCCCSC 34a_100011217163_100009816466 [1,0,1,0,0,0|2,0,0]=4 5101 B15R0.81 COC(=O)CCCCCOCCCCSC 7a_100011217163_100009816466 [1,0,1,0,0,0|2,0,0]=4 5102 B15R0.81 COC(=O)CCCCCSCCCCCF 62a_100000729378_100009816466 [1,0,1,0,0,0|2,0,0]=4 5103 B15R0.81 COC(=O)CCCCCSCCCCCF 62a_100009816466_100000729378 [1,0,1,0,0,0|2,0,0]=4 5104 B15R0.81 COC(=O)CCCCCSCCCCCO 62a_100000746330_100009816466 [1,0,1,0,0,0|2,0,0]=4 5105 B15R0.81 COC(=O)CCCCCSCCCCCO 62a_100009816466_100000746330 [1,0,1,0,0,0|2,0,0]=4 5106 B15R0.81 COC(=O)CCCCNCCCCCCO 2230a_100000686447_100000204269 [1,0,1,0,0,0|2,0,0]=4 5107 B15R0.81 COC(=O)CCCCNCCCCCCO 34a_100000686447_100000204269 [1,0,1,0,0,0|2,0,0]=4 5108 B15R0.81 COC(=O)CCCCOCCCCCCBr 34a_100011215345_100000204269 [1,0,1,0,0,0|2,0,0]=4 5109 B15R0.81 COC(=O)CCCCOCCCCCCBr 7a_100011215345_100000204269 [1,0,1,0,0,0|2,0,0]=4 5110 B15R0.81 COC(=O)CCCCOCCCCCCCl 34a_100000766143_100000204269 [1,0,1,0,0,0|2,0,0]=4 5111 B15R0.81 COC(=O)CCCCOCCCCCCCl 7a_100000766143_100000204269 [1,0,1,0,0,0|2,0,0]=4 5112 B15R0.81 COC(=O)CCCCOCCCCCCF 34a_100000059025_100015922095 [1,0,1,0,0,0|2,0,0]=4 5113 B15R0.81 COC(=O)CCCCOCCCCCCF 34a_100000732779_100000204269 [1,0,1,0,0,0|2,0,0]=4 5114 B15R0.81 COC(=O)CCCCOCCCCCCF 7a_100000059025_100015922095 [1,0,1,0,0,0|2,0,0]=4 5115 B15R0.81 COC(=O)CCCCOCCCCCCF 7a_100000732779_100000204269 [1,0,1,0,0,0|2,0,0]=4 5116 B15R0.81 COC(=O)CCCCOCCCCCCN 34a_100000686447_100000204269 [1,0,1,0,0,0|2,0,0]=4 5117 B15R0.81 COC(=O)CCCCOCCCCCCO 34a_100000059025_100000766143 [1,0,1,0,0,0|2,0,0]=4 5118 B15R0.81 COC(=O)CCCCOCCCCCCO 7a_100000059025_100000766143 [1,0,1,0,0,0|2,0,0]=4 5119 B15R0.81 COC(=O)CCCCSCCCCCCF 62a_100000204269_100015922095 [1,0,1,0,0,0|2,0,0]=4 5120 B15R0.81 COC(=O)CCCCSCCCCCCF 62a_100015922095_100000204269 [1,0,1,0,0,0|2,0,0]=4 5121 B15R0.81 COC(=O)CCCCSCCCCCCO 62a_100000204269_100000766143 [1,0,1,0,0,0|2,0,0]=4 5122 B15R0.81 COC(=O)CCCCSCCCCCCO 62a_100000766143_100000204269 [1,0,1,0,0,0|2,0,0]=4 5123 B15R0.81 COC(=O)CCCNCCCCCCCO 2230a_100011996573_100011218270 [1,0,1,0,0,0|2,0,0]=4 5124 B15R0.81 COC(=O)CCCNCCCCCCCO 34a_100011996573_100000742333 [1,0,1,0,0,0|2,0,0]=4 5125 B15R0.81 COC(=O)CCCOCCCCCCCBr 34a_100000760002_100000742333 [1,0,1,0,0,0|2,0,0]=4 5126 B15R0.81 COC(=O)CCCOCCCCCCCBr 7a_100000760002_100011218270 [1,0,1,0,0,0|2,0,0]=4 5127 B15R0.81 COC(=O)CCCOCCCCCCCN 34a_100011996573_100000742333 [1,0,1,0,0,0|2,0,0]=4 5128 B15R0.81 COC(=O)CCCSCCCCCCCO 62a_100000760002_100011218270 [1,0,1,0,0,0|2,0,0]=4 5129 B15R0.81 COC(=O)CCCSCCCCCCCO 62a_100011218270_100000760002 [1,0,1,0,0,0|2,0,0]=4 5130 B15R0.81 COC(=O)CCNCCCCCCCCO 2230a_102515433106_100000204255 [1,0,1,0,0,0|2,0,0]=4 5131 B15R0.81 COC(=O)CCNCCCCCCCCO 34a_102515433106_100000742370 [1,0,1,0,0,0|2,0,0]=4 5132 B15R0.81 COC(=O)CCOCCCCCCCCBr 34a_100009813846_100000742370 [1,0,1,0,0,0|2,0,0]=4 5133 B15R0.81 COC(=O)CCOCCCCCCCCBr 7a_100009813846_100000204255 [1,0,1,0,0,0|2,0,0]=4 5134 B15R0.81 COC(=O)CCOCCCCCCCCCl 34a_100000033203_100000742370 [1,0,1,0,0,0|2,0,0]=4 5135 B15R0.81 COC(=O)CCOCCCCCCCCCl 7a_100000033203_100000204255 [1,0,1,0,0,0|2,0,0]=4 5136 B15R0.81 COC(=O)CCOCCCCCCCCN 34a_102515433106_100000742370 [1,0,1,0,0,0|2,0,0]=4 5137 B15R0.81 COC(=O)CCSCCCCCCCCO 62a_100000033203_100000204255 [1,0,1,0,0,0|2,0,0]=4 5138 B15R0.81 COC(=O)CCSCCCCCCCCO 62a_100000204255_100000033203 [1,0,1,0,0,0|2,0,0]=4 5139 B15R0.81 COC(=O)CNCCCCCCCCCO 2230a_100000078944_100000747449 [1,0,1,0,0,0|2,0,0]=4 5140 B15R0.81 COC(=O)CNCCCCCCCCCO 34a_100000078944_100000747449 [1,0,1,0,0,0|2,0,0]=4 5141 B15R0.81 COC(=O)COCCCCCCCCCBr 34a_100009813782_100000747449 [1,0,1,0,0,0|2,0,0]=4 5142 B15R0.81 COC(=O)COCCCCCCCCCBr 7a_100009813782_100000747449 [1,0,1,0,0,0|2,0,0]=4 5143 B15R0.81 COC(=O)COCCCCCCCCCCl 34a_100009868337_100000747449 [1,0,1,0,0,0|2,0,0]=4 5144 B15R0.81 COC(=O)COCCCCCCCCCCl 7a_100009868337_100000747449 [1,0,1,0,0,0|2,0,0]=4 5145 B15R0.81 COC(=O)COCCCCCCCCCN 34a_100000078944_100000747449 [1,0,1,0,0,0|2,0,0]=4 5146 B15R0.81 COC(=O)CSCCCCCCCCCO 62a_100000747449_100009813782 [1,0,1,0,0,0|2,0,0]=4 5147 B15R0.81 COC(=O)CSCCCCCCCCCO 62a_100009813782_100000747449 [1,0,1,0,0,0|2,0,0]=4 5148 B15R0.81 COCCCCCCCCCCC(=O)OC 34a_100011003013_200000210301 [1,0,1,0,0,0|1,0,0]=3 5149 B15R0.81 COCCCCCCCCCCC(=O)OC 34a_100138415774_100009812566 [1,0,1,0,0,0|1,0,0]=3 5150 B15R0.81 COCCCCCCCCCCC(=O)OC 7a_100011003013_200000210301 [1,0,1,0,0,0|1,0,0]=3 5151 B15R0.81 COCCCCCCOCCCC(=O)OC 34a_200012092642_100000742333 [1,0,1,0,0,0|2,0,0]=4 5152 B15R0.81 COCCCCCCOCCCC(=O)OC 7a_200012092642_100011218270 [1,0,1,0,0,0|2,0,0]=4 5153 B15R0.81 COCCCCCCSCCCC(=O)OC 62a_100011218270_100011998445 [1,0,1,0,0,0|2,0,0]=4 5154 B15R0.81 COCCCCCCSCCCC(=O)OC 62a_100011998445_100011218270 [1,0,1,0,0,0|2,0,0]=4 5155 B15R0.81 COCCCCCNCCCCC(=O)OC 2230a_100000747528_100000204269 [1,0,1,0,0,0|2,0,0]=4 5156 B15R0.81 COCCCCCNCCCCC(=O)OC 34a_100000747528_100000204269 [1,0,1,0,0,0|2,0,0]=4 5157 B15R0.81 COCCCCOCCCCCC(=O)OC 34a_100000074720_100000755781 [1,0,1,0,0,0|2,0,0]=4 5158 B15R0.81 COCCCCOCCCCCC(=O)OC 34a_100000740925_100009816466 [1,0,1,0,0,0|2,0,0]=4 5159 B15R0.81 COCCCCOCCCCCC(=O)OC 7a_100000074720_100000730899 [1,0,1,0,0,0|2,0,0]=4 5160 B15R0.81 COCCCCSCCCCCC(=O)OC 62a_100000730899_100009816466 [1,0,1,0,0,0|2,0,0]=4 5161 B15R0.81 COCCCCSCCCCCC(=O)OC 62a_100009816466_100000730899 [1,0,1,0,0,0|2,0,0]=4 5162 B15R0.81 COCCCNCCCCCCC(=O)OC 34a_100150723488_100009815986 [1,0,1,0,0,0|2,0,0]=4 5163 B15R0.81 COCCCOCCCCCCC(=O)OC 34a_100000740835_100009815986 [1,0,1,0,0,0|2,0,0]=4 5164 B15R0.81 COCCCOCCCCCCC(=O)OC 34a_100009863599_100000740836 [1,0,1,0,0,0|2,0,0]=4 5165 B15R0.81 COCCCOCCCCCCC(=O)OC 7a_100009863599_100000740836 [1,0,1,0,0,0|2,0,0]=4 5166 B15R0.81 COCCCSCCCCCCC(=O)OC 62a_100000709357_100009815986 [1,0,1,0,0,0|2,0,0]=4 5167 B15R0.81 COCCCSCCCCCCC(=O)OC 62a_100009815986_100000709357 [1,0,1,0,0,0|2,0,0]=4 5168 B15R0.81 COCCNCCCCCCCC(=O)OC 2230a_100000209980_100010004213 [1,0,1,0,0,0|2,0,0]=4 5169 B15R0.81 COCCOCCCCCCCC(=O)OC 34a_100000210237_100010004213 [1,0,1,0,0,0|2,0,0]=4 5170 B15R0.81 COCCOCCCCCCCC(=O)OC 34a_100011022521_100011201679 [1,0,1,0,0,0|2,0,0]=4 5171 B15R0.81 COCCOCCCCCCCC(=O)OC 7a_100011022521_100000233755 [1,0,1,0,0,0|2,0,0]=4 5172 B15R0.81 COCCSCCCCCCCC(=O)OC 62a_100000233755_100010004213 [1,0,1,0,0,0|2,0,0]=4 5173 B15R0.81 COCCSCCCCCCCC(=O)OC 62a_100010004213_100000233755 [1,0,1,0,0,0|2,0,0]=4 5174 B15R0.81 COCSCCCCCCCCC(=O)OC 62a_100000766300_100010282707 [1,0,1,0,0,0|2,0,0]=4 5175 B15R0.81 COCSCCCCCCCCC(=O)OC 62a_100010282707_100000766300 [1,0,1,0,0,0|2,0,0]=4 5176 B15R0.81 O=C(CO)CCCCCCCCCCCO 1458a_100000210174_100009812471 [1,0,1,0,0,0|2,0,0]=4 5177 B15R0.366 C#CCC(=O)CCCCCCCCCCC 1458a_100000210736_100000184674 [1,0,1,0,0,0|0,0,2]=4 5178 B15R0.366 C#CCC(=O)CCCCCCCCCCC 1458a_100011220946_100011215454 [1,0,1,0,0,0|0,0,2]=4 5179 B15R0.366 C=CCC(=O)CCCCCCCCCCC 1458a_100000210193_100011215454 [1,0,1,0,0,0|0,0,2]=4 5180 B15R0.366 C=CCC(=O)CCCCCCCCCCC 1458a_100000210736_100000210623 [1,0,1,0,0,0|0,0,2]=4 5181 B15R0.366 C=CCCCCCCCCCC(=O)CCC 1458a_100000211992_100009814027 [1,0,1,0,0,0|0,0,2]=4 5182 B15R0.366 CC#CC(=O)CCCCCCCCCCC 1458a_100000763181_100011215454 [1,0,1,0,0,0|0,0,2]=4 5183 B15R0.366 CC=CC(=O)CCCCCCCCCCC 1458a_100000210699_100011215454 [1,0,1,0,0,0|0,0,2]=4 5184 B15R0.366 CCCC(=O)CCCCCCCCCCO 1458a_100000211992_100009813290 [1,0,1,0,0,0|1,0,0]=3 5185 B15R0.366 CCCC(=O)CNCCCCCCCCO 2230a_102515433106_100000747444 [1,0,1,0,0,0|2,0,0]=4 5186 B15R0.366 CCCC(=O)COCCCCCCCCBr 7a_100009813846_100000747444 [1,0,1,0,0,0|2,0,0]=4 5187 B15R0.366 CCCC(=O)COCCCCCCCCCl 7a_100000033203_100000747444 [1,0,1,0,0,0|2,0,0]=4 5188 B15R0.366 CCCC(=O)CSCCCCCCCCO 62a_100000033203_100000747444 [1,0,1,0,0,0|2,0,0]=4 5189 B15R0.366 CCCC(=O)CSCCCCCCCCO 62a_100000747444_100000033203 [1,0,1,0,0,0|2,0,0]=4 5190 B15R0.366 CCCC(=O)NCCCCCCCCCO 240690a_100000078944_100000211992 [1,0,1,0,0,0|2,0,0]=4 5191 B15R0.366 CCCC(=O)OCNCCCCCCCO 2230a_100011996573_100000034017 [1,0,1,0,0,0|2,0,0]=4 5192 B15R0.366 CCCC(=O)OCNCCCCCCCO 34a_100011996573_100000034017 [1,0,1,0,0,0|2,0,0]=4 5193 B15R0.366 CCCC(=O)OCOCCCCCCCBr 34a_100000760002_100000034017 [1,0,1,0,0,0|2,0,0]=4 5194 B15R0.366 CCCC(=O)OCOCCCCCCCN 34a_100011996573_100000034017 [1,0,1,0,0,0|2,0,0]=4 5195 B15R0.366 CCCC(=O)OCOCCCCCCOC 34a_200012092642_100000034017 [1,0,1,0,0,0|2,0,0]=4 5196 B15R0.366 CCCC(=O)OCSCCCCCCCO 62a_100000760002_100000034017 [1,0,1,0,0,0|2,0,0]=4 5197 B15R0.366 CCCC(=O)OCSCCCCCCOC 62a_100011998445_100000034017 [1,0,1,0,0,0|2,0,0]=4 5198 B15R0.366 CCCCCCCCCC=CC(=O)CCC 1458a_200015352897_100000210303 [1,0,1,0,0,0|0,0,2]=4 5199 B15R0.366 CCCCCCCCCCCC(=O)CC#N 1458a_100000210736_100011214920 [1,0,1,0,0,0|1,0,1]=4 5200 B15R0.366 CCCCCCCCCCCC(=O)CC#N 1458a_100051588842_100011215454 [1,0,1,0,0,0|1,0,1]=4 5201 B15R0.366 CCCCCCCCCCCC(=O)CCC 1458a_100000210736_100000210303 [1,0,1,0,0,0|0,0,0]=2 5202 B15R0.366 CCCCCCCCCCCC(=O)CCC 1458a_100000211992_100011215454 [1,0,1,0,0,0|0,0,0]=2 5203 B15R0.366 CCCCCCCCCCCC(=O)CCF 1458a_100000210736_100011217306 [1,0,1,0,0,0|1,0,0]=3 5204 B15R0.366 CCCCCCCCCCCC(=O)CCO 1458a_100000210736_100000211926 [1,0,1,0,0,0|1,0,0]=3 5205 B15R0.366 CCCCCCCCCCCC(=O)CCO 1458a_100011216618_100011215454 [1,0,1,0,0,0|1,0,0]=3 5206 B15R0.366 CCCCCCCCCCCC(=O)COC 1458a_100000210968_100011215454 [1,0,1,0,0,0|1,0,0]=3 5207 B15R0.366 CCCCCCCCCCCC(=O)CSC 1458a_100000184570_100011215454 [1,0,1,0,0,0|1,0,0]=3 5208 B15R0.366 CCCCCCCCCCCC(=O)NCC 11a_100015525214_100000210736 [1,0,1,0,0,0|1,0,0]=3 5209 B15R0.366 CCCCCCCCCCCC(=O)NCC 240690a_100015525214_100000210736 [1,0,1,0,0,0|1,0,0]=3 5210 B15R0.366 CCCCCCCCCCCC(=O)NNC 22a_100016993582_100000210736 [1,0,1,0,0,0|2,0,0]=4 5211 B15R0.366 CCCCCCCCCCCC(C)OCC 34a_100011217895_100000210202 [1,0,1,0,0,0|1,0,1]=4 5212 B15R0.366 CCCCCCCCCCCC(C)OCC 7a_100011217895_100000210202 [1,0,1,0,0,0|1,0,1]=4 5213 B15R0.366 CCCCCCCCCCCN(C)CCC 2230a_100000747261_100011215454 [1,0,1,0,0,0|2,0,0]=4 5214 B15R0.366 CCCCCCCCCCCN(C)CCC 269982a_100000747261_100011215454 [1,0,1,0,0,0|2,0,0]=4 5215 B15R0.366 CCCCCCCCCCNC(=O)CCC 11a_100000684558_100000211992 [1,0,1,0,0,0|1,0,0]=3 5216 B15R0.366 CCCCCCCCCCNC(=O)CCC 1626a_100000684558_100000211992 [1,0,1,0,0,0|1,0,0]=3 5217 B15R0.366 CCCCCCCCCCNC(=O)CCC 240690a_100000684558_100000211992 [1,0,1,0,0,0|1,0,0]=3 5218 B15R0.366 CCCCCCCCCCNC(=O)CCC 527a_100000684558_100000211992 [1,0,1,0,0,0|1,0,0]=3 5219 B15R0.366 CCCCCCCCCCNC(=O)CCO 240690a_100000684558_100011216618 [1,0,1,0,0,0|2,0,0]=4 5220 B15R0.366 CCCCCCCCCCNC(=O)COC 11a_100000684558_100000210968 [1,0,1,0,0,0|2,0,0]=4 5221 B15R0.366 CCCCCCCCCCNC(=O)COC 1626a_100000684558_100000210968 [1,0,1,0,0,0|2,0,0]=4 5222 B15R0.366 CCCCCCCCCCNC(=O)COC 240690a_100000684558_100000210968 [1,0,1,0,0,0|2,0,0]=4 5223 B15R0.366 CCCCCCCCCCNC(=O)COC 527a_100000684558_100000210968 [1,0,1,0,0,0|2,0,0]=4 5224 B15R0.366 CCCCCCCCCCNC(=O)CSC 11a_100000684558_100000184570 [1,0,1,0,0,0|2,0,0]=4 5225 B15R0.366 CCCCCCCCCCNC(=O)CSC 1626a_100000684558_100000184570 [1,0,1,0,0,0|2,0,0]=4 5226 B15R0.366 CCCCCCCCCCNC(=O)CSC 240690a_100000684558_100000184570 [1,0,1,0,0,0|2,0,0]=4 5227 B15R0.366 CCCCCCCCCCNC(=O)CSC 527a_100000684558_100000184570 [1,0,1,0,0,0|2,0,0]=4 5228 B15R0.366 CCCCCCCCCCNC(=O)NCC 2708a_100000684558_100015525214 [1,0,1,0,0,0|2,0,0]=4 5229 B15R0.366 CCCCCCCCCCNC(=O)NCC 2708a_100015525214_100000684558 [1,0,1,0,0,0|2,0,0]=4 5230 B15R0.366 CCCCCCCCCCNC(=O)NCC 273464a_100000684558_100015525214 [1,0,1,0,0,0|2,0,0]=4 5231 B15R0.366 CCCCCCCCCCNC(=O)NCC 273464a_100015525214_100000684558 [1,0,1,0,0,0|2,0,0]=4 5232 B15R0.366 CCCCCCCCCCNC(=O)NCC 512a_100000684558_100015525214 [1,0,1,0,0,0|2,0,0]=4 5233 B15R0.366 CCCCCCCCCCNC(=O)NCC 512a_100015525214_100000684558 [1,0,1,0,0,0|2,0,0]=4 5234 B15R0.366 CCCCCCCCCCOC(=O)CNC 2230a_106832991635_100000210668 [1,0,1,0,0,0|1,0,0]=3 5235 B15R0.366 CCCCCCCCCCOC(=O)CNC 34a_100102657272_100000210668 [1,0,1,0,0,0|1,0,0]=3 5236 B15R0.366 CCCCCCCCCCOC(=O)CNC 7a_106832991635_100000210668 [1,0,1,0,0,0|1,0,0]=3 5237 B15R0.366 CCCCCCCCCCOC(=O)COC 34a_100138415774_100000210668 [1,0,1,0,0,0|1,0,0]=3 5238 B15R0.366 CCCCCCCCCCOC(=O)CSC 62a_100000680656_200000210301 [1,0,1,0,0,0|1,0,0]=3 5239 B15R0.366 CCCCCCCCCCOC(=O)CSC 62a_200000210301_100000680656 [1,0,1,0,0,0|1,0,0]=3 5240 B15R0.366 CCCCCCCCCCOC(=O)CS[13CH3] 62a_100000680656_200025704644 [1,0,1,0,0,0|1,0,0]=3 5241 B15R0.366 CCCCCCCCCCOC(=O)CS[13CH3] 62a_200025704644_100000680656 [1,0,1,0,0,0|1,0,0]=3 5242 B15R0.366 CCCCCCCCCCOC(C)CCC 34a_100000210711_100000766640 [1,0,1,0,0,0|1,0,1]=4 5243 B15R0.366 CCCCCCCCCCOC(C)CCC 34a_100000764384_100000210320 [1,0,1,0,0,0|1,0,1]=4 5244 B15R0.366 CCCCCCCCCCOC(C)CCC 7a_100000210711_100000766640 [1,0,1,0,0,0|1,0,1]=4 5245 B15R0.366 CCCCCCCCCCOC(C)CCC 7a_100000764384_100000210320 [1,0,1,0,0,0|1,0,1]=4 5246 B15R0.366 CCCCCCCCCNCC(=O)CCC 2230a_100000212291_100000747444 [1,0,1,0,0,0|1,0,0]=3 5247 B15R0.366 CCCCCCCCCNCC(=O)NCC 2230a_100000212291_100000183381 [1,0,1,0,0,0|2,0,0]=4 5248 B15R0.366 CCCCCCCCCNCC(=O)NCC 2230a_100016988866_100011214924 [1,0,1,0,0,0|2,0,0]=4 5249 B15R0.366 CCCCCCCCCNCC(=O)NCC 34a_100000212291_100000183381 [1,0,1,0,0,0|2,0,0]=4 5250 B15R0.366 CCCCCCCCCNCC(=O)OCC 2230a_100000212291_100000188475 [1,0,1,0,0,0|1,0,0]=3 5251 B15R0.366 CCCCCCCCCNCC(=O)OCC 34a_100000212291_100000188475 [1,0,1,0,0,0|1,0,0]=3 5252 B15R0.366 CCCCCCCCCOCC(=O)CCC 7a_100000210712_100000747444 [1,0,1,0,0,0|1,0,0]=3 5253 B15R0.366 CCCCCCCCCOCC(=O)NCC 34a_100000210712_100000183381 [1,0,1,0,0,0|2,0,0]=4 5254 B15R0.366 CCCCCCCCCOCC(=O)NCC 7a_100000210712_100000183381 [1,0,1,0,0,0|2,0,0]=4 5255 B15R0.366 CCCCCCCCCOCC(=O)OCC 34a_100000210712_100000188475 [1,0,1,0,0,0|1,0,0]=3 5256 B15R0.366 CCCCCCCCCOCC(=O)OCC 7a_100000210712_100000188475 [1,0,1,0,0,0|1,0,0]=3 5257 B15R0.366 CCCCCCCCCSCC(=O)CCC 62a_100000747444_100000210670 [1,0,1,0,0,0|1,0,0]=3 5258 B15R0.366 CCCCCCCCCSCC(=O)NCC 62a_100000183381_100000210670 [1,0,1,0,0,0|2,0,0]=4 5259 B15R0.366 CCCCCCCCCSCC(=O)OCC 62a_100000188475_100000210670 [1,0,1,0,0,0|1,0,0]=3 5260 B15R0.366 CCCCCCCCNCCC(=O)NCC 2230a_100000229939_100000737597 [1,0,1,0,0,0|2,0,0]=4 5261 B15R0.366 CCCCCCCCNCCC(=O)NCC 34a_100025743525_100000210759 [1,0,1,0,0,0|2,0,0]=4 5262 B15R0.366 CCCCCCCCNCCC(=O)OCC 2230a_100000229939_100011206558 [1,0,1,0,0,0|1,0,0]=3 5263 B15R0.366 CCCCCCCCNCCC(=O)OCC 34a_100000229939_100000765890 [1,0,1,0,0,0|1,0,0]=3 5264 B15R0.366 CCCCCCCCNCOC(=O)CCC 2230a_100000229939_100000034017 [1,0,1,0,0,0|1,0,0]=3 5265 B15R0.366 CCCCCCCCNCOC(=O)CCC 34a_100000229939_100000034017 [1,0,1,0,0,0|1,0,0]=3 5266 B15R0.366 CCCCCCCCOCCC(=O)NCC 7a_100000210232_100000737597 [1,0,1,0,0,0|2,0,0]=4 5267 B15R0.366 CCCCCCCCOCCC(=O)OCC 34a_100000210232_100000765890 [1,0,1,0,0,0|1,0,0]=3 5268 B15R0.366 CCCCCCCCOCCC(=O)OCC 7a_100000210232_100011206558 [1,0,1,0,0,0|1,0,0]=3 5269 B15R0.366 CCCCCCCCOCOC(=O)CCC 34a_100000210232_100000034017 [1,0,1,0,0,0|1,0,0]=3 5270 B15R0.366 CCCCCCCCSCCC(=O)NCC 62a_100000210759_100000737597 [1,0,1,0,0,0|2,0,0]=4 5271 B15R0.366 CCCCCCCCSCCC(=O)NCC 62a_100000737597_100000210317 [1,0,1,0,0,0|2,0,0]=4 5272 B15R0.366 CCCCCCCCSCCC(=O)OCC 62a_100000210759_100000765890 [1,0,1,0,0,0|1,0,0]=3 5273 B15R0.366 CCCCCCCCSCCC(=O)OCC 62a_100000765890_100000210317 [1,0,1,0,0,0|1,0,0]=3 5274 B15R0.366 CCCCCCCCSCOC(=O)CCC 62a_100000210759_100000034017 [1,0,1,0,0,0|1,0,0]=3 5275 B15R0.366 CCCCCCCCSCOC(=O)OCC 62a_100000210759_100000075025 [1,0,1,0,0,0|2,0,0]=4 5276 B15R0.366 CCCCCCCNCCCC(=O)OCC 2230a_100000229938_100009991533 [1,0,1,0,0,0|1,0,0]=3 5277 B15R0.366 CCCCCCCOCCCC(=O)OCC 34a_100000210272_100009991533 [1,0,1,0,0,0|1,0,0]=3 5278 B15R0.366 CCCCCCCOCCCC(=O)OCC 7a_100000210272_100011215271 [1,0,1,0,0,0|1,0,0]=3 5279 B15R0.366 CCCCCCCOCCCC(=O)OCC 7a_100012001163_100000210614 [1,0,1,0,0,0|1,0,0]=3 5280 B15R0.366 CCCCCCCOCCNC(=O)OCC 34a_100000158857_100000210614 [1,0,1,0,0,0|2,0,0]=4 5281 B15R0.366 CCCCCCCOCCNC(=O)OCC 7a_100000210272_200011445536 [1,0,1,0,0,0|2,0,0]=4 5282 B15R0.366 CCCCCCCSCCCC(=O)OCC 62a_100000210614_100009991533 [1,0,1,0,0,0|1,0,0]=3 5283 B15R0.366 CCCCCCCSCCCC(=O)OCC 62a_100009991533_100000210316 [1,0,1,0,0,0|1,0,0]=3 5284 B15R0.366 CCCCCCCSCCNC(=O)OCC 62a_100000210614_200011445536 [1,0,1,0,0,0|2,0,0]=4 5285 B15R0.366 CCCCCCNCCCCC(=O)OCC 2230a_100000210581_100000750268 [1,0,1,0,0,0|1,0,0]=3 5286 B15R0.366 CCCCCCNCCOCC(=O)OCC 2230a_100000210581_100000088970 [1,0,1,0,0,0|2,0,0]=4 5287 B15R0.366 CCCCCCOCCCCC(=O)OCC 34a_100000210259_100000750268 [1,0,1,0,0,0|1,0,0]=3 5288 B15R0.366 CCCCCCOCCCCC(=O)OCC 7a_100000210259_100000750268 [1,0,1,0,0,0|1,0,0]=3 5289 B15R0.366 CCCCCCOCCOCC(=O)CCC 7a_100000691444_100000747444 [1,0,1,0,0,0|2,0,0]=4 5290 B15R0.366 CCCCCCOCCOCC(=O)OCC 34a_100000210259_100000088970 [1,0,1,0,0,0|2,0,0]=4 5291 B15R0.366 CCCCCCOCCOCC(=O)OCC 34a_100000691444_100000188475 [1,0,1,0,0,0|2,0,0]=4 5292 B15R0.366 CCCCCCOCCOCC(=O)OCC 7a_100000210259_100000088970 [1,0,1,0,0,0|2,0,0]=4 5293 B15R0.366 CCCCCCOCCOCC(=O)OCC 7a_100000691444_100000188475 [1,0,1,0,0,0|2,0,0]=4 5294 B15R0.366 CCCCCCOCCSCC(=O)OCC 7a_200000230590_100000210314 [1,0,1,0,0,0|2,0,0]=4 5295 B15R0.366 CCCCCCSCCCCC(=O)OCC 62a_100000210314_100000750268 [1,0,1,0,0,0|1,0,0]=3 5296 B15R0.366 CCCCCCSCCCCC(=O)OCC 62a_100000750268_100000210757 [1,0,1,0,0,0|1,0,0]=3 5297 B15R0.366 CCCCCCSCCOCC(=O)OCC 62a_100000088970_100000210757 [1,0,1,0,0,0|2,0,0]=4 5298 B15R0.366 CCCCCCSCCOCC(=O)OCC 62a_100000210314_100000088970 [1,0,1,0,0,0|2,0,0]=4 5299 B15R0.366 CCCCCNCCCCCC(=O)OCC 2230a_100000209983_100000755133 [1,0,1,0,0,0|1,0,0]=3 5300 B15R0.366 CCCCCNCCCOCC(=O)OCC 2230a_100000209983_100009893628 [1,0,1,0,0,0|2,0,0]=4 5301 B15R0.366 CCCCCNCCOCCC(=O)OCC 34a_100000224656_100000765890 [1,0,1,0,0,0|2,0,0]=4 5302 B15R0.366 CCCCCNCCOCOC(=O)CCC 34a_100000224656_100000034017 [1,0,1,0,0,0|2,0,0]=4 5303 B15R0.366 CCCCCOCCCCCC(=O)OCC 34a_100000210253_100000755133 [1,0,1,0,0,0|1,0,0]=3 5304 B15R0.366 CCCCCOCCCCCC(=O)OCC 7a_100000210253_100000755133 [1,0,1,0,0,0|1,0,0]=3 5305 B15R0.366 CCCCCOCCCCCC(=O)OCC 7a_100011214988_100000210326 [1,0,1,0,0,0|1,0,0]=3 5306 B15R0.366 CCCCCOCCCOCC(=O)OCC 34a_100000210253_100009893628 [1,0,1,0,0,0|2,0,0]=4 5307 B15R0.366 CCCCCOCCCOCC(=O)OCC 7a_100000210253_100009893628 [1,0,1,0,0,0|2,0,0]=4 5308 B15R0.366 CCCCCOCCOCCC(=O)OCC 34a_100011215259_100000765890 [1,0,1,0,0,0|2,0,0]=4 5309 B15R0.366 CCCCCOCCOCCC(=O)OCC 7a_100011215259_100011206558 [1,0,1,0,0,0|2,0,0]=4 5310 B15R0.366 CCCCCOCCOCOC(=O)CCC 34a_100011215259_100000034017 [1,0,1,0,0,0|2,0,0]=4 5311 B15R0.366 CCCCCSCCCCCC(=O)OCC 62a_100000210326_100000755133 [1,0,1,0,0,0|1,0,0]=3 5312 B15R0.366 CCCCCSCCCCCC(=O)OCC 62a_100000755133_100000210326 [1,0,1,0,0,0|1,0,0]=3 5313 B15R0.366 CCCCCSCCCOCC(=O)OCC 62a_100000210326_100009893628 [1,0,1,0,0,0|2,0,0]=4 5314 B15R0.366 CCCCCSCCCOCC(=O)OCC 62a_100009893628_100000210326 [1,0,1,0,0,0|2,0,0]=4 5315 B15R0.366 CCCCNCCCCCCC(=O)OCC 2230a_100000102301_100009814379 [1,0,1,0,0,0|1,0,0]=3 5316 B15R0.366 CCCCNCCCCCCC(=O)OCC 7a_106832991798_100009814379 [1,0,1,0,0,0|1,0,0]=3 5317 B15R0.366 CCCCNCCCCOCC(=O)OCC 34a_200011216965_100000188475 [1,0,1,0,0,0|2,0,0]=4 5318 B15R0.366 CCCCOCCCCCCC(=O)OCC 34a_100000210227_100009814379 [1,0,1,0,0,0|1,0,0]=3 5319 B15R0.366 CCCCOCCCCCCC(=O)OCC 7a_100000210227_100009814379 [1,0,1,0,0,0|1,0,0]=3 5320 B15R0.366 CCCCOCCCCOCC(=O)CCC 7a_200000760531_100000747444 [1,0,1,0,0,0|2,0,0]=4 5321 B15R0.366 CCCCOCCCCOCC(=O)OCC 34a_200000760531_100000188475 [1,0,1,0,0,0|2,0,0]=4 5322 B15R0.366 CCCCOCCCCOCC(=O)OCC 7a_200000760531_100000188475 [1,0,1,0,0,0|2,0,0]=4 5323 B15R0.366 CCCCOCCCNCCC(=O)OCC 2230a_200000211371_100011206558 [1,0,1,0,0,0|2,0,0]=4 5324 B15R0.366 CCCCOCCCNCCC(=O)OCC 34a_200000211371_100000765890 [1,0,1,0,0,0|2,0,0]=4 5325 B15R0.366 CCCCOCCCNCOC(=O)CCC 2230a_200000211371_100000034017 [1,0,1,0,0,0|2,0,0]=4 5326 B15R0.366 CCCCOCCCNCOC(=O)CCC 34a_200000211371_100000034017 [1,0,1,0,0,0|2,0,0]=4 5327 B15R0.366 CCCCOCCCOCCC(=O)OCC 34a_200011215613_100000765890 [1,0,1,0,0,0|2,0,0]=4 5328 B15R0.366 CCCCOCCCOCCC(=O)OCC 7a_200011215613_100011206558 [1,0,1,0,0,0|2,0,0]=4 5329 B15R0.366 CCCCOCCCOCOC(=O)CCC 34a_200011215613_100000034017 [1,0,1,0,0,0|2,0,0]=4 5330 B15R0.366 CCCCOCCOCCCC(=O)OCC 34a_100000210238_100009991533 [1,0,1,0,0,0|2,0,0]=4 5331 B15R0.366 CCCCOCCOCCCC(=O)OCC 7a_100000210238_100011215271 [1,0,1,0,0,0|2,0,0]=4 5332 B15R0.366 CCCCOCCOCCCC(=O)OCC 7a_100012001163_100000743108 [1,0,1,0,0,0|2,0,0]=4 5333 B15R0.366 CCCCOCCSCCCC(=O)OCC 62a_100000743108_100009991533 [1,0,1,0,0,0|2,0,0]=4 5334 B15R0.366 CCCCOCCSCCCC(=O)OCC 62a_100009991533_100000743108 [1,0,1,0,0,0|2,0,0]=4 5335 B15R0.366 CCCCOCSCCCCC(=O)OCC 62a_100000750268_100011995733 [1,0,1,0,0,0|2,0,0]=4 5336 B15R0.366 CCCCOCSCCCCC(=O)OCC 62a_100011995733_100000750268 [1,0,1,0,0,0|2,0,0]=4 5337 B15R0.366 CCCCSCCCCCCC(=O)OCC 62a_100000210211_100009814379 [1,0,1,0,0,0|1,0,0]=3 5338 B15R0.366 CCCCSCCNCCCC(=O)OCC 2230a_100025743550_100009991533 [1,0,1,0,0,0|2,0,0]=4 5339 B15R0.366 CCCCSCCOCCCC(=O)OCC 34a_200000230436_100009991533 [1,0,1,0,0,0|2,0,0]=4 5340 B15R0.366 CCCCSCCOCCCC(=O)OCC 7a_200000230436_100011215271 [1,0,1,0,0,0|2,0,0]=4 5341 B15R0.366 CCCOCCCCCCCC(=O)OCC 34a_100000210258_100009991516 [1,0,1,0,0,0|1,0,0]=3 5342 B15R0.366 CCCOCCCNCCCC(=O)OCC 2230a_100011217757_100009991533 [1,0,1,0,0,0|2,0,0]=4 5343 B15R0.366 CCCOCCCNCCCC(=O)OCC 34a_100011217757_100009991533 [1,0,1,0,0,0|2,0,0]=4 5344 B15R0.366 CCCOCCNCCCCC(=O)OCC 2230a_100161115042_100000750268 [1,0,1,0,0,0|2,0,0]=4 5345 B15R0.366 CCCOCCNCCCCC(=O)OCC 34a_100161115042_100000750268 [1,0,1,0,0,0|2,0,0]=4 5346 B15R0.366 CCCOCCOCCCCC(=O)OCC 34a_100000752267_100000750268 [1,0,1,0,0,0|2,0,0]=4 5347 B15R0.366 CCCOCCOCCCCC(=O)OCC 7a_100000752267_100000750268 [1,0,1,0,0,0|2,0,0]=4 5348 B15R0.366 CCCOCCSCCCCC(=O)OCC 62a_100000750268_100011215938 [1,0,1,0,0,0|2,0,0]=4 5349 B15R0.366 CCCOCCSCCCCC(=O)OCC 62a_100011215938_100000750268 [1,0,1,0,0,0|2,0,0]=4 5350 B15R0.366 CCCSCCCCCCCC(=O)OCC 62a_100000210303_100009991516 [1,0,1,0,0,0|1,0,0]=3 5351 B15R0.366 CCCSCCNCCCCC(=O)OCC 2230a_100020603323_100000750268 [1,0,1,0,0,0|2,0,0]=4 5352 B15R0.366 CCCSCCOCCCCC(=O)OCC 34a_200000230433_100000750268 [1,0,1,0,0,0|2,0,0]=4 5353 B15R0.366 CCCSCCOCCCCC(=O)OCC 7a_200000230433_100000750268 [1,0,1,0,0,0|2,0,0]=4 5354 B15R0.366 CCNC(=O)CCCCCCCCCCO 240690a_100015525214_200000016029 [1,0,1,0,0,0|2,0,0]=4 5355 B15R0.366 CCNCCCCCCCCC(=O)OCC 2230a_100015525214_100010175975 [1,0,1,0,0,0|1,0,0]=3 5356 B15R0.366 CCOC(=O)CCCCCCCCCNC 2230a_106832991635_100009828014 [1,0,1,0,0,0|1,0,0]=3 5357 B15R0.366 CCOC(=O)CCCCCCCCCNC 34a_100102657272_100009828014 [1,0,1,0,0,0|1,0,0]=3 5358 B15R0.366 CCOC(=O)CCCCCCCCCNC 7a_106832991635_100009828014 [1,0,1,0,0,0|1,0,0]=3 5359 B15R0.366 CCOC(=O)CCCCCCCCCOC 34a_100138415774_100009828014 [1,0,1,0,0,0|1,0,0]=3 5360 B15R0.366 CCOC(=O)CCCCCCCCCSC 62a_200000210301_100009828014 [1,0,1,0,0,0|1,0,0]=3 5361 B15R0.366 CCOC(=O)CCCCCCCCCS[13CH3] 62a_200025704644_100009828014 [1,0,1,0,0,0|1,0,0]=3 5362 B15R0.366 CCOC(=O)CCCCCCCCSCC 62a_100000210202_100010175975 [1,0,1,0,0,0|1,0,0]=3 5363 B15R0.366 CCOC(=O)CCCCCCCCSCF 62a_100015361967_100010175975 [1,0,1,0,0,0|2,0,0]=4 5364 B15R0.366 CCOC(=O)CCCCCCCNCCF 34a_100000724931_100009991516 [1,0,1,0,0,0|2,0,0]=4 5365 B15R0.366 CCOC(=O)CCCCCCCNCCO 2230a_100016997473_100009991516 [1,0,1,0,0,0|2,0,0]=4 5366 B15R0.366 CCOC(=O)CCCCCCCNCCO 34a_100016990907_100009991516 [1,0,1,0,0,0|2,0,0]=4 5367 B15R0.366 CCOC(=O)CCCCCCCOCCBr 34a_100000211926_100009991516 [1,0,1,0,0,0|2,0,0]=4 5368 B15R0.366 CCOC(=O)CCCCCCCOCCN 34a_100000210304_100009991516 [1,0,1,0,0,0|2,0,0]=4 5369 B15R0.366 CCOC(=O)CCCCCCCSCCF 62a_100011217306_100009991516 [1,0,1,0,0,0|2,0,0]=4 5370 B15R0.366 CCOC(=O)CCCCCCCSCCO 62a_100000211926_100009991516 [1,0,1,0,0,0|2,0,0]=4 5371 B15R0.366 CCOC(=O)CCCCCCCSCOC 62a_100000766300_100009991516 [1,0,1,0,0,0|2,0,0]=4 5372 B15R0.366 CCOC(=O)CCCCCCCSCSC 62a_100011218213_100009991516 [1,0,1,0,0,0|2,0,0]=4 5373 B15R0.366 CCOC(=O)CCCCCCNCCCF 2230a_100015189416_100009814379 [1,0,1,0,0,0|2,0,0]=4 5374 B15R0.366 CCOC(=O)CCCCCCNCCCF 34a_100015189416_100009814379 [1,0,1,0,0,0|2,0,0]=4 5375 B15R0.366 CCOC(=O)CCCCCCNCCOC 2230a_100000209980_100009814379 [1,0,1,0,0,0|2,0,0]=4 5376 B15R0.366 CCOC(=O)CCCCCCNCCSC 2230a_100020590264_100009814379 [1,0,1,0,0,0|2,0,0]=4 5377 B15R0.366 CCOC(=O)CCCCCCOCCCBr 34a_100011217188_100009814379 [1,0,1,0,0,0|2,0,0]=4 5378 B15R0.366 CCOC(=O)CCCCCCOCCCCl 34a_100000230001_100009814379 [1,0,1,0,0,0|2,0,0]=4 5379 B15R0.366 CCOC(=O)CCCCCCOCCCF 34a_100000759539_100009814379 [1,0,1,0,0,0|2,0,0]=4 5380 B15R0.366 CCOC(=O)CCCCCCOCCCN 34a_100000182051_100009814379 [1,0,1,0,0,0|2,0,0]=4 5381 B15R0.366 CCOC(=O)CCCCCCOCCOC 34a_100000210237_100009814379 [1,0,1,0,0,0|2,0,0]=4 5382 B15R0.366 CCOC(=O)CCCCCCOCCSC 34a_100000230434_100009814379 [1,0,1,0,0,0|2,0,0]=4 5383 B15R0.366 CCOC(=O)CCCCCCOCCSC 7a_100000230434_100009814379 [1,0,1,0,0,0|2,0,0]=4 5384 B15R0.366 CCOC(=O)CCCCCCSCCCF 62a_100011934791_100009814379 [1,0,1,0,0,0|2,0,0]=4 5385 B15R0.366 CCOC(=O)CCCCCCSCCCO 62a_100011215043_100009814379 [1,0,1,0,0,0|2,0,0]=4 5386 B15R0.366 CCOC(=O)CCCCCCSCCOC 62a_100000233755_100009814379 [1,0,1,0,0,0|2,0,0]=4 5387 B15R0.366 CCOC(=O)CCCCCCSCCSC 62a_100000212216_100009814379 [1,0,1,0,0,0|2,0,0]=4 5388 B15R0.366 CCOC(=O)CCCCCNCCCCO 2230a_100000750430_100000755133 [1,0,1,0,0,0|2,0,0]=4 5389 B15R0.366 CCOC(=O)CCCCCNCCCCO 34a_100000750430_100000755133 [1,0,1,0,0,0|2,0,0]=4 5390 B15R0.366 CCOC(=O)CCCCCNCCCOC 34a_100150723488_100000755133 [1,0,1,0,0,0|2,0,0]=4 5391 B15R0.366 CCOC(=O)CCCCCNCCCSC 2230a_100000749238_100000755133 [1,0,1,0,0,0|2,0,0]=4 5392 B15R0.366 CCOC(=O)CCCCCNCCSCC 2230a_100000106463_100000755133 [1,0,1,0,0,0|2,0,0]=4 5393 B15R0.366 CCOC(=O)CCCCCOCCCCBr 34a_100011216708_100000755133 [1,0,1,0,0,0|2,0,0]=4 5394 B15R0.366 CCOC(=O)CCCCCOCCCCCl 34a_100000210776_100000755133 [1,0,1,0,0,0|2,0,0]=4 5395 B15R0.366 CCOC(=O)CCCCCOCCCCCl 7a_100000210776_100000755133 [1,0,1,0,0,0|2,0,0]=4 5396 B15R0.366 CCOC(=O)CCCCCOCCCCF 34a_100011995726_100000755133 [1,0,1,0,0,0|2,0,0]=4 5397 B15R0.366 CCOC(=O)CCCCCOCCCCF 7a_100011214988_100000729493 [1,0,1,0,0,0|2,0,0]=4 5398 B15R0.366 CCOC(=O)CCCCCOCCCCF 7a_100011995726_100000755133 [1,0,1,0,0,0|2,0,0]=4 5399 B15R0.366 CCOC(=O)CCCCCOCCCCI 34a_200012148704_100000755133 [1,0,1,0,0,0|2,0,0]=4 5400 B15R0.366 CCOC(=O)CCCCCOCCCCN 34a_100000750430_100000755133 [1,0,1,0,0,0|2,0,0]=4 5401 B15R0.366 CCOC(=O)CCCCCOCCCCO 7a_100011214988_100000210776 [1,0,1,0,0,0|2,0,0]=4 5402 B15R0.366 CCOC(=O)CCCCCOCCCNC 34a_100000213112_100000755133 [1,0,1,0,0,0|2,0,0]=4 5403 B15R0.366 CCOC(=O)CCCCCOCCCOC 34a_100000740835_100000755133 [1,0,1,0,0,0|2,0,0]=4 5404 B15R0.366 CCOC(=O)CCCCCOCCCOC 7a_100011214988_100000740836 [1,0,1,0,0,0|2,0,0]=4 5405 B15R0.366 CCOC(=O)CCCCCOCCCSC 34a_100000690336_100000755133 [1,0,1,0,0,0|2,0,0]=4 5406 B15R0.366 CCOC(=O)CCCCCOCCCSC 7a_100000690336_100000755133 [1,0,1,0,0,0|2,0,0]=4 5407 B15R0.366 CCOC(=O)CCCCCOCCSCC 34a_100000212035_100000755133 [1,0,1,0,0,0|2,0,0]=4 5408 B15R0.366 CCOC(=O)CCCCCOCCSCC 7a_100000212035_100000755133 [1,0,1,0,0,0|2,0,0]=4 5409 B15R0.366 CCOC(=O)CCCCCOCCSCC 7a_100011214988_100000757381 [1,0,1,0,0,0|2,0,0]=4 5410 B15R0.366 CCOC(=O)CCCCCSCCCCF 62a_100000729493_100000755133 [1,0,1,0,0,0|2,0,0]=4 5411 B15R0.366 CCOC(=O)CCCCCSCCCCF 62a_100000755133_100000729493 [1,0,1,0,0,0|2,0,0]=4 5412 B15R0.366 CCOC(=O)CCCCCSCCCCO 62a_100000210776_100000755133 [1,0,1,0,0,0|2,0,0]=4 5413 B15R0.366 CCOC(=O)CCCCCSCCCCO 62a_100000755133_100000210776 [1,0,1,0,0,0|2,0,0]=4 5414 B15R0.366 CCOC(=O)CCCCCSCCCOC 62a_100000709357_100000755133 [1,0,1,0,0,0|2,0,0]=4 5415 B15R0.366 CCOC(=O)CCCCCSCCCOC 62a_100000755133_100000709357 [1,0,1,0,0,0|2,0,0]=4 5416 B15R0.366 CCOC(=O)CCCCCSCCSCC 62a_100000755133_100000757381 [1,0,1,0,0,0|2,0,0]=4 5417 B15R0.366 CCOC(=O)CCCCCSCCSCC 62a_100000757381_100000755133 [1,0,1,0,0,0|2,0,0]=4 5418 B15R0.366 CCOC(=O)CCCCNCCCCCO 2230a_100000762737_100000750268 [1,0,1,0,0,0|2,0,0]=4 5419 B15R0.366 CCOC(=O)CCCCNCCCCCO 34a_100000762737_100000750268 [1,0,1,0,0,0|2,0,0]=4 5420 B15R0.366 CCOC(=O)CCCCOCCCCCBr 34a_100000746331_100000750268 [1,0,1,0,0,0|2,0,0]=4 5421 B15R0.366 CCOC(=O)CCCCOCCCCCBr 7a_100000746331_100000750268 [1,0,1,0,0,0|2,0,0]=4 5422 B15R0.366 CCOC(=O)CCCCOCCCCCCl 34a_100000746330_100000750268 [1,0,1,0,0,0|2,0,0]=4 5423 B15R0.366 CCOC(=O)CCCCOCCCCCCl 7a_100000746330_100000750268 [1,0,1,0,0,0|2,0,0]=4 5424 B15R0.366 CCOC(=O)CCCCOCCCCCI 34a_200012148887_100000750268 [1,0,1,0,0,0|2,0,0]=4 5425 B15R0.366 CCOC(=O)CCCCOCCCCCI 7a_200012148887_100000750268 [1,0,1,0,0,0|2,0,0]=4 5426 B15R0.366 CCOC(=O)CCCCOCCCCCN 34a_100000762737_100000750268 [1,0,1,0,0,0|2,0,0]=4 5427 B15R0.366 CCOC(=O)CCCCOCCCCOC 34a_100000740925_100000750268 [1,0,1,0,0,0|2,0,0]=4 5428 B15R0.366 CCOC(=O)CCCCOCCCCSC 34a_100011217163_100000750268 [1,0,1,0,0,0|2,0,0]=4 5429 B15R0.366 CCOC(=O)CCCCOCCCCSC 7a_100011217163_100000750268 [1,0,1,0,0,0|2,0,0]=4 5430 B15R0.366 CCOC(=O)CCCCOCCCSCC 34a_100011216438_100000750268 [1,0,1,0,0,0|2,0,0]=4 5431 B15R0.366 CCOC(=O)CCCCOCCCSCC 7a_100011216438_100000750268 [1,0,1,0,0,0|2,0,0]=4 5432 B15R0.366 CCOC(=O)CCCCSCCCCCF 62a_100000729378_100000750268 [1,0,1,0,0,0|2,0,0]=4 5433 B15R0.366 CCOC(=O)CCCCSCCCCCF 62a_100000750268_100000729378 [1,0,1,0,0,0|2,0,0]=4 5434 B15R0.366 CCOC(=O)CCCCSCCCCCO 62a_100000746330_100000750268 [1,0,1,0,0,0|2,0,0]=4 5435 B15R0.366 CCOC(=O)CCCCSCCCCCO 62a_100000750268_100000746330 [1,0,1,0,0,0|2,0,0]=4 5436 B15R0.366 CCOC(=O)CCCCSCCCCOC 62a_100000730899_100000750268 [1,0,1,0,0,0|2,0,0]=4 5437 B15R0.366 CCOC(=O)CCCCSCCCCOC 62a_100000750268_100000730899 [1,0,1,0,0,0|2,0,0]=4 5438 B15R0.366 CCOC(=O)CCCNCCCCCCO 2230a_100000686447_100009991533 [1,0,1,0,0,0|2,0,0]=4 5439 B15R0.366 CCOC(=O)CCCNCCCCCCO 34a_100000686447_100009991533 [1,0,1,0,0,0|2,0,0]=4 5440 B15R0.366 CCOC(=O)CCCNCCCCCOC 2230a_100000747528_100009991533 [1,0,1,0,0,0|2,0,0]=4 5441 B15R0.366 CCOC(=O)CCCNCCCCCOC 34a_100000747528_100009991533 [1,0,1,0,0,0|2,0,0]=4 5442 B15R0.366 CCOC(=O)CCCOCCCCCCBr 34a_100011215345_100009991533 [1,0,1,0,0,0|2,0,0]=4 5443 B15R0.366 CCOC(=O)CCCOCCCCCCBr 7a_100011215345_100011215271 [1,0,1,0,0,0|2,0,0]=4 5444 B15R0.366 CCOC(=O)CCCOCCCCCCCl 34a_100000766143_100009991533 [1,0,1,0,0,0|2,0,0]=4 5445 B15R0.366 CCOC(=O)CCCOCCCCCCCl 7a_100000766143_100011215271 [1,0,1,0,0,0|2,0,0]=4 5446 B15R0.366 CCOC(=O)CCCOCCCCCCF 34a_100000732779_100009991533 [1,0,1,0,0,0|2,0,0]=4 5447 B15R0.366 CCOC(=O)CCCOCCCCCCF 7a_100000732779_100011215271 [1,0,1,0,0,0|2,0,0]=4 5448 B15R0.366 CCOC(=O)CCCOCCCCCCF 7a_100012001163_100015922095 [1,0,1,0,0,0|2,0,0]=4 5449 B15R0.366 CCOC(=O)CCCOCCCCCCN 34a_100000686447_100009991533 [1,0,1,0,0,0|2,0,0]=4 5450 B15R0.366 CCOC(=O)CCCOCCCCCCO 7a_100012001163_100000766143 [1,0,1,0,0,0|2,0,0]=4 5451 B15R0.366 CCOC(=O)CCCOCCCCCNC 34a_100000722520_100009991533 [1,0,1,0,0,0|2,0,0]=4 5452 B15R0.366 CCOC(=O)CCCSCCCCCCF 62a_100009991533_100015922095 [1,0,1,0,0,0|2,0,0]=4 5453 B15R0.366 CCOC(=O)CCCSCCCCCCF 62a_100015922095_100009991533 [1,0,1,0,0,0|2,0,0]=4 5454 B15R0.366 CCOC(=O)CCCSCCCCCCO 62a_100000766143_100009991533 [1,0,1,0,0,0|2,0,0]=4 5455 B15R0.366 CCOC(=O)CCCSCCCCCCO 62a_100009991533_100000766143 [1,0,1,0,0,0|2,0,0]=4 5456 B15R0.366 CCOC(=O)CCNCCCCCCCO 2230a_100011996573_100011206558 [1,0,1,0,0,0|2,0,0]=4 5457 B15R0.366 CCOC(=O)CCNCCCCCCCO 34a_100011996573_100000765890 [1,0,1,0,0,0|2,0,0]=4 5458 B15R0.366 CCOC(=O)CCOCCCCCCCBr 34a_100000760002_100000765890 [1,0,1,0,0,0|2,0,0]=4 5459 B15R0.366 CCOC(=O)CCOCCCCCCCBr 7a_100000760002_100011206558 [1,0,1,0,0,0|2,0,0]=4 5460 B15R0.366 CCOC(=O)CCOCCCCCCCN 34a_100011996573_100000765890 [1,0,1,0,0,0|2,0,0]=4 5461 B15R0.366 CCOC(=O)CCOCCCCCCOC 34a_200012092642_100000765890 [1,0,1,0,0,0|2,0,0]=4 5462 B15R0.366 CCOC(=O)CCOCCCCCCOC 7a_200012092642_100011206558 [1,0,1,0,0,0|2,0,0]=4 5463 B15R0.366 CCOC(=O)CCSCCCCCCCO 62a_100000760002_100000765890 [1,0,1,0,0,0|2,0,0]=4 5464 B15R0.366 CCOC(=O)CCSCCCCCCCO 62a_100000765890_100000760002 [1,0,1,0,0,0|2,0,0]=4 5465 B15R0.366 CCOC(=O)CCSCCCCCCOC 62a_100000765890_100011998445 [1,0,1,0,0,0|2,0,0]=4 5466 B15R0.366 CCOC(=O)CCSCCCCCCOC 62a_100011998445_100000765890 [1,0,1,0,0,0|2,0,0]=4 5467 B15R0.366 CCOC(=O)CNCCCCCCCCO 2230a_102515433106_100000188475 [1,0,1,0,0,0|2,0,0]=4 5468 B15R0.366 CCOC(=O)CNCCCCCCCCO 34a_102515433106_100000188475 [1,0,1,0,0,0|2,0,0]=4 5469 B15R0.366 CCOC(=O)COCCCCCCCCBr 34a_100009813846_100000188475 [1,0,1,0,0,0|2,0,0]=4 5470 B15R0.366 CCOC(=O)COCCCCCCCCBr 7a_100009813846_100000188475 [1,0,1,0,0,0|2,0,0]=4 5471 B15R0.366 CCOC(=O)COCCCCCCCCCl 34a_100000033203_100000188475 [1,0,1,0,0,0|2,0,0]=4 5472 B15R0.366 CCOC(=O)COCCCCCCCCCl 7a_100000033203_100000188475 [1,0,1,0,0,0|2,0,0]=4 5473 B15R0.366 CCOC(=O)COCCCCCCCCN 34a_102515433106_100000188475 [1,0,1,0,0,0|2,0,0]=4 5474 B15R0.366 CCOC(=O)CSCCCCCCCCO 62a_100000033203_100000188475 [1,0,1,0,0,0|2,0,0]=4 5475 B15R0.366 CCOC(=O)CSCCCCCCCCO 62a_100000188475_100000033203 [1,0,1,0,0,0|2,0,0]=4 5476 B15R0.366 CCOCCCCCCCCC(=O)OCC 34a_100121572206_100010175975 [1,0,1,0,0,0|1,0,0]=3 5477 B15R0.366 CCOCCCNCCCCC(=O)OCC 2230a_100000210961_100000750268 [1,0,1,0,0,0|2,0,0]=4 5478 B15R0.366 CCOCCCNCCCCC(=O)OCC 34a_100000210961_100000750268 [1,0,1,0,0,0|2,0,0]=4 5479 B15R0.366 CCOCCCOCCCCC(=O)OCC 34a_100000757476_100000750268 [1,0,1,0,0,0|2,0,0]=4 5480 B15R0.366 CCOCCCOCCCCC(=O)OCC 7a_100000757476_100000750268 [1,0,1,0,0,0|2,0,0]=4 5481 B15R0.366 CCOCCCSCCCCC(=O)OCC 62a_100000750268_100012232248 [1,0,1,0,0,0|2,0,0]=4 5482 B15R0.366 CCOCCCSCCCCC(=O)OCC 62a_100012232248_100000750268 [1,0,1,0,0,0|2,0,0]=4 5483 B15R0.366 CCOCCNCCCCCC(=O)OCC 2230a_102516460346_100000755133 [1,0,1,0,0,0|2,0,0]=4 5484 B15R0.366 CCOCCNCCCCCC(=O)OCC 34a_102516460346_100000755133 [1,0,1,0,0,0|2,0,0]=4 5485 B15R0.366 CCOCCOCCCCCC(=O)OCC 34a_100000210136_100000755133 [1,0,1,0,0,0|2,0,0]=4 5486 B15R0.366 CCOCCOCCCCCC(=O)OCC 7a_100000210136_100000755133 [1,0,1,0,0,0|2,0,0]=4 5487 B15R0.366 CCOCCOCCCCCC(=O)OCC 7a_100011214988_100011215890 [1,0,1,0,0,0|2,0,0]=4 5488 B15R0.366 CCOCCSCCCCCC(=O)OCC 62a_100000210147_100000755133 [1,0,1,0,0,0|2,0,0]=4 5489 B15R0.366 CCOCCSCCCCCC(=O)OCC 62a_100000755133_100011215890 [1,0,1,0,0,0|2,0,0]=4 5490 B15R0.366 CCOCSCCCCCCC(=O)OCC 62a_100000739092_100009814379 [1,0,1,0,0,0|2,0,0]=4 5491 B15R0.366 COCC(=O)CCCCCCCCCCO 1458a_100000210968_100009813290 [1,0,1,0,0,0|2,0,0]=4 5492 B15R0.366 CSCC(=O)CCCCCCCCCCO 1458a_100000184570_100009813290 [1,0,1,0,0,0|2,0,0]=4 5493 B15R0.366 O=C(CCO)CCCCCCCCCCO 1458a_100011216618_100009813290 [1,0,1,0,0,0|2,0,0]=4 5494 B15R0.322 C#CCCCC(=O)CCCCCCCCC 1458a_100000210558_100000731252 [1,0,1,0,0,0|0,0,2]=4 5495 B15R0.322 C#CCCCC(=O)CCCCCCCCC 1458a_100000690238_100000210670 [1,0,1,0,0,0|0,0,2]=4 5496 B15R0.322 C#CCCCCCCCC(=O)CCCCC 1458a_100000087357_100000210326 [1,0,1,0,0,0|0,0,2]=4 5497 B15R0.322 C#CCCCCCCCC(=O)CCCCC 1458a_100000212188_100153394163 [1,0,1,0,0,0|0,0,2]=4 5498 B15R0.322 C=CCCCC(=O)CCCCCCCCC 1458a_100000210558_100000757094 [1,0,1,0,0,0|0,0,2]=4 5499 B15R0.322 C=CCCCC(=O)CCCCCCCCC 1458a_100000766728_100000210670 [1,0,1,0,0,0|0,0,2]=4 5500 B15R0.322 C=CCCCCCCCC(=O)CCCCC 1458a_100000212188_100012355270 [1,0,1,0,0,0|0,0,2]=4 5501 B15R0.322 C=CCCCCCCCC(=O)CCCCC 1458a_100011216160_100000210326 [1,0,1,0,0,0|0,0,2]=4 5502 B15R0.322 CC/C=C/CC(=O)CCCCCCCCC 1458a_100016274230_100000210670 [1,0,1,0,0,0|0,0,2]=4 5503 B15R0.322 CC/C=C\CC(=O)CCCCCCCCC 1458a_100000210558_100103147603 [1,0,1,0,0,0|0,0,2]=4 5504 B15R0.322 CCC#CCC(=O)CCCCCCCCC 1458a_100000210558_100009813939 [1,0,1,0,0,0|0,0,2]=4 5505 B15R0.322 CCCC#CC(=O)CCCCCCCCC 1458a_200011218047_100000210670 [1,0,1,0,0,0|0,0,2]=4 5506 B15R0.322 CCCC=CC(=O)CCCCCCCCC 1458a_100000212230_100000210670 [1,0,1,0,0,0|0,0,2]=4 5507 B15R0.322 CCCCC#CCCCC(=O)CCCCC 1458a_100000212188_200000047210 [1,0,1,0,0,0|0,0,2]=4 5508 B15R0.322 CCCCC/C=C/CCC(=O)CCCCC 1458a_200015255902_100000210326 [1,0,1,0,0,0|0,0,2]=4 5509 B15R0.322 CCCCCC(=O)CCCCCCCCO 1458a_100000212188_100000033203 [1,0,1,0,0,0|1,0,0]=3 5510 B15R0.322 CCCCCC(=O)CNCCCCCCO 2230a_100000686447_200012276598 [1,0,1,0,0,0|2,0,0]=4 5511 B15R0.322 CCCCCC(=O)CNCCCCCCO 34a_100000686447_200012276598 [1,0,1,0,0,0|2,0,0]=4 5512 B15R0.322 CCCCCC(=O)CNCCCCCOC 2230a_100000747528_200012276598 [1,0,1,0,0,0|2,0,0]=4 5513 B15R0.322 CCCCCC(=O)CNCCCCCOC 34a_100000747528_200012276598 [1,0,1,0,0,0|2,0,0]=4 5514 B15R0.322 CCCCCC(=O)CNCCCOCCC 2230a_100011217757_200012276598 [1,0,1,0,0,0|2,0,0]=4 5515 B15R0.322 CCCCCC(=O)CNCCCOCCC 34a_100011217757_200012276598 [1,0,1,0,0,0|2,0,0]=4 5516 B15R0.322 CCCCCC(=O)CNCCSCCCC 2230a_100025743550_200012276598 [1,0,1,0,0,0|2,0,0]=4 5517 B15R0.322 CCCCCC(=O)COCCCCCCBr 34a_100011215345_200012276598 [1,0,1,0,0,0|2,0,0]=4 5518 B15R0.322 CCCCCC(=O)COCCCCCCBr 7a_100011215345_200012276598 [1,0,1,0,0,0|2,0,0]=4 5519 B15R0.322 CCCCCC(=O)COCCCCCCCl 34a_100000766143_200012276598 [1,0,1,0,0,0|2,0,0]=4 5520 B15R0.322 CCCCCC(=O)COCCCCCCCl 7a_100000766143_200012276598 [1,0,1,0,0,0|2,0,0]=4 5521 B15R0.322 CCCCCC(=O)COCCCCCCF 34a_100000732779_200012276598 [1,0,1,0,0,0|2,0,0]=4 5522 B15R0.322 CCCCCC(=O)COCCCCCCF 7a_100000732779_200012276598 [1,0,1,0,0,0|2,0,0]=4 5523 B15R0.322 CCCCCC(=O)COCCCCCCN 34a_100000686447_200012276598 [1,0,1,0,0,0|2,0,0]=4 5524 B15R0.322 CCCCCC(=O)COCCCCCNC 34a_100000722520_200012276598 [1,0,1,0,0,0|2,0,0]=4 5525 B15R0.322 CCCCCC(=O)COCCOCCCC 1458a_100011216887_100000210326 [1,0,1,0,0,0|2,0,0]=4 5526 B15R0.322 CCCCCC(=O)COCCOCCCC 34a_100000210238_200012276598 [1,0,1,0,0,0|2,0,0]=4 5527 B15R0.322 CCCCCC(=O)COCCOCCCC 7a_100000210238_200012276598 [1,0,1,0,0,0|2,0,0]=4 5528 B15R0.322 CCCCCC(=O)COCCSCCCC 34a_200000230436_200012276598 [1,0,1,0,0,0|2,0,0]=4 5529 B15R0.322 CCCCCC(=O)COCCSCCCC 7a_200000230436_200012276598 [1,0,1,0,0,0|2,0,0]=4 5530 B15R0.322 CCCCCC(=O)CSCCCCCCF 62a_100015922095_200012276598 [1,0,1,0,0,0|2,0,0]=4 5531 B15R0.322 CCCCCC(=O)CSCCCCCCF 62a_200012276598_100015922095 [1,0,1,0,0,0|2,0,0]=4 5532 B15R0.322 CCCCCC(=O)CSCCCCCCO 62a_100000766143_200012276598 [1,0,1,0,0,0|2,0,0]=4 5533 B15R0.322 CCCCCC(=O)CSCCCCCCO 62a_200012276598_100000766143 [1,0,1,0,0,0|2,0,0]=4 5534 B15R0.322 CCCCCC(=O)CSCCOCCCC 62a_100000743108_200012276598 [1,0,1,0,0,0|2,0,0]=4 5535 B15R0.322 CCCCCC(=O)CSCCOCCCC 62a_200012276598_100000743108 [1,0,1,0,0,0|2,0,0]=4 5536 B15R0.322 CCCCCC(=O)NCCCCCCCO 240690a_100011996573_100000212188 [1,0,1,0,0,0|2,0,0]=4 5537 B15R0.322 CCCCCC(=O)NCCCOCCCC 1626a_200000211371_100000212188 [1,0,1,0,0,0|2,0,0]=4 5538 B15R0.322 CCCCCC(=O)NCCCOCCCC 240690a_200000211371_100000212188 [1,0,1,0,0,0|2,0,0]=4 5539 B15R0.322 CCCCCC(=O)NCCCOCCCC 527a_200000211371_100000212188 [1,0,1,0,0,0|2,0,0]=4 5540 B15R0.322 CCCCCC/C=C/CC(=O)CCCCC 1458a_100020681715_100000210326 [1,0,1,0,0,0|0,0,2]=4 5541 B15R0.322 CCCCCCCC=CC(=O)CCCCC 1458a_200015332781_100000210326 [1,0,1,0,0,0|0,0,2]=4 5542 B15R0.322 CCCCCCCCCC(=O)CCCC#N 1458a_100000075515_100000210670 [1,0,1,0,0,0|1,0,1]=4 5543 B15R0.322 CCCCCCCCCC(=O)CCCC#N 1458a_100000210558_100000211468 [1,0,1,0,0,0|1,0,1]=4 5544 B15R0.322 CCCCCCCCCC(=O)CCCCC 1458a_100000210558_100000210326 [1,0,1,0,0,0|0,0,0]=2 5545 B15R0.322 CCCCCCCCCC(=O)CCCCC 1458a_100000212188_100000210670 [1,0,1,0,0,0|0,0,0]=2 5546 B15R0.322 CCCCCCCCCC(=O)CCCCF 1458a_100000210558_100000729493 [1,0,1,0,0,0|1,0,0]=3 5547 B15R0.322 CCCCCCCCCC(=O)CCCCO 1458a_100000210558_100000210776 [1,0,1,0,0,0|1,0,0]=3 5548 B15R0.322 CCCCCCCCCC(=O)CCCCO 1458a_100000695505_100000210670 [1,0,1,0,0,0|1,0,0]=3 5549 B15R0.322 CCCCCCCCCC(=O)CCCOC 1458a_100000210558_100000740836 [1,0,1,0,0,0|1,0,0]=3 5550 B15R0.322 CCCCCCCCCC(=O)CCCOC 1458a_100000741012_100000210670 [1,0,1,0,0,0|1,0,0]=3 5551 B15R0.322 CCCCCCCCCC(=O)CCCSC 1458a_100000173376_100000210670 [1,0,1,0,0,0|1,0,0]=3 5552 B15R0.322 CCCCCCCCCC(=O)CCOCC 1458a_100000210558_100011215890 [1,0,1,0,0,0|1,0,0]=3 5553 B15R0.322 CCCCCCCCCC(=O)CCOCC 1458a_100000749530_100000210670 [1,0,1,0,0,0|1,0,0]=3 5554 B15R0.322 CCCCCCCCCC(=O)CCSCC 1458a_100000210558_100000757381 [1,0,1,0,0,0|1,0,0]=3 5555 B15R0.322 CCCCCCCCCC(=O)CCSCC 1458a_100000230768_100000210670 [1,0,1,0,0,0|1,0,0]=3 5556 B15R0.322 CCCCCCCCCC(=O)COCCC 1458a_100000745993_100000210670 [1,0,1,0,0,0|1,0,0]=3 5557 B15R0.322 CCCCCCCCCC(=O)COCCO 1458a_100000708028_100000210670 [1,0,1,0,0,0|2,0,0]=4 5558 B15R0.322 CCCCCCCCCC(=O)CSCCC 1458a_100000217233_100000210670 [1,0,1,0,0,0|1,0,0]=3 5559 B15R0.322 CCCCCCCCCC(=O)NCCCC 11a_100000102301_100000210558 [1,0,1,0,0,0|1,0,0]=3 5560 B15R0.322 CCCCCCCCCC(=O)NCCCC 1626a_100000102301_100000210558 [1,0,1,0,0,0|1,0,0]=3 5561 B15R0.322 CCCCCCCCCC(=O)NCCCC 240690a_100000102301_100000210558 [1,0,1,0,0,0|1,0,0]=3 5562 B15R0.322 CCCCCCCCCC(=O)NCCCC 527a_100000102301_100000210558 [1,0,1,0,0,0|1,0,0]=3 5563 B15R0.322 CCCCCCCCCC(=O)NCCCF 11a_100015189416_100000210558 [1,0,1,0,0,0|2,0,0]=4 5564 B15R0.322 CCCCCCCCCC(=O)NCCCF 1626a_100015189416_100000210558 [1,0,1,0,0,0|2,0,0]=4 5565 B15R0.322 CCCCCCCCCC(=O)NCCCF 240690a_100015189416_100000210558 [1,0,1,0,0,0|2,0,0]=4 5566 B15R0.322 CCCCCCCCCC(=O)NCCCF 527a_100015189416_100000210558 [1,0,1,0,0,0|2,0,0]=4 5567 B15R0.322 CCCCCCCCCC(=O)NCCCO 240690a_100000182051_100000210558 [1,0,1,0,0,0|2,0,0]=4 5568 B15R0.322 CCCCCCCCCC(=O)NCCCO 527a_100000182051_100000210558 [1,0,1,0,0,0|2,0,0]=4 5569 B15R0.322 CCCCCCCCCC(=O)NCCOC 1626a_100000209980_100000210558 [1,0,1,0,0,0|2,0,0]=4 5570 B15R0.322 CCCCCCCCCC(=O)NCCOC 240690a_100000209980_100000210558 [1,0,1,0,0,0|2,0,0]=4 5571 B15R0.322 CCCCCCCCCC(=O)NCCOC 527a_100000209980_100000210558 [1,0,1,0,0,0|2,0,0]=4 5572 B15R0.322 CCCCCCCCCC(=O)NCCSC 11a_100020590264_100000210558 [1,0,1,0,0,0|2,0,0]=4 5573 B15R0.322 CCCCCCCCCC(=O)NCCSC 1626a_100020590264_100000210558 [1,0,1,0,0,0|2,0,0]=4 5574 B15R0.322 CCCCCCCCCC(=O)NCCSC 240690a_100020590264_100000210558 [1,0,1,0,0,0|2,0,0]=4 5575 B15R0.322 CCCCCCCCCC(=O)NCCSC 527a_100020590264_100000210558 [1,0,1,0,0,0|2,0,0]=4 5576 B15R0.322 CCCCCCCCCC(=O)NNCCC 22a_100000740057_100000210558 [1,0,1,0,0,0|2,0,0]=4 5577 B15R0.322 CCCCCCCCCC(=O)OCNCC 2230a_100015525214_200010990708 [1,0,1,0,0,0|1,0,0]=3 5578 B15R0.322 CCCCCCCCCC(=O)OCOCC 34a_100121572206_200010990708 [1,0,1,0,0,0|1,0,0]=3 5579 B15R0.322 CCCCCCCCCC(=O)OCSCC 62a_100000210202_200010990708 [1,0,1,0,0,0|1,0,0]=3 5580 B15R0.322 CCCCCCCCCC(=O)OCSCF 62a_100015361967_200010990708 [1,0,1,0,0,0|2,0,0]=4 5581 B15R0.322 CCCCCCCCCC(C)OCCCC 34a_100011218016_100000210210 [1,0,1,0,0,0|1,0,1]=4 5582 B15R0.322 CCCCCCCCCC(C)OCCCC 7a_100011218016_100000210211 [1,0,1,0,0,0|1,0,1]=4 5583 B15R0.322 CCCCCCCCCN(C)CCCCC 2230a_100000223495_100011214924 [1,0,1,0,0,0|2,0,0]=4 5584 B15R0.322 CCCCCCCCCN(C)CCCCC 2230a_100000232482_100000210326 [1,0,1,0,0,0|2,0,0]=4 5585 B15R0.322 CCCCCCCCCN(C)CCCCC 269982a_100000223495_100000210670 [1,0,1,0,0,0|2,0,0]=4 5586 B15R0.322 CCCCCCCCCN(C)CCCCC 269982a_100000232482_100000210215 [1,0,1,0,0,0|2,0,0]=4 5587 B15R0.322 CCCCCCCCNC(=O)CCCCC 11a_100000229939_100000212188 [1,0,1,0,0,0|1,0,0]=3 5588 B15R0.322 CCCCCCCCNC(=O)CCCCC 1626a_100000229939_100000212188 [1,0,1,0,0,0|1,0,0]=3 5589 B15R0.322 CCCCCCCCNC(=O)CCCCC 240690a_100000229939_100000212188 [1,0,1,0,0,0|1,0,0]=3 5590 B15R0.322 CCCCCCCCNC(=O)CCCCC 527a_100000229939_100000212188 [1,0,1,0,0,0|1,0,0]=3 5591 B15R0.322 CCCCCCCCNC(=O)CCCCO 1626a_100000229939_100000695505 [1,0,1,0,0,0|2,0,0]=4 5592 B15R0.322 CCCCCCCCNC(=O)CCCOC 11a_100000229939_100000741012 [1,0,1,0,0,0|2,0,0]=4 5593 B15R0.322 CCCCCCCCNC(=O)CCCOC 1626a_100000229939_100000741012 [1,0,1,0,0,0|2,0,0]=4 5594 B15R0.322 CCCCCCCCNC(=O)CCCOC 240690a_100000229939_100000741012 [1,0,1,0,0,0|2,0,0]=4 5595 B15R0.322 CCCCCCCCNC(=O)CCCOC 527a_100000229939_100000741012 [1,0,1,0,0,0|2,0,0]=4 5596 B15R0.322 CCCCCCCCNC(=O)CCCSC 11a_100000229939_100000173376 [1,0,1,0,0,0|2,0,0]=4 5597 B15R0.322 CCCCCCCCNC(=O)CCCSC 1626a_100000229939_100000173376 [1,0,1,0,0,0|2,0,0]=4 5598 B15R0.322 CCCCCCCCNC(=O)CCCSC 240690a_100000229939_100000173376 [1,0,1,0,0,0|2,0,0]=4 5599 B15R0.322 CCCCCCCCNC(=O)CCCSC 527a_100000229939_100000173376 [1,0,1,0,0,0|2,0,0]=4 5600 B15R0.322 CCCCCCCCNC(=O)CCOCC 11a_100000229939_100000749530 [1,0,1,0,0,0|2,0,0]=4 5601 B15R0.322 CCCCCCCCNC(=O)CCOCC 1626a_100000229939_100000749530 [1,0,1,0,0,0|2,0,0]=4 5602 B15R0.322 CCCCCCCCNC(=O)CCOCC 240690a_100000229939_100000749530 [1,0,1,0,0,0|2,0,0]=4 5603 B15R0.322 CCCCCCCCNC(=O)CCOCC 527a_100000229939_100000749530 [1,0,1,0,0,0|2,0,0]=4 5604 B15R0.322 CCCCCCCCNC(=O)CCSCC 11a_100000229939_100000230768 [1,0,1,0,0,0|2,0,0]=4 5605 B15R0.322 CCCCCCCCNC(=O)CCSCC 1626a_100000229939_100000230768 [1,0,1,0,0,0|2,0,0]=4 5606 B15R0.322 CCCCCCCCNC(=O)CCSCC 240690a_100000229939_100000230768 [1,0,1,0,0,0|2,0,0]=4 5607 B15R0.322 CCCCCCCCNC(=O)CCSCC 527a_100000229939_100000230768 [1,0,1,0,0,0|2,0,0]=4 5608 B15R0.322 CCCCCCCCNC(=O)COCCC 11a_100000229939_100000745993 [1,0,1,0,0,0|2,0,0]=4 5609 B15R0.322 CCCCCCCCNC(=O)COCCC 1626a_100000229939_100000745993 [1,0,1,0,0,0|2,0,0]=4 5610 B15R0.322 CCCCCCCCNC(=O)COCCC 240690a_100000229939_100000745993 [1,0,1,0,0,0|2,0,0]=4 5611 B15R0.322 CCCCCCCCNC(=O)COCCC 527a_100000229939_100000745993 [1,0,1,0,0,0|2,0,0]=4 5612 B15R0.322 CCCCCCCCNC(=O)CSCCC 11a_100000229939_100000217233 [1,0,1,0,0,0|2,0,0]=4 5613 B15R0.322 CCCCCCCCNC(=O)CSCCC 1626a_100000229939_100000217233 [1,0,1,0,0,0|2,0,0]=4 5614 B15R0.322 CCCCCCCCNC(=O)CSCCC 240690a_100000229939_100000217233 [1,0,1,0,0,0|2,0,0]=4 5615 B15R0.322 CCCCCCCCNC(=O)CSCCC 527a_100000229939_100000217233 [1,0,1,0,0,0|2,0,0]=4 5616 B15R0.322 CCCCCCCCNC(=O)NCCCC 2708a_100000102301_100000229939 [1,0,1,0,0,0|2,0,0]=4 5617 B15R0.322 CCCCCCCCNC(=O)NCCCC 2708a_100000229939_100000102301 [1,0,1,0,0,0|2,0,0]=4 5618 B15R0.322 CCCCCCCCNC(=O)NCCCC 273464a_100000102301_100000229939 [1,0,1,0,0,0|2,0,0]=4 5619 B15R0.322 CCCCCCCCNC(=O)NCCCC 273464a_100000229939_100000102301 [1,0,1,0,0,0|2,0,0]=4 5620 B15R0.322 CCCCCCCCNC(=O)NCCCC 512a_100000102301_100000229939 [1,0,1,0,0,0|2,0,0]=4 5621 B15R0.322 CCCCCCCCNC(=O)NCCCC 512a_100000229939_100000102301 [1,0,1,0,0,0|2,0,0]=4 5622 B15R0.322 CCCCCCCCOC(C)CCCCC 34a_100000210232_200011218191 [1,0,1,0,0,0|1,0,1]=4 5623 B15R0.322 CCCCCCCCOC(C)CCCCC 34a_100011215632_100000210759 [1,0,1,0,0,0|1,0,1]=4 5624 B15R0.322 CCCCCCCCOC(C)CCCCC 7a_100000210232_200011218191 [1,0,1,0,0,0|1,0,1]=4 5625 B15R0.322 CCCCCCCCOC(C)CCCCC 7a_100011215632_100000210759 [1,0,1,0,0,0|1,0,1]=4 5626 B15R0.322 CCCCCCCNCC(=O)CCCCC 2230a_100000229938_200012276598 [1,0,1,0,0,0|1,0,0]=3 5627 B15R0.322 CCCCCCCNCC(=O)NCCCC 2230a_100000229938_100000182744 [1,0,1,0,0,0|2,0,0]=4 5628 B15R0.322 CCCCCCCNCC(=O)OCCCC 2230a_100000229938_100000211628 [1,0,1,0,0,0|1,0,0]=3 5629 B15R0.322 CCCCCCCNCC(=O)OCCOC 2230a_100000229938_200000040189 [1,0,1,0,0,0|2,0,0]=4 5630 B15R0.322 CCCCCCCOCC(=O)CCCCC 34a_100000210272_200012276598 [1,0,1,0,0,0|1,0,0]=3 5631 B15R0.322 CCCCCCCOCC(=O)CCCCC 7a_100000210272_200012276598 [1,0,1,0,0,0|1,0,0]=3 5632 B15R0.322 CCCCCCCOCC(=O)NCCCC 34a_100000210272_100000182744 [1,0,1,0,0,0|2,0,0]=4 5633 B15R0.322 CCCCCCCOCC(=O)NCCCC 7a_100000210272_100000182744 [1,0,1,0,0,0|2,0,0]=4 5634 B15R0.322 CCCCCCCOCC(=O)OCCCC 34a_100000210272_100000211628 [1,0,1,0,0,0|1,0,0]=3 5635 B15R0.322 CCCCCCCOCC(=O)OCCCC 7a_100000210272_100000211628 [1,0,1,0,0,0|1,0,0]=3 5636 B15R0.322 CCCCCCCOCC(=O)OCCOC 34a_100000210272_200000040189 [1,0,1,0,0,0|2,0,0]=4 5637 B15R0.322 CCCCCCCOCC(=O)OCCOC 7a_100000210272_200000040189 [1,0,1,0,0,0|2,0,0]=4 5638 B15R0.322 CCCCCCCSCC(=O)CCCCC 62a_100000210614_200012276598 [1,0,1,0,0,0|1,0,0]=3 5639 B15R0.322 CCCCCCCSCC(=O)CCCCC 62a_200012276598_100000210316 [1,0,1,0,0,0|1,0,0]=3 5640 B15R0.322 CCCCCCCSCC(=O)NCCCC 62a_100000182744_100000210316 [1,0,1,0,0,0|2,0,0]=4 5641 B15R0.322 CCCCCCCSCC(=O)NCCCC 62a_100000210614_100000182744 [1,0,1,0,0,0|2,0,0]=4 5642 B15R0.322 CCCCCCCSCC(=O)OCCCC 62a_100000210614_100000211628 [1,0,1,0,0,0|1,0,0]=3 5643 B15R0.322 CCCCCCCSCC(=O)OCCCC 62a_100000211628_100000210316 [1,0,1,0,0,0|1,0,0]=3 5644 B15R0.322 CCCCCCCSCC(=O)OCCOC 62a_100000210614_200000040189 [1,0,1,0,0,0|2,0,0]=4 5645 B15R0.322 CCCCCCCSCC(=O)OCCOC 62a_200000040189_100000210316 [1,0,1,0,0,0|2,0,0]=4 5646 B15R0.322 CCCCNC(=O)CCCCCCCCO 240690a_100000102301_100000015970 [1,0,1,0,0,0|2,0,0]=4 5647 B15R0.322 CCCCOC(=O)CNCCCCCCO 2230a_100000686447_100000211628 [1,0,1,0,0,0|2,0,0]=4 5648 B15R0.322 CCCCOC(=O)CNCCCCCCO 34a_100000686447_100000211628 [1,0,1,0,0,0|2,0,0]=4 5649 B15R0.322 CCCCOC(=O)CNCCCCCOC 2230a_100000747528_100000211628 [1,0,1,0,0,0|2,0,0]=4 5650 B15R0.322 CCCCOC(=O)CNCCCCCOC 34a_100000747528_100000211628 [1,0,1,0,0,0|2,0,0]=4 5651 B15R0.322 CCCCOC(=O)CNCCCOCCC 2230a_100011217757_100000211628 [1,0,1,0,0,0|2,0,0]=4 5652 B15R0.322 CCCCOC(=O)CNCCCOCCC 34a_100011217757_100000211628 [1,0,1,0,0,0|2,0,0]=4 5653 B15R0.322 CCCCOC(=O)CNCCSCCCC 2230a_100025743550_100000211628 [1,0,1,0,0,0|2,0,0]=4 5654 B15R0.322 CCCCOC(=O)COCCCCCCBr 34a_100011215345_100000211628 [1,0,1,0,0,0|2,0,0]=4 5655 B15R0.322 CCCCOC(=O)COCCCCCCBr 7a_100011215345_100000211628 [1,0,1,0,0,0|2,0,0]=4 5656 B15R0.322 CCCCOC(=O)COCCCCCCCl 34a_100000766143_100000211628 [1,0,1,0,0,0|2,0,0]=4 5657 B15R0.322 CCCCOC(=O)COCCCCCCCl 7a_100000766143_100000211628 [1,0,1,0,0,0|2,0,0]=4 5658 B15R0.322 CCCCOC(=O)COCCCCCCF 34a_100000732779_100000211628 [1,0,1,0,0,0|2,0,0]=4 5659 B15R0.322 CCCCOC(=O)COCCCCCCF 7a_100000732779_100000211628 [1,0,1,0,0,0|2,0,0]=4 5660 B15R0.322 CCCCOC(=O)COCCCCCCN 34a_100000686447_100000211628 [1,0,1,0,0,0|2,0,0]=4 5661 B15R0.322 CCCCOC(=O)COCCCCCNC 34a_100000722520_100000211628 [1,0,1,0,0,0|2,0,0]=4 5662 B15R0.322 CCCCOC(=O)COCCSCCCC 34a_200000230436_100000211628 [1,0,1,0,0,0|2,0,0]=4 5663 B15R0.322 CCCCOC(=O)COCCSCCCC 7a_200000230436_100000211628 [1,0,1,0,0,0|2,0,0]=4 5664 B15R0.322 CCCCOC(=O)CSCCCCCCF 62a_100000211628_100015922095 [1,0,1,0,0,0|2,0,0]=4 5665 B15R0.322 CCCCOC(=O)CSCCCCCCF 62a_100015922095_100000211628 [1,0,1,0,0,0|2,0,0]=4 5666 B15R0.322 CCCCOC(=O)CSCCCCCCO 62a_100000211628_100000766143 [1,0,1,0,0,0|2,0,0]=4 5667 B15R0.322 CCCCOC(=O)CSCCCCCCO 62a_100000766143_100000211628 [1,0,1,0,0,0|2,0,0]=4 5668 B15R0.322 CCCCOCCOCC(=O)OCCCC 34a_100000210238_100000211628 [1,0,1,0,0,0|2,0,0]=4 5669 B15R0.322 CCCCOCCOCC(=O)OCCCC 7a_100000210238_100000211628 [1,0,1,0,0,0|2,0,0]=4 5670 B15R0.322 CCCCOCCSCC(=O)OCCCC 62a_100000211628_100000743108 [1,0,1,0,0,0|2,0,0]=4 5671 B15R0.322 CCCCOCCSCC(=O)OCCCC 62a_100000743108_100000211628 [1,0,1,0,0,0|2,0,0]=4 5672 B15R0.322 CCCOCC(=O)CCCCCCCCO 1458a_100000745993_100000033203 [1,0,1,0,0,0|2,0,0]=4 5673 B15R0.322 CCCSCC(=O)CCCCCCCCO 1458a_100000217233_100000033203 [1,0,1,0,0,0|2,0,0]=4 5674 B15R0.322 CCOCCC(=O)CCCCCCCCO 1458a_100000749530_100000033203 [1,0,1,0,0,0|2,0,0]=4 5675 B15R0.322 CCSCCC(=O)CCCCCCCCO 1458a_100000230768_100000033203 [1,0,1,0,0,0|2,0,0]=4 5676 B15R0.322 COCCCC(=O)CCCCCCCCO 1458a_100000741012_100000033203 [1,0,1,0,0,0|2,0,0]=4 5677 B15R0.322 CSCCCC(=O)CCCCCCCCO 1458a_100000173376_100000033203 [1,0,1,0,0,0|2,0,0]=4 5678 B15R0.322 O=C(CCCCO)CCCCCCCCO 1458a_100000695505_100000033203 [1,0,1,0,0,0|2,0,0]=4 5679 B15R0.2002 C#CCCC(=O)CCCCCCCCCC 1458a_100000210375_100000753159 [1,0,1,0,0,0|0,0,2]=4 5680 B15R0.2002 C#CCCC(=O)CCCCCCCCCC 1458a_100000692101_100000210319 [1,0,1,0,0,0|0,0,2]=4 5681 B15R0.2002 C#CCCCCCCCCC(=O)CCCC 1458a_100000029693_100000210211 [1,0,1,0,0,0|0,0,2]=4 5682 B15R0.2002 C/C=C/CC(=O)CCCCCCCCCC 1458a_100000210375_100102629194 [1,0,1,0,0,0|0,0,2]=4 5683 B15R0.2002 C=CCCC(=O)CCCCCCCCCC 1458a_100000210375_100000754431 [1,0,1,0,0,0|0,0,2]=4 5684 B15R0.2002 C=CCCC(=O)CCCCCCCCCC 1458a_100000749702_100000210319 [1,0,1,0,0,0|0,0,2]=4 5685 B15R0.2002 C=CCCCCCCCCC(=O)CCCC 1458a_100000210183_100011933949 [1,0,1,0,0,0|0,0,2]=4 5686 B15R0.2002 C=CCCCCCCCCC(=O)CCCC 1458a_100000211349_100000210211 [1,0,1,0,0,0|0,0,2]=4 5687 B15R0.2002 CC#CCC(=O)CCCCCCCCCC 1458a_100000210375_100000748600 [1,0,1,0,0,0|0,0,2]=4 5688 B15R0.2002 CC#CCCCCCCCC(=O)CCCC 1458a_100000066323_100000210211 [1,0,1,0,0,0|0,0,2]=4 5689 B15R0.2002 CC=CCC(=O)CCCCCCCCCC 1458a_100000210375_100000070051 [1,0,1,0,0,0|0,0,2]=4 5690 B15R0.2002 CC=CCC(=O)CCCCCCCCCC 1458a_100121576822_100000210319 [1,0,1,0,0,0|0,0,2]=4 5691 B15R0.2002 CCC#CC(=O)CCCCCCCCCC 1458a_100011827653_100000210319 [1,0,1,0,0,0|0,0,2]=4 5692 B15R0.2002 CCC#CCCCCCCC(=O)CCCC 1458a_100000210183_200000036426 [1,0,1,0,0,0|0,0,2]=4 5693 B15R0.2002 CCC=CC(=O)CCCCCCCCCC 1458a_100000212282_100000210319 [1,0,1,0,0,0|0,0,2]=4 5694 B15R0.2002 CCCCC(=O)CCCCCCCCCF 1458a_200009909015_100000210211 [1,0,1,0,0,0|1,0,0]=3 5695 B15R0.2002 CCCCC(=O)CCCCCCCCCO 1458a_100000210183_100009813782 [1,0,1,0,0,0|1,0,0]=3 5696 B15R0.2002 CCCCC(=O)NCCCCCCCCO 240690a_102515433106_100000210183 [1,0,1,0,0,0|2,0,0]=4 5697 B15R0.2002 CCCCCCCCC=CC(=O)CCCC 1458a_100015345288_100000210211 [1,0,1,0,0,0|0,0,2]=4 5698 B15R0.2002 CCCCCCCCCCC(=O)CCC#N 1458a_100000210375_100011215226 [1,0,1,0,0,0|1,0,1]=4 5699 B15R0.2002 CCCCCCCCCCC(=O)CCC#N 1458a_100011934036_100000210319 [1,0,1,0,0,0|1,0,1]=4 5700 B15R0.2002 CCCCCCCCCCC(=O)CCCC 1458a_100000210183_100000210319 [1,0,1,0,0,0|0,0,0]=2 5701 B15R0.2002 CCCCCCCCCCC(=O)CCCC 1458a_100000210375_100000210211 [1,0,1,0,0,0|0,0,0]=2 5702 B15R0.2002 CCCCCCCCCCC(=O)CCCF 1458a_100000210375_100011934791 [1,0,1,0,0,0|1,0,0]=3 5703 B15R0.2002 CCCCCCCCCCC(=O)CCCO 1458a_100000210375_100011215043 [1,0,1,0,0,0|1,0,0]=3 5704 B15R0.2002 CCCCCCCCCCC(=O)CCOC 1458a_100000210375_100000233755 [1,0,1,0,0,0|1,0,0]=3 5705 B15R0.2002 CCCCCCCCCCC(=O)CCOC 1458a_100000749529_100000210319 [1,0,1,0,0,0|1,0,0]=3 5706 B15R0.2002 CCCCCCCCCCC(=O)CCSC 1458a_100000174002_100000210319 [1,0,1,0,0,0|1,0,0]=3 5707 B15R0.2002 CCCCCCCCCCC(=O)CCSC 1458a_100000210375_100000751147 [1,0,1,0,0,0|1,0,0]=3 5708 B15R0.2002 CCCCCCCCCCC(=O)COCC 1458a_100000211967_100000210319 [1,0,1,0,0,0|1,0,0]=3 5709 B15R0.2002 CCCCCCCCCCC(=O)CSCC 1458a_100000230394_100000210319 [1,0,1,0,0,0|1,0,0]=3 5710 B15R0.2002 CCCCCCCCCCC(=O)NCCC 11a_100020643023_100000210375 [1,0,1,0,0,0|1,0,0]=3 5711 B15R0.2002 CCCCCCCCCCC(=O)NCCC 1626a_100020643023_100000210375 [1,0,1,0,0,0|1,0,0]=3 5712 B15R0.2002 CCCCCCCCCCC(=O)NCCC 240690a_100020643023_100000210375 [1,0,1,0,0,0|1,0,0]=3 5713 B15R0.2002 CCCCCCCCCCC(=O)NCCF 11a_100000724931_100000210375 [1,0,1,0,0,0|2,0,0]=4 5714 B15R0.2002 CCCCCCCCCCC(=O)NCCF 1626a_100000724931_100000210375 [1,0,1,0,0,0|2,0,0]=4 5715 B15R0.2002 CCCCCCCCCCC(=O)NCCF 240690a_100000724931_100000210375 [1,0,1,0,0,0|2,0,0]=4 5716 B15R0.2002 CCCCCCCCCCC(=O)NCCO 240690a_100000210304_100000210375 [1,0,1,0,0,0|2,0,0]=4 5717 B15R0.2002 CCCCCCCCCCC(=O)NNCC 22a_100000756455_100000210375 [1,0,1,0,0,0|2,0,0]=4 5718 B15R0.2002 CCCCCCCCCCC(C)OCCC 34a_100011215000_100000210303 [1,0,1,0,0,0|1,0,1]=4 5719 B15R0.2002 CCCCCCCCCCC(C)OCCC 7a_100011215000_100000210303 [1,0,1,0,0,0|1,0,1]=4 5720 B15R0.2002 CCCCCCCCCCN(C)CCCC 2230a_100000207549_100000210320 [1,0,1,0,0,0|2,0,0]=4 5721 B15R0.2002 CCCCCCCCCCN(C)CCCC 2230a_100000207566_100000210211 [1,0,1,0,0,0|2,0,0]=4 5722 B15R0.2002 CCCCCCCCCCN(C)CCCC 269982a_100000207549_100000210320 [1,0,1,0,0,0|2,0,0]=4 5723 B15R0.2002 CCCCCCCCCCN(C)CCCC 269982a_100000207566_100000210211 [1,0,1,0,0,0|2,0,0]=4 5724 B15R0.2002 CCCCCCCCCNC(=O)CCCC 11a_100000212291_100000210183 [1,0,1,0,0,0|1,0,0]=3 5725 B15R0.2002 CCCCCCCCCNC(=O)CCCC 1626a_100000212291_100000210183 [1,0,1,0,0,0|1,0,0]=3 5726 B15R0.2002 CCCCCCCCCNC(=O)CCCC 240690a_100000212291_100000210183 [1,0,1,0,0,0|1,0,0]=3 5727 B15R0.2002 CCCCCCCCCNC(=O)CCCC 527a_100000212291_100000210183 [1,0,1,0,0,0|1,0,0]=3 5728 B15R0.2002 CCCCCCCCCNC(=O)CCOC 11a_100000212291_100000749529 [1,0,1,0,0,0|2,0,0]=4 5729 B15R0.2002 CCCCCCCCCNC(=O)CCOC 1626a_100000212291_100000749529 [1,0,1,0,0,0|2,0,0]=4 5730 B15R0.2002 CCCCCCCCCNC(=O)CCOC 240690a_100000212291_100000749529 [1,0,1,0,0,0|2,0,0]=4 5731 B15R0.2002 CCCCCCCCCNC(=O)CCOC 527a_100000212291_100000749529 [1,0,1,0,0,0|2,0,0]=4 5732 B15R0.2002 CCCCCCCCCNC(=O)CCSC 11a_100000212291_100000174002 [1,0,1,0,0,0|2,0,0]=4 5733 B15R0.2002 CCCCCCCCCNC(=O)CCSC 1626a_100000212291_100000174002 [1,0,1,0,0,0|2,0,0]=4 5734 B15R0.2002 CCCCCCCCCNC(=O)CCSC 240690a_100000212291_100000174002 [1,0,1,0,0,0|2,0,0]=4 5735 B15R0.2002 CCCCCCCCCNC(=O)CCSC 527a_100000212291_100000174002 [1,0,1,0,0,0|2,0,0]=4 5736 B15R0.2002 CCCCCCCCCNC(=O)COCC 11a_100000212291_100000211967 [1,0,1,0,0,0|2,0,0]=4 5737 B15R0.2002 CCCCCCCCCNC(=O)COCC 1626a_100000212291_100000211967 [1,0,1,0,0,0|2,0,0]=4 5738 B15R0.2002 CCCCCCCCCNC(=O)COCC 240690a_100000212291_100000211967 [1,0,1,0,0,0|2,0,0]=4 5739 B15R0.2002 CCCCCCCCCNC(=O)COCC 527a_100000212291_100000211967 [1,0,1,0,0,0|2,0,0]=4 5740 B15R0.2002 CCCCCCCCCNC(=O)CSCC 11a_100000212291_100000230394 [1,0,1,0,0,0|2,0,0]=4 5741 B15R0.2002 CCCCCCCCCNC(=O)CSCC 1626a_100000212291_100000230394 [1,0,1,0,0,0|2,0,0]=4 5742 B15R0.2002 CCCCCCCCCNC(=O)CSCC 240690a_100000212291_100000230394 [1,0,1,0,0,0|2,0,0]=4 5743 B15R0.2002 CCCCCCCCCNC(=O)CSCC 527a_100000212291_100000230394 [1,0,1,0,0,0|2,0,0]=4 5744 B15R0.2002 CCCCCCCCCNC(=O)NCCC 2708a_100000212291_100020643023 [1,0,1,0,0,0|2,0,0]=4 5745 B15R0.2002 CCCCCCCCCNC(=O)NCCC 2708a_100020643023_100000212291 [1,0,1,0,0,0|2,0,0]=4 5746 B15R0.2002 CCCCCCCCCNC(=O)NCCC 273464a_100000212291_100020643023 [1,0,1,0,0,0|2,0,0]=4 5747 B15R0.2002 CCCCCCCCCNC(=O)NCCC 273464a_100020643023_100000212291 [1,0,1,0,0,0|2,0,0]=4 5748 B15R0.2002 CCCCCCCCCNC(=O)NCCC 512a_100000212291_100020643023 [1,0,1,0,0,0|2,0,0]=4 5749 B15R0.2002 CCCCCCCCCNC(=O)NCCC 512a_100020643023_100000212291 [1,0,1,0,0,0|2,0,0]=4 5750 B15R0.2002 CCCCCCCCCOC(C)CCCC 34a_100000210712_200011215066 [1,0,1,0,0,0|1,0,1]=4 5751 B15R0.2002 CCCCCCCCCOC(C)CCCC 34a_100000687866_100011214924 [1,0,1,0,0,0|1,0,1]=4 5752 B15R0.2002 CCCCCCCCCOC(C)CCCC 7a_100000210712_200011215066 [1,0,1,0,0,0|1,0,1]=4 5753 B15R0.2002 CCCCCCCCCOC(C)CCCC 7a_100000687866_100000210328 [1,0,1,0,0,0|1,0,1]=4 5754 B15R0.2002 CCCCCCCCNCC(=O)NCCC 2230a_100000174927_100000210759 [1,0,1,0,0,0|2,0,0]=4 5755 B15R0.2002 CCCCCCCCNCC(=O)NCCC 2230a_100000229939_100000183358 [1,0,1,0,0,0|2,0,0]=4 5756 B15R0.2002 CCCCCCCCNCC(=O)NCCC 34a_100000229939_100000183358 [1,0,1,0,0,0|2,0,0]=4 5757 B15R0.2002 CCCCCCCCNCC(=O)OCCC 2230a_100000229939_200011215008 [1,0,1,0,0,0|1,0,0]=3 5758 B15R0.2002 CCCCCCCCNCC(=O)OCCC 34a_100000229939_200011215008 [1,0,1,0,0,0|1,0,0]=3 5759 B15R0.2002 CCCCCCCCOCC(=O)CCCC 1458a_100000759886_100000210211 [1,0,1,0,0,0|1,0,0]=3 5760 B15R0.2002 CCCCCCCCOCC(=O)CCCF 1458a_100000759886_100011934791 [1,0,1,0,0,0|2,0,0]=4 5761 B15R0.2002 CCCCCCCCOCC(=O)CCCO 1458a_100000759886_100011215043 [1,0,1,0,0,0|2,0,0]=4 5762 B15R0.2002 CCCCCCCCOCC(=O)CCOC 1458a_100000759886_100000233755 [1,0,1,0,0,0|2,0,0]=4 5763 B15R0.2002 CCCCCCCCOCC(=O)CCSC 1458a_100000759886_100000751147 [1,0,1,0,0,0|2,0,0]=4 5764 B15R0.2002 CCCCCCCCOCC(=O)NCCC 11a_100020643023_100000759886 [1,0,1,0,0,0|2,0,0]=4 5765 B15R0.2002 CCCCCCCCOCC(=O)NCCC 1626a_100020643023_100000759886 [1,0,1,0,0,0|2,0,0]=4 5766 B15R0.2002 CCCCCCCCOCC(=O)NCCC 240690a_100020643023_100000759886 [1,0,1,0,0,0|2,0,0]=4 5767 B15R0.2002 CCCCCCCCOCC(=O)NCCC 34a_100000210232_100000183358 [1,0,1,0,0,0|2,0,0]=4 5768 B15R0.2002 CCCCCCCCOCC(=O)NCCC 527a_100020643023_100000759886 [1,0,1,0,0,0|2,0,0]=4 5769 B15R0.2002 CCCCCCCCOCC(=O)NCCC 7a_100000210232_100000183358 [1,0,1,0,0,0|2,0,0]=4 5770 B15R0.2002 CCCCCCCCOCC(=O)OCCC 34a_100000210232_200011215008 [1,0,1,0,0,0|1,0,0]=3 5771 B15R0.2002 CCCCCCCCOCC(=O)OCCC 7a_100000210232_200011215008 [1,0,1,0,0,0|1,0,0]=3 5772 B15R0.2002 CCCCCCCCSCC(=O)NCCC 62a_100000183358_100000210317 [1,0,1,0,0,0|2,0,0]=4 5773 B15R0.2002 CCCCCCCCSCC(=O)NCCC 62a_100000210759_100000183358 [1,0,1,0,0,0|2,0,0]=4 5774 B15R0.2002 CCCCCCCCSCC(=O)OCCC 62a_100000210759_200011215008 [1,0,1,0,0,0|1,0,0]=3 5775 B15R0.2002 CCCCCCCCSCC(=O)OCCC 62a_200011215008_100000210317 [1,0,1,0,0,0|1,0,0]=3 5776 B15R0.2002 CCCCCCCOCOC(=O)OCCC 34a_100000210272_200000139673 [1,0,1,0,0,0|2,0,0]=4 5777 B15R0.2002 CCCCCCCOCOC(=O)OCCC 7a_100000210272_200000139673 [1,0,1,0,0,0|2,0,0]=4 5778 B15R0.2002 CCCCCCCSCOC(=O)OCCC 62a_100000210614_200000139673 [1,0,1,0,0,0|2,0,0]=4 5779 B15R0.2002 CCCCCCNCCCC(=O)NCCC 2230a_100000210581_100011194427 [1,0,1,0,0,0|2,0,0]=4 5780 B15R0.2002 CCCCCCOCCCC(=O)NCCC 7a_100000210259_100011194427 [1,0,1,0,0,0|2,0,0]=4 5781 B15R0.2002 CCCCCCSCCCC(=O)NCCC 62a_100000210314_100011194427 [1,0,1,0,0,0|2,0,0]=4 5782 B15R0.2002 CCCCCCSCCCC(=O)NCCC 62a_100011194427_100000210757 [1,0,1,0,0,0|2,0,0]=4 5783 B15R0.2002 CCCCCNCCOCC(=O)OCCC 34a_100000224656_200011215008 [1,0,1,0,0,0|2,0,0]=4 5784 B15R0.2002 CCCCCOCCOCC(=O)OCCC 34a_100011215259_200011215008 [1,0,1,0,0,0|2,0,0]=4 5785 B15R0.2002 CCCCCOCCOCC(=O)OCCC 7a_100011215259_200011215008 [1,0,1,0,0,0|2,0,0]=4 5786 B15R0.2002 CCCCOCCCNCC(=O)OCCC 2230a_200000211371_200011215008 [1,0,1,0,0,0|2,0,0]=4 5787 B15R0.2002 CCCCOCCCNCC(=O)OCCC 34a_200000211371_200011215008 [1,0,1,0,0,0|2,0,0]=4 5788 B15R0.2002 CCCCOCCCOCC(=O)OCCC 34a_200011215613_200011215008 [1,0,1,0,0,0|2,0,0]=4 5789 B15R0.2002 CCCCOCCCOCC(=O)OCCC 7a_200011215613_200011215008 [1,0,1,0,0,0|2,0,0]=4 5790 B15R0.2002 CCCNC(=O)CCCCCCCCCF 11a_100020643023_200009909015 [1,0,1,0,0,0|2,0,0]=4 5791 B15R0.2002 CCCNC(=O)CCCCCCCCCF 240690a_100020643023_200009909015 [1,0,1,0,0,0|2,0,0]=4 5792 B15R0.2002 CCCNC(=O)CCCCCCCCCF 527a_100020643023_200009909015 [1,0,1,0,0,0|2,0,0]=4 5793 B15R0.2002 CCCNC(=O)CCCCCCCCCO 240690a_100020643023_100000032657 [1,0,1,0,0,0|2,0,0]=4 5794 B15R0.2002 CCCOC(=O)CNCCCCCCCO 2230a_100011996573_200011215008 [1,0,1,0,0,0|2,0,0]=4 5795 B15R0.2002 CCCOC(=O)CNCCCCCCCO 34a_100011996573_200011215008 [1,0,1,0,0,0|2,0,0]=4 5796 B15R0.2002 CCCOC(=O)COCCCCCCCBr 34a_100000760002_200011215008 [1,0,1,0,0,0|2,0,0]=4 5797 B15R0.2002 CCCOC(=O)COCCCCCCCBr 7a_100000760002_200011215008 [1,0,1,0,0,0|2,0,0]=4 5798 B15R0.2002 CCCOC(=O)COCCCCCCCN 34a_100011996573_200011215008 [1,0,1,0,0,0|2,0,0]=4 5799 B15R0.2002 CCCOC(=O)COCCCCCCOC 34a_200012092642_200011215008 [1,0,1,0,0,0|2,0,0]=4 5800 B15R0.2002 CCCOC(=O)COCCCCCCOC 7a_200012092642_200011215008 [1,0,1,0,0,0|2,0,0]=4 5801 B15R0.2002 CCCOC(=O)CSCCCCCCCO 62a_100000760002_200011215008 [1,0,1,0,0,0|2,0,0]=4 5802 B15R0.2002 CCCOC(=O)CSCCCCCCCO 62a_200011215008_100000760002 [1,0,1,0,0,0|2,0,0]=4 5803 B15R0.2002 CCCOC(=O)CSCCCCCCOC 62a_100011998445_200011215008 [1,0,1,0,0,0|2,0,0]=4 5804 B15R0.2002 CCCOC(=O)CSCCCCCCOC 62a_200011215008_100011998445 [1,0,1,0,0,0|2,0,0]=4 5805 B15R0.2002 CCOCC(=O)CCCCCCCCCO 1458a_100000211967_100009813782 [1,0,1,0,0,0|2,0,0]=4 5806 B15R0.2002 CCSCC(=O)CCCCCCCCCO 1458a_100000230394_100009813782 [1,0,1,0,0,0|2,0,0]=4 5807 B15R0.2002 COCCC(=O)CCCCCCCCCF 1458a_200009909015_100000233755 [1,0,1,0,0,0|2,0,0]=4 5808 B15R0.2002 COCCC(=O)CCCCCCCCCO 1458a_100000749529_100009813782 [1,0,1,0,0,0|2,0,0]=4 5809 B15R0.2002 CSCCC(=O)CCCCCCCCCF 1458a_200009909015_100000751147 [1,0,1,0,0,0|2,0,0]=4 5810 B15R0.2002 CSCCC(=O)CCCCCCCCCO 1458a_100000174002_100009813782 [1,0,1,0,0,0|2,0,0]=4 5811 B15R0.2002 O=C(CCCF)CCCCCCCCCF 1458a_200009909015_100011934791 [1,0,1,0,0,0|2,0,0]=4 5812 B15R0.2002 O=C(CCCO)CCCCCCCCCF 1458a_200009909015_100011215043 [1,0,1,0,0,0|2,0,0]=4 5813 B15R0.133 C#CCCCCCC(=O)CCCCCCC 1458a_100000211969_100012094781 [1,0,1,0,0,0|0,0,2]=4 5814 B15R0.133 C#CCCCCCC(=O)CCCCCCC 1458a_100000694772_100000210614 [1,0,1,0,0,0|0,0,2]=4 5815 B15R0.133 C=CCCCCCC(=O)CCCCCCC 1458a_100000211969_100000700193 [1,0,1,0,0,0|0,0,2]=4 5816 B15R0.133 C=CCCCCCC(=O)CCCCCCC 1458a_100011934241_100000210614 [1,0,1,0,0,0|0,0,2]=4 5817 B15R0.133 CCCC/C=C/CC(=O)CCCCCCC 1458a_200016282684_100000210614 [1,0,1,0,0,0|0,0,2]=4 5818 B15R0.133 CCCCCC#CC(=O)CCCCCCC 1458a_100011215388_100000210614 [1,0,1,0,0,0|0,0,2]=4 5819 B15R0.133 CCCCCC=CC(=O)CCCCCCC 1458a_100016263427_100000210614 [1,0,1,0,0,0|0,0,2]=4 5820 B15R0.133 CCCCCCCC(=O)CCCCCC#N 1458a_100000211969_100009813376 [1,0,1,0,0,0|1,0,1]=4 5821 B15R0.133 CCCCCCCC(=O)CCCCCCC 1458a_100000211969_100000210614 [1,0,1,0,0,0|0,0,0]=2 5822 B15R0.133 CCCCCCCC(=O)CCCCCCF 1458a_100000211969_100015922095 [1,0,1,0,0,0|1,0,0]=3 5823 B15R0.133 CCCCCCCC(=O)CCCCCCO 1458a_100000211969_100000766143 [1,0,1,0,0,0|1,0,0]=3 5824 B15R0.133 CCCCCCCC(=O)CCCCCCO 1458a_100011996774_100000210614 [1,0,1,0,0,0|1,0,0]=3 5825 B15R0.133 CCCCCCCC(=O)CCCCCOC 1458a_100011935119_100000210614 [1,0,1,0,0,0|1,0,0]=3 5826 B15R0.133 CCCCCCCC(=O)CCOCCCC 1458a_100000211969_100000743108 [1,0,1,0,0,0|1,0,0]=3 5827 B15R0.133 CCCCCCCC(=O)CCOCCOC 1458a_100000211969_100000695917 [1,0,1,0,0,0|2,0,0]=4 5828 B15R0.133 CCCCCCCC(=O)CCOCCOC 1458a_100000745395_100000210614 [1,0,1,0,0,0|2,0,0]=4 5829 B15R0.133 CCCCCCCC(=O)NCCCCCC 11a_100000210581_100000211969 [1,0,1,0,0,0|1,0,0]=3 5830 B15R0.133 CCCCCCCC(=O)NCCCCCC 1626a_100000210581_100000211969 [1,0,1,0,0,0|1,0,0]=3 5831 B15R0.133 CCCCCCCC(=O)NCCCCCC 240690a_100000210581_100000211969 [1,0,1,0,0,0|1,0,0]=3 5832 B15R0.133 CCCCCCCC(=O)NCCCCCC 527a_100000210581_100000211969 [1,0,1,0,0,0|1,0,0]=3 5833 B15R0.133 CCCCCCCC(=O)NCCCCCO 240690a_100000762737_100000211969 [1,0,1,0,0,0|2,0,0]=4 5834 B15R0.133 CCCCCCCC(=O)NCCCOCC 11a_100000210961_100000211969 [1,0,1,0,0,0|2,0,0]=4 5835 B15R0.133 CCCCCCCC(=O)NCCCOCC 1626a_100000210961_100000211969 [1,0,1,0,0,0|2,0,0]=4 5836 B15R0.133 CCCCCCCC(=O)NCCCOCC 240690a_100000210961_100000211969 [1,0,1,0,0,0|2,0,0]=4 5837 B15R0.133 CCCCCCCC(=O)NCCCOCC 527a_100000210961_100000211969 [1,0,1,0,0,0|2,0,0]=4 5838 B15R0.133 CCCCCCCC(=O)NCCOCCC 1626a_100161115042_100000211969 [1,0,1,0,0,0|2,0,0]=4 5839 B15R0.133 CCCCCCCC(=O)NCCOCCC 240690a_100161115042_100000211969 [1,0,1,0,0,0|2,0,0]=4 5840 B15R0.133 CCCCCCCC(=O)NCCOCCC 527a_100161115042_100000211969 [1,0,1,0,0,0|2,0,0]=4 5841 B15R0.133 CCCCCCCC(=O)NCCSCCC 11a_100020603323_100000211969 [1,0,1,0,0,0|2,0,0]=4 5842 B15R0.133 CCCCCCCC(=O)NCCSCCC 240690a_100020603323_100000211969 [1,0,1,0,0,0|2,0,0]=4 5843 B15R0.133 CCCCCCCC(=O)NCCSCCC 527a_100020603323_100000211969 [1,0,1,0,0,0|2,0,0]=4 5844 B15R0.133 CCCCCCCC(=O)NNCCCCC 22a_100000694160_100000211969 [1,0,1,0,0,0|2,0,0]=4 5845 B15R0.133 CCCCCCCC(=O)OCNCCCC 2230a_100000102301_100009852258 [1,0,1,0,0,0|1,0,0]=3 5846 B15R0.133 CCCCCCCC(=O)OCNCCCC 7a_106832991798_100009852258 [1,0,1,0,0,0|1,0,0]=3 5847 B15R0.133 CCCCCCCC(=O)OCNCCCF 2230a_100015189416_100009852258 [1,0,1,0,0,0|2,0,0]=4 5848 B15R0.133 CCCCCCCC(=O)OCNCCCF 34a_100015189416_100009852258 [1,0,1,0,0,0|2,0,0]=4 5849 B15R0.133 CCCCCCCC(=O)OCNCCOC 2230a_100000209980_100009852258 [1,0,1,0,0,0|2,0,0]=4 5850 B15R0.133 CCCCCCCC(=O)OCNCCSC 2230a_100020590264_100009852258 [1,0,1,0,0,0|2,0,0]=4 5851 B15R0.133 CCCCCCCC(=O)OCOCCCBr 34a_100011217188_100009852258 [1,0,1,0,0,0|2,0,0]=4 5852 B15R0.133 CCCCCCCC(=O)OCOCCCC 34a_100000210227_100009852258 [1,0,1,0,0,0|1,0,0]=3 5853 B15R0.133 CCCCCCCC(=O)OCOCCCC 7a_100000210227_100009852258 [1,0,1,0,0,0|1,0,0]=3 5854 B15R0.133 CCCCCCCC(=O)OCOCCCCl 34a_100000230001_100009852258 [1,0,1,0,0,0|2,0,0]=4 5855 B15R0.133 CCCCCCCC(=O)OCOCCCF 34a_100000759539_100009852258 [1,0,1,0,0,0|2,0,0]=4 5856 B15R0.133 CCCCCCCC(=O)OCOCCCN 34a_100000182051_100009852258 [1,0,1,0,0,0|2,0,0]=4 5857 B15R0.133 CCCCCCCC(=O)OCOCCOC 34a_100000210237_100009852258 [1,0,1,0,0,0|2,0,0]=4 5858 B15R0.133 CCCCCCCC(=O)OCOCCSC 34a_100000230434_100009852258 [1,0,1,0,0,0|2,0,0]=4 5859 B15R0.133 CCCCCCCC(=O)OCOCCSC 7a_100000230434_100009852258 [1,0,1,0,0,0|2,0,0]=4 5860 B15R0.133 CCCCCCCC(=O)OCSCCCC 62a_100000210211_100009852258 [1,0,1,0,0,0|1,0,0]=3 5861 B15R0.133 CCCCCCCC(=O)OCSCCCF 62a_100011934791_100009852258 [1,0,1,0,0,0|2,0,0]=4 5862 B15R0.133 CCCCCCCC(=O)OCSCCCO 62a_100011215043_100009852258 [1,0,1,0,0,0|2,0,0]=4 5863 B15R0.133 CCCCCCCC(=O)OCSCCOC 62a_100000233755_100009852258 [1,0,1,0,0,0|2,0,0]=4 5864 B15R0.133 CCCCCCCC(=O)OCSCCSC 62a_100000212216_100009852258 [1,0,1,0,0,0|2,0,0]=4 5865 B15R0.133 CCCCCCCC(=O)OCSCOCC 62a_100000739092_100009852258 [1,0,1,0,0,0|2,0,0]=4 5866 B15R0.133 CCCCCCCC(C)OCCCCCC 34a_100000210259_200011218727 [1,0,1,0,0,0|1,0,1]=4 5867 B15R0.133 CCCCCCCC(C)OCCCCCC 34a_200011215852_100000210314 [1,0,1,0,0,0|1,0,1]=4 5868 B15R0.133 CCCCCCCC(C)OCCCCCC 7a_100000210259_200011218727 [1,0,1,0,0,0|1,0,1]=4 5869 B15R0.133 CCCCCCCC(C)OCCCCCC 7a_200011215852_100000210314 [1,0,1,0,0,0|1,0,1]=4 5870 B15R0.133 CCCCCCCN(C)CCCCCCC 2230a_100000228206_100000210681 [1,0,1,0,0,0|2,0,0]=4 5871 B15R0.133 CCCCCCCN(C)CCCCCCC 2230a_100000730722_200000210301 [1,0,1,0,0,0|2,0,0]=4 5872 B15R0.133 CCCCCCCN(C)CCCCCCC 269982a_100000228206_100000210681 [1,0,1,0,0,0|2,0,0]=4 5873 B15R0.133 CCCCCCCN(C)CCCCCCC 269982a_100000730722_200000210301 [1,0,1,0,0,0|2,0,0]=4 5874 B15R0.133 CCCCCCCN([13CH3])CCCCCCC 2230a_100000730722_200025704644 [1,0,1,0,0,0|2,0,0]=4 5875 B15R0.133 CCCCCCCN([13CH3])CCCCCCC 269982a_100000730722_200025704644 [1,0,1,0,0,0|2,0,0]=4 5876 B15R0.133 CCCCCCNC(=O)CCCCCCO 240690a_100000210581_100011996774 [1,0,1,0,0,0|2,0,0]=4 5877 B15R0.133 CCCCCCNC(=O)CCCCCOC 11a_100000210581_100011935119 [1,0,1,0,0,0|2,0,0]=4 5878 B15R0.133 CCCCCCNC(=O)CCCCCOC 1626a_100000210581_100011935119 [1,0,1,0,0,0|2,0,0]=4 5879 B15R0.133 CCCCCCNC(=O)CCCCCOC 240690a_100000210581_100011935119 [1,0,1,0,0,0|2,0,0]=4 5880 B15R0.133 CCCCCCNC(=O)CCCCCOC 527a_100000210581_100011935119 [1,0,1,0,0,0|2,0,0]=4 5881 B15R0.133 CCCCCCNC(=O)CNCCCCC 2230a_100000209983_100000230325 [1,0,1,0,0,0|2,0,0]=4 5882 B15R0.133 CCCCCCNC(=O)COCCCCC 34a_100000210253_100000230325 [1,0,1,0,0,0|2,0,0]=4 5883 B15R0.133 CCCCCCNC(=O)COCCCCC 7a_100000210253_100000230325 [1,0,1,0,0,0|2,0,0]=4 5884 B15R0.133 CCCCCCNC(=O)CSCCCCC 62a_100000230325_100000210326 [1,0,1,0,0,0|2,0,0]=4 5885 B15R0.133 CCCCCCNC(=O)NCCCCCC 2708a_100000210581_100000210581 [1,0,1,0,0,0|2,0,0]=4 5886 B15R0.133 CCCCCCNC(=O)NCCCCCC 273464a_100000210581_100000210581 [1,0,1,0,0,0|2,0,0]=4 5887 B15R0.133 CCCCCCNC(=O)NCCCCCC 512a_100000210581_100000210581 [1,0,1,0,0,0|2,0,0]=4 5888 B15R0.133 CCCCOCCC(=O)CCCCCCO 1458a_100011996774_100000743108 [1,0,1,0,0,0|2,0,0]=4 5889 B15R0.133 CCCCOCCC(=O)CCCCCOC 1458a_100011935119_100000743108 [1,0,1,0,0,0|2,0,0]=4 5890 B15R0.133 COCCCCCC(=O)CCCCCCF 1458a_100011935119_100015922095 [1,0,1,0,0,0|2,0,0]=4 5891 B15R0.133 COCCCCCC(=O)CCCCCCO 1458a_100011935119_100000766143 [1,0,1,0,0,0|2,0,0]=4 5892 B15R0.133 O=C(CCCCCCO)CCCCCCF 1458a_100011996774_100015922095 [1,0,1,0,0,0|2,0,0]=4 5893 B15R0.133 O=C(CCCCCCO)CCCCCCO 1458a_100011996774_100000766143 [1,0,1,0,0,0|2,0,0]=4 5894 B15R0.149 C#CCCCCC(=O)CCCCCCCC 1458a_100000210188_100010269958 [1,0,1,0,0,0|0,0,2]=4 5895 B15R0.149 C#CCCCCC(=O)CCCCCCCC 1458a_100000696528_100000210759 [1,0,1,0,0,0|0,0,2]=4 5896 B15R0.149 C#CCCCCCCC(=O)CCCCCC 1458a_100000034748_100000210757 [1,0,1,0,0,0|0,0,2]=4 5897 B15R0.149 C#CCCCCCCC(=O)CCCCCC 1458a_100102632555_100012276617 [1,0,1,0,0,0|0,0,2]=4 5898 B15R0.149 C=CCCCCC(=O)CCCCCCCC 1458a_100000210188_100011215482 [1,0,1,0,0,0|0,0,2]=4 5899 B15R0.149 C=CCCCCC(=O)CCCCCCCC 1458a_100011215552_100000210759 [1,0,1,0,0,0|0,0,2]=4 5900 B15R0.149 C=CCCCCCCC(=O)CCCCCC 1458a_100011809334_100000210757 [1,0,1,0,0,0|0,0,2]=4 5901 B15R0.149 C=CCCCCCCC(=O)CCCCCC 1458a_100102632555_100011215473 [1,0,1,0,0,0|0,0,2]=4 5902 B15R0.149 CC/C=C\CCC(=O)CCCCCCCC 1458a_100000210188_100015370543 [1,0,1,0,0,0|0,0,2]=4 5903 B15R0.149 CCC/C=C/CC(=O)CCCCCCCC 1458a_200016266809_100000210759 [1,0,1,0,0,0|0,0,2]=4 5904 B15R0.149 CCCCC/C=C/CC(=O)CCCCCC 1458a_100020675968_100000210757 [1,0,1,0,0,0|0,0,2]=4 5905 B15R0.149 CCCCC=CC(=O)CCCCCCCC 1458a_100016266645_100000210759 [1,0,1,0,0,0|0,0,2]=4 5906 B15R0.149 CCCCCC#CCC(=O)CCCCCC 1458a_100102632555_100009816472 [1,0,1,0,0,0|0,0,2]=4 5907 B15R0.149 CCCCCCC(=O)CCCCCCC#N 1458a_100102632555_100009813337 [1,0,1,0,0,0|1,0,1]=4 5908 B15R0.149 CCCCCCC(=O)CCCCCCCO 1458a_100011219782_100000210757 [1,0,1,0,0,0|1,0,0]=3 5909 B15R0.149 CCCCCCC(=O)CCCCCCCO 1458a_100102632555_100000760002 [1,0,1,0,0,0|1,0,0]=3 5910 B15R0.149 CCCCCCC(=O)CCCCCCOC 1458a_100102632555_100011998445 [1,0,1,0,0,0|1,0,0]=3 5911 B15R0.149 CCCCCCC(=O)CCCOCCOC 1458a_100102632555_100011216529 [1,0,1,0,0,0|2,0,0]=4 5912 B15R0.149 CCCCCCC(=O)CCOCCOCC 1458a_100102632555_100011211534 [1,0,1,0,0,0|2,0,0]=4 5913 B15R0.149 CCCCCCC(=O)NCCCCCCO 240690a_100000686447_100102632555 [1,0,1,0,0,0|2,0,0]=4 5914 B15R0.149 CCCCCCC(=O)NCCCCCCO 527a_100000686447_100102632555 [1,0,1,0,0,0|2,0,0]=4 5915 B15R0.149 CCCCCCC(=O)NCCCCCOC 11a_100000747528_100102632555 [1,0,1,0,0,0|2,0,0]=4 5916 B15R0.149 CCCCCCC(=O)NCCCCCOC 1626a_100000747528_100102632555 [1,0,1,0,0,0|2,0,0]=4 5917 B15R0.149 CCCCCCC(=O)NCCCCCOC 240690a_100000747528_100102632555 [1,0,1,0,0,0|2,0,0]=4 5918 B15R0.149 CCCCCCC(=O)NCCCCCOC 527a_100000747528_100102632555 [1,0,1,0,0,0|2,0,0]=4 5919 B15R0.149 CCCCCCC(=O)NCCCOCCC 1626a_100011217757_100102632555 [1,0,1,0,0,0|2,0,0]=4 5920 B15R0.149 CCCCCCC(=O)NCCCOCCC 240690a_100011217757_100102632555 [1,0,1,0,0,0|2,0,0]=4 5921 B15R0.149 CCCCCCC(=O)NCCCOCCC 527a_100011217757_100102632555 [1,0,1,0,0,0|2,0,0]=4 5922 B15R0.149 CCCCCCC(=O)NCCSCCCC 11a_100025743550_100102632555 [1,0,1,0,0,0|2,0,0]=4 5923 B15R0.149 CCCCCCC(=O)NCCSCCCC 1626a_100025743550_100102632555 [1,0,1,0,0,0|2,0,0]=4 5924 B15R0.149 CCCCCCC(=O)NCCSCCCC 240690a_100025743550_100102632555 [1,0,1,0,0,0|2,0,0]=4 5925 B15R0.149 CCCCCCC(=O)NCCSCCCC 527a_100025743550_100102632555 [1,0,1,0,0,0|2,0,0]=4 5926 B15R0.149 CCCCCCC=CC(=O)CCCCCC 1458a_200015324643_100000210757 [1,0,1,0,0,0|0,0,2]=4 5927 B15R0.149 CCCCCCCCC(=O)CCCCC#N 1458a_100000210188_100000211819 [1,0,1,0,0,0|1,0,1]=4 5928 B15R0.149 CCCCCCCCC(=O)CCCCCC 1458a_100000210188_100000210757 [1,0,1,0,0,0|0,0,0]=2 5929 B15R0.149 CCCCCCCCC(=O)CCCCCC 1458a_100102632555_100000210759 [1,0,1,0,0,0|0,0,0]=2 5930 B15R0.149 CCCCCCCCC(=O)CCCCCF 1458a_100000210188_100000729378 [1,0,1,0,0,0|1,0,0]=3 5931 B15R0.149 CCCCCCCCC(=O)CCCCCO 1458a_100000210188_100000746330 [1,0,1,0,0,0|1,0,0]=3 5932 B15R0.149 CCCCCCCCC(=O)CCCCCO 1458a_100102619762_100000210759 [1,0,1,0,0,0|1,0,0]=3 5933 B15R0.149 CCCCCCCCC(=O)CCCCOC 1458a_100000210188_100000755781 [1,0,1,0,0,0|1,0,0]=3 5934 B15R0.149 CCCCCCCCC(=O)CCCOCC 1458a_100000210188_100012232248 [1,0,1,0,0,0|1,0,0]=3 5935 B15R0.149 CCCCCCCCC(=O)CCOCCC 1458a_100000210188_100011215938 [1,0,1,0,0,0|1,0,0]=3 5936 B15R0.149 CCCCCCCCC(=O)CCOCCO 1458a_100000210188_100011215305 [1,0,1,0,0,0|2,0,0]=4 5937 B15R0.149 CCCCCCCCC(=O)CCOCCO 1458a_100011229844_100000210759 [1,0,1,0,0,0|2,0,0]=4 5938 B15R0.149 CCCCCCCCC(=O)COCCCC 1458a_100000210188_100011995733 [1,0,1,0,0,0|1,0,0]=3 5939 B15R0.149 CCCCCCCCC(=O)COCCCC 1458a_100000757543_100000210759 [1,0,1,0,0,0|1,0,0]=3 5940 B15R0.149 CCCCCCCCC(=O)COCCOC 1458a_100000211095_100000210759 [1,0,1,0,0,0|2,0,0]=4 5941 B15R0.149 CCCCCCCCC(=O)CSCCCC 1458a_100000191162_100000210759 [1,0,1,0,0,0|1,0,0]=3 5942 B15R0.149 CCCCCCCCC(=O)NCCCCC 11a_100000209983_100000210188 [1,0,1,0,0,0|1,0,0]=3 5943 B15R0.149 CCCCCCCCC(=O)NCCCCC 1626a_100000209983_100000210188 [1,0,1,0,0,0|1,0,0]=3 5944 B15R0.149 CCCCCCCCC(=O)NCCCCC 240690a_100000209983_100000210188 [1,0,1,0,0,0|1,0,0]=3 5945 B15R0.149 CCCCCCCCC(=O)NCCCCC 527a_100000209983_100000210188 [1,0,1,0,0,0|1,0,0]=3 5946 B15R0.149 CCCCCCCCC(=O)NCCCCO 240690a_100000750430_100000210188 [1,0,1,0,0,0|2,0,0]=4 5947 B15R0.149 CCCCCCCCC(=O)NCCCCO 527a_100000750430_100000210188 [1,0,1,0,0,0|2,0,0]=4 5948 B15R0.149 CCCCCCCCC(=O)NCCCOC 1626a_100150723488_100000210188 [1,0,1,0,0,0|2,0,0]=4 5949 B15R0.149 CCCCCCCCC(=O)NCCCOC 240690a_100150723488_100000210188 [1,0,1,0,0,0|2,0,0]=4 5950 B15R0.149 CCCCCCCCC(=O)NCCCOC 527a_100150723488_100000210188 [1,0,1,0,0,0|2,0,0]=4 5951 B15R0.149 CCCCCCCCC(=O)NCCCSC 11a_100000749238_100000210188 [1,0,1,0,0,0|2,0,0]=4 5952 B15R0.149 CCCCCCCCC(=O)NCCCSC 1626a_100000749238_100000210188 [1,0,1,0,0,0|2,0,0]=4 5953 B15R0.149 CCCCCCCCC(=O)NCCCSC 240690a_100000749238_100000210188 [1,0,1,0,0,0|2,0,0]=4 5954 B15R0.149 CCCCCCCCC(=O)NCCCSC 527a_100000749238_100000210188 [1,0,1,0,0,0|2,0,0]=4 5955 B15R0.149 CCCCCCCCC(=O)NCCOCC 11a_100011200944_100000210188 [1,0,1,0,0,0|2,0,0]=4 5956 B15R0.149 CCCCCCCCC(=O)NCCOCC 1626a_102516460346_100000210188 [1,0,1,0,0,0|2,0,0]=4 5957 B15R0.149 CCCCCCCCC(=O)NCCOCC 240690a_100011200944_100000210188 [1,0,1,0,0,0|2,0,0]=4 5958 B15R0.149 CCCCCCCCC(=O)NCCOCC 527a_100011200944_100000210188 [1,0,1,0,0,0|2,0,0]=4 5959 B15R0.149 CCCCCCCCC(=O)NCCSCC 11a_100000106463_100000210188 [1,0,1,0,0,0|2,0,0]=4 5960 B15R0.149 CCCCCCCCC(=O)NCCSCC 1626a_100000106463_100000210188 [1,0,1,0,0,0|2,0,0]=4 5961 B15R0.149 CCCCCCCCC(=O)NCCSCC 240690a_100000106463_100000210188 [1,0,1,0,0,0|2,0,0]=4 5962 B15R0.149 CCCCCCCCC(=O)NCCSCC 527a_100000106463_100000210188 [1,0,1,0,0,0|2,0,0]=4 5963 B15R0.149 CCCCCCCCC(=O)NNCCCC 22a_100025702795_100000210188 [1,0,1,0,0,0|2,0,0]=4 5964 B15R0.149 CCCCCCCCC(C)OCCCCC 34a_100000210740_100000718602 [1,0,1,0,0,0|1,0,1]=4 5965 B15R0.149 CCCCCCCCC(C)OCCCCC 7a_100000210740_100000210326 [1,0,1,0,0,0|1,0,1]=4 5966 B15R0.149 CCCCCCCCN(C)CCCCCC 2230a_100000207567_100000210314 [1,0,1,0,0,0|2,0,0]=4 5967 B15R0.149 CCCCCCCCN(C)CCCCCC 2230a_106256046315_100000210759 [1,0,1,0,0,0|2,0,0]=4 5968 B15R0.149 CCCCCCCCN(C)CCCCCC 269982a_100000207567_100000210757 [1,0,1,0,0,0|2,0,0]=4 5969 B15R0.149 CCCCCCCCN(C)CCCCCC 269982a_106256046315_100000210759 [1,0,1,0,0,0|2,0,0]=4 5970 B15R0.149 CCCCCCCNC(=O)CCCCCC 11a_100000229938_100102632555 [1,0,1,0,0,0|1,0,0]=3 5971 B15R0.149 CCCCCCCNC(=O)CCCCCC 1626a_100000229938_100102632555 [1,0,1,0,0,0|1,0,0]=3 5972 B15R0.149 CCCCCCCNC(=O)CCCCCC 240690a_100000229938_100102632555 [1,0,1,0,0,0|1,0,0]=3 5973 B15R0.149 CCCCCCCNC(=O)CCCCCC 527a_100000229938_100102632555 [1,0,1,0,0,0|1,0,0]=3 5974 B15R0.149 CCCCCCCNC(=O)CCCCCO 240690a_100000229938_100102619762 [1,0,1,0,0,0|2,0,0]=4 5975 B15R0.149 CCCCCCCNC(=O)COCCCC 11a_100000229938_100000757543 [1,0,1,0,0,0|2,0,0]=4 5976 B15R0.149 CCCCCCCNC(=O)COCCCC 1626a_100000229938_100000757543 [1,0,1,0,0,0|2,0,0]=4 5977 B15R0.149 CCCCCCCNC(=O)COCCCC 240690a_100000229938_100000757543 [1,0,1,0,0,0|2,0,0]=4 5978 B15R0.149 CCCCCCCNC(=O)COCCCC 527a_100000229938_100000757543 [1,0,1,0,0,0|2,0,0]=4 5979 B15R0.149 CCCCCCCNC(=O)CSCCCC 11a_100000229938_100000191162 [1,0,1,0,0,0|2,0,0]=4 5980 B15R0.149 CCCCCCCNC(=O)CSCCCC 1626a_100000229938_100000191162 [1,0,1,0,0,0|2,0,0]=4 5981 B15R0.149 CCCCCCCNC(=O)CSCCCC 240690a_100000229938_100000191162 [1,0,1,0,0,0|2,0,0]=4 5982 B15R0.149 CCCCCCCNC(=O)CSCCCC 527a_100000229938_100000191162 [1,0,1,0,0,0|2,0,0]=4 5983 B15R0.149 CCCCCCCNC(=O)NCCCCC 2708a_100000209983_100000229938 [1,0,1,0,0,0|2,0,0]=4 5984 B15R0.149 CCCCCCCNC(=O)NCCCCC 2708a_100000229938_100000209983 [1,0,1,0,0,0|2,0,0]=4 5985 B15R0.149 CCCCCCCNC(=O)NCCCCC 273464a_100000209983_100000229938 [1,0,1,0,0,0|2,0,0]=4 5986 B15R0.149 CCCCCCCNC(=O)NCCCCC 273464a_100000229938_100000209983 [1,0,1,0,0,0|2,0,0]=4 5987 B15R0.149 CCCCCCCNC(=O)NCCCCC 512a_100000209983_100000229938 [1,0,1,0,0,0|2,0,0]=4 5988 B15R0.149 CCCCCCCNC(=O)NCCCCC 512a_100000229938_100000209983 [1,0,1,0,0,0|2,0,0]=4 5989 B15R0.149 CCCCCCCOC(C)CCCCCC 34a_100000210265_100000210614 [1,0,1,0,0,0|1,0,1]=4 5990 B15R0.149 CCCCCCCOC(C)CCCCCC 34a_100000210272_100011215978 [1,0,1,0,0,0|1,0,1]=4 5991 B15R0.149 CCCCCCCOC(C)CCCCCC 7a_100000210265_100000210614 [1,0,1,0,0,0|1,0,1]=4 5992 B15R0.149 CCCCCCCOC(C)CCCCCC 7a_100000210272_100011215978 [1,0,1,0,0,0|1,0,1]=4 5993 B15R0.149 CCCCCCNCC(=O)NCCCCC 2230a_100000210581_100000230301 [1,0,1,0,0,0|2,0,0]=4 5994 B15R0.149 CCCCCCNCC(=O)OCCOCC 2230a_100000210581_200000101388 [1,0,1,0,0,0|2,0,0]=4 5995 B15R0.149 CCCCCCOCC(=O)NCCCCC 34a_100000210259_100000230301 [1,0,1,0,0,0|2,0,0]=4 5996 B15R0.149 CCCCCCOCC(=O)NCCCCC 7a_100000210259_100000230301 [1,0,1,0,0,0|2,0,0]=4 5997 B15R0.149 CCCCCCOCC(=O)OCCOCC 34a_100000210259_200000101388 [1,0,1,0,0,0|2,0,0]=4 5998 B15R0.149 CCCCCCOCC(=O)OCCOCC 7a_100000210259_200000101388 [1,0,1,0,0,0|2,0,0]=4 5999 B15R0.149 CCCCCCSCC(=O)NCCCCC 62a_100000210314_100000230301 [1,0,1,0,0,0|2,0,0]=4 6000 B15R0.149 CCCCCCSCC(=O)NCCCCC 62a_100000230301_100000210757 [1,0,1,0,0,0|2,0,0]=4 6001 B15R0.149 CCCCCCSCC(=O)OCCOCC 62a_100000210314_200000101388 [1,0,1,0,0,0|2,0,0]=4 6002 B15R0.149 CCCCCCSCC(=O)OCCOCC 62a_200000101388_100000210757 [1,0,1,0,0,0|2,0,0]=4 6003 B15R0.149 CCCCCNC(=O)CCCCCCCO 240690a_100000209983_100011219782 [1,0,1,0,0,0|2,0,0]=4 6004 B15R0.149 CCCCOCC(=O)CCCCCCCO 1458a_100000757543_100000760002 [1,0,1,0,0,0|2,0,0]=4 6005 B15R0.149 CCCCOCC(=O)CCCCCCCO 1458a_100011219782_100011995733 [1,0,1,0,0,0|2,0,0]=4 6006 B15R0.149 CCCCOCC(=O)CCCCCCOC 1458a_100000757543_100011998445 [1,0,1,0,0,0|2,0,0]=4 6007 B15R0.149 CCCCSCC(=O)CCCCCCCO 1458a_100000191162_100000760002 [1,0,1,0,0,0|2,0,0]=4 6008 B15R0.149 CCCCSCC(=O)CCCCCCOC 1458a_100000191162_100011998445 [1,0,1,0,0,0|2,0,0]=4 6009 B15R0.149 CCCOCCC(=O)CCCCCCCO 1458a_100011219782_100011215938 [1,0,1,0,0,0|2,0,0]=4 6010 B15R0.149 CCOCCCC(=O)CCCCCCCO 1458a_100011219782_100012232248 [1,0,1,0,0,0|2,0,0]=4 6011 B15R0.149 COCCCCC(=O)CCCCCCCO 1458a_100011219782_100000755781 [1,0,1,0,0,0|2,0,0]=4 6012 B15R0.149 COCCCCCCC(=O)CCCCCO 1458a_100102619762_100011998445 [1,0,1,0,0,0|2,0,0]=4 6013 B15R0.149 O=C(CCCCCF)CCCCCCCO 1458a_100011219782_100000729378 [1,0,1,0,0,0|2,0,0]=4 6014 B15R0.149 O=C(CCCCCO)CCCCCCCO 1458a_100011219782_100000746330 [1,0,1,0,0,0|2,0,0]=4 6015 B15R0.149 O=C(CCCCCO)CCCCCCCO 1458a_100102619762_100000760002 [1,0,1,0,0,0|2,0,0]=4 6016 B15R0.164 C=C(C)CCNCCCCCCCCCC 2230a_100000684558_100000730704 [1,0,1,0,0,0|2,0,0]=4 6017 B15R0.164 C=C(C)CCNCCCCCCCCCC 34a_100000684558_100000730704 [1,0,1,0,0,0|2,0,0]=4 6018 B15R0.164 C=C(C)CCOCCCCCCCCCC 34a_100000210711_100000730704 [1,0,1,0,0,0|2,0,0]=4 6019 B15R0.164 C=C(C)CCOCCCCCCCCCC 34a_100000764851_100000210320 [1,0,1,0,0,0|2,0,0]=4 6020 B15R0.164 C=C(C)CCOCCCCCCCCCC 7a_100000210711_100000730704 [1,0,1,0,0,0|2,0,0]=4 6021 B15R0.164 C=C(C)CCSCCCCCCCCCC 62a_100000730704_100000210320 [1,0,1,0,0,0|2,0,0]=4 6022 B15R0.164 C=C(C)CNCCCCCCCCCCC 2230a_200011215754_100000748629 [1,0,1,0,0,0|2,0,0]=4 6023 B15R0.164 C=C(C)CNCCCCCCCCCCC 34a_200011215754_100000748629 [1,0,1,0,0,0|2,0,0]=4 6024 B15R0.164 C=C(C)COCCCCCCCCCCC 34a_100000210245_100011215454 [1,0,1,0,0,0|2,0,0]=4 6025 B15R0.164 C=C(C)COCCCCCCCCCCC 34a_100000210809_100000748629 [1,0,1,0,0,0|2,0,0]=4 6026 B15R0.164 C=C(C)COCCCCCCCCCCC 7a_100000210809_100000748629 [1,0,1,0,0,0|2,0,0]=4 6027 B15R0.164 C=C(C)CSCCCCCCCCCCC 62a_100000748629_100011215454 [1,0,1,0,0,0|2,0,0]=4 6028 B15R0.164 C=CCCCCCCCCCCCC(=O)C 1458a_100000070787_102130925996 [1,0,1,0,0,0|0,0,2]=4 6029 B15R0.164 CC(=O)CCCCCCCCCCCCO 1458a_100000070787_100009813331 [1,0,1,0,0,0|1,0,0]=3 6030 B15R0.164 CC(=O)CCCCCCOCCCCCO 1458a_100000070787_200132310570 [1,0,1,0,0,0|2,0,0]=4 6031 B15R0.164 CC(=O)CCCCNCCCCCCCO 34a_100011996573_100009817362 [1,0,1,0,0,0|2,0,0]=4 6032 B15R0.164 CC(=O)CCCCOCCCCCCCBr 34a_100000760002_100009817362 [1,0,1,0,0,0|2,0,0]=4 6033 B15R0.164 CC(=O)CCCCOCCCCCCCBr 7a_100000760002_100000735457 [1,0,1,0,0,0|2,0,0]=4 6034 B15R0.164 CC(=O)CCCCOCCCCCCCN 34a_100011996573_100009817362 [1,0,1,0,0,0|2,0,0]=4 6035 B15R0.164 CC(=O)CCCCSCCCCCCCO 62a_100000735457_100000760002 [1,0,1,0,0,0|2,0,0]=4 6036 B15R0.164 CC(=O)CCCCSCCCCCCCO 62a_100000760002_100000735457 [1,0,1,0,0,0|2,0,0]=4 6037 B15R0.164 CC(=O)CCCNCCCCCCCCO 34a_102515433106_100000685027 [1,0,1,0,0,0|2,0,0]=4 6038 B15R0.164 CC(=O)CCCOCCCCCCCCBr 34a_100009813846_100000685027 [1,0,1,0,0,0|2,0,0]=4 6039 B15R0.164 CC(=O)CCCOCCCCCCCCBr 7a_100009813846_100011215641 [1,0,1,0,0,0|2,0,0]=4 6040 B15R0.164 CC(=O)CCCOCCCCCCCCCl 34a_100000033203_100000685027 [1,0,1,0,0,0|2,0,0]=4 6041 B15R0.164 CC(=O)CCCOCCCCCCCCCl 7a_100000033203_100011215641 [1,0,1,0,0,0|2,0,0]=4 6042 B15R0.164 CC(=O)CCCOCCCCCCCCN 34a_102515433106_100000685027 [1,0,1,0,0,0|2,0,0]=4 6043 B15R0.164 CC(=O)CCCOCCCCCCCCO 34a_100000759063_100000033203 [1,0,1,0,0,0|2,0,0]=4 6044 B15R0.164 CC(=O)CCCOCCCCCCCCO 7a_100000759063_100000033203 [1,0,1,0,0,0|2,0,0]=4 6045 B15R0.164 CC(=O)CCCSCCCCCCCCO 62a_100000033203_100011215641 [1,0,1,0,0,0|2,0,0]=4 6046 B15R0.164 CC(=O)CCCSCCCCCCCCO 62a_100011215641_100000033203 [1,0,1,0,0,0|2,0,0]=4 6047 B15R0.164 CC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000053229 [1,0,1,0,0,0|2,0,0]=4 6048 B15R0.164 CC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000053229 [1,0,1,0,0,0|2,0,0]=4 6049 B15R0.164 CC(=O)CCOCCCCCCCCCO 34a_100000759926_100009813782 [1,0,1,0,0,0|2,0,0]=4 6050 B15R0.164 CC(=O)CCOCCCCCCCCCO 7a_100000759926_100009813782 [1,0,1,0,0,0|2,0,0]=4 6051 B15R0.164 CC(=O)CCSCCCCCCCCCO 62a_100000053229_100009813782 [1,0,1,0,0,0|2,0,0]=4 6052 B15R0.164 CC(=O)CCSCCCCCCCCCO 62a_100009813782_100000053229 [1,0,1,0,0,0|2,0,0]=4 6053 B15R0.164 CC(=O)COCCCCCCCCCCO 34a_100000211253_100009813290 [1,0,1,0,0,0|2,0,0]=4 6054 B15R0.164 CC(=O)OCCCCCNCCCCCO 2230a_100000762737_100009813381 [1,0,1,0,0,0|2,0,0]=4 6055 B15R0.164 CC(=O)OCCCCCNCCCCCO 34a_100000762737_100000033007 [1,0,1,0,0,0|2,0,0]=4 6056 B15R0.164 CC(=O)OCCCCCOCCCCCBr 34a_100000746331_100000033007 [1,0,1,0,0,0|2,0,0]=4 6057 B15R0.164 CC(=O)OCCCCCOCCCCCBr 7a_100000746331_100000033007 [1,0,1,0,0,0|2,0,0]=4 6058 B15R0.164 CC(=O)OCCCCCOCCCCCCl 34a_100000746330_100000033007 [1,0,1,0,0,0|2,0,0]=4 6059 B15R0.164 CC(=O)OCCCCCOCCCCCCl 7a_100000746330_100000033007 [1,0,1,0,0,0|2,0,0]=4 6060 B15R0.164 CC(=O)OCCCCCOCCCCCI 34a_200012148887_100000033007 [1,0,1,0,0,0|2,0,0]=4 6061 B15R0.164 CC(=O)OCCCCCOCCCCCI 7a_200012148887_100000033007 [1,0,1,0,0,0|2,0,0]=4 6062 B15R0.164 CC(=O)OCCCCCOCCCCCN 34a_100000762737_100000033007 [1,0,1,0,0,0|2,0,0]=4 6063 B15R0.164 CC(=O)OCCCCCSCCCCCF 62a_100000033007_100000729378 [1,0,1,0,0,0|2,0,0]=4 6064 B15R0.164 CC(=O)OCCCCCSCCCCCF 62a_100000729378_100000033007 [1,0,1,0,0,0|2,0,0]=4 6065 B15R0.164 CC(=O)OCCCCCSCCCCCO 62a_100000033007_100000746330 [1,0,1,0,0,0|2,0,0]=4 6066 B15R0.164 CC(=O)OCCCCCSCCCCCO 62a_100000746330_100000033007 [1,0,1,0,0,0|2,0,0]=4 6067 B15R0.164 CC(=O)OCCCCNCCCCCCO 34a_100000686447_100000033659 [1,0,1,0,0,0|2,0,0]=4 6068 B15R0.164 CC(=O)OCCCCOCCCCCCBr 34a_100011215345_100000033659 [1,0,1,0,0,0|2,0,0]=4 6069 B15R0.164 CC(=O)OCCCCOCCCCCCBr 7a_100011215345_100000033659 [1,0,1,0,0,0|2,0,0]=4 6070 B15R0.164 CC(=O)OCCCCOCCCCCCCl 34a_100000766143_100000033659 [1,0,1,0,0,0|2,0,0]=4 6071 B15R0.164 CC(=O)OCCCCOCCCCCCCl 7a_100000766143_100000033659 [1,0,1,0,0,0|2,0,0]=4 6072 B15R0.164 CC(=O)OCCCCOCCCCCCF 34a_100000073216_100015922095 [1,0,1,0,0,0|2,0,0]=4 6073 B15R0.164 CC(=O)OCCCCOCCCCCCF 34a_100000732779_100000033659 [1,0,1,0,0,0|2,0,0]=4 6074 B15R0.164 CC(=O)OCCCCOCCCCCCF 7a_100000073216_100015922095 [1,0,1,0,0,0|2,0,0]=4 6075 B15R0.164 CC(=O)OCCCCOCCCCCCF 7a_100000732779_100000033659 [1,0,1,0,0,0|2,0,0]=4 6076 B15R0.164 CC(=O)OCCCCOCCCCCCN 34a_100000686447_100000033659 [1,0,1,0,0,0|2,0,0]=4 6077 B15R0.164 CC(=O)OCCCCOCCCCCCO 34a_100000073216_100000766143 [1,0,1,0,0,0|2,0,0]=4 6078 B15R0.164 CC(=O)OCCCCOCCCCCCO 7a_100000073216_100000766143 [1,0,1,0,0,0|2,0,0]=4 6079 B15R0.164 CC(=O)OCCCCSCCCCCCF 62a_100000033659_100015922095 [1,0,1,0,0,0|2,0,0]=4 6080 B15R0.164 CC(=O)OCCCCSCCCCCCF 62a_100015922095_100000033659 [1,0,1,0,0,0|2,0,0]=4 6081 B15R0.164 CC(=O)OCCCCSCCCCCCO 62a_100000033659_100000766143 [1,0,1,0,0,0|2,0,0]=4 6082 B15R0.164 CC(=O)OCCCCSCCCCCCO 62a_100000766143_100000033659 [1,0,1,0,0,0|2,0,0]=4 6083 B15R0.164 CC(=O)OCCCNCCCCCCCO 34a_100011996573_100000042594 [1,0,1,0,0,0|2,0,0]=4 6084 B15R0.164 CC(=O)OCCCOCCCCCCCBr 34a_100000760002_100000042594 [1,0,1,0,0,0|2,0,0]=4 6085 B15R0.164 CC(=O)OCCCOCCCCCCCBr 7a_100000760002_100000042594 [1,0,1,0,0,0|2,0,0]=4 6086 B15R0.164 CC(=O)OCCCOCCCCCCCN 34a_100011996573_100000042594 [1,0,1,0,0,0|2,0,0]=4 6087 B15R0.164 CC(=O)OCCCSCCCCCCCO 62a_100000042594_100000760002 [1,0,1,0,0,0|2,0,0]=4 6088 B15R0.164 CC(=O)OCCCSCCCCCCCO 62a_100000760002_100000042594 [1,0,1,0,0,0|2,0,0]=4 6089 B15R0.164 CC(=O)OCCNCCCCCCCCO 34a_102515433106_100009814007 [1,0,1,0,0,0|2,0,0]=4 6090 B15R0.164 CC(=O)OCCOCCCCCCCCBr 34a_100009813846_100009814007 [1,0,1,0,0,0|2,0,0]=4 6091 B15R0.164 CC(=O)OCCOCCCCCCCCBr 7a_100009813846_100009814007 [1,0,1,0,0,0|2,0,0]=4 6092 B15R0.164 CC(=O)OCCOCCCCCCCCCl 34a_100000033203_100009814007 [1,0,1,0,0,0|2,0,0]=4 6093 B15R0.164 CC(=O)OCCOCCCCCCCCCl 7a_100000033203_100009814007 [1,0,1,0,0,0|2,0,0]=4 6094 B15R0.164 CC(=O)OCCOCCCCCCCCN 34a_102515433106_100009814007 [1,0,1,0,0,0|2,0,0]=4 6095 B15R0.164 CC(=O)OCCSCCCCCCCCO 62a_100000033203_100009814007 [1,0,1,0,0,0|2,0,0]=4 6096 B15R0.164 CC(=O)OCCSCCCCCCCCO 62a_100009814007_100000033203 [1,0,1,0,0,0|2,0,0]=4 6097 B15R0.164 CC(=O)OCNCCCCCCCCCO 34a_100000078944_100009813279 [1,0,1,0,0,0|2,0,0]=4 6098 B15R0.164 CC(=O)OCOCCCCCCCCCBr 34a_100009813782_100009813279 [1,0,1,0,0,0|2,0,0]=4 6099 B15R0.164 CC(=O)OCOCCCCCCCCCCl 34a_100009868337_100009813279 [1,0,1,0,0,0|2,0,0]=4 6100 B15R0.164 CC(=O)OCOCCCCCCCCCN 34a_100000078944_100009813279 [1,0,1,0,0,0|2,0,0]=4 6101 B15R0.164 CC(=O)OCSCCCCCCCCCO 62a_100000076356_100009813782 [1,0,1,0,0,0|2,0,0]=4 6102 B15R0.164 CC(=O)OCSCCCCCCCCCO 62a_100009813782_100000076356 [1,0,1,0,0,0|2,0,0]=4 6103 B15R0.164 CCCCCCCCCCCCCC(=O)C 1458a_100000070787_100000210684 [1,0,1,0,0,0|0,0,0]=2 6104 B15R0.164 CCCCCCCCCCCCCC(=O)C 1458a_100000756256_200000210301 [1,0,1,0,0,0|0,0,0]=2 6105 B15R0.164 CCCCCCCCCCCCCC(=O)[13CH3] 1458a_100000756256_200025704644 [1,0,1,0,0,0|0,0,0]=2 6106 B15R0.164 CCCCCCCCCCCCCN(C)C 2230a_100102631434_100000210684 [1,0,1,0,0,0|2,0,0]=4 6107 B15R0.164 CCCCCCCCCCCCCN(C)C 269982a_100102631434_100000210684 [1,0,1,0,0,0|2,0,0]=4 6108 B15R0.164 CCCCCCCCCCCCCN(C)C 270004a_100102631434_200011215488 [1,0,1,0,0,0|2,0,0]=4 6109 B15R0.164 CCCCCCCCCCCCNC(=O)C 11a_100000210451_100015343762 [1,0,1,0,0,0|1,0,0]=3 6110 B15R0.164 CCCCCCCCCCCCNC(=O)C 1626a_100000210451_100015343762 [1,0,1,0,0,0|1,0,0]=3 6111 B15R0.164 CCCCCCCCCCCCNC(=O)C 240690a_100000210451_100015343762 [1,0,1,0,0,0|1,0,0]=3 6112 B15R0.164 CCCCCCCCCCCCNC(=O)C 527a_100000210451_100103153847 [1,0,1,0,0,0|1,0,0]=3 6113 B15R0.164 CCCCCCCCCCCCOC(C)C 34a_100000210810_100000210206 [1,0,1,0,0,0|1,0,1]=4 6114 B15R0.164 CCCCCCCCCCCCOC(C)C 34a_100000212225_100000759014 [1,0,1,0,0,0|1,0,1]=4 6115 B15R0.164 CCCCCCCCCCCCOC(C)C 7a_100000210810_100000210206 [1,0,1,0,0,0|1,0,1]=4 6116 B15R0.164 CCCCCCCCCCCNCC(=O)N 2230a_100000711301_100011215454 [1,0,1,0,0,0|2,0,0]=4 6117 B15R0.164 CCCCCCCCCCCNCC(=O)N 2230a_200011215754_100000747473 [1,0,1,0,0,0|2,0,0]=4 6118 B15R0.164 CCCCCCCCCCCNCC(=O)N 34a_200011215754_100000187820 [1,0,1,0,0,0|2,0,0]=4 6119 B15R0.164 CCCCCCCCCCCNCC(=O)O 269956a_100016091260_100011215454 [1,0,1,0,0,0|1,0,0]=3 6120 B15R0.164 CCCCCCCCCCCNCC(=O)[O-] 34a_200011215754_100020667443 [1,0,1,0,0,0|1,0,1]=4 6121 B15R0.164 CCCCCCCCCCCOCC(=O)C 34a_100000211253_100011215454 [1,0,1,0,0,0|1,0,0]=3 6122 B15R0.164 CCCCCCCCCCCOCC(=O)N 34a_100000210809_100000187820 [1,0,1,0,0,0|2,0,0]=4 6123 B15R0.164 CCCCCCCCCCCOCC(=O)N 7a_100000210809_100000187820 [1,0,1,0,0,0|2,0,0]=4 6124 B15R0.164 CCCCCCCCCCCOCC(=O)[O-] 34a_100000210809_100020667443 [1,0,1,0,0,0|1,0,1]=4 6125 B15R0.164 CCCCCCCCCCCSCC(=O)N 62a_100000747473_100011215454 [1,0,1,0,0,0|2,0,0]=4 6126 B15R0.164 CCCCCCCCCCCSCC(=O)[O-] 62a_100020667443_100011215454 [1,0,1,0,0,0|1,0,1]=4 6127 B15R0.164 CCCCCCCCCCNCCC(=O)N 2230a_100000684558_100000744528 [1,0,1,0,0,0|2,0,0]=4 6128 B15R0.164 CCCCCCCCCCNCCC(=O)N 34a_100000684558_100000731001 [1,0,1,0,0,0|2,0,0]=4 6129 B15R0.164 CCCCCCCCCCNCOC(=O)C 34a_100000684558_100009813279 [1,0,1,0,0,0|1,0,0]=3 6130 B15R0.164 CCCCCCCCCCNOCC(=O)O 269956a_100000106656_100000210320 [1,0,1,0,0,0|2,0,0]=4 6131 B15R0.164 CCCCCCCCCCOCCC(=O)C 34a_100000759926_100000210320 [1,0,1,0,0,0|1,0,0]=3 6132 B15R0.164 CCCCCCCCCCOCCC(=O)C 7a_100000210711_100000053229 [1,0,1,0,0,0|1,0,0]=3 6133 B15R0.164 CCCCCCCCCCOCCC(=O)C 7a_100000759926_100000210320 [1,0,1,0,0,0|1,0,0]=3 6134 B15R0.164 CCCCCCCCCCOCCC(=O)N 34a_100000210711_100000731001 [1,0,1,0,0,0|2,0,0]=4 6135 B15R0.164 CCCCCCCCCCOCCC(=O)N 34a_100000757172_100000210320 [1,0,1,0,0,0|2,0,0]=4 6136 B15R0.164 CCCCCCCCCCOCCC(=O)N 7a_100000210711_100000744528 [1,0,1,0,0,0|2,0,0]=4 6137 B15R0.164 CCCCCCCCCCOCCC(=O)N 7a_100000757172_100000210320 [1,0,1,0,0,0|2,0,0]=4 6138 B15R0.164 CCCCCCCCCCOCOC(=O)C 34a_100000210711_100009813279 [1,0,1,0,0,0|1,0,0]=3 6139 B15R0.164 CCCCCCCCCCSCCC(=O)C 62a_100000053229_100000210320 [1,0,1,0,0,0|1,0,0]=3 6140 B15R0.164 CCCCCCCCCCSCCC(=O)N 62a_100000744528_100000210320 [1,0,1,0,0,0|2,0,0]=4 6141 B15R0.164 CCCCCCCCCCSCOC(=O)C 62a_100000076356_100000210320 [1,0,1,0,0,0|1,0,0]=3 6142 B15R0.164 CCCCCCCCCNCCCC(=O)C 34a_100000212291_100000685027 [1,0,1,0,0,0|1,0,0]=3 6143 B15R0.164 CCCCCCCCCNCCCC(=O)N 34a_100000212291_100102525003 [1,0,1,0,0,0|2,0,0]=4 6144 B15R0.164 CCCCCCCCCNCCCC(=O)N 34a_100000739312_100011214924 [1,0,1,0,0,0|2,0,0]=4 6145 B15R0.164 CCCCCCCCCNCCCS(=O)C 2230a_200000753449_100011214924 [1,0,1,0,0,0|2,0,0]=4 6146 B15R0.164 CCCCCCCCCNCCNC(=O)C 2230a_100000209853_100011214924 [1,0,1,0,0,0|2,0,0]=4 6147 B15R0.164 CCCCCCCCCNCCNC(=O)C 2230a_100000212291_100000189650 [1,0,1,0,0,0|2,0,0]=4 6148 B15R0.164 CCCCCCCCCNCCOC(=O)C 34a_100000212291_100009814007 [1,0,1,0,0,0|1,0,0]=3 6149 B15R0.164 CCCCCCCCCNCCOC(=O)N 34a_100000212291_200011214921 [1,0,1,0,0,0|2,0,0]=4 6150 B15R0.164 CCCCCCCCCOCCCC(=O)C 34a_100000210712_100000685027 [1,0,1,0,0,0|1,0,0]=3 6151 B15R0.164 CCCCCCCCCOCCCC(=O)C 34a_100000759063_100011214924 [1,0,1,0,0,0|1,0,0]=3 6152 B15R0.164 CCCCCCCCCOCCCC(=O)C 7a_100000210712_100011215641 [1,0,1,0,0,0|1,0,0]=3 6153 B15R0.164 CCCCCCCCCOCCCC(=O)C 7a_100000759063_100000210328 [1,0,1,0,0,0|1,0,0]=3 6154 B15R0.164 CCCCCCCCCOCCCC(=O)N 34a_100000210712_100102525003 [1,0,1,0,0,0|2,0,0]=4 6155 B15R0.164 CCCCCCCCCOCCCC(=O)N 7a_100000210712_100102525003 [1,0,1,0,0,0|2,0,0]=4 6156 B15R0.164 CCCCCCCCCOCCNC(=O)C 34a_100000158858_100011214924 [1,0,1,0,0,0|2,0,0]=4 6157 B15R0.164 CCCCCCCCCOCCNC(=O)C 7a_100000210712_100000189650 [1,0,1,0,0,0|2,0,0]=4 6158 B15R0.164 CCCCCCCCCOCCOC(=O)C 34a_100000210712_100009814007 [1,0,1,0,0,0|1,0,0]=3 6159 B15R0.164 CCCCCCCCCOCCOC(=O)C 7a_100000210712_100009814007 [1,0,1,0,0,0|1,0,0]=3 6160 B15R0.164 CCCCCCCCCOCCOC(=O)N 34a_100000210712_200011214921 [1,0,1,0,0,0|2,0,0]=4 6161 B15R0.164 CCCCCCCCCOCCOC(=O)N 7a_100000210712_200011214921 [1,0,1,0,0,0|2,0,0]=4 6162 B15R0.164 CCCCCCCCCOCCOC(=O)N 7a_100000766696_100000210328 [1,0,1,0,0,0|2,0,0]=4 6163 B15R0.164 CCCCCCCCCSCCCC(=O)C 62a_100011215641_100000210670 [1,0,1,0,0,0|1,0,0]=3 6164 B15R0.164 CCCCCCCCCSCCCC(=O)N 62a_100102525003_100000210670 [1,0,1,0,0,0|2,0,0]=4 6165 B15R0.164 CCCCCCCCCSCCNC(=O)C 62a_100000189650_100000210670 [1,0,1,0,0,0|2,0,0]=4 6166 B15R0.164 CCCCCCCCCSCCOC(=O)C 62a_100009814007_100000210670 [1,0,1,0,0,0|1,0,0]=3 6167 B15R0.164 CCCCCCCCCSCCOC(=O)N 62a_200011214921_100000210670 [1,0,1,0,0,0|2,0,0]=4 6168 B15R0.164 CCCCCCCCNCCCCC(=O)C 34a_100000229939_100009817362 [1,0,1,0,0,0|1,0,0]=3 6169 B15R0.164 CCCCCCCCNCCCCC(=O)N 34a_100000696515_100000210759 [1,0,1,0,0,0|2,0,0]=4 6170 B15R0.164 CCCCCCCCNCCCNC(=O)C 34a_100000736810_100000210759 [1,0,1,0,0,0|2,0,0]=4 6171 B15R0.164 CCCCCCCCNCCCOC(=O)C 34a_100000229939_100000042594 [1,0,1,0,0,0|1,0,0]=3 6172 B15R0.164 CCCCCCCCNCCCOC(=S)C 2230a_100000229939_200135323944 [1,0,1,0,0,0|1,1,0]=4 6173 B15R0.164 CCCCCCCCNCCCOC(=S)C 34a_100000229939_200135323944 [1,0,1,0,0,0|1,1,0]=4 6174 B15R0.164 CCCCCCCCNCCCSC(=O)C 2230a_100000229939_100000038929 [1,0,1,0,0,0|1,1,0]=4 6175 B15R0.164 CCCCCCCCNCCCSC(=O)C 34a_100000229939_100000038929 [1,0,1,0,0,0|1,1,0]=4 6176 B15R0.164 CCCCCCCCNCCOCC(=O)O 269956a_100000700818_100000210759 [1,0,1,0,0,0|2,0,0]=4 6177 B15R0.164 CCCCCCCCOCCCCC(=O)C 34a_100000210232_100009817362 [1,0,1,0,0,0|1,0,0]=3 6178 B15R0.164 CCCCCCCCOCCCCC(=O)C 7a_100000210232_100000735457 [1,0,1,0,0,0|1,0,0]=3 6179 B15R0.164 CCCCCCCCOCCCCC(=O)N 34a_100012022536_100000210759 [1,0,1,0,0,0|2,0,0]=4 6180 B15R0.164 CCCCCCCCOCCCCC(=O)N 7a_100012022536_100000210759 [1,0,1,0,0,0|2,0,0]=4 6181 B15R0.164 CCCCCCCCOCCCNC(=O)C 34a_100000752032_100000210759 [1,0,1,0,0,0|2,0,0]=4 6182 B15R0.164 CCCCCCCCOCCCOC(=O)C 34a_100000210232_100000042594 [1,0,1,0,0,0|1,0,0]=3 6183 B15R0.164 CCCCCCCCOCCCOC(=O)C 7a_100000210232_100000042594 [1,0,1,0,0,0|1,0,0]=3 6184 B15R0.164 CCCCCCCCOCCCOC(=S)C 34a_100000210232_200135323944 [1,0,1,0,0,0|1,1,0]=4 6185 B15R0.164 CCCCCCCCOCCCOC(=S)C 7a_100000210232_200135323944 [1,0,1,0,0,0|1,1,0]=4 6186 B15R0.164 CCCCCCCCOCCCSC(=O)C 34a_100000210232_100000038929 [1,0,1,0,0,0|1,1,0]=4 6187 B15R0.164 CCCCCCCCOCCCSC(=O)C 7a_100000210232_100000038929 [1,0,1,0,0,0|1,1,0]=4 6188 B15R0.164 CCCCCCCCSCCCCC(=O)C 62a_100000210759_100000735457 [1,0,1,0,0,0|1,0,0]=3 6189 B15R0.164 CCCCCCCCSCCCCC(=O)C 62a_100000735457_100000210317 [1,0,1,0,0,0|1,0,0]=3 6190 B15R0.164 CCCCCCCCSCCCOC(=O)C 62a_100000042594_100000210317 [1,0,1,0,0,0|1,0,0]=3 6191 B15R0.164 CCCCCCCCSCCCOC(=O)C 62a_100000210759_100000042594 [1,0,1,0,0,0|1,0,0]=3 6192 B15R0.164 CCCCCCCCSCCCOC(=S)C 62a_100000210759_200135323944 [1,0,1,0,0,0|1,1,0]=4 6193 B15R0.164 CCCCCCCCSCCCOC(=S)C 62a_200135323944_100000210317 [1,0,1,0,0,0|1,1,0]=4 6194 B15R0.164 CCCCCCCCSCCCSC(=O)C 62a_100000038929_100000210317 [1,0,1,0,0,0|1,1,0]=4 6195 B15R0.164 CCCCCCCCSCCCSC(=O)C 62a_100000210759_100000038929 [1,0,1,0,0,0|1,1,0]=4 6196 B15R0.164 CCCCCCCNCCCCCC(=O)N 2230a_100000229938_100009817443 [1,0,1,0,0,0|2,0,0]=4 6197 B15R0.164 CCCCCCCNCCCCNC(=O)C 2230a_200011368371_100000210681 [1,0,1,0,0,0|2,0,0]=4 6198 B15R0.164 CCCCCCCNCCCCNC(=O)C 34a_200011368371_100000210614 [1,0,1,0,0,0|2,0,0]=4 6199 B15R0.164 CCCCCCCNCCCCSC(=O)C 2230a_100000229938_200010402107 [1,0,1,0,0,0|1,1,0]=4 6200 B15R0.164 CCCCCCCOCCCCCC(=O)N 34a_100000123541_100000210614 [1,0,1,0,0,0|2,0,0]=4 6201 B15R0.164 CCCCCCCOCCCCCC(=O)N 34a_100000210272_100009817443 [1,0,1,0,0,0|2,0,0]=4 6202 B15R0.164 CCCCCCCOCCCCCC(=O)N 7a_100000123541_100000210614 [1,0,1,0,0,0|2,0,0]=4 6203 B15R0.164 CCCCCCCOCCCCCC(=O)N 7a_100000210272_100009817443 [1,0,1,0,0,0|2,0,0]=4 6204 B15R0.164 CCCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210614 [1,0,1,0,0,0|1,0,1]=4 6205 B15R0.164 CCCCCCCOCCCCOC(=O)C 34a_100000073216_100000210614 [1,0,1,0,0,0|1,0,0]=3 6206 B15R0.164 CCCCCCCOCCCCOC(=O)C 34a_100000210272_100000033659 [1,0,1,0,0,0|1,0,0]=3 6207 B15R0.164 CCCCCCCOCCCCOC(=O)C 7a_100000073216_100000210614 [1,0,1,0,0,0|1,0,0]=3 6208 B15R0.164 CCCCCCCOCCCCOC(=O)C 7a_100000210272_100000033659 [1,0,1,0,0,0|1,0,0]=3 6209 B15R0.164 CCCCCCCOCCCCSC(=O)C 34a_100000210272_200010402107 [1,0,1,0,0,0|1,1,0]=4 6210 B15R0.164 CCCCCCCOCCCCSC(=O)C 7a_100000210272_200010402107 [1,0,1,0,0,0|1,1,0]=4 6211 B15R0.164 CCCCCCCOCOCCOC(=O)C 34a_100000210272_100000076355 [1,0,1,0,0,0|2,0,0]=4 6212 B15R0.164 CCCCCCCSCCCCCC(=O)N 62a_100000210614_100009817443 [1,0,1,0,0,0|2,0,0]=4 6213 B15R0.164 CCCCCCCSCCCCCC(=O)N 62a_100009817443_100000210316 [1,0,1,0,0,0|2,0,0]=4 6214 B15R0.164 CCCCCCCSCCCCOC(=O)C 62a_100000033659_100000210316 [1,0,1,0,0,0|1,0,0]=3 6215 B15R0.164 CCCCCCCSCCCCOC(=O)C 62a_100000210614_100000033659 [1,0,1,0,0,0|1,0,0]=3 6216 B15R0.164 CCCCCCCSCCCCSC(=O)C 62a_100000210614_200010402107 [1,0,1,0,0,0|1,1,0]=4 6217 B15R0.164 CCCCCCCSCCCCSC(=O)C 62a_200010402107_100000210316 [1,0,1,0,0,0|1,1,0]=4 6218 B15R0.164 CCCCCCCSCOCCOC(=O)C 62a_100000076355_100000210316 [1,0,1,0,0,0|2,0,0]=4 6219 B15R0.164 CCCCCCCSCOCCOC(=O)C 62a_100000210614_100000076355 [1,0,1,0,0,0|2,0,0]=4 6220 B15R0.164 CCCCCCNCCCCCNC(=O)C 2230a_200012022750_100000210314 [1,0,1,0,0,0|2,0,0]=4 6221 B15R0.164 CCCCCCNCCCCCNC(=O)C 34a_200012022750_100000210314 [1,0,1,0,0,0|2,0,0]=4 6222 B15R0.164 CCCCCCNCCCCCOC(=O)C 2230a_100000210581_100009813381 [1,0,1,0,0,0|1,0,0]=3 6223 B15R0.164 CCCCCCNCCOCCOC(=O)C 2230a_100000210581_200000083610 [1,0,1,0,0,0|2,0,0]=4 6224 B15R0.164 CCCCCCOCCCCCOC(=O)C 34a_100000210259_100000033007 [1,0,1,0,0,0|1,0,0]=3 6225 B15R0.164 CCCCCCOCCCCCOC(=O)C 7a_100000210259_100000033007 [1,0,1,0,0,0|1,0,0]=3 6226 B15R0.164 CCCCCCOCCOCCCC(=O)C 34a_100000691444_100000685027 [1,0,1,0,0,0|2,0,0]=4 6227 B15R0.164 CCCCCCOCCOCCCC(=O)C 7a_100000691444_100011215641 [1,0,1,0,0,0|2,0,0]=4 6228 B15R0.164 CCCCCCOCCOCCOC(=O)C 34a_100000210259_200000083610 [1,0,1,0,0,0|2,0,0]=4 6229 B15R0.164 CCCCCCOCCOCCOC(=O)C 34a_100000691444_100009814007 [1,0,1,0,0,0|2,0,0]=4 6230 B15R0.164 CCCCCCOCCOCCOC(=O)C 7a_100000210259_200000083610 [1,0,1,0,0,0|2,0,0]=4 6231 B15R0.164 CCCCCCOCCOCCOC(=O)C 7a_100000691444_100009814007 [1,0,1,0,0,0|2,0,0]=4 6232 B15R0.164 CCCCCCSCCCCCOC(=O)C 62a_100000033007_100000210757 [1,0,1,0,0,0|1,0,0]=3 6233 B15R0.164 CCCCCCSCCCCCOC(=O)C 62a_100000210314_100000033007 [1,0,1,0,0,0|1,0,0]=3 6234 B15R0.164 CCCCCCSCCOCCOC(=O)C 62a_100000210314_200000083610 [1,0,1,0,0,0|2,0,0]=4 6235 B15R0.164 CCCCCCSCCOCCOC(=O)C 62a_200000083610_100000210757 [1,0,1,0,0,0|2,0,0]=4 6236 B15R0.164 CCCCCNCCCCCCNC(=O)C 2230a_200011996284_100000210326 [1,0,1,0,0,0|2,0,0]=4 6237 B15R0.164 CCCCCNCCCCCCNC(=O)C 34a_200011996284_100000718602 [1,0,1,0,0,0|2,0,0]=4 6238 B15R0.164 CCCCCNCCOCCCCC(=O)C 34a_100000224656_100009817362 [1,0,1,0,0,0|2,0,0]=4 6239 B15R0.164 CCCCCNCCOCCCOC(=O)C 34a_100000224656_100000042594 [1,0,1,0,0,0|2,0,0]=4 6240 B15R0.164 CCCCCOCCOCCCCC(=O)C 34a_100011215259_100009817362 [1,0,1,0,0,0|2,0,0]=4 6241 B15R0.164 CCCCCOCCOCCCCC(=O)C 7a_100011215259_100000735457 [1,0,1,0,0,0|2,0,0]=4 6242 B15R0.164 CCCCCOCCOCCCOC(=O)C 34a_100011215259_100000042594 [1,0,1,0,0,0|2,0,0]=4 6243 B15R0.164 CCCCCOCCOCCCOC(=O)C 7a_100011215259_100000042594 [1,0,1,0,0,0|2,0,0]=4 6244 B15R0.164 CCCCNCCCCOCCCC(=O)C 34a_200011216965_100000685027 [1,0,1,0,0,0|2,0,0]=4 6245 B15R0.164 CCCCNCCCCOCCOC(=O)C 34a_200011216965_100009814007 [1,0,1,0,0,0|2,0,0]=4 6246 B15R0.164 CCCCOCCCCOCCCC(=O)C 34a_200000760531_100000685027 [1,0,1,0,0,0|2,0,0]=4 6247 B15R0.164 CCCCOCCCCOCCCC(=O)C 7a_200000760531_100011215641 [1,0,1,0,0,0|2,0,0]=4 6248 B15R0.164 CCCCOCCCCOCCOC(=O)C 34a_200000760531_100009814007 [1,0,1,0,0,0|2,0,0]=4 6249 B15R0.164 CCCCOCCCCOCCOC(=O)C 7a_200000760531_100009814007 [1,0,1,0,0,0|2,0,0]=4 6250 B15R0.164 CCCCOCCCNCCCCC(=O)C 34a_200000211371_100009817362 [1,0,1,0,0,0|2,0,0]=4 6251 B15R0.164 CCCCOCCCNCCCOC(=O)C 34a_200000211371_100000042594 [1,0,1,0,0,0|2,0,0]=4 6252 B15R0.164 CCCCOCCCOCCCCC(=O)C 34a_200011215613_100009817362 [1,0,1,0,0,0|2,0,0]=4 6253 B15R0.164 CCCCOCCCOCCCCC(=O)C 7a_200011215613_100000735457 [1,0,1,0,0,0|2,0,0]=4 6254 B15R0.164 CCCCOCCCOCCCOC(=O)C 34a_200011215613_100000042594 [1,0,1,0,0,0|2,0,0]=4 6255 B15R0.164 CCCCOCCCOCCCOC(=O)C 7a_200011215613_100000042594 [1,0,1,0,0,0|2,0,0]=4 6256 B15R0.164 CCCCOCCOCCCCOC(=O)C 34a_100000073216_100000743108 [1,0,1,0,0,0|2,0,0]=4 6257 B15R0.164 CCCCOCCOCCCCOC(=O)C 34a_100000210238_100000033659 [1,0,1,0,0,0|2,0,0]=4 6258 B15R0.164 CCCCOCCOCCCCOC(=O)C 7a_100000073216_100000743108 [1,0,1,0,0,0|2,0,0]=4 6259 B15R0.164 CCCCOCCOCCCCOC(=O)C 7a_100000210238_100000033659 [1,0,1,0,0,0|2,0,0]=4 6260 B15R0.164 CCCCOCCSCCCCOC(=O)C 62a_100000033659_100000743108 [1,0,1,0,0,0|2,0,0]=4 6261 B15R0.164 CCCCOCCSCCCCOC(=O)C 62a_100000743108_100000033659 [1,0,1,0,0,0|2,0,0]=4 6262 B15R0.164 CCCCOCSCCCCCOC(=O)C 62a_100000033007_100011995733 [1,0,1,0,0,0|2,0,0]=4 6263 B15R0.164 CCCCOCSCCCCCOC(=O)C 62a_100011995733_100000033007 [1,0,1,0,0,0|2,0,0]=4 6264 B15R0.164 CCCCSCCOCCCCOC(=O)C 34a_200000230436_100000033659 [1,0,1,0,0,0|2,0,0]=4 6265 B15R0.164 CCCCSCCOCCCCOC(=O)C 7a_200000230436_100000033659 [1,0,1,0,0,0|2,0,0]=4 6266 B15R0.164 CCCOCCCNCCCCOC(=O)C 34a_100011217757_100000033659 [1,0,1,0,0,0|2,0,0]=4 6267 B15R0.164 CCCOCCNCCCCCOC(=O)C 2230a_100161115042_100009813381 [1,0,1,0,0,0|2,0,0]=4 6268 B15R0.164 CCCOCCNCCCCCOC(=O)C 34a_100161115042_100000033007 [1,0,1,0,0,0|2,0,0]=4 6269 B15R0.164 CCCOCCOCCCCCOC(=O)C 34a_100000752267_100000033007 [1,0,1,0,0,0|2,0,0]=4 6270 B15R0.164 CCCOCCOCCCCCOC(=O)C 7a_100000752267_100000033007 [1,0,1,0,0,0|2,0,0]=4 6271 B15R0.164 CCCOCCSCCCCCOC(=O)C 62a_100000033007_100011215938 [1,0,1,0,0,0|2,0,0]=4 6272 B15R0.164 CCCOCCSCCCCCOC(=O)C 62a_100011215938_100000033007 [1,0,1,0,0,0|2,0,0]=4 6273 B15R0.164 CCCSCCNCCCCCOC(=O)C 2230a_100020603323_100009813381 [1,0,1,0,0,0|2,0,0]=4 6274 B15R0.164 CCCSCCOCCCCCOC(=O)C 34a_200000230433_100000033007 [1,0,1,0,0,0|2,0,0]=4 6275 B15R0.164 CCCSCCOCCCCCOC(=O)C 7a_200000230433_100000033007 [1,0,1,0,0,0|2,0,0]=4 6276 B15R0.164 CCNCCCCCCCCCCC(=O)N 2230a_100015525214_200010167045 [1,0,1,0,0,0|2,0,0]=4 6277 B15R0.164 CCOCCCCCCCCCCC(=O)N 34a_100121572206_200010167045 [1,0,1,0,0,0|2,0,0]=4 6278 B15R0.164 CCOCCCNCCCCCOC(=O)C 2230a_100000210961_100009813381 [1,0,1,0,0,0|2,0,0]=4 6279 B15R0.164 CCOCCCNCCCCCOC(=O)C 34a_100000210961_100000033007 [1,0,1,0,0,0|2,0,0]=4 6280 B15R0.164 CCOCCCOCCCCCOC(=O)C 34a_100000757476_100000033007 [1,0,1,0,0,0|2,0,0]=4 6281 B15R0.164 CCOCCCOCCCCCOC(=O)C 7a_100000757476_100000033007 [1,0,1,0,0,0|2,0,0]=4 6282 B15R0.164 CCOCCCSCCCCCOC(=O)C 62a_100000033007_100012232248 [1,0,1,0,0,0|2,0,0]=4 6283 B15R0.164 CCOCCCSCCCCCOC(=O)C 62a_100012232248_100000033007 [1,0,1,0,0,0|2,0,0]=4 6284 B15R0.164 CCSCCCCCCCCCCC(=O)N 62a_100000210202_200010167045 [1,0,1,0,0,0|2,0,0]=4 6285 B15R0.164 CCSCCCCCCCCCCC(=O)N 62a_200010167045_100000210202 [1,0,1,0,0,0|2,0,0]=4 6286 B15R0.164 CCSCCCOCCCCCOC(=O)C 34a_100011216438_100000033007 [1,0,1,0,0,0|2,0,0]=4 6287 B15R0.164 CCSCCCOCCCCCOC(=O)C 7a_100011216438_100000033007 [1,0,1,0,0,0|2,0,0]=4 6288 B15R0.164 CNCCCCCOCCCCOC(=O)C 34a_100000722520_100000033659 [1,0,1,0,0,0|2,0,0]=4 6289 B15R0.164 COCCCCCCOCCCCC(=O)C 34a_200012092642_100009817362 [1,0,1,0,0,0|2,0,0]=4 6290 B15R0.164 COCCCCCCOCCCCC(=O)C 7a_200012092642_100000735457 [1,0,1,0,0,0|2,0,0]=4 6291 B15R0.164 COCCCCCCOCCCOC(=O)C 34a_200012092642_100000042594 [1,0,1,0,0,0|2,0,0]=4 6292 B15R0.164 COCCCCCCOCCCOC(=O)C 7a_200012092642_100000042594 [1,0,1,0,0,0|2,0,0]=4 6293 B15R0.164 COCCCCCCSCCCCC(=O)C 62a_100000735457_100011998445 [1,0,1,0,0,0|2,0,0]=4 6294 B15R0.164 COCCCCCCSCCCCC(=O)C 62a_100011998445_100000735457 [1,0,1,0,0,0|2,0,0]=4 6295 B15R0.164 COCCCCCCSCCCOC(=O)C 62a_100000042594_100011998445 [1,0,1,0,0,0|2,0,0]=4 6296 B15R0.164 COCCCCCCSCCCOC(=O)C 62a_100011998445_100000042594 [1,0,1,0,0,0|2,0,0]=4 6297 B15R0.164 COCCCCCNCCCCOC(=O)C 34a_100000747528_100000033659 [1,0,1,0,0,0|2,0,0]=4 6298 B15R0.164 COCCCCOCCCCCOC(=O)C 34a_100000740925_100000033007 [1,0,1,0,0,0|2,0,0]=4 6299 B15R0.164 COCCCCSCCCCCOC(=O)C 62a_100000033007_100000730899 [1,0,1,0,0,0|2,0,0]=4 6300 B15R0.164 COCCCCSCCCCCOC(=O)C 62a_100000730899_100000033007 [1,0,1,0,0,0|2,0,0]=4 6301 B15R0.164 CSCCCCOCCCCCOC(=O)C 34a_100011217163_100000033007 [1,0,1,0,0,0|2,0,0]=4 6302 B15R0.164 CSCCCCOCCCCCOC(=O)C 7a_100011217163_100000033007 [1,0,1,0,0,0|2,0,0]=4 6303 B15R0.164 O=C(O)CNCCCCCCCCCCO 269956a_100016091260_100009813290 [1,0,1,0,0,0|2,0,0]=4 6304 B17R0.88 CCCCCCCC(=O)CCCCC(=O)OCC 1458a_100000211969_100000750268 [0,1,1,0,0,0|0,0,1]=3 6305 B17R0.88 CCCCCCCC(=O)CCCCC(=O)OCC 1458a_100011217402_100000210614 [0,1,1,0,0,0|0,0,1]=3 6306 B17R0.88 CCCCCCCC(=O)CCOCC(=O)OCC 1458a_100000211969_100000088970 [0,1,1,0,0,0|1,0,1]=4 6307 B17R0.88 CCCCCCCC(=O)NCCCC(=O)OCC 188690a_100000211256_100000211969 [0,1,1,0,0,0|1,0,1]=4 6308 B17R0.88 CCCCCCCC(C)OCCCC(=O)OCC 34a_200011215852_100009991533 [0,1,1,0,0,0|1,0,0]=3 6309 B17R0.88 CCCCCCCC(C)OCCCC(=O)OCC 7a_100012001163_200011218727 [0,1,1,0,0,0|1,0,0]=3 6310 B17R0.88 CCCCCCCC(C)OCCCC(=O)OCC 7a_200011215852_100011215271 [0,1,1,0,0,0|1,0,0]=3 6311 B17R0.88 CCCCCCCC(C)OCCNC(=O)OCC 34a_100000158857_200011218727 [0,1,1,0,0,0|2,0,0]=4 6312 B17R0.88 CCCCCCCC(C)OCCNC(=O)OCC 7a_200011215852_200011445536 [0,1,1,0,0,0|2,0,0]=4 6313 B17R0.88 CCCCCCCC(C)SCCCC(=O)OCC 62a_100009991533_200011218727 [0,1,1,0,0,0|1,0,0]=3 6314 B17R0.88 CCCCCCCC(C)SCCCC(=O)OCC 62a_200011218727_100009991533 [0,1,1,0,0,0|1,0,0]=3 6315 B17R0.88 CCCCCCCC(C)SCCNC(=O)OCC 62a_200011218727_200011445536 [0,1,1,0,0,0|2,0,0]=4 6316 B17R0.88 CCCCCCCN(C)CCCCC(=O)OCC 2230a_100000228206_100000750268 [0,1,1,0,0,0|1,0,0]=3 6317 B17R0.88 CCCCCCCN(C)CCCCC(=O)OCC 269982a_100000228206_100000750268 [0,1,1,0,0,0|1,0,0]=3 6318 B17R0.88 CCCCCCCN(C)CCOCC(=O)OCC 2230a_100000228206_100000088970 [0,1,1,0,0,0|2,0,0]=4 6319 B17R0.88 CCCCCCCN(C)CCOCC(=O)OCC 269982a_100000228206_100000088970 [0,1,1,0,0,0|2,0,0]=4 6320 B17R0.88 CCCCCCNC(=O)CCCCC(=O)OCC 11a_100000210581_100011217402 [0,1,1,0,0,0|1,0,1]=4 6321 B17R0.88 CCCCCCNC(=O)CCCCC(=O)OCC 1626a_100000210581_100011217402 [0,1,1,0,0,0|1,0,1]=4 6322 B17R0.88 CCCCCCNC(=O)CCCCC(=O)OCC 240690a_100000210581_100011217402 [0,1,1,0,0,0|1,0,1]=4 6323 B17R0.88 CCCCCCNC(=O)CCCCC(=O)OCC 527a_100000210581_100011217402 [0,1,1,0,0,0|1,0,1]=4 6324 B17R0.88 CCCCOCCC(=O)CCCCC(=O)OCC 1458a_100011217402_100000743108 [0,1,1,0,0,0|1,0,1]=4 6325 B17R0.88 CCOC(=O)CCCCC(=O)CCCCCCF 1458a_100011217402_100015922095 [0,1,1,0,0,0|1,0,1]=4 6326 B17R0.88 CCOC(=O)CCCCC(=O)CCCCCCO 1458a_100011217402_100000766143 [0,1,1,0,0,0|1,0,1]=4 6327 B17R0.88 CCOC(=O)CCCCC(=O)CCCCCCO 1458a_100011996774_100000750268 [0,1,1,0,0,0|1,0,1]=4 6328 B17R0.88 CCOC(=O)CCCCC(=O)CCCCCOC 1458a_100011935119_100000750268 [0,1,1,0,0,0|1,0,1]=4 6329 B17R0.90 CCCCC(=O)CCCCCCCC(=O)OCC 1458a_100000210183_100009991516 [0,1,1,0,0,0|0,0,1]=3 6330 B17R0.90 CCCCC(=O)NCCCCCCC(=O)OCC 188690a_100000741137_100000210183 [0,1,1,0,0,0|1,0,1]=4 6331 B17R0.90 CCCCC(C)CCCCOCCC(=O)NCC 7a_200011021034_100000737597 [0,1,1,0,0,0|2,0,0]=4 6332 B17R0.90 CCCCC(C)CCCCOCCC(=O)OCC 34a_200011021034_100000765890 [0,1,1,0,0,0|1,0,0]=3 6333 B17R0.90 CCCCC(C)CCCCOCCC(=O)OCC 7a_200011021034_100011206558 [0,1,1,0,0,0|1,0,0]=3 6334 B17R0.90 CCCCC(C)CCCCOCOC(=O)CCC 34a_200011021034_100000034017 [0,1,1,0,0,0|1,0,0]=3 6335 B17R0.90 CCCCC(C)COCCCCCC(=O)OCC 34a_100011995851_100000755133 [0,1,1,0,0,0|1,0,0]=3 6336 B17R0.90 CCCCC(C)COCCCCCC(=O)OCC 7a_100011995851_100000755133 [0,1,1,0,0,0|1,0,0]=3 6337 B17R0.90 CCCCC(C)COCCCOCC(=O)OCC 34a_100011995851_100009893628 [0,1,1,0,0,0|2,0,0]=4 6338 B17R0.90 CCCCC(C)COCCCOCC(=O)OCC 7a_100011995851_100009893628 [0,1,1,0,0,0|2,0,0]=4 6339 B17R0.90 CCCCC(C)NCCCCCCC(=O)OCC 2230a_100000126638_100009814379 [0,1,1,0,0,0|1,0,0]=3 6340 B17R0.90 CCCCC(C)OCCCCCCC(=O)OCC 34a_100000687866_100009814379 [0,1,1,0,0,0|1,0,0]=3 6341 B17R0.90 CCCCC(C)OCCCCCCC(=O)OCC 7a_100000687866_100009814379 [0,1,1,0,0,0|1,0,0]=3 6342 B17R0.90 CCCCC(C)SCCCCCCC(=O)OCC 62a_200011215066_100009814379 [0,1,1,0,0,0|1,0,0]=3 6343 B17R0.90 CCCCN(C)CCCCCCCC(=O)OCC 2230a_100000207549_100009991516 [0,1,1,0,0,0|1,0,0]=3 6344 B17R0.90 CCCCN(C)CCCCCCCC(=O)OCC 269982a_100000207549_100009991516 [0,1,1,0,0,0|1,0,0]=3 6345 B17R0.90 CCCC[C@H](N)COCCCCCC(=O)OCC 34a_100011934283_100000755133 [0,1,1,0,0,0|1,0,0]=3 6346 B17R0.90 CCCC[C@H](N)COCCCOCC(=O)OCC 34a_100011934283_100009893628 [0,1,1,0,0,0|2,0,0]=4 6347 B17R0.90 CCCOC(C)CNCCCCCC(=O)OCC 2230a_100015185124_100000755133 [0,1,1,0,0,0|2,0,0]=4 6348 B17R0.90 CCCOC(C)CNCCCCCC(=O)OCC 34a_100015185124_100000755133 [0,1,1,0,0,0|2,0,0]=4 6349 B17R0.90 CCOC(=O)CCCCCCCC(=O)CCOC 1458a_100000749529_100009991516 [0,1,1,0,0,0|1,0,1]=4 6350 B17R0.90 CCOC(=O)CCCCCCCC(=O)CCSC 1458a_100000174002_100009991516 [0,1,1,0,0,0|1,0,1]=4 6351 B17R0.90 CCOC(=O)CCCCCCCC(=O)CSCC 1458a_100000230394_100009991516 [0,1,1,0,0,0|1,0,1]=4 6352 B17R0.90 CCOC(=O)CCCCCCCN(C)CCCO 2230a_100000213112_100009991516 [0,1,1,0,0,0|2,0,0]=4 6353 B17R0.90 CCOC(=O)CCCCCCCN(C)CCCO 269982a_100000213112_100009991516 [0,1,1,0,0,0|2,0,0]=4 6354 B17R0.90 CCOC(=O)CCCCCCCN(C)CCOC 2230a_100000743101_100009991516 [0,1,1,0,0,0|2,0,0]=4 6355 B17R0.90 CCOC(=O)CCCCCCCN(C)CCOC 269982a_100000743101_100009991516 [0,1,1,0,0,0|2,0,0]=4 6356 B17R0.90 CCOC(=O)CCCCCCCN(C)CCSC 2230a_100000686725_100009991516 [0,1,1,0,0,0|2,0,0]=4 6357 B17R0.90 CCOC(=O)CCCCCCCN(C)CCSC 269982a_100000686725_100009991516 [0,1,1,0,0,0|2,0,0]=4 6358 B17R0.90 CCOC(=O)CCCCCCOC(C)CCCCl 34a_200000718107_100009814379 [0,1,1,0,0,0|2,0,0]=4 6359 B17R0.90 CCOC(=O)CCCCCCOC(C)CCCCl 7a_200000718107_100009814379 [0,1,1,0,0,0|2,0,0]=4 6360 B17R0.90 CCOC(=O)CCCCCNC[C@H](C)CCCO 2230a_100160569302_100000755133 [0,1,1,0,0,0|2,0,0]=4 6361 B17R0.90 CCOC(=O)CCCCCNC[C@H](C)CCCO 34a_100160569302_100000755133 [0,1,1,0,0,0|2,0,0]=4 6362 B17R0.90 CCOC(=O)CCCCCOC[C@@H](N)CCSC 34a_100011827619_100000755133 [0,1,1,0,0,0|2,0,0]=4 6363 B17R0.90 CCOCC(=O)CCCCCCCC(=O)OCC 1458a_100000211967_100009991516 [0,1,1,0,0,0|1,0,1]=4 6364 B17R0.90 CCOCC(C)OCCCCCCC(=O)OCC 34a_100000718985_100009814379 [0,1,1,0,0,0|2,0,0]=4 6365 B17R0.90 CCOCC(C)OCCCCCCC(=O)OCC 7a_100000718985_100009814379 [0,1,1,0,0,0|2,0,0]=4 6366 B17R0.90 CCOCC(O)CNCCCCCC(=O)OCC 2230a_102515437182_100000755133 [0,1,1,0,0,0|2,0,0]=4 6367 B17R0.90 CCOCC(O)CNCCCCCC(=O)OCC 34a_102515437182_100000755133 [0,1,1,0,0,0|2,0,0]=4 6368 B17R0.116 C=C(C)CC(=O)CCCCCCCCCCCC 1458a_100011215791_100000748629 [0,1,1,0,0,0|1,0,1]=4 6369 B17R0.116 CC(C)CC(=O)CCCCCCCCCCCO 1458a_100000210554_100009812471 [0,1,1,0,0,0|2,0,0]=4 6370 B17R0.116 CC(C)CC(=O)NCCCCCCCCCCO 240690a_100000066964_100000210554 [0,1,1,0,0,0|2,0,0]=4 6371 B17R0.116 CC(C)NC(=O)CCCCCCCCCCCO 240690a_100138425928_100000037981 [0,1,1,0,0,0|2,0,0]=4 6372 B17R0.116 CC(C)OC(=O)CCCCCNCCCCCO 2230a_100000762737_200010986244 [0,1,1,0,0,0|2,0,0]=4 6373 B17R0.116 CC(C)OC(=O)CCCCCNCCCCCO 34a_100000762737_200010986244 [0,1,1,0,0,0|2,0,0]=4 6374 B17R0.116 CC(C)OC(=O)CCCCCOCCCCCBr 34a_100000746331_200010986244 [0,1,1,0,0,0|2,0,0]=4 6375 B17R0.116 CC(C)OC(=O)CCCCCOCCCCCBr 7a_100000746331_200010986244 [0,1,1,0,0,0|2,0,0]=4 6376 B17R0.116 CC(C)OC(=O)CCCCCOCCCCCCl 34a_100000746330_200010986244 [0,1,1,0,0,0|2,0,0]=4 6377 B17R0.116 CC(C)OC(=O)CCCCCOCCCCCCl 7a_100000746330_200010986244 [0,1,1,0,0,0|2,0,0]=4 6378 B17R0.116 CC(C)OC(=O)CCCCCOCCCCCI 34a_200012148887_200010986244 [0,1,1,0,0,0|2,0,0]=4 6379 B17R0.116 CC(C)OC(=O)CCCCCOCCCCCI 7a_200012148887_200010986244 [0,1,1,0,0,0|2,0,0]=4 6380 B17R0.116 CC(C)OC(=O)CCCCCOCCCCCN 34a_100000762737_200010986244 [0,1,1,0,0,0|2,0,0]=4 6381 B17R0.116 CC(C)OC(=O)CCCCCSCCCCCF 62a_100000729378_200010986244 [0,1,1,0,0,0|2,0,0]=4 6382 B17R0.116 CC(C)OC(=O)CCCCCSCCCCCF 62a_200010986244_100000729378 [0,1,1,0,0,0|2,0,0]=4 6383 B17R0.116 CC(C)OC(=O)CCCCCSCCCCCO 62a_100000746330_200010986244 [0,1,1,0,0,0|2,0,0]=4 6384 B17R0.116 CC(C)OC(=O)CCCCCSCCCCCO 62a_200010986244_100000746330 [0,1,1,0,0,0|2,0,0]=4 6385 B17R0.116 CC(C)OC(=O)CCNCCCCCCCCO 2230a_102515433106_100000760027 [0,1,1,0,0,0|2,0,0]=4 6386 B17R0.116 CC(C)OC(=O)CCOCCCCCCCCBr 7a_100009813846_100000760027 [0,1,1,0,0,0|2,0,0]=4 6387 B17R0.116 CC(C)OC(=O)CCOCCCCCCCCCl 7a_100000033203_100000760027 [0,1,1,0,0,0|2,0,0]=4 6388 B17R0.116 CC(C)OC(=O)CCSCCCCCCCCO 62a_100000033203_100000760027 [0,1,1,0,0,0|2,0,0]=4 6389 B17R0.116 CC(C)OC(=O)CCSCCCCCCCCO 62a_100000760027_100000033203 [0,1,1,0,0,0|2,0,0]=4 6390 B17R0.116 CC(C)OC(=O)CNCCCCCCCCCO 2230a_100000078944_100011215430 [0,1,1,0,0,0|2,0,0]=4 6391 B17R0.116 CC(C)OC(=O)CNCCCCCCCCCO 34a_100000078944_100011215430 [0,1,1,0,0,0|2,0,0]=4 6392 B17R0.116 CC(C)OC(=O)COCCCCCCCCCBr 34a_100009813782_100011215430 [0,1,1,0,0,0|2,0,0]=4 6393 B17R0.116 CC(C)OC(=O)COCCCCCCCCCBr 7a_100009813782_100011215430 [0,1,1,0,0,0|2,0,0]=4 6394 B17R0.116 CC(C)OC(=O)COCCCCCCCCCCl 34a_100009868337_100011215430 [0,1,1,0,0,0|2,0,0]=4 6395 B17R0.116 CC(C)OC(=O)COCCCCCCCCCCl 7a_100009868337_100011215430 [0,1,1,0,0,0|2,0,0]=4 6396 B17R0.116 CC(C)OC(=O)COCCCCCCCCCN 34a_100000078944_100011215430 [0,1,1,0,0,0|2,0,0]=4 6397 B17R0.116 CC(C)OC(=O)CSCCCCCCCCCO 62a_100009813782_100011215430 [0,1,1,0,0,0|2,0,0]=4 6398 B17R0.116 CC(C)OC(=O)CSCCCCCCCCCO 62a_100011215430_100009813782 [0,1,1,0,0,0|2,0,0]=4 6399 B17R0.116 CCCCCCCCCCCCC(=O)C=C(C)C 1458a_100000211388_100000759014 [0,1,1,0,0,0|1,0,1]=4 6400 B17R0.116 CCCCCCCCCCCCC(=O)CC(C)C 1458a_100000210554_100000759014 [0,1,1,0,0,0|1,0,0]=3 6401 B17R0.116 CCCCCCCCCCCCC(=O)CC(C)C 1458a_100011215791_100000210624 [0,1,1,0,0,0|1,0,0]=3 6402 B17R0.116 CCCCCCCCCCCCC(=O)CC(C)O 1458a_100011215791_100011218427 [0,1,1,0,0,0|1,0,0]=3 6403 B17R0.116 CCCCCCCCCCCCC(=O)CC(F)F 1458a_100011215791_100011934356 [0,1,1,0,0,0|2,0,0]=4 6404 B17R0.116 CCCCCCCCCCCCC(=O)CN(C)C 1458a_100000750896_100000759014 [0,1,1,0,0,0|2,0,0]=4 6405 B17R0.116 CCCCCCCCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100000759014 [0,1,1,0,0,0|1,0,0]=3 6406 B17R0.116 CCCCCCCCCCCCC(=O)C[S+](C)C 1458a_200159257847_100000759014 [0,1,1,0,0,0|2,0,0]=4 6407 B17R0.116 CCCCCCCCCCCCC(=O)NC(C)C 11a_100138425928_100011215791 [0,1,1,0,0,0|1,0,0]=3 6408 B17R0.116 CCCCCCCCCCCCC(=O)NC(C)C 1626a_100138425928_100011215791 [0,1,1,0,0,0|1,0,0]=3 6409 B17R0.116 CCCCCCCCCCCCC(=O)NC(C)C 240690a_100138425928_100011215791 [0,1,1,0,0,0|1,0,0]=3 6410 B17R0.116 CCCCCCCCCCCNC(=O)CC(C)C 11a_200011215754_100000210554 [0,1,1,0,0,0|1,0,0]=3 6411 B17R0.116 CCCCCCCCCCCNC(=O)CC(C)C 1626a_200011215754_100000210554 [0,1,1,0,0,0|1,0,0]=3 6412 B17R0.116 CCCCCCCCCCCNC(=O)CC(C)C 240690a_200011215754_100000210554 [0,1,1,0,0,0|1,0,0]=3 6413 B17R0.116 CCCCCCCCCCCNC(=O)CC(C)C 527a_200011215754_100000210554 [0,1,1,0,0,0|1,0,0]=3 6414 B17R0.116 CCCCCCCCCCCNC(=O)CN(C)C 11a_200011215754_100000750896 [0,1,1,0,0,0|2,0,0]=4 6415 B17R0.116 CCCCCCCCCCCNC(=O)CN(C)C 240690a_200011215754_100000750896 [0,1,1,0,0,0|2,0,0]=4 6416 B17R0.116 CCCCCCCCCCCNC(=O)CN(C)C 527a_200011215754_100000750896 [0,1,1,0,0,0|2,0,0]=4 6417 B17R0.116 CCCCCCCCCCCNC(=O)C[C@@H](C)O 240690a_200011215754_100011933948 [0,1,1,0,0,0|1,0,0]=3 6418 B17R0.116 CCCCCCCCCCCNC(=O)C[S+](C)C 11a_200011215754_200159257847 [0,1,1,0,0,0|2,0,0]=4 6419 B17R0.116 CCCCCCCCCCCNC(=O)C[S+](C)C 1626a_200011215754_200159257847 [0,1,1,0,0,0|2,0,0]=4 6420 B17R0.116 CCCCCCCCCCCNC(=O)C[S+](C)C 240690a_200011215754_200159257847 [0,1,1,0,0,0|2,0,0]=4 6421 B17R0.116 CCCCCCCCCCCNC(=O)C[S+](C)C 527a_200011215754_200159257847 [0,1,1,0,0,0|2,0,0]=4 6422 B17R0.116 CCCCCCCCCCCNC(=O)NC(C)C 2708a_100138425928_200011215754 [0,1,1,0,0,0|2,0,0]=4 6423 B17R0.116 CCCCCCCCCCCNC(=O)NC(C)C 2708a_200011215754_100138425928 [0,1,1,0,0,0|2,0,0]=4 6424 B17R0.116 CCCCCCCCCCCNC(=O)NC(C)C 273464a_100138425928_200011215754 [0,1,1,0,0,0|2,0,0]=4 6425 B17R0.116 CCCCCCCCCCCNC(=O)NC(C)C 512a_100138425928_200011215754 [0,1,1,0,0,0|2,0,0]=4 6426 B17R0.116 CCCCCCCCCCCNC(=O)NC(C)C 512a_200011215754_100138425928 [0,1,1,0,0,0|2,0,0]=4 6427 B17R0.116 CCCCCCCCCCCOC(C)CC(C)C 34a_100000210809_100000731052 [0,1,1,0,0,0|1,0,1]=4 6428 B17R0.116 CCCCCCCCCCCOC(C)CC(C)C 34a_100000211805_100011215454 [0,1,1,0,0,0|1,0,1]=4 6429 B17R0.116 CCCCCCCCCCCOC(C)CC(C)C 7a_100000210809_100000731052 [0,1,1,0,0,0|1,0,1]=4 6430 B17R0.116 CCCCCCCCCCCOC(C)CC(C)C 7a_100000211805_100011215454 [0,1,1,0,0,0|1,0,1]=4 6431 B17R0.116 CCCCCCCCCCNCC(=O)NC(C)C 2230a_100000168517_100000210320 [0,1,1,0,0,0|2,0,0]=4 6432 B17R0.116 CCCCCCCCCCNCC(=O)NC(C)C 2230a_100000684558_100000183996 [0,1,1,0,0,0|2,0,0]=4 6433 B17R0.116 CCCCCCCCCCNCC(=O)NC(C)C 34a_100000684558_100000183996 [0,1,1,0,0,0|2,0,0]=4 6434 B17R0.116 CCCCCCCCCCNCC(=O)OC(C)C 2230a_100000684558_100011215430 [0,1,1,0,0,0|1,0,0]=3 6435 B17R0.116 CCCCCCCCCCNCC(=O)OC(C)C 34a_100000684558_100011215430 [0,1,1,0,0,0|1,0,0]=3 6436 B17R0.116 CCCCCCCCCCOCC(=O)NC(C)C 34a_100000210711_100000183996 [0,1,1,0,0,0|2,0,0]=4 6437 B17R0.116 CCCCCCCCCCOCC(=O)NC(C)C 7a_100000210711_100000183996 [0,1,1,0,0,0|2,0,0]=4 6438 B17R0.116 CCCCCCCCCCOCC(=O)OC(C)C 34a_100000210711_100011215430 [0,1,1,0,0,0|1,0,0]=3 6439 B17R0.116 CCCCCCCCCCOCC(=O)OC(C)C 7a_100000210711_100011215430 [0,1,1,0,0,0|1,0,0]=3 6440 B17R0.116 CCCCCCCCCCSCC(=O)NC(C)C 62a_100000183996_100000210320 [0,1,1,0,0,0|2,0,0]=4 6441 B17R0.116 CCCCCCCCCCSCC(=O)OC(C)C 62a_100011215430_100000210320 [0,1,1,0,0,0|1,0,0]=3 6442 B17R0.116 CCCCCCCCCNCCC(=O)NC(C)C 2230a_100000212291_100000737564 [0,1,1,0,0,0|2,0,0]=4 6443 B17R0.116 CCCCCCCCCNCCC(=O)OC(C)C 2230a_100000212291_100000760027 [0,1,1,0,0,0|1,0,0]=3 6444 B17R0.116 CCCCCCCCCOCCC(=O)NC(C)C 7a_100000210712_100000737564 [0,1,1,0,0,0|2,0,0]=4 6445 B17R0.116 CCCCCCCCCOCCC(=O)OC(C)C 7a_100000210712_100000760027 [0,1,1,0,0,0|1,0,0]=3 6446 B17R0.116 CCCCCCCCCSCCC(=O)NC(C)C 62a_100000737564_100000210670 [0,1,1,0,0,0|2,0,0]=4 6447 B17R0.116 CCCCCCCCCSCCC(=O)OC(C)C 62a_100000760027_100000210670 [0,1,1,0,0,0|1,0,0]=3 6448 B17R0.116 CCCCCCCCCSCOC(=O)OC(C)C 62a_100000003507_100000210670 [0,1,1,0,0,0|2,0,0]=4 6449 B17R0.116 CCCCCCCCNCCOC(=O)CC(=O)C 34a_100000229939_100000102702 [0,1,1,0,0,0|1,0,1]=4 6450 B17R0.116 CCCCCCCCOCCOC(=O)CC(=O)C 34a_100000210232_100000102702 [0,1,1,0,0,0|1,0,1]=4 6451 B17R0.116 CCCCCCCCSCCOC(=O)CC(=O)C 62a_100000102702_100000210317 [0,1,1,0,0,0|1,0,1]=4 6452 B17R0.116 CCCCCCCCSCCOC(=O)CC(=O)C 62a_100000210759_100000102702 [0,1,1,0,0,0|1,0,1]=4 6453 B17R0.116 CCCCCCNCCCCCC(=O)OC(C)C 2230a_100000210581_200010986244 [0,1,1,0,0,0|1,0,0]=3 6454 B17R0.116 CCCCCCOCCCCCC(=O)OC(C)C 34a_100000210259_200010986244 [0,1,1,0,0,0|1,0,0]=3 6455 B17R0.116 CCCCCCOCCCCCC(=O)OC(C)C 7a_100000210259_200010986244 [0,1,1,0,0,0|1,0,0]=3 6456 B17R0.116 CCCCCCOCCOCCC(=O)OC(C)C 7a_100000691444_100000760027 [0,1,1,0,0,0|2,0,0]=4 6457 B17R0.116 CCCCCCSCCCCCC(=O)OC(C)C 62a_100000210314_200010986244 [0,1,1,0,0,0|1,0,0]=3 6458 B17R0.116 CCCCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000210757 [0,1,1,0,0,0|1,0,0]=3 6459 B17R0.116 CCCCOCCCCOCCC(=O)OC(C)C 7a_200000760531_100000760027 [0,1,1,0,0,0|2,0,0]=4 6460 B17R0.116 CCCCOCSCCCCCC(=O)OC(C)C 62a_100011995733_200010986244 [0,1,1,0,0,0|2,0,0]=4 6461 B17R0.116 CCCCOCSCCCCCC(=O)OC(C)C 62a_200010986244_100011995733 [0,1,1,0,0,0|2,0,0]=4 6462 B17R0.116 CCCOCCNCCCCCC(=O)OC(C)C 2230a_100161115042_200010986244 [0,1,1,0,0,0|2,0,0]=4 6463 B17R0.116 CCCOCCNCCCCCC(=O)OC(C)C 34a_100161115042_200010986244 [0,1,1,0,0,0|2,0,0]=4 6464 B17R0.116 CCCOCCOCCCCCC(=O)OC(C)C 34a_100000752267_200010986244 [0,1,1,0,0,0|2,0,0]=4 6465 B17R0.116 CCCOCCOCCCCCC(=O)OC(C)C 7a_100000752267_200010986244 [0,1,1,0,0,0|2,0,0]=4 6466 B17R0.116 CCCOCCSCCCCCC(=O)OC(C)C 62a_100011215938_200010986244 [0,1,1,0,0,0|2,0,0]=4 6467 B17R0.116 CCCOCCSCCCCCC(=O)OC(C)C 62a_200010986244_100011215938 [0,1,1,0,0,0|2,0,0]=4 6468 B17R0.116 CCCSCCNCCCCCC(=O)OC(C)C 2230a_100020603323_200010986244 [0,1,1,0,0,0|2,0,0]=4 6469 B17R0.116 CCCSCCOCCCCCC(=O)OC(C)C 34a_200000230433_200010986244 [0,1,1,0,0,0|2,0,0]=4 6470 B17R0.116 CCCSCCOCCCCCC(=O)OC(C)C 7a_200000230433_200010986244 [0,1,1,0,0,0|2,0,0]=4 6471 B17R0.116 CCOCCCNCCCCCC(=O)OC(C)C 2230a_100000210961_200010986244 [0,1,1,0,0,0|2,0,0]=4 6472 B17R0.116 CCOCCCNCCCCCC(=O)OC(C)C 34a_100000210961_200010986244 [0,1,1,0,0,0|2,0,0]=4 6473 B17R0.116 CCOCCCOCCCCCC(=O)OC(C)C 34a_100000757476_200010986244 [0,1,1,0,0,0|2,0,0]=4 6474 B17R0.116 CCOCCCOCCCCCC(=O)OC(C)C 7a_100000757476_200010986244 [0,1,1,0,0,0|2,0,0]=4 6475 B17R0.116 CCOCCCSCCCCCC(=O)OC(C)C 62a_100012232248_200010986244 [0,1,1,0,0,0|2,0,0]=4 6476 B17R0.116 CCOCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100012232248 [0,1,1,0,0,0|2,0,0]=4 6477 B17R0.116 CCSCCCOCCCCCC(=O)OC(C)C 34a_100011216438_200010986244 [0,1,1,0,0,0|2,0,0]=4 6478 B17R0.116 CCSCCCOCCCCCC(=O)OC(C)C 7a_100011216438_200010986244 [0,1,1,0,0,0|2,0,0]=4 6479 B17R0.116 COCCCCOCCCCCC(=O)OC(C)C 34a_100000740925_200010986244 [0,1,1,0,0,0|2,0,0]=4 6480 B17R0.116 COCCCCSCCCCCC(=O)OC(C)C 62a_100000730899_200010986244 [0,1,1,0,0,0|2,0,0]=4 6481 B17R0.116 COCCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000730899 [0,1,1,0,0,0|2,0,0]=4 6482 B17R0.116 CSCCCCOCCCCCC(=O)OC(C)C 34a_100011217163_200010986244 [0,1,1,0,0,0|2,0,0]=4 6483 B17R0.116 CSCCCCOCCCCCC(=O)OC(C)C 7a_100011217163_200010986244 [0,1,1,0,0,0|2,0,0]=4 6484 B17R0.116 C[C@@H](O)CC(=O)CCCCCCCCCCCO 1458a_100011933948_100009812471 [0,1,1,0,0,0|2,0,0]=4 6485 B17R0.116 C[C@@H](O)CC(=O)NCCCCCCCCCCO 240690a_100000066964_100011933948 [0,1,1,0,0,0|2,0,0]=4 6486 B17R0.196 C#CCCC(=O)CCCCCCCCCCCC 1458a_100000692101_100000759014 [0,1,1,0,0,0|1,0,1]=4 6487 B17R0.196 C#CCCC(=O)CCCCCCCCCCCC 1458a_100011215791_100000753159 [0,1,1,0,0,0|1,0,1]=4 6488 B17R0.196 C#CCCC(=O)NCCCCCCCCCCC 11a_200011215754_100000692101 [0,1,1,0,0,0|1,0,1]=4 6489 B17R0.196 C#CCCC(=O)NCCCCCCCCCCC 1626a_200011215754_100000692101 [0,1,1,0,0,0|1,0,1]=4 6490 B17R0.196 C#CCCC(=O)NCCCCCCCCCCC 240690a_200011215754_100000692101 [0,1,1,0,0,0|1,0,1]=4 6491 B17R0.196 C#CCCC(=O)NCCCCCCCCCCC 527a_200011215754_100000692101 [0,1,1,0,0,0|1,0,1]=4 6492 B17R0.196 C#CCNC(=O)CCCCCCCCCCCC 11a_100000212058_100011215791 [0,1,1,0,0,0|1,0,1]=4 6493 B17R0.196 C#CCNC(=O)CCCCCCCCCCCC 1626a_100000212058_100011215791 [0,1,1,0,0,0|1,0,1]=4 6494 B17R0.196 C#CCNC(=O)CCCCCCCCCCCC 240690a_100000212058_100011215791 [0,1,1,0,0,0|1,0,1]=4 6495 B17R0.196 C/C=C/CC(=O)CCCCCCCCCCCC 1458a_100011215791_100102629194 [0,1,1,0,0,0|1,0,1]=4 6496 B17R0.196 C=C(CNCCCCCCCCCC)OCOC 34a_100000684558_100000042856 [0,1,1,0,0,0|2,0,0]=4 6497 B17R0.196 C=C(COCCCCCCCCCC)OCOC 34a_100000210711_100000042856 [0,1,1,0,0,0|2,0,0]=4 6498 B17R0.196 C=C(CSCCCCCCCCCC)OCOC 62a_100000042856_100000210320 [0,1,1,0,0,0|2,0,0]=4 6499 B17R0.196 C=CCCC(=O)CCCCCCCCCCCC 1458a_100000749702_100000759014 [0,1,1,0,0,0|1,0,1]=4 6500 B17R0.196 C=CCCC(=O)CCCCCCCCCCCC 1458a_100011215791_100000754431 [0,1,1,0,0,0|1,0,1]=4 6501 B17R0.196 C=CCCC(=O)NCCCCCCCCCCC 11a_200011215754_100000749702 [0,1,1,0,0,0|1,0,1]=4 6502 B17R0.196 C=CCCC(=O)NCCCCCCCCCCC 1626a_200011215754_100000749702 [0,1,1,0,0,0|1,0,1]=4 6503 B17R0.196 C=CCCC(=O)NCCCCCCCCCCC 240690a_200011215754_100000749702 [0,1,1,0,0,0|1,0,1]=4 6504 B17R0.196 C=CCCC(=O)NCCCCCCCCCCC 527a_200011215754_100000749702 [0,1,1,0,0,0|1,0,1]=4 6505 B17R0.196 C=CCCCCCCCCCCC(=O)COCC 1458a_100000211967_100011093070 [0,1,1,0,0,0|0,0,2]=4 6506 B17R0.196 C=CCNC(=O)CCCCCCCCCCCC 1626a_100020586998_100011215791 [0,1,1,0,0,0|1,0,1]=4 6507 B17R0.196 C=CCNC(=O)CCCCCCCCCCCC 240690a_100020586998_100011215791 [0,1,1,0,0,0|1,0,1]=4 6508 B17R0.196 C=CCOC(=O)CNCCCCCCCCCC 2230a_100000684558_100000033060 [0,1,1,0,0,0|1,0,1]=4 6509 B17R0.196 C=CCOC(=O)CNCCCCCCCCCC 34a_100000684558_100000033060 [0,1,1,0,0,0|1,0,1]=4 6510 B17R0.196 C=CCOC(=O)COCCCCCCCCCC 34a_100000210711_100000033060 [0,1,1,0,0,0|1,0,1]=4 6511 B17R0.196 C=CCOC(=O)COCCCCCCCCCC 7a_100000210711_100000033060 [0,1,1,0,0,0|1,0,1]=4 6512 B17R0.196 C=CCOC(=O)CSCCCCCCCCCC 62a_100000033060_100000210320 [0,1,1,0,0,0|1,0,1]=4 6513 B17R0.196 CC#CCC(=O)CCCCCCCCCCCC 1458a_100011215791_100000748600 [0,1,1,0,0,0|1,0,1]=4 6514 B17R0.196 CC=CCC(=O)CCCCCCCCCCCC 1458a_100011215791_100000070051 [0,1,1,0,0,0|1,0,1]=4 6515 B17R0.196 CC=CCC(=O)CCCCCCCCCCCC 1458a_100121576822_100000759014 [0,1,1,0,0,0|1,0,1]=4 6516 B17R0.196 CC=CCC(=O)NCCCCCCCCCCC 11a_200011215754_100121576822 [0,1,1,0,0,0|1,0,1]=4 6517 B17R0.196 CC=CCC(=O)NCCCCCCCCCCC 1626a_200011215754_100121576822 [0,1,1,0,0,0|1,0,1]=4 6518 B17R0.196 CC=CCC(=O)NCCCCCCCCCCC 240690a_200011215754_100121576822 [0,1,1,0,0,0|1,0,1]=4 6519 B17R0.196 CC=CCC(=O)NCCCCCCCCCCC 527a_200011215754_100121576822 [0,1,1,0,0,0|1,0,1]=4 6520 B17R0.196 CCC#CC(=O)CCCCCCCCCCCC 1458a_100011827653_100000759014 [0,1,1,0,0,0|1,0,0]=3 6521 B17R0.196 CCC#CC(=O)CCCCCCCCCCCO 1458a_100011827653_100009812471 [0,1,1,0,0,0|2,0,0]=4 6522 B17R0.196 CCC=CC(=O)CCCCCCCCCCCC 1458a_100000212282_100000759014 [0,1,1,0,0,0|1,0,0]=3 6523 B17R0.196 CCC=CC(=O)CCCCCCCCCCCO 1458a_100000212282_100009812471 [0,1,1,0,0,0|2,0,0]=4 6524 B17R0.196 CCC=CC(=O)NCCCCCCCCCCC 11a_200011215754_100000212282 [0,1,1,0,0,0|1,0,1]=4 6525 B17R0.196 CCC=CC(=O)NCCCCCCCCCCC 1626a_200011215754_100000212282 [0,1,1,0,0,0|1,0,1]=4 6526 B17R0.196 CCC=CC(=O)NCCCCCCCCCCC 240690a_200011215754_100000212282 [0,1,1,0,0,0|1,0,1]=4 6527 B17R0.196 CCCCC#CCCCCCCC(=O)COCC 1458a_100000211967_200000043322 [0,1,1,0,0,0|0,0,2]=4 6528 B17R0.196 CCCCC(=O)CCCCCCCCCCCO 1458a_100000210183_100009812471 [0,1,1,0,0,0|2,0,0]=4 6529 B17R0.196 CCCCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000210183 [0,1,1,0,0,0|2,0,0]=4 6530 B17R0.196 CCCCCCCCCCC=CC(=O)NCCC 11a_100020643023_100015291182 [0,1,1,0,0,0|1,0,1]=4 6531 B17R0.196 CCCCCCCCCCC=CC(=O)NCCC 1626a_100020643023_100015291182 [0,1,1,0,0,0|1,0,1]=4 6532 B17R0.196 CCCCCCCCCCC=CC(=O)NCCC 240690a_100020643023_100015291182 [0,1,1,0,0,0|1,0,1]=4 6533 B17R0.196 CCCCCCCCCCCCC(=NNCC)C 4a_100000756455_100011219199 [0,1,1,0,0,0|2,0,0]=4 6534 B17R0.196 CCCCCCCCCCCCC(=O)C#CCO 1458a_100000049017_100000759014 [0,1,1,0,0,0|1,0,1]=4 6535 B17R0.196 CCCCCCCCCCCCC(=O)C=COC 1458a_100016268678_100000759014 [0,1,1,0,0,0|1,0,1]=4 6536 B17R0.196 CCCCCCCCCCCCC(=O)CCC#N 1458a_100011215791_100011215226 [0,1,1,0,0,0|1,0,1]=4 6537 B17R0.196 CCCCCCCCCCCCC(=O)CCC#N 1458a_100011934036_100000759014 [0,1,1,0,0,0|1,0,1]=4 6538 B17R0.196 CCCCCCCCCCCCC(=O)CCCF 1458a_100011215791_100011934791 [0,1,1,0,0,0|1,0,0]=3 6539 B17R0.196 CCCCCCCCCCCCC(=O)CCCO 1458a_100011215791_100011215043 [0,1,1,0,0,0|1,0,0]=3 6540 B17R0.196 CCCCCCCCCCCCC(=O)CCOC 1458a_100000749529_100000759014 [0,1,1,0,0,0|1,0,0]=3 6541 B17R0.196 CCCCCCCCCCCCC(=O)CCOC 1458a_100011215791_100000233755 [0,1,1,0,0,0|1,0,0]=3 6542 B17R0.196 CCCCCCCCCCCCC(=O)CCSC 1458a_100000174002_100000759014 [0,1,1,0,0,0|1,0,0]=3 6543 B17R0.196 CCCCCCCCCCCCC(=O)CCSC 1458a_100011215791_100000751147 [0,1,1,0,0,0|1,0,0]=3 6544 B17R0.196 CCCCCCCCCCCCC(=O)COCC 1458a_100000211967_100000759014 [0,1,1,0,0,0|0,0,0]=2 6545 B17R0.196 CCCCCCCCCCCCC(=O)CSCC 1458a_100000230394_100000759014 [0,1,1,0,0,0|0,1,0]=3 6546 B17R0.196 CCCCCCCCCCCCC(=O)NCC#N 1626a_100000734998_100011215791 [0,1,1,0,0,0|1,0,1]=4 6547 B17R0.196 CCCCCCCCCCCCC(=O)NCCC 11a_100020643023_100011215791 [0,1,1,0,0,0|1,0,0]=3 6548 B17R0.196 CCCCCCCCCCCCC(=O)NCCC 1626a_100020643023_100011215791 [0,1,1,0,0,0|1,0,0]=3 6549 B17R0.196 CCCCCCCCCCCCC(=O)NCCC 240690a_100020643023_100011215791 [0,1,1,0,0,0|1,0,0]=3 6550 B17R0.196 CCCCCCCCCCCCC(=O)NCCF 11a_100000724931_100011215791 [0,1,1,0,0,0|1,0,0]=3 6551 B17R0.196 CCCCCCCCCCCCC(=O)NCCF 1626a_100000724931_100011215791 [0,1,1,0,0,0|1,0,0]=3 6552 B17R0.196 CCCCCCCCCCCCC(=O)NCCF 240690a_100000724931_100011215791 [0,1,1,0,0,0|1,0,0]=3 6553 B17R0.196 CCCCCCCCCCCCC(=O)NCCO 240690a_100000210304_100011215791 [0,1,1,0,0,0|1,0,0]=3 6554 B17R0.196 CCCCCCCCCCCCC(=O)NNCC 22a_100000756455_100011215791 [0,1,1,0,0,0|1,0,0]=3 6555 B17R0.196 CCCCCCCCCCCCC(C)COCC 34a_100000724949_100000210202 [0,1,1,0,0,0|1,0,1]=4 6556 B17R0.196 CCCCCCCCCCCCC(C)COCC 7a_100000724949_100000210202 [0,1,1,0,0,0|1,0,1]=4 6557 B17R0.196 CCCCCCCCCCCCC(C)OCCF 34a_200011215752_100011217306 [0,1,1,0,0,0|1,0,1]=4 6558 B17R0.196 CCCCCCCCCCCCC(C)OCCF 7a_200011215752_100011217306 [0,1,1,0,0,0|1,0,1]=4 6559 B17R0.196 CCCCCCCCCCCCC(C)OCCN 34a_100000210304_200011217028 [0,1,1,0,0,0|1,0,1]=4 6560 B17R0.196 CCCCCCCCCCCCC(C)OCCO 34a_200011215752_100000211926 [0,1,1,0,0,0|1,0,1]=4 6561 B17R0.196 CCCCCCCCCCCCC(C)OCCO 7a_200011215752_100000211926 [0,1,1,0,0,0|1,0,1]=4 6562 B17R0.196 CCCCCCCCCCCCN(C)COCC 269982a_100000227908_100000739092 [0,1,1,0,0,0|2,0,0]=4 6563 B17R0.196 CCCCCCCCCCCNC(=O)CCC#N 11a_200011215754_100011934036 [0,1,1,0,0,0|1,0,1]=4 6564 B17R0.196 CCCCCCCCCCCNC(=O)CCC#N 1626a_200011215754_100011934036 [0,1,1,0,0,0|1,0,1]=4 6565 B17R0.196 CCCCCCCCCCCNC(=O)CCC#N 240690a_200011215754_100011934036 [0,1,1,0,0,0|1,0,1]=4 6566 B17R0.196 CCCCCCCCCCCNC(=O)CCC#N 527a_200011215754_100011934036 [0,1,1,0,0,0|1,0,1]=4 6567 B17R0.196 CCCCCCCCCCCNC(=O)CCCC 11a_200011215754_100000210183 [0,1,1,0,0,0|1,0,0]=3 6568 B17R0.196 CCCCCCCCCCCNC(=O)CCCC 1626a_200011215754_100000210183 [0,1,1,0,0,0|1,0,0]=3 6569 B17R0.196 CCCCCCCCCCCNC(=O)CCCC 240690a_200011215754_100000210183 [0,1,1,0,0,0|1,0,0]=3 6570 B17R0.196 CCCCCCCCCCCNC(=O)CCCC 527a_200011215754_100000210183 [0,1,1,0,0,0|1,0,0]=3 6571 B17R0.196 CCCCCCCCCCCNC(=O)CCOC 11a_200011215754_100000749529 [0,1,1,0,0,0|1,0,0]=3 6572 B17R0.196 CCCCCCCCCCCNC(=O)CCOC 1626a_200011215754_100000749529 [0,1,1,0,0,0|1,0,0]=3 6573 B17R0.196 CCCCCCCCCCCNC(=O)CCOC 240690a_200011215754_100000749529 [0,1,1,0,0,0|1,0,0]=3 6574 B17R0.196 CCCCCCCCCCCNC(=O)CCOC 527a_200011215754_100000749529 [0,1,1,0,0,0|1,0,0]=3 6575 B17R0.196 CCCCCCCCCCCNC(=O)CCSC 11a_200011215754_100000174002 [0,1,1,0,0,0|1,0,0]=3 6576 B17R0.196 CCCCCCCCCCCNC(=O)CCSC 1626a_200011215754_100000174002 [0,1,1,0,0,0|1,0,0]=3 6577 B17R0.196 CCCCCCCCCCCNC(=O)CCSC 240690a_200011215754_100000174002 [0,1,1,0,0,0|1,0,0]=3 6578 B17R0.196 CCCCCCCCCCCNC(=O)CCSC 527a_200011215754_100000174002 [0,1,1,0,0,0|1,0,0]=3 6579 B17R0.196 CCCCCCCCCCCNC(=O)COCC 11a_200011215754_100000211967 [0,1,1,0,0,0|1,0,0]=3 6580 B17R0.196 CCCCCCCCCCCNC(=O)COCC 1626a_200011215754_100000211967 [0,1,1,0,0,0|1,0,0]=3 6581 B17R0.196 CCCCCCCCCCCNC(=O)COCC 240690a_200011215754_100000211967 [0,1,1,0,0,0|1,0,0]=3 6582 B17R0.196 CCCCCCCCCCCNC(=O)COCC 527a_200011215754_100000211967 [0,1,1,0,0,0|1,0,0]=3 6583 B17R0.196 CCCCCCCCCCCNC(=O)CSCC 11a_200011215754_100000230394 [0,1,1,0,0,0|1,0,0]=3 6584 B17R0.196 CCCCCCCCCCCNC(=O)CSCC 1626a_200011215754_100000230394 [0,1,1,0,0,0|1,0,0]=3 6585 B17R0.196 CCCCCCCCCCCNC(=O)CSCC 240690a_200011215754_100000230394 [0,1,1,0,0,0|1,0,0]=3 6586 B17R0.196 CCCCCCCCCCCNC(=O)CSCC 527a_200011215754_100000230394 [0,1,1,0,0,0|1,0,0]=3 6587 B17R0.196 CCCCCCCCCCCNC(=O)NCCC 2708a_100020643023_200011215754 [0,1,1,0,0,0|1,0,0]=3 6588 B17R0.196 CCCCCCCCCCCNC(=O)NCCC 2708a_200011215754_100020643023 [0,1,1,0,0,0|1,0,0]=3 6589 B17R0.196 CCCCCCCCCCCNC(=O)NCCC 273464a_100020643023_200011215754 [0,1,1,0,0,0|1,0,0]=3 6590 B17R0.196 CCCCCCCCCCCNC(=O)NCCC 273464a_200011215754_100020643023 [0,1,1,0,0,0|1,0,0]=3 6591 B17R0.196 CCCCCCCCCCCNC(=O)NCCC 512a_100020643023_200011215754 [0,1,1,0,0,0|1,0,0]=3 6592 B17R0.196 CCCCCCCCCCCNC(=O)NCCC 512a_200011215754_100020643023 [0,1,1,0,0,0|1,0,0]=3 6593 B17R0.196 CCCCCCCCCCCNC(=O)NCCF 2708a_200011215754_100000724931 [0,1,1,0,0,0|2,0,0]=4 6594 B17R0.196 CCCCCCCCCCCNC(=O)NCCF 273464a_100000724931_200011215754 [0,1,1,0,0,0|2,0,0]=4 6595 B17R0.196 CCCCCCCCCCCNC(=O)NCCF 273464a_200011215754_100000724931 [0,1,1,0,0,0|2,0,0]=4 6596 B17R0.196 CCCCCCCCCCCNC(=O)NCCF 512a_200011215754_100000724931 [0,1,1,0,0,0|2,0,0]=4 6597 B17R0.196 CCCCCCCCCCCNC(=O)NCCO 2708a_200011215754_100000210304 [0,1,1,0,0,0|2,0,0]=4 6598 B17R0.196 CCCCCCCCCCCNC(=O)NCCO 273464a_100000210304_200011215754 [0,1,1,0,0,0|2,0,0]=4 6599 B17R0.196 CCCCCCCCCCCNC(=O)NCCO 273464a_200011215754_100000210304 [0,1,1,0,0,0|2,0,0]=4 6600 B17R0.196 CCCCCCCCCCCNC(=O)NCCO 512a_200011215754_100000210304 [0,1,1,0,0,0|2,0,0]=4 6601 B17R0.196 CCCCCCCCCCCNC(=O)NNCC 273464a_200011215754_100000756455 [0,1,1,0,0,0|2,0,0]=4 6602 B17R0.196 CCCCCCCCCCCNC(=O)NNCC 512a_100000756455_200011215754 [0,1,1,0,0,0|2,0,0]=4 6603 B17R0.196 CCCCCCCCCCCNC(=O)NNCC 512a_200011215754_100000756455 [0,1,1,0,0,0|2,0,0]=4 6604 B17R0.196 CCCCCCCCCCCOC(C)CCCCl 34a_200000718107_100011215454 [0,1,1,0,0,0|1,0,1]=4 6605 B17R0.196 CCCCCCCCCCCOC(C)CCCCl 7a_200000718107_100011215454 [0,1,1,0,0,0|1,0,1]=4 6606 B17R0.196 CCCCCCCCCCCOC(C)COCC 34a_100000718985_100011215454 [0,1,1,0,0,0|1,0,1]=4 6607 B17R0.196 CCCCCCCCCCCOC(C)COCC 7a_100000718985_100011215454 [0,1,1,0,0,0|1,0,1]=4 6608 B17R0.196 CCCCCCCCCCNCC(=O)NCCC 2230a_100000174927_100000210320 [0,1,1,0,0,0|2,0,0]=4 6609 B17R0.196 CCCCCCCCCCNCC(=O)NCCC 2230a_100000684558_100000183358 [0,1,1,0,0,0|2,0,0]=4 6610 B17R0.196 CCCCCCCCCCNCC(=O)NCCC 34a_100000684558_100000183358 [0,1,1,0,0,0|2,0,0]=4 6611 B17R0.196 CCCCCCCCCCNCC(=O)NCCF 2230a_100000725713_100000210320 [0,1,1,0,0,0|2,0,0]=4 6612 B17R0.196 CCCCCCCCCCNCC(=O)OCCC 2230a_100000684558_200011215008 [0,1,1,0,0,0|1,0,0]=3 6613 B17R0.196 CCCCCCCCCCNCC(=O)OCCC 34a_100000684558_200011215008 [0,1,1,0,0,0|1,0,0]=3 6614 B17R0.196 CCCCCCCCCCOCC(=O)NCCC 34a_100000210711_100000183358 [0,1,1,0,0,0|2,0,0]=4 6615 B17R0.196 CCCCCCCCCCOCC(=O)NCCC 7a_100000210711_100000183358 [0,1,1,0,0,0|2,0,0]=4 6616 B17R0.196 CCCCCCCCCCOCC(=O)OCCC 34a_100000210711_200011215008 [0,1,1,0,0,0|1,0,0]=3 6617 B17R0.196 CCCCCCCCCCOCC(=O)OCCC 7a_100000210711_200011215008 [0,1,1,0,0,0|1,0,0]=3 6618 B17R0.196 CCCCCCCCCCSCC(=O)NCCC 62a_100000183358_100000210320 [0,1,1,0,0,0|2,0,0]=4 6619 B17R0.196 CCCCCCCCCCSCC(=O)OCCC 62a_200011215008_100000210320 [0,1,1,0,0,0|1,0,0]=3 6620 B17R0.196 CCCCCCCCCNCOC(=O)OCCC 34a_100000212291_200000139673 [0,1,1,0,0,0|1,0,0]=3 6621 B17R0.196 CCCCCCCCCOCOC(=O)OCCC 34a_100000210712_200000139673 [0,1,1,0,0,0|1,0,0]=3 6622 B17R0.196 CCCCCCCCCOCOC(=O)OCCC 7a_100000210712_200000139673 [0,1,1,0,0,0|1,0,0]=3 6623 B17R0.196 CCCCCCCCNCCCC(=O)NCCC 2230a_100000229939_100011194427 [0,1,1,0,0,0|2,0,0]=4 6624 B17R0.196 CCCCCCCCOCCCC(=O)NCCC 7a_100000210232_100011194427 [0,1,1,0,0,0|2,0,0]=4 6625 B17R0.196 CCCCCCCCSCCCC(=O)NCCC 62a_100000210759_100011194427 [0,1,1,0,0,0|2,0,0]=4 6626 B17R0.196 CCCCCCCCSCCCC(=O)NCCC 62a_100011194427_100000210317 [0,1,1,0,0,0|2,0,0]=4 6627 B17R0.196 CCCCCCOCCOCOC(=O)OCCC 34a_100000691444_200000139673 [0,1,1,0,0,0|2,0,0]=4 6628 B17R0.196 CCCCCCOCCOCOC(=O)OCCC 7a_100000691444_200000139673 [0,1,1,0,0,0|2,0,0]=4 6629 B17R0.196 CCCCNCCCCOCOC(=O)OCCC 34a_200011216965_200000139673 [0,1,1,0,0,0|2,0,0]=4 6630 B17R0.196 CCCCOCCCCOCOC(=O)OCCC 34a_200000760531_200000139673 [0,1,1,0,0,0|2,0,0]=4 6631 B17R0.196 CCCCOCCCCOCOC(=O)OCCC 7a_200000760531_200000139673 [0,1,1,0,0,0|2,0,0]=4 6632 B17R0.196 CCCNC(=O)CCCCCCCCCCCO 240690a_100020643023_100000037981 [0,1,1,0,0,0|2,0,0]=4 6633 B17R0.196 CCCNC(=O)NCCCCCCCCCCO 2708a_100000066964_100020643023 [0,1,1,0,0,0|2,0,0]=4 6634 B17R0.196 CCCNC(=O)NCCCCCCCCCCO 2708a_100020643023_100000066964 [0,1,1,0,0,0|2,0,0]=4 6635 B17R0.196 CCCNC(=O)NCCCCCCCCCCO 273464a_100000066964_100020643023 [0,1,1,0,0,0|2,0,0]=4 6636 B17R0.196 CCCNC(=O)NCCCCCCCCCCO 273464a_100020643023_100000066964 [0,1,1,0,0,0|2,0,0]=4 6637 B17R0.196 CCCNC(=O)NCCCCCCCCCCO 512a_100000066964_100020643023 [0,1,1,0,0,0|2,0,0]=4 6638 B17R0.196 CCCNC(=O)NCCCCCCCCCCO 512a_100020643023_100000066964 [0,1,1,0,0,0|2,0,0]=4 6639 B17R0.196 CCCOC(=O)CNCCCCCCCCCO 2230a_100000078944_200011215008 [0,1,1,0,0,0|2,0,0]=4 6640 B17R0.196 CCCOC(=O)CNCCCCCCCCCO 34a_100000078944_200011215008 [0,1,1,0,0,0|2,0,0]=4 6641 B17R0.196 CCCOC(=O)COCCCCCCCCCBr 34a_100009813782_200011215008 [0,1,1,0,0,0|2,0,0]=4 6642 B17R0.196 CCCOC(=O)COCCCCCCCCCBr 7a_100009813782_200011215008 [0,1,1,0,0,0|2,0,0]=4 6643 B17R0.196 CCCOC(=O)COCCCCCCCCCCl 34a_100009868337_200011215008 [0,1,1,0,0,0|2,0,0]=4 6644 B17R0.196 CCCOC(=O)COCCCCCCCCCCl 7a_100009868337_200011215008 [0,1,1,0,0,0|2,0,0]=4 6645 B17R0.196 CCCOC(=O)COCCCCCCCCCN 34a_100000078944_200011215008 [0,1,1,0,0,0|2,0,0]=4 6646 B17R0.196 CCCOC(=O)CSCCCCCCCCCO 62a_100009813782_200011215008 [0,1,1,0,0,0|2,0,0]=4 6647 B17R0.196 CCCOC(=O)CSCCCCCCCCCO 62a_200011215008_100009813782 [0,1,1,0,0,0|2,0,0]=4 6648 B17R0.196 CCCOC(=O)OCNCCCCCCCCO 34a_102515433106_200000139673 [0,1,1,0,0,0|2,0,0]=4 6649 B17R0.196 CCCOC(=O)OCOCCCCCCCCBr 34a_100009813846_200000139673 [0,1,1,0,0,0|2,0,0]=4 6650 B17R0.196 CCCOC(=O)OCOCCCCCCCCBr 7a_100009813846_200000139673 [0,1,1,0,0,0|2,0,0]=4 6651 B17R0.196 CCCOC(=O)OCOCCCCCCCCCl 34a_100000033203_200000139673 [0,1,1,0,0,0|2,0,0]=4 6652 B17R0.196 CCCOC(=O)OCOCCCCCCCCCl 7a_100000033203_200000139673 [0,1,1,0,0,0|2,0,0]=4 6653 B17R0.196 CCCOC(=O)OCOCCCCCCCCN 34a_102515433106_200000139673 [0,1,1,0,0,0|2,0,0]=4 6654 B17R0.196 CCCOC(=O)OCSCCCCCCCCO 62a_100000033203_200000139673 [0,1,1,0,0,0|2,0,0]=4 6655 B17R0.196 CCNNC(=O)CCCCCCCCCCCO 22a_100000756455_100000037981 [0,1,1,0,0,0|2,0,0]=4 6656 B17R0.196 CCOCC(=O)CCCCCCCCCCCO 1458a_100000211967_100009812471 [0,1,1,0,0,0|1,0,0]=3 6657 B17R0.196 CCOCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000211967 [0,1,1,0,0,0|2,0,0]=4 6658 B17R0.196 CCSCC(=O)CCCCCCCCCCCO 1458a_100000230394_100009812471 [0,1,1,0,0,0|1,1,0]=4 6659 B17R0.196 CCSCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000230394 [0,1,1,0,0,0|2,0,0]=4 6660 B17R0.196 COCCC(=O)CCCCCCCCCCCO 1458a_100000749529_100009812471 [0,1,1,0,0,0|2,0,0]=4 6661 B17R0.196 COCCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000749529 [0,1,1,0,0,0|2,0,0]=4 6662 B17R0.196 CSCCC(=O)CCCCCCCCCCCO 1458a_100000174002_100009812471 [0,1,1,0,0,0|2,0,0]=4 6663 B17R0.196 CSCCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000174002 [0,1,1,0,0,0|2,0,0]=4 6664 B17R0.196 O=C(CCCCCCCCCCCO)NCCF 240690a_100000724931_100000037981 [0,1,1,0,0,0|2,0,0]=4 6665 B17R0.196 O=C(CCCCCCCCCCCO)NCCO 240690a_100000210304_100000037981 [0,1,1,0,0,0|2,0,0]=4 6666 B17R0.231 CCCCCCCCCCC(=O)CC(=O)CCC 1458a_100000210375_100000747444 [0,1,1,0,0,0|1,0,1]=4 6667 B17R0.231 CCCCCCCCCCC(=O)CC(=O)NCC 1458a_100000210375_100000183381 [0,1,1,0,0,0|1,0,1]=4 6668 B17R0.231 CCCCCCCCCCC(=O)CC(=O)OCC 1458a_100000210375_100000188475 [0,1,1,0,0,0|0,0,1]=3 6669 B17R0.231 CCCCCCCCCCC(=O)CC(=O)OCC 1458a_100000243816_100000210319 [0,1,1,0,0,0|0,0,1]=3 6670 B17R0.231 CCCCCCCCCCN(C)CC(=O)CCC 2230a_100000207566_100000747444 [0,1,1,0,0,0|2,0,0]=4 6671 B17R0.231 CCCCCCCCCCN(C)CC(=O)CCC 269982a_100000207566_100000747444 [0,1,1,0,0,0|2,0,0]=4 6672 B17R0.231 CCCCCCCCCCN(C)CC(=O)NCC 2230a_100000207566_100000183381 [0,1,1,0,0,0|2,0,0]=4 6673 B17R0.231 CCCCCCCCCCN(C)CC(=O)NCC 2230a_100000741943_100000210320 [0,1,1,0,0,0|2,0,0]=4 6674 B17R0.231 CCCCCCCCCCN(C)CC(=O)NCC 269982a_100000207566_100000183381 [0,1,1,0,0,0|2,0,0]=4 6675 B17R0.231 CCCCCCCCCCN(C)CC(=O)NCC 269982a_100000741943_100000210320 [0,1,1,0,0,0|2,0,0]=4 6676 B17R0.231 CCCCCCCCCCN(C)CC(=O)OCC 2230a_100000207566_100000188475 [0,1,1,0,0,0|1,0,0]=3 6677 B17R0.231 CCCCCCCCCCN(C)CC(=O)OCC 2230a_100000220588_100000210320 [0,1,1,0,0,0|1,0,0]=3 6678 B17R0.231 CCCCCCCCCCN(C)CC(=O)OCC 269982a_100000207566_100000188475 [0,1,1,0,0,0|1,0,0]=3 6679 B17R0.231 CCCCCCCCCNC(=O)CC(=O)OCC 240690a_100000212291_100000243816 [0,1,1,0,0,0|1,0,1]=4 6680 B17R0.231 CCCCCCCCCNC(C)CC(=O)OCC 2230a_100000212291_100009817359 [0,1,1,0,0,0|1,0,0]=3 6681 B17R0.231 CCCCCCCCCOC(C)CC(=O)OCC 7a_100000210712_100009817359 [0,1,1,0,0,0|1,0,0]=3 6682 B17R0.231 CCCCCCCCCO[C@H](C)CC(=O)OCC 7a_100009816390_100000210328 [0,1,1,0,0,0|1,0,0]=3 6683 B17R0.231 CCCCCCCCCSC(C)CC(=O)OCC 62a_100009817359_100000210670 [0,1,1,0,0,0|1,0,0]=3 6684 B17R0.231 CCCCCCCCCSC(C)OC(=O)OCC 62a_100000036008_100000210670 [0,1,1,0,0,0|2,0,0]=4 6685 B17R0.231 CCCCCCCCNC[C@@H](O)CC(=O)OCC 34a_100000229939_100000688340 [0,1,1,0,0,0|1,0,0]=3 6686 B17R0.231 CCCCCCCCOCC(=O)CC(=O)OCC 1458a_100000759886_100000188475 [0,1,1,0,0,0|1,0,1]=4 6687 B17R0.231 CCCCCCCCOC[C@@H](O)CC(=O)OCC 34a_100000210232_100000688340 [0,1,1,0,0,0|1,0,0]=3 6688 B17R0.231 CCCCCCCCOC[C@@H](O)CC(=O)OCC 7a_100000210232_100000688340 [0,1,1,0,0,0|1,0,0]=3 6689 B17R0.231 CCCCCCCCSCC(=O)CC(=O)OCC 62a_100000210311_100000210317 [0,1,1,0,0,0|1,0,1]=4 6690 B17R0.231 CCCCCCCCSCC(=O)CC(=O)OCC 62a_100000210759_100000210311 [0,1,1,0,0,0|1,0,1]=4 6691 B17R0.231 CCCCCCCCSC[C@@H](O)CC(=O)OCC 62a_100000210759_100000688340 [0,1,1,0,0,0|1,0,0]=3 6692 B17R0.231 CCCCCCCCSC[C@@H](O)CC(=O)OCC 62a_100000688340_100000210317 [0,1,1,0,0,0|1,0,0]=3 6693 B17R0.231 CCCCCCOCCOC(C)CC(=O)OCC 7a_100000691444_100009817359 [0,1,1,0,0,0|2,0,0]=4 6694 B17R0.231 CCCCCNCCOC[C@@H](O)CC(=O)OCC 34a_100000224656_100000688340 [0,1,1,0,0,0|2,0,0]=4 6695 B17R0.231 CCCCCOCCOC[C@@H](O)CC(=O)OCC 34a_100011215259_100000688340 [0,1,1,0,0,0|2,0,0]=4 6696 B17R0.231 CCCCCOCCOC[C@@H](O)CC(=O)OCC 7a_100011215259_100000688340 [0,1,1,0,0,0|2,0,0]=4 6697 B17R0.231 CCCCOCCCCOC(C)CC(=O)OCC 7a_200000760531_100009817359 [0,1,1,0,0,0|2,0,0]=4 6698 B17R0.231 CCCCOCCCNC[C@@H](O)CC(=O)OCC 34a_200000211371_100000688340 [0,1,1,0,0,0|2,0,0]=4 6699 B17R0.231 CCCCOCCCOC[C@@H](O)CC(=O)OCC 34a_200011215613_100000688340 [0,1,1,0,0,0|2,0,0]=4 6700 B17R0.231 CCCCOCCCOC[C@@H](O)CC(=O)OCC 7a_200011215613_100000688340 [0,1,1,0,0,0|2,0,0]=4 6701 B17R0.231 CCOC(=O)CC(=O)CCCCCCCCCF 1458a_200009909015_100000188475 [0,1,1,0,0,0|1,0,1]=4 6702 B17R0.231 CCOC(=O)CC(=O)CCCCCCCCCO 1458a_100000243816_100009813782 [0,1,1,0,0,0|1,0,1]=4 6703 B17R0.231 CCOC(=O)CC(C)NCCCCCCCCO 2230a_102515433106_100009817359 [0,1,1,0,0,0|2,0,0]=4 6704 B17R0.231 CCOC(=O)CC(C)OCCCCCCCCBr 7a_100009813846_100009817359 [0,1,1,0,0,0|2,0,0]=4 6705 B17R0.231 CCOC(=O)CC(C)OCCCCCCCCCl 7a_100000033203_100009817359 [0,1,1,0,0,0|2,0,0]=4 6706 B17R0.231 CCOC(=O)CC(C)SCCCCCCCCO 62a_100000033203_100009817359 [0,1,1,0,0,0|2,0,0]=4 6707 B17R0.231 CCOC(=O)CC(C)SCCCCCCCCO 62a_100009817359_100000033203 [0,1,1,0,0,0|2,0,0]=4 6708 B17R0.231 CCOC(=O)CN(C)CCCCCCCCCO 2230a_100000220588_100009813782 [0,1,1,0,0,0|2,0,0]=4 6709 B17R0.231 CCOC(=O)C[C@@H](C)OCCCCCCCCO 7a_100009816390_100000033203 [0,1,1,0,0,0|2,0,0]=4 6710 B17R0.231 CCOC(=O)C[C@H](O)CNCCCCCCCO 34a_100011996573_100000688340 [0,1,1,0,0,0|2,0,0]=4 6711 B17R0.231 CCOC(=O)C[C@H](O)COCCCCCCCBr 34a_100000760002_100000688340 [0,1,1,0,0,0|2,0,0]=4 6712 B17R0.231 CCOC(=O)C[C@H](O)COCCCCCCCBr 7a_100000760002_100000688340 [0,1,1,0,0,0|2,0,0]=4 6713 B17R0.231 CCOC(=O)C[C@H](O)COCCCCCCCN 34a_100011996573_100000688340 [0,1,1,0,0,0|2,0,0]=4 6714 B17R0.231 CCOC(=O)C[C@H](O)COCCCCCCOC 34a_200012092642_100000688340 [0,1,1,0,0,0|2,0,0]=4 6715 B17R0.231 CCOC(=O)C[C@H](O)COCCCCCCOC 7a_200012092642_100000688340 [0,1,1,0,0,0|2,0,0]=4 6716 B17R0.231 CCOC(=O)C[C@H](O)CSCCCCCCCO 62a_100000688340_100000760002 [0,1,1,0,0,0|2,0,0]=4 6717 B17R0.231 CCOC(=O)C[C@H](O)CSCCCCCCCO 62a_100000760002_100000688340 [0,1,1,0,0,0|2,0,0]=4 6718 B17R0.231 CCOC(=O)C[C@H](O)CSCCCCCCOC 62a_100000688340_100011998445 [0,1,1,0,0,0|2,0,0]=4 6719 B17R0.231 CCOC(=O)C[C@H](O)CSCCCCCCOC 62a_100011998445_100000688340 [0,1,1,0,0,0|2,0,0]=4 6720 B17R0.247 CCCCCCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100000210757 [0,1,1,0,0,0|0,0,1]=3 6721 B17R0.247 CCCCCCC(=O)CCCCCC(=O)OCC 1458a_100102632555_100000755133 [0,1,1,0,0,0|0,0,1]=3 6722 B17R0.247 CCCCCCC(=O)CCCOCC(=O)OCC 1458a_100102632555_100009893628 [0,1,1,0,0,0|1,0,1]=4 6723 B17R0.247 CCCCCCC(=O)NCCCCC(=O)OCC 188690a_100000718961_100102632555 [0,1,1,0,0,0|1,0,1]=4 6724 B17R0.247 CCCCCCC(C)CCOCCC(=O)NCC 7a_200011024964_100000737597 [0,1,1,0,0,0|2,0,0]=4 6725 B17R0.247 CCCCCCC(C)CCOCCC(=O)OCC 34a_200011024964_100000765890 [0,1,1,0,0,0|1,0,0]=3 6726 B17R0.247 CCCCCCC(C)CCOCCC(=O)OCC 7a_200011024964_100011206558 [0,1,1,0,0,0|1,0,0]=3 6727 B17R0.247 CCCCCCC(C)CCOCOC(=O)CCC 34a_200011024964_100000034017 [0,1,1,0,0,0|1,0,0]=3 6728 B17R0.247 CCCCCCC(C)NCCCCC(=O)OCC 2230a_100000210919_100000750268 [0,1,1,0,0,0|1,0,0]=3 6729 B17R0.247 CCCCCCC(C)NCCCCC(=O)OCC 34a_100000210919_100000750268 [0,1,1,0,0,0|1,0,0]=3 6730 B17R0.247 CCCCCCC(C)NCCOCC(=O)OCC 2230a_100000210919_100000088970 [0,1,1,0,0,0|2,0,0]=4 6731 B17R0.247 CCCCCCC(C)NCCOCC(=O)OCC 34a_100000210919_100000088970 [0,1,1,0,0,0|2,0,0]=4 6732 B17R0.247 CCCCCCC(C)OCCCCC(=O)OCC 34a_100000210265_100000750268 [0,1,1,0,0,0|1,0,0]=3 6733 B17R0.247 CCCCCCC(C)OCCCCC(=O)OCC 7a_100000210265_100000750268 [0,1,1,0,0,0|1,0,0]=3 6734 B17R0.247 CCCCCCC(C)OCCOCC(=O)OCC 34a_100000210265_100000088970 [0,1,1,0,0,0|2,0,0]=4 6735 B17R0.247 CCCCCCC(C)OCCOCC(=O)OCC 7a_100000210265_100000088970 [0,1,1,0,0,0|2,0,0]=4 6736 B17R0.247 CCCCCCC(C)OCCSCC(=O)OCC 7a_200000230590_100011215978 [0,1,1,0,0,0|2,0,0]=4 6737 B17R0.247 CCCCCCC(C)SCCCCC(=O)OCC 62a_100000750268_100011215978 [0,1,1,0,0,0|1,0,0]=3 6738 B17R0.247 CCCCCCC(C)SCCCCC(=O)OCC 62a_100011215978_100000750268 [0,1,1,0,0,0|1,0,0]=3 6739 B17R0.247 CCCCCCC(C)SCCOCC(=O)OCC 62a_100000088970_100011215978 [0,1,1,0,0,0|2,0,0]=4 6740 B17R0.247 CCCCCCC(C)SCCOCC(=O)OCC 62a_100011215978_100000088970 [0,1,1,0,0,0|2,0,0]=4 6741 B17R0.247 CCCCCCN(C)CCCCCC(=O)OCC 2230a_106256046315_100000755133 [0,1,1,0,0,0|1,0,0]=3 6742 B17R0.247 CCCCCCN(C)CCCCCC(=O)OCC 269982a_106256046315_100000755133 [0,1,1,0,0,0|1,0,0]=3 6743 B17R0.247 CCCCCCN(C)CCCOCC(=O)OCC 2230a_106256046315_100009893628 [0,1,1,0,0,0|2,0,0]=4 6744 B17R0.247 CCCCCCN(C)CCCOCC(=O)OCC 269982a_106256046315_100009893628 [0,1,1,0,0,0|2,0,0]=4 6745 B17R0.247 CCCCCNC(=O)CCCCCC(=O)OCC 11a_100000209983_100000037472 [0,1,1,0,0,0|1,0,1]=4 6746 B17R0.247 CCCCCNC(=O)CCCCCC(=O)OCC 1626a_100000209983_100000037472 [0,1,1,0,0,0|1,0,1]=4 6747 B17R0.247 CCCCCNC(=O)CCCCCC(=O)OCC 240690a_100000209983_100000037472 [0,1,1,0,0,0|1,0,1]=4 6748 B17R0.247 CCCCCNC(=O)CCCCCC(=O)OCC 527a_100000209983_100000037472 [0,1,1,0,0,0|1,0,1]=4 6749 B17R0.247 CCCCOCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100011995733 [0,1,1,0,0,0|1,0,1]=4 6750 B17R0.247 CCCCOCC(=O)CCCCCC(=O)OCC 1458a_100000757543_100000755133 [0,1,1,0,0,0|1,0,1]=4 6751 B17R0.247 CCCCOCC(C)OCCCCC(=O)OCC 34a_100011217071_100000750268 [0,1,1,0,0,0|2,0,0]=4 6752 B17R0.247 CCCCOCC(C)OCCCCC(=O)OCC 7a_100011217071_100000750268 [0,1,1,0,0,0|2,0,0]=4 6753 B17R0.247 CCCCSCC(=O)CCCCCC(=O)OCC 1458a_100000191162_100000755133 [0,1,1,0,0,0|1,0,1]=4 6754 B17R0.247 CCCOCCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100011215938 [0,1,1,0,0,0|1,0,1]=4 6755 B17R0.247 CCOC(=O)CCCCCC(=O)CCCCCF 1458a_100000037472_100000729378 [0,1,1,0,0,0|1,0,1]=4 6756 B17R0.247 CCOC(=O)CCCCCC(=O)CCCCCO 1458a_100000037472_100000746330 [0,1,1,0,0,0|1,0,1]=4 6757 B17R0.247 CCOC(=O)CCCCCC(=O)CCCCCO 1458a_100102619762_100000755133 [0,1,1,0,0,0|1,0,1]=4 6758 B17R0.247 CCOC(=O)CCCCCC(=O)CCCCOC 1458a_100000037472_100000755781 [0,1,1,0,0,0|1,0,1]=4 6759 B17R0.247 CCOC(=O)CCCCCN(C)CCCCCO 2230a_100000722520_100000755133 [0,1,1,0,0,0|2,0,0]=4 6760 B17R0.247 CCOC(=O)CCCCCN(C)CCCCCO 269982a_100000722520_100000755133 [0,1,1,0,0,0|2,0,0]=4 6761 B17R0.247 CCOCCCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100012232248 [0,1,1,0,0,0|1,0,1]=4 6762 B17R0.250 C#CCCCCCCCCCOCC(=O)CCC 7a_100000034437_100000747444 [0,1,1,0,0,0|0,0,2]=4 6763 B17R0.250 C#CCCCCCCCCCOCC(=O)OCC 34a_100000034437_100000188475 [0,1,1,0,0,0|0,0,2]=4 6764 B17R0.250 C#CCCCCCCCCCOCC(=O)OCC 7a_100000034437_100000188475 [0,1,1,0,0,0|0,0,2]=4 6765 B17R0.250 C#CCCCCCCCCOCCC(=O)OCC 34a_100000065265_100000765890 [0,1,1,0,0,0|0,0,2]=4 6766 B17R0.250 C#CCCCCCCCCOCCC(=O)OCC 7a_100000065265_100011206558 [0,1,1,0,0,0|0,0,2]=4 6767 B17R0.250 C#CCCCCCCCCOCOC(=O)CCC 34a_100000065265_100000034017 [0,1,1,0,0,0|0,0,2]=4 6768 B17R0.250 C#CCCCCCCCOCCCC(=O)OCC 34a_100000054614_100009991533 [0,1,1,0,0,0|0,0,2]=4 6769 B17R0.250 C#CCCCCCCCOCCCC(=O)OCC 7a_100000054614_100011215271 [0,1,1,0,0,0|0,0,2]=4 6770 B17R0.250 C#CCCCCCCCOCCCC(=O)OCC 7a_100012001163_100153394163 [0,1,1,0,0,0|0,0,2]=4 6771 B17R0.250 C#CCCCCCCCSCCCC(=O)OCC 62a_100009991533_100153394163 [0,1,1,0,0,0|0,0,2]=4 6772 B17R0.250 C#CCCCCCCCSCCCC(=O)OCC 62a_100153394163_100009991533 [0,1,1,0,0,0|0,0,2]=4 6773 B17R0.250 C#CCCCCCCOCCCCC(=O)OCC 34a_100011217361_100000750268 [0,1,1,0,0,0|0,0,2]=4 6774 B17R0.250 C#CCCCCCCOCCCCC(=O)OCC 7a_100011217361_100000750268 [0,1,1,0,0,0|0,0,2]=4 6775 B17R0.250 C#CCCCCCCSCCCCC(=O)OCC 62a_100000750268_100012276617 [0,1,1,0,0,0|0,0,2]=4 6776 B17R0.250 C#CCCCCCCSCCCCC(=O)OCC 62a_100012276617_100000750268 [0,1,1,0,0,0|0,0,2]=4 6777 B17R0.250 C#CCCCCCOCCCCCC(=O)OCC 34a_100000766912_100000755133 [0,1,1,0,0,0|0,0,2]=4 6778 B17R0.250 C#CCCCCCOCCCCCC(=O)OCC 7a_100000766912_100000755133 [0,1,1,0,0,0|0,0,2]=4 6779 B17R0.250 C#CCCCCCOCCCCCC(=O)OCC 7a_100011214988_100012094781 [0,1,1,0,0,0|0,0,2]=4 6780 B17R0.250 C#CCCCCCSCCCCCC(=O)OCC 62a_100000755133_100012094781 [0,1,1,0,0,0|0,0,2]=4 6781 B17R0.250 C#CCCCCCSCCCCCC(=O)OCC 62a_100012094781_100000755133 [0,1,1,0,0,0|0,0,2]=4 6782 B17R0.250 C#CCCCCNCCCCCCC(=O)OCC 2230a_100000706060_100009814379 [0,1,1,0,0,0|0,0,2]=4 6783 B17R0.250 C#CCCCCNCCCCCCC(=O)OCC 34a_100000706060_100009814379 [0,1,1,0,0,0|0,0,2]=4 6784 B17R0.250 C#CCCCCOCCCCCCC(=O)OCC 34a_100000766709_100009814379 [0,1,1,0,0,0|0,0,2]=4 6785 B17R0.250 C#CCCCCOCCCCCCC(=O)OCC 7a_100000766709_100009814379 [0,1,1,0,0,0|0,0,2]=4 6786 B17R0.250 C#CCCCCSCCCCCCC(=O)OCC 62a_100010269958_100009814379 [0,1,1,0,0,0|0,0,2]=4 6787 B17R0.250 C#CCCCNCCCCCCCC(=O)OCC 34a_100000718082_100009991516 [0,1,1,0,0,0|0,0,2]=4 6788 B17R0.250 C#CCCCOCCCCCCCC(=O)OCC 34a_100000215630_100009991516 [0,1,1,0,0,0|0,0,2]=4 6789 B17R0.250 C#CCCCOCCCCCCCC(=O)OCC 7a_100000215630_100009991516 [0,1,1,0,0,0|0,0,2]=4 6790 B17R0.250 C#CCCCSCCCCCCCC(=O)OCC 62a_100011215417_100009991516 [0,1,1,0,0,0|0,0,2]=4 6791 B17R0.250 C#CCCNCCCCCCCCC(=O)OCC 34a_100000755551_100010175975 [0,1,1,0,0,0|0,0,2]=4 6792 B17R0.250 C#CCCOCCCCCCCCC(=O)OCC 34a_100011215631_100010175975 [0,1,1,0,0,0|0,0,2]=4 6793 B17R0.250 C#CCCSCCCCCCCCC(=O)OCC 62a_100000688953_100010175975 [0,1,1,0,0,0|0,0,2]=4 6794 B17R0.250 C#CCNCCCCCCCCCC(=O)OCC 34a_100000212058_100009828014 [0,1,1,0,0,0|0,0,2]=4 6795 B17R0.250 C#CCOCCCCCCCCCC(=O)OCC 34a_100000210247_100009828014 [0,1,1,0,0,0|0,0,2]=4 6796 B17R0.250 C#CCSCCCCCCCCCC(=O)OCC 62a_100000038162_100009828014 [0,1,1,0,0,0|0,0,2]=4 6797 B17R0.250 C/C=C/CCOCCCCCCCC(=O)OCC 34a_100016278192_100009991516 [0,1,1,0,0,0|0,0,2]=4 6798 B17R0.250 C/C=C/COCCCCCCCCC(=O)OCC 34a_100016270725_100010175975 [0,1,1,0,0,0|0,0,2]=4 6799 B17R0.250 C/C=C/CSCCCCCCCCC(=O)OCC 62a_100102629194_100010175975 [0,1,1,0,0,0|0,0,2]=4 6800 B17R0.250 C=CCCCCCCCCCCCC(=O)CCC 1458a_100000211992_102130925996 [0,1,1,0,0,0|1,0,1]=4 6801 B17R0.250 C=CCCCCCCCCCNCC(=O)OCC 2230a_100000081888_100000188475 [0,1,1,0,0,0|0,0,2]=4 6802 B17R0.250 C=CCCCCCCCCCNCC(=O)OCC 34a_100000081888_100000188475 [0,1,1,0,0,0|0,0,2]=4 6803 B17R0.250 C=CCCCCCCCCCOCC(=O)CCC 7a_100000038209_100000747444 [0,1,1,0,0,0|0,0,2]=4 6804 B17R0.250 C=CCCCCCCCCCOCC(=O)OCC 34a_100000038209_100000188475 [0,1,1,0,0,0|0,0,2]=4 6805 B17R0.250 C=CCCCCCCCCCOCC(=O)OCC 7a_100000038209_100000188475 [0,1,1,0,0,0|0,0,2]=4 6806 B17R0.250 C=CCCCCCCCCCSCC(=O)OCC 62a_100000188475_100009814027 [0,1,1,0,0,0|0,0,2]=4 6807 B17R0.250 C=CCCCCCCCCCSCC(=O)OCC 62a_100009814027_100000188475 [0,1,1,0,0,0|0,0,2]=4 6808 B17R0.250 C=CCCCCCCCCOCCC(=O)OCC 34a_100011215194_100000765890 [0,1,1,0,0,0|0,0,2]=4 6809 B17R0.250 C=CCCCCCCCCOCCC(=O)OCC 7a_100011215194_100011206558 [0,1,1,0,0,0|0,0,2]=4 6810 B17R0.250 C=CCCCCCCCCOCOC(=O)CCC 34a_100011215194_100000034017 [0,1,1,0,0,0|0,0,2]=4 6811 B17R0.250 C=CCCCCCCCCSCCC(=O)OCC 62a_100000765890_100011933949 [0,1,1,0,0,0|0,0,2]=4 6812 B17R0.250 C=CCCCCCCCCSCCC(=O)OCC 62a_100011933949_100000765890 [0,1,1,0,0,0|0,0,2]=4 6813 B17R0.250 C=CCCCCCCCCSCOC(=O)CCC 62a_100011933949_100000034017 [0,1,1,0,0,0|0,0,2]=4 6814 B17R0.250 C=CCCCCCCCOCCCC(=O)OCC 34a_100000730831_100009991533 [0,1,1,0,0,0|0,0,2]=4 6815 B17R0.250 C=CCCCCCCCOCCCC(=O)OCC 7a_100000730831_100011215271 [0,1,1,0,0,0|0,0,2]=4 6816 B17R0.250 C=CCCCCCCCOCCCC(=O)OCC 7a_100012001163_100012355270 [0,1,1,0,0,0|0,0,2]=4 6817 B17R0.250 C=CCCCCCCCSCCCC(=O)OCC 62a_100009991533_100012355270 [0,1,1,0,0,0|0,0,2]=4 6818 B17R0.250 C=CCCCCCCCSCCCC(=O)OCC 62a_100012355270_100009991533 [0,1,1,0,0,0|0,0,2]=4 6819 B17R0.250 C=CCCCCCCOCCCCC(=O)OCC 34a_200011216477_100000750268 [0,1,1,0,0,0|0,0,2]=4 6820 B17R0.250 C=CCCCCCCOCCCCC(=O)OCC 7a_200011216477_100000750268 [0,1,1,0,0,0|0,0,2]=4 6821 B17R0.250 C=CCCCCCCSCCCCC(=O)OCC 62a_100000750268_100011215473 [0,1,1,0,0,0|0,0,2]=4 6822 B17R0.250 C=CCCCCCCSCCCCC(=O)OCC 62a_100011215473_100000750268 [0,1,1,0,0,0|0,0,2]=4 6823 B17R0.250 C=CCCCCCOCCCCCC(=O)OCC 34a_100011216702_100000755133 [0,1,1,0,0,0|0,0,2]=4 6824 B17R0.250 C=CCCCCCOCCCCCC(=O)OCC 7a_100011214988_100000700193 [0,1,1,0,0,0|0,0,2]=4 6825 B17R0.250 C=CCCCCCOCCCCCC(=O)OCC 7a_100011216702_100000755133 [0,1,1,0,0,0|0,0,2]=4 6826 B17R0.250 C=CCCCCCSCCCCCC(=O)OCC 62a_100000700193_100000755133 [0,1,1,0,0,0|0,0,2]=4 6827 B17R0.250 C=CCCCCCSCCCCCC(=O)OCC 62a_100000755133_100000700193 [0,1,1,0,0,0|0,0,2]=4 6828 B17R0.250 C=CCCCCNCCCCCCC(=O)OCC 2230a_100000703577_100009814379 [0,1,1,0,0,0|0,0,2]=4 6829 B17R0.250 C=CCCCCNCCCCCCC(=O)OCC 34a_100000703577_100009814379 [0,1,1,0,0,0|0,0,2]=4 6830 B17R0.250 C=CCCCCOCCCCCCC(=O)OCC 34a_100000766645_100009814379 [0,1,1,0,0,0|0,0,2]=4 6831 B17R0.250 C=CCCCCOCCCCCCC(=O)OCC 7a_100000766645_100009814379 [0,1,1,0,0,0|0,0,2]=4 6832 B17R0.250 C=CCCCCSCCCCCCC(=O)OCC 62a_100011215482_100009814379 [0,1,1,0,0,0|0,0,2]=4 6833 B17R0.250 C=CCCCNCCCCCCCC(=O)OCC 2230a_100000700776_100009991516 [0,1,1,0,0,0|0,0,2]=4 6834 B17R0.250 C=CCCCNCCCCCCCC(=O)OCC 34a_100000700776_100009991516 [0,1,1,0,0,0|0,0,2]=4 6835 B17R0.250 C=CCCCOCCCCCCCC(=O)OCC 34a_100000758997_100009991516 [0,1,1,0,0,0|0,0,2]=4 6836 B17R0.250 C=CCCCOCCCCCCCC(=O)OCC 7a_100000758997_100009991516 [0,1,1,0,0,0|0,0,2]=4 6837 B17R0.250 C=CCCCSCCCCCCCC(=O)OCC 62a_100011713584_100009991516 [0,1,1,0,0,0|0,0,2]=4 6838 B17R0.250 C=CCCNCCCCCCCCC(=O)OCC 2230a_100015191253_100010175975 [0,1,1,0,0,0|0,0,2]=4 6839 B17R0.250 C=CCCOCCCCCCCCC(=O)OCC 34a_100011205117_100010175975 [0,1,1,0,0,0|0,0,2]=4 6840 B17R0.250 C=CCCSCCCCCCCCC(=O)OCC 62a_100000754431_100010175975 [0,1,1,0,0,0|0,0,2]=4 6841 B17R0.250 C=CCNCCCCCCCCCC(=O)OCC 2230a_100020586998_100009828014 [0,1,1,0,0,0|0,0,2]=4 6842 B17R0.250 C=CCOCCCCCCCCCC(=O)OCC 34a_200000210373_100009828014 [0,1,1,0,0,0|0,0,2]=4 6843 B17R0.250 C=CCSCCCCCCCCCC(=O)OCC 62a_100000210623_100009828014 [0,1,1,0,0,0|0,0,2]=4 6844 B17R0.250 C=COC(=O)CNCCCCCCCCCCC 2230a_200011215754_100000036128 [0,1,1,0,0,0|0,0,2]=4 6845 B17R0.250 C=COC(=O)CNCCCCCCCCCCC 34a_200011215754_100000036128 [0,1,1,0,0,0|0,0,2]=4 6846 B17R0.250 C=COC(=O)COCCCCCCCCCCC 34a_100000210809_100000036128 [0,1,1,0,0,0|0,0,2]=4 6847 B17R0.250 C=COC(=O)CSCCCCCCCCCCC 62a_100000036128_100011215454 [0,1,1,0,0,0|0,0,2]=4 6848 B17R0.250 CC#CC(=O)CCCCCCCCCCCCC 1458a_100000763181_100000210684 [0,1,1,0,0,0|1,0,1]=4 6849 B17R0.250 CC#CC(=O)CCCCCCCCCCCCO 1458a_100000763181_100009813331 [0,1,1,0,0,0|1,0,1]=4 6850 B17R0.250 CC#CCCOCCCCCCCC(=O)OCC 34a_100000750427_100009991516 [0,1,1,0,0,0|0,0,2]=4 6851 B17R0.250 CC#CCNCCCCCCCCC(=O)OCC 2230a_100000685387_100010175975 [0,1,1,0,0,0|0,0,2]=4 6852 B17R0.250 CC#CCNCCCCCCCCC(=O)OCC 34a_100000685387_100010175975 [0,1,1,0,0,0|0,0,2]=4 6853 B17R0.250 CC#CCOCCCCCCCCC(=O)OCC 34a_100000761923_100010175975 [0,1,1,0,0,0|0,0,2]=4 6854 B17R0.250 CC#CCSCCCCCCCCC(=O)OCC 62a_100000748600_100010175975 [0,1,1,0,0,0|0,0,2]=4 6855 B17R0.250 CC/C=C/CCCOCCCCCC(=O)OCC 34a_100016287902_100000755133 [0,1,1,0,0,0|0,0,2]=4 6856 B17R0.250 CC/C=C/CCCOCCCCCC(=O)OCC 7a_100016287902_100000755133 [0,1,1,0,0,0|0,0,2]=4 6857 B17R0.250 CC/C=C\CCCCCOCCCC(=O)OCC 34a_100016268722_100009991533 [0,1,1,0,0,0|0,0,2]=4 6858 B17R0.250 CC/C=C\CCCCCOCCCC(=O)OCC 7a_100016268722_100011215271 [0,1,1,0,0,0|0,0,2]=4 6859 B17R0.250 CC/C=C\CCCCOCCCCC(=O)OCC 34a_100016287862_100000750268 [0,1,1,0,0,0|0,0,2]=4 6860 B17R0.250 CC/C=C\CCCCOCCCCC(=O)OCC 7a_100016287862_100000750268 [0,1,1,0,0,0|0,0,2]=4 6861 B17R0.250 CC/C=C\CCOCCCCCCC(=O)OCC 34a_100016288707_100009814379 [0,1,1,0,0,0|0,0,2]=4 6862 B17R0.250 CC/C=C\CCOCCCCCCC(=O)OCC 7a_100016288707_100009814379 [0,1,1,0,0,0|0,0,2]=4 6863 B17R0.250 CC/C=C\CCSCCCCCCC(=O)OCC 62a_100015370543_100009814379 [0,1,1,0,0,0|0,0,2]=4 6864 B17R0.250 CC/C=C\COCCCCCCCC(=O)OCC 34a_100016268518_100009991516 [0,1,1,0,0,0|0,0,2]=4 6865 B17R0.250 CC/C=C\CSCCCCCCCC(=O)OCC 62a_100103147603_100009991516 [0,1,1,0,0,0|0,0,2]=4 6866 B17R0.250 CC=CC(=O)CCCCCCCCCCCCC 1458a_100000210699_100000210684 [0,1,1,0,0,0|1,0,1]=4 6867 B17R0.250 CC=CC(=O)CCCCCCCCCCCCO 1458a_100000210699_100009813331 [0,1,1,0,0,0|1,0,1]=4 6868 B17R0.250 CC=CC(=O)NCCCCCCCCCCCC 11a_100000210451_100000210699 [0,1,1,0,0,0|1,0,1]=4 6869 B17R0.250 CC=CC(=O)NCCCCCCCCCCCC 1626a_100000210451_100000210699 [0,1,1,0,0,0|1,0,1]=4 6870 B17R0.250 CC=CC(=O)NCCCCCCCCCCCC 240690a_100000210451_100000210699 [0,1,1,0,0,0|1,0,1]=4 6871 B17R0.250 CC=CCCCOCCCCCCC(=O)OCC 34a_100020645299_100009814379 [0,1,1,0,0,0|0,0,2]=4 6872 B17R0.250 CC=CCSCCCCCCCCC(=O)OCC 62a_100000070051_100010175975 [0,1,1,0,0,0|0,0,2]=4 6873 B17R0.250 CCC#CCCCCCCSCCC(=O)OCC 62a_100000765890_200000036426 [0,1,1,0,0,0|0,0,2]=4 6874 B17R0.250 CCC#CCCCCCCSCCC(=O)OCC 62a_200000036426_100000765890 [0,1,1,0,0,0|0,0,2]=4 6875 B17R0.250 CCC#CCCCCCCSCOC(=O)CCC 62a_200000036426_100000034017 [0,1,1,0,0,0|0,0,2]=4 6876 B17R0.250 CCC#CCCOCCCCCCC(=O)OCC 34a_100000036655_100009814379 [0,1,1,0,0,0|0,0,2]=4 6877 B17R0.250 CCC#CCCOCCCCCCC(=O)OCC 7a_100000036655_100009814379 [0,1,1,0,0,0|0,0,2]=4 6878 B17R0.250 CCC#CCOCCCCCCCC(=O)OCC 34a_100000032950_100009991516 [0,1,1,0,0,0|0,0,2]=4 6879 B17R0.250 CCC#CCSCCCCCCCC(=O)OCC 62a_100009813939_100009991516 [0,1,1,0,0,0|0,0,2]=4 6880 B17R0.250 CCC/C=C/COCCCCCCC(=O)OCC 34a_100016278788_100009814379 [0,1,1,0,0,0|0,0,2]=4 6881 B17R0.250 CCC/C=C/COCCCCCCC(=O)OCC 7a_100016278788_100009814379 [0,1,1,0,0,0|0,0,2]=4 6882 B17R0.250 CCCC#CCCOCCCCCC(=O)OCC 34a_100000042726_100000755133 [0,1,1,0,0,0|0,0,2]=4 6883 B17R0.250 CCCC#CCCOCCCCCC(=O)OCC 7a_100000042726_100000755133 [0,1,1,0,0,0|0,0,2]=4 6884 B17R0.250 CCCC#CCOCCCCCCC(=O)OCC 34a_100000034806_100009814379 [0,1,1,0,0,0|0,0,2]=4 6885 B17R0.250 CCCC#CCOCCCCCCC(=O)OCC 7a_100000034806_100009814379 [0,1,1,0,0,0|0,0,2]=4 6886 B17R0.250 CCCC(=O)CCCCCCCCCCCCO 1458a_100000211992_100009813331 [0,1,1,0,0,0|1,0,0]=3 6887 B17R0.250 CCCC(=O)CCCCCCOCCCCCO 1458a_100000211992_200132310570 [0,1,1,0,0,0|2,0,0]=4 6888 B17R0.250 CCCC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000747444 [0,1,1,0,0,0|2,0,0]=4 6889 B17R0.250 CCCC(=O)COCCCCCCCCCCBr 7a_100009813290_100000747444 [0,1,1,0,0,0|1,0,0]=3 6890 B17R0.250 CCCC(=O)COCCCCCCCCCCCl 7a_200000033068_100000747444 [0,1,1,0,0,0|1,0,0]=3 6891 B17R0.250 CCCC(=O)CSCCCCCCCCCCO 62a_100000747444_200000033068 [0,1,1,0,0,0|1,1,0]=4 6892 B17R0.250 CCCC(=O)CSCCCCCCCCCCO 62a_100009813290_100000747444 [0,1,1,0,0,0|1,1,0]=4 6893 B17R0.250 CCCC(=O)OCNCCCCCCCCCO 2230a_100000078944_100000034017 [0,1,1,0,0,0|1,0,0]=3 6894 B17R0.250 CCCC(=O)OCNCCCCCCCCCO 34a_100000078944_100000034017 [0,1,1,0,0,0|1,0,0]=3 6895 B17R0.250 CCCC(=O)OCOCCCCCCCCCBr 34a_100009813782_100000034017 [0,1,1,0,0,0|1,0,0]=3 6896 B17R0.250 CCCC(=O)OCOCCCCCCCCCCl 34a_100009868337_100000034017 [0,1,1,0,0,0|1,0,0]=3 6897 B17R0.250 CCCC(=O)OCOCCCCCCCCCN 34a_100000078944_100000034017 [0,1,1,0,0,0|1,0,0]=3 6898 B17R0.250 CCCC(=O)OCSCCCCCCCCCO 62a_100009813782_100000034017 [0,1,1,0,0,0|1,0,0]=3 6899 B17R0.250 CCCC(C)OCCCCCCCCCCCO 34a_100000764384_100009812471 [0,1,1,0,0,0|1,0,1]=4 6900 B17R0.250 CCCC(C)OCCCCCCCCCCCO 7a_100000764384_100009812471 [0,1,1,0,0,0|1,0,1]=4 6901 B17R0.250 CCCC(C)OCCCCCCCCCOCC 34a_100009875440_100000766640 [0,1,1,0,0,0|1,0,1]=4 6902 B17R0.250 CCCC(C)OCCCCCCCCCOCC 7a_100009875440_100000766640 [0,1,1,0,0,0|1,0,1]=4 6903 B17R0.250 CCCC/C=C/CCCCOCCC(=O)OCC 34a_200020645093_100000765890 [0,1,1,0,0,0|0,0,2]=4 6904 B17R0.250 CCCC/C=C/CCCCOCCC(=O)OCC 7a_200020645093_100011206558 [0,1,1,0,0,0|0,0,2]=4 6905 B17R0.250 CCCC/C=C/CCCCOCOC(=O)CCC 34a_200020645093_100000034017 [0,1,1,0,0,0|0,0,2]=4 6906 B17R0.250 CCCC/C=C/COCCCCCC(=O)OCC 34a_200016272032_100000755133 [0,1,1,0,0,0|0,0,2]=4 6907 B17R0.250 CCCC/C=C/COCCCCCC(=O)OCC 7a_200016272032_100000755133 [0,1,1,0,0,0|0,0,2]=4 6908 B17R0.250 CCCC/C=C\CCOCCCCC(=O)OCC 34a_200016286491_100000750268 [0,1,1,0,0,0|0,0,2]=4 6909 B17R0.250 CCCC/C=C\CCOCCCCC(=O)OCC 7a_200016286491_100000750268 [0,1,1,0,0,0|0,0,2]=4 6910 B17R0.250 CCCCC#CCCCCOCCC(=O)OCC 34a_200000066234_100000765890 [0,1,1,0,0,0|0,0,2]=4 6911 B17R0.250 CCCCC#CCCCCOCCC(=O)OCC 7a_200000066234_100011206558 [0,1,1,0,0,0|0,0,2]=4 6912 B17R0.250 CCCCC#CCCCCOCOC(=O)CCC 34a_200000066234_100000034017 [0,1,1,0,0,0|0,0,2]=4 6913 B17R0.250 CCCCC#CCCCOCCCC(=O)OCC 7a_100012001163_200000047210 [0,1,1,0,0,0|0,0,2]=4 6914 B17R0.250 CCCCC#CCCCSCCCC(=O)OCC 62a_100009991533_200000047210 [0,1,1,0,0,0|0,0,2]=4 6915 B17R0.250 CCCCC#CCCCSCCCC(=O)OCC 62a_200000047210_100009991533 [0,1,1,0,0,0|0,0,2]=4 6916 B17R0.250 CCCCC#CCCOCCCCC(=O)OCC 34a_100000037610_100000750268 [0,1,1,0,0,0|0,0,2]=4 6917 B17R0.250 CCCCC#CCCOCCCCC(=O)OCC 7a_100000037610_100000750268 [0,1,1,0,0,0|0,0,2]=4 6918 B17R0.250 CCCCC#CCOCCCCCC(=O)OCC 34a_200000034558_100000755133 [0,1,1,0,0,0|0,0,2]=4 6919 B17R0.250 CCCCC#CCOCCCCCC(=O)OCC 7a_200000034558_100000755133 [0,1,1,0,0,0|0,0,2]=4 6920 B17R0.250 CCCCC/C=C/COCCCCC(=O)OCC 34a_100016258190_100000750268 [0,1,1,0,0,0|0,0,2]=4 6921 B17R0.250 CCCCC/C=C/COCCCCC(=O)OCC 7a_100016258190_100000750268 [0,1,1,0,0,0|0,0,2]=4 6922 B17R0.250 CCCCC/C=C\CCCOCCC(=O)OCC 34a_100020655193_100000765890 [0,1,1,0,0,0|0,0,2]=4 6923 B17R0.250 CCCCC/C=C\CCCOCCC(=O)OCC 7a_100020655193_100011206558 [0,1,1,0,0,0|0,0,2]=4 6924 B17R0.250 CCCCC/C=C\CCCOCOC(=O)CCC 34a_100020655193_100000034017 [0,1,1,0,0,0|0,0,2]=4 6925 B17R0.250 CCCCC/C=C\CCOCCCC(=O)OCC 34a_100016277358_100009991533 [0,1,1,0,0,0|0,0,2]=4 6926 B17R0.250 CCCCC/C=C\CCOCCCC(=O)OCC 7a_100016277358_100011215271 [0,1,1,0,0,0|0,0,2]=4 6927 B17R0.250 CCCCCC#CCCOCCCC(=O)OCC 34a_200000042877_100009991533 [0,1,1,0,0,0|0,0,2]=4 6928 B17R0.250 CCCCCC#CCCOCCCC(=O)OCC 7a_200000042877_100011215271 [0,1,1,0,0,0|0,0,2]=4 6929 B17R0.250 CCCCCC#CCOCCCCC(=O)OCC 34a_200000033628_100000750268 [0,1,1,0,0,0|0,0,2]=4 6930 B17R0.250 CCCCCC#CCOCCCCC(=O)OCC 7a_200000033628_100000750268 [0,1,1,0,0,0|0,0,2]=4 6931 B17R0.250 CCCCCC#CCSCCCCC(=O)OCC 62a_100000750268_100009816472 [0,1,1,0,0,0|0,0,2]=4 6932 B17R0.250 CCCCCC#CCSCCCCC(=O)OCC 62a_100009816472_100000750268 [0,1,1,0,0,0|0,0,2]=4 6933 B17R0.250 CCCCCC/C=C/COCCCC(=O)OCC 34a_200016276170_100009991533 [0,1,1,0,0,0|0,0,2]=4 6934 B17R0.250 CCCCCC/C=C/COCCCC(=O)OCC 7a_200016276170_100011215271 [0,1,1,0,0,0|0,0,2]=4 6935 B17R0.250 CCCCCCC#CCCOCCC(=O)OCC 34a_200000033163_100000765890 [0,1,1,0,0,0|0,0,2]=4 6936 B17R0.250 CCCCCCC#CCCOCCC(=O)OCC 7a_200000033163_100011206558 [0,1,1,0,0,0|0,0,2]=4 6937 B17R0.250 CCCCCCC#CCCOCOC(=O)CCC 34a_200000033163_100000034017 [0,1,1,0,0,0|0,0,2]=4 6938 B17R0.250 CCCCCCC#CCOCCCC(=O)OCC 34a_200000037284_100009991533 [0,1,1,0,0,0|0,0,2]=4 6939 B17R0.250 CCCCCCC#CCOCCCC(=O)OCC 7a_200000037284_100011215271 [0,1,1,0,0,0|0,0,2]=4 6940 B17R0.250 CCCCCCCC#CCOCCC(=O)OCC 34a_200000061759_100000765890 [0,1,1,0,0,0|0,0,2]=4 6941 B17R0.250 CCCCCCCC#CCOCCC(=O)OCC 7a_200000061759_100011206558 [0,1,1,0,0,0|0,0,2]=4 6942 B17R0.250 CCCCCCCC#CCOCOC(=O)CCC 34a_200000061759_100000034017 [0,1,1,0,0,0|0,0,2]=4 6943 B17R0.250 CCCCCCCC/C=C/COCC(=O)CCC 7a_200020667288_100000747444 [0,1,1,0,0,0|0,0,2]=4 6944 B17R0.250 CCCCCCCC/C=C/COCC(=O)OCC 34a_200020667288_100000188475 [0,1,1,0,0,0|0,0,2]=4 6945 B17R0.250 CCCCCCCC/C=C/COCC(=O)OCC 7a_200020667288_100000188475 [0,1,1,0,0,0|0,0,2]=4 6946 B17R0.250 CCCCCCCCCCC=NNC(=O)CCC 4a_100000189770_100011218819 [0,1,1,0,0,0|1,0,1]=4 6947 B17R0.250 CCCCCCCCCCCCCC(=O)CCF 1458a_100000756256_100011217306 [0,1,1,0,0,0|2,0,0]=4 6948 B17R0.250 CCCCCCCCCCCCCC(=O)CCO 1458a_100000756256_100000211926 [0,1,1,0,0,0|2,0,0]=4 6949 B17R0.250 CCCCCCCCCCCCCC(=O)CCO 1458a_100011216618_100000210684 [0,1,1,0,0,0|2,0,0]=4 6950 B17R0.250 CCCCCCCCCCCCCC(=O)COC 1458a_100000210968_100000210684 [0,1,1,0,0,0|2,0,0]=4 6951 B17R0.250 CCCCCCCCCCCCCC(=O)CSC 1458a_100000184570_100000210684 [0,1,1,0,0,0|2,0,0]=4 6952 B17R0.250 CCCCCCCCCCCCCC(=O)NCC 11a_100015525214_100000756256 [0,1,1,0,0,0|1,0,0]=3 6953 B17R0.250 CCCCCCCCCCCCCC(=O)NCC 240690a_100015525214_100000756256 [0,1,1,0,0,0|1,0,0]=3 6954 B17R0.250 CCCCCCCCCCCCCC(=O)NNC 22a_100016993582_100000756256 [0,1,1,0,0,0|2,0,0]=4 6955 B17R0.250 CCCCCCCCCCCCNC(=O)CCC 11a_100000210451_100000211992 [0,1,1,0,0,0|1,0,0]=3 6956 B17R0.250 CCCCCCCCCCCCNC(=O)CCC 1626a_100000210451_100000211992 [0,1,1,0,0,0|1,0,0]=3 6957 B17R0.250 CCCCCCCCCCCCNC(=O)CCC 240690a_100000210451_100000211992 [0,1,1,0,0,0|1,0,0]=3 6958 B17R0.250 CCCCCCCCCCCCNC(=O)CCC 527a_100000210451_100000211992 [0,1,1,0,0,0|1,0,0]=3 6959 B17R0.250 CCCCCCCCCCCCNC(=O)CCO 240690a_100000210451_100011216618 [0,1,1,0,0,0|2,0,0]=4 6960 B17R0.250 CCCCCCCCCCCCNC(=O)COC 11a_100000210451_100000210968 [0,1,1,0,0,0|2,0,0]=4 6961 B17R0.250 CCCCCCCCCCCCNC(=O)COC 1626a_100000210451_100000210968 [0,1,1,0,0,0|2,0,0]=4 6962 B17R0.250 CCCCCCCCCCCCNC(=O)COC 240690a_100000210451_100000210968 [0,1,1,0,0,0|2,0,0]=4 6963 B17R0.250 CCCCCCCCCCCCNC(=O)COC 527a_100000210451_100000210968 [0,1,1,0,0,0|2,0,0]=4 6964 B17R0.250 CCCCCCCCCCCCNC(=O)CSC 11a_100000210451_100000184570 [0,1,1,0,0,0|2,0,0]=4 6965 B17R0.250 CCCCCCCCCCCCNC(=O)CSC 1626a_100000210451_100000184570 [0,1,1,0,0,0|2,0,0]=4 6966 B17R0.250 CCCCCCCCCCCCNC(=O)CSC 240690a_100000210451_100000184570 [0,1,1,0,0,0|2,0,0]=4 6967 B17R0.250 CCCCCCCCCCCCNC(=O)CSC 527a_100000210451_100000184570 [0,1,1,0,0,0|2,0,0]=4 6968 B17R0.250 CCCCCCCCCCCCNC(=O)NCC 2708a_100000210451_100015525214 [0,1,1,0,0,0|1,0,0]=3 6969 B17R0.250 CCCCCCCCCCCCNC(=O)NCC 2708a_100015525214_100000210451 [0,1,1,0,0,0|1,0,0]=3 6970 B17R0.250 CCCCCCCCCCCCNC(=O)NCC 273464a_100000210451_100015525214 [0,1,1,0,0,0|1,0,0]=3 6971 B17R0.250 CCCCCCCCCCCCNC(=O)NCC 273464a_100015525214_100000210451 [0,1,1,0,0,0|1,0,0]=3 6972 B17R0.250 CCCCCCCCCCCCNC(=O)NCC 512a_100000210451_100015525214 [0,1,1,0,0,0|1,0,0]=3 6973 B17R0.250 CCCCCCCCCCCCNC(=O)NCC 512a_100015525214_100000210451 [0,1,1,0,0,0|1,0,0]=3 6974 B17R0.250 CCCCCCCCCCCCNC(=O)NNC 273464a_100000210451_100016993582 [0,1,1,0,0,0|2,0,0]=4 6975 B17R0.250 CCCCCCCCCCCCNC(=O)NNC 512a_100000210451_100016993582 [0,1,1,0,0,0|2,0,0]=4 6976 B17R0.250 CCCCCCCCCCCCNC(=O)NNC 512a_100016993582_100000210451 [0,1,1,0,0,0|2,0,0]=4 6977 B17R0.250 CCCCCCCCCCCNCC(=O)CCC 2230a_200011215754_100000747444 [0,1,1,0,0,0|1,0,0]=3 6978 B17R0.250 CCCCCCCCCCCNCC(=O)NCC 2230a_100016988866_100011215454 [0,1,1,0,0,0|1,0,0]=3 6979 B17R0.250 CCCCCCCCCCCNCC(=O)NCC 2230a_200011215754_100000183381 [0,1,1,0,0,0|1,0,0]=3 6980 B17R0.250 CCCCCCCCCCCNCC(=O)NCC 34a_200011215754_100000183381 [0,1,1,0,0,0|1,0,0]=3 6981 B17R0.250 CCCCCCCCCCCNCC(=O)NCO 2230a_200011215754_100000185155 [0,1,1,0,0,0|2,0,0]=4 6982 B17R0.250 CCCCCCCCCCCNCC(=O)NCO 34a_200011215754_100000185155 [0,1,1,0,0,0|2,0,0]=4 6983 B17R0.250 CCCCCCCCCCCNCC(=O)OCC 2230a_200011215754_100000188475 [0,1,1,0,0,0|0,0,0]=2 6984 B17R0.250 CCCCCCCCCCCNCC(=O)OCC 34a_200011215754_100000188475 [0,1,1,0,0,0|0,0,0]=2 6985 B17R0.250 CCCCCCCCCCCOCC(=O)CCC 7a_100000210809_100000747444 [0,1,1,0,0,0|0,0,0]=2 6986 B17R0.250 CCCCCCCCCCCOCC(=O)NCC 34a_100000210809_100000183381 [0,1,1,0,0,0|1,0,0]=3 6987 B17R0.250 CCCCCCCCCCCOCC(=O)NCC 7a_100000210809_100000183381 [0,1,1,0,0,0|1,0,0]=3 6988 B17R0.250 CCCCCCCCCCCOCC(=O)NCO 34a_100000210809_100000185155 [0,1,1,0,0,0|2,0,0]=4 6989 B17R0.250 CCCCCCCCCCCOCC(=O)NCO 7a_100000210809_100000185155 [0,1,1,0,0,0|2,0,0]=4 6990 B17R0.250 CCCCCCCCCCCOCC(=O)OCC 34a_100000210809_100000188475 [0,1,1,0,0,0|0,0,0]=2 6991 B17R0.250 CCCCCCCCCCCOCC(=O)OCC 7a_100000210809_100000188475 [0,1,1,0,0,0|0,0,0]=2 6992 B17R0.250 CCCCCCCCCCCOCC(C)CCC 34a_100000210809_100011216630 [0,1,1,0,0,0|1,0,1]=4 6993 B17R0.250 CCCCCCCCCCCOCC(C)CCC 34a_100000688023_100011215454 [0,1,1,0,0,0|1,0,1]=4 6994 B17R0.250 CCCCCCCCCCCOCC(C)CCC 7a_100000210809_100011216630 [0,1,1,0,0,0|1,0,1]=4 6995 B17R0.250 CCCCCCCCCCCOCC(C)CCC 7a_100000688023_100011215454 [0,1,1,0,0,0|1,0,1]=4 6996 B17R0.250 CCCCCCCCCCCOC[C@@H](N)CCC 34a_100000732646_100011215454 [0,1,1,0,0,0|1,0,1]=4 6997 B17R0.250 CCCCCCCCCCCSCC(=O)CCC 62a_100000747444_100011215454 [0,1,1,0,0,0|0,1,0]=3 6998 B17R0.250 CCCCCCCCCCCSCC(=O)NCC 62a_100000183381_100011215454 [0,1,1,0,0,0|1,0,0]=3 6999 B17R0.250 CCCCCCCCCCCSCC(=O)NCO 62a_100000185155_100011215454 [0,1,1,0,0,0|2,0,0]=4 7000 B17R0.250 CCCCCCCCCCCSCC(=O)OCC 62a_100000188475_100011215454 [0,1,1,0,0,0|0,0,0]=2 7001 B17R0.250 CCCCCCCCCCNCCC(=O)NCC 2230a_100000684558_100000737597 [0,1,1,0,0,0|1,0,0]=3 7002 B17R0.250 CCCCCCCCCCNCCC(=O)NCC 34a_100025743525_100000210320 [0,1,1,0,0,0|1,0,0]=3 7003 B17R0.250 CCCCCCCCCCNCCC(=O)OCC 2230a_100000684558_100011206558 [0,1,1,0,0,0|0,0,0]=2 7004 B17R0.250 CCCCCCCCCCNCCC(=O)OCC 34a_100000684558_100000765890 [0,1,1,0,0,0|0,0,0]=2 7005 B17R0.250 CCCCCCCCCCNCOC(=O)CCC 2230a_100000684558_100000034017 [0,1,1,0,0,0|0,0,0]=2 7006 B17R0.250 CCCCCCCCCCNCOC(=O)CCC 34a_100000684558_100000034017 [0,1,1,0,0,0|0,0,0]=2 7007 B17R0.250 CCCCCCCCCCOCCC(=O)NCC 7a_100000210711_100000737597 [0,1,1,0,0,0|1,0,0]=3 7008 B17R0.250 CCCCCCCCCCOCCC(=O)OCC 34a_100000210711_100000765890 [0,1,1,0,0,0|0,0,0]=2 7009 B17R0.250 CCCCCCCCCCOCCC(=O)OCC 7a_100000210711_100011206558 [0,1,1,0,0,0|0,0,0]=2 7010 B17R0.250 CCCCCCCCCCOCOC(=O)CCC 34a_100000210711_100000034017 [0,1,1,0,0,0|0,0,0]=2 7011 B17R0.250 CCCCCCCCCCSCCC(=O)NCC 62a_100000737597_100000210320 [0,1,1,0,0,0|1,0,0]=3 7012 B17R0.250 CCCCCCCCCCSCCC(=O)OCC 62a_100000765890_100000210320 [0,1,1,0,0,0|0,0,0]=2 7013 B17R0.250 CCCCCCCCCNC/C=C/C(=O)OCC 2230a_100000212291_100016267167 [0,1,1,0,0,0|0,0,2]=4 7014 B17R0.250 CCCCCCCCCNC/C=C/C(=O)OCC 34a_100000212291_100016267167 [0,1,1,0,0,0|0,0,2]=4 7015 B17R0.250 CCCCCCCCCNCCCC(=O)OCC 2230a_100000212291_100009991533 [0,1,1,0,0,0|0,0,0]=2 7016 B17R0.250 CCCCCCCCCNCCCC(=O)OCC 34a_100000212291_100009991533 [0,1,1,0,0,0|0,0,0]=2 7017 B17R0.250 CCCCCCCCCOC/C=C/C(=O)OCC 34a_100000210712_100016267167 [0,1,1,0,0,0|0,0,2]=4 7018 B17R0.250 CCCCCCCCCOC/C=C/C(=O)OCC 7a_100000210712_100016267167 [0,1,1,0,0,0|0,0,2]=4 7019 B17R0.250 CCCCCCCCCOCCCC(=O)OCC 34a_100000210712_100009991533 [0,1,1,0,0,0|0,0,0]=2 7020 B17R0.250 CCCCCCCCCOCCCC(=O)OCC 7a_100000210712_100011215271 [0,1,1,0,0,0|0,0,0]=2 7021 B17R0.250 CCCCCCCCCOCCCC(=O)OCC 7a_100012001163_100000210328 [0,1,1,0,0,0|0,0,0]=2 7022 B17R0.250 CCCCCCCCCOCCNC(=O)OCC 34a_100000158857_100011214924 [0,1,1,0,0,0|1,0,0]=3 7023 B17R0.250 CCCCCCCCCOCCNC(=O)OCC 7a_100000210712_200011445536 [0,1,1,0,0,0|1,0,0]=3 7024 B17R0.250 CCCCCCCCCSC/C=C/C(=O)OCC 62a_100016267167_100000210670 [0,1,1,0,0,0|0,0,2]=4 7025 B17R0.250 CCCCCCCCCSCCCC(=O)OCC 62a_100009991533_100000210670 [0,1,1,0,0,0|0,0,0]=2 7026 B17R0.250 CCCCCCCCNCCCCC(=O)OCC 2230a_100000229939_100000750268 [0,1,1,0,0,0|0,0,0]=2 7027 B17R0.250 CCCCCCCCNCCCCC(=O)OCC 34a_100000229939_100000750268 [0,1,1,0,0,0|0,0,0]=2 7028 B17R0.250 CCCCCCCCNCCOCC(=O)OCC 2230a_100000229939_100000088970 [0,1,1,0,0,0|1,0,0]=3 7029 B17R0.250 CCCCCCCCNCCOCC(=O)OCC 34a_100000229939_100000088970 [0,1,1,0,0,0|1,0,0]=3 7030 B17R0.250 CCCCCCCCOCCCCC(=O)OCC 34a_100000210232_100000750268 [0,1,1,0,0,0|0,0,0]=2 7031 B17R0.250 CCCCCCCCOCCCCC(=O)OCC 7a_100000210232_100000750268 [0,1,1,0,0,0|0,0,0]=2 7032 B17R0.250 CCCCCCCCOCCOCC(=O)OCC 34a_100000210232_100000088970 [0,1,1,0,0,0|1,0,0]=3 7033 B17R0.250 CCCCCCCCOCCOCC(=O)OCC 7a_100000210232_100000088970 [0,1,1,0,0,0|1,0,0]=3 7034 B17R0.250 CCCCCCCCOCCSCC(=O)OCC 7a_200000230590_100000210759 [0,1,1,0,0,0|1,0,0]=3 7035 B17R0.250 CCCCCCCCSCCCCC(=O)OCC 62a_100000210759_100000750268 [0,1,1,0,0,0|0,0,0]=2 7036 B17R0.250 CCCCCCCCSCCCCC(=O)OCC 62a_100000750268_100000210317 [0,1,1,0,0,0|0,0,0]=2 7037 B17R0.250 CCCCCCCCSCCOCC(=O)OCC 62a_100000088970_100000210317 [0,1,1,0,0,0|1,0,0]=3 7038 B17R0.250 CCCCCCCCSCCOCC(=O)OCC 62a_100000210759_100000088970 [0,1,1,0,0,0|1,0,0]=3 7039 B17R0.250 CCCCCCCNCCCCCC(=O)OCC 2230a_100000229938_100000755133 [0,1,1,0,0,0|0,0,0]=2 7040 B17R0.250 CCCCCCCNCCCOCC(=O)OCC 2230a_100000229938_100009893628 [0,1,1,0,0,0|1,0,0]=3 7041 B17R0.250 CCCCCCCOCCCCCC(=O)OCC 34a_100000210272_100000755133 [0,1,1,0,0,0|0,0,0]=2 7042 B17R0.250 CCCCCCCOCCCCCC(=O)OCC 7a_100000210272_100000755133 [0,1,1,0,0,0|0,0,0]=2 7043 B17R0.250 CCCCCCCOCCCCCC(=O)OCC 7a_100011214988_100000210614 [0,1,1,0,0,0|0,0,0]=2 7044 B17R0.250 CCCCCCCOCCCOCC(=O)OCC 34a_100000210272_100009893628 [0,1,1,0,0,0|1,0,0]=3 7045 B17R0.250 CCCCCCCOCCCOCC(=O)OCC 7a_100000210272_100009893628 [0,1,1,0,0,0|1,0,0]=3 7046 B17R0.250 CCCCCCCSCCCCCC(=O)OCC 62a_100000210614_100000755133 [0,1,1,0,0,0|0,0,0]=2 7047 B17R0.250 CCCCCCCSCCCCCC(=O)OCC 62a_100000755133_100000210316 [0,1,1,0,0,0|0,0,0]=2 7048 B17R0.250 CCCCCCCSCCCOCC(=O)OCC 62a_100000210614_100009893628 [0,1,1,0,0,0|1,0,0]=3 7049 B17R0.250 CCCCCCCSCCCOCC(=O)OCC 62a_100009893628_100000210316 [0,1,1,0,0,0|1,0,0]=3 7050 B17R0.250 CCCCCCNCCCCCCC(=O)OCC 2230a_100000210581_100009814379 [0,1,1,0,0,0|0,0,0]=2 7051 B17R0.250 CCCCCCOCCCCCCC(=O)OCC 34a_100000210259_100009814379 [0,1,1,0,0,0|0,0,0]=2 7052 B17R0.250 CCCCCCOCCCCCCC(=O)OCC 7a_100000210259_100009814379 [0,1,1,0,0,0|0,0,0]=2 7053 B17R0.250 CCCCCCOCCOCCCC(=O)OCC 34a_100000691444_100009991533 [0,1,1,0,0,0|1,0,0]=3 7054 B17R0.250 CCCCCCOCCOCCCC(=O)OCC 7a_100000691444_100011215271 [0,1,1,0,0,0|1,0,0]=3 7055 B17R0.250 CCCCCCOCCOCCNC(=O)OCC 7a_100000691444_200011445536 [0,1,1,0,0,0|2,0,0]=4 7056 B17R0.250 CCCCCCSCCCCCCC(=O)OCC 62a_100000210314_100009814379 [0,1,1,0,0,0|0,0,0]=2 7057 B17R0.250 CCCCCNCCCCCCCC(=O)OCC 2230a_100000209983_100009991516 [0,1,1,0,0,0|0,0,0]=2 7058 B17R0.250 CCCCCNCCOCCCCC(=O)OCC 34a_100000224656_100000750268 [0,1,1,0,0,0|1,0,0]=3 7059 B17R0.250 CCCCCNCCOCCOCC(=O)OCC 34a_100000224656_100000088970 [0,1,1,0,0,0|2,0,0]=4 7060 B17R0.250 CCCCCNN=CCCCCCC(=O)OCC 4a_100000694160_100000085164 [0,1,1,0,0,0|1,0,1]=4 7061 B17R0.250 CCCCCOCCCCCCCC(=O)OCC 34a_100000210253_100009991516 [0,1,1,0,0,0|0,0,0]=2 7062 B17R0.250 CCCCCOCCCCCCCC(=O)OCC 7a_100000210253_100009991516 [0,1,1,0,0,0|0,0,0]=2 7063 B17R0.250 CCCCCOCCOCCCCC(=O)OCC 34a_100011215259_100000750268 [0,1,1,0,0,0|1,0,0]=3 7064 B17R0.250 CCCCCOCCOCCCCC(=O)OCC 7a_100011215259_100000750268 [0,1,1,0,0,0|1,0,0]=3 7065 B17R0.250 CCCCCOCCOCCOCC(=O)OCC 34a_100011215259_100000088970 [0,1,1,0,0,0|2,0,0]=4 7066 B17R0.250 CCCCCOCCOCCOCC(=O)OCC 7a_100011215259_100000088970 [0,1,1,0,0,0|2,0,0]=4 7067 B17R0.250 CCCCCSCCCCCCCC(=O)OCC 62a_100000210326_100009991516 [0,1,1,0,0,0|0,0,0]=2 7068 B17R0.250 CCCCNCCCCCCCCC(=O)OCC 2230a_100000102301_100010175975 [0,1,1,0,0,0|0,0,0]=2 7069 B17R0.250 CCCCNCCCCCCCCC(=O)OCC 7a_106832991798_100010175975 [0,1,1,0,0,0|0,0,0]=2 7070 B17R0.250 CCCCNCCCCOCCCC(=O)OCC 34a_200011216965_100009991533 [0,1,1,0,0,0|1,0,0]=3 7071 B17R0.250 CCCCOCCCCCCCCC(=O)OCC 34a_100000210227_100010175975 [0,1,1,0,0,0|0,0,0]=2 7072 B17R0.250 CCCCOCCCCCCCCC(=O)OCC 7a_100000210227_100010175975 [0,1,1,0,0,0|0,0,0]=2 7073 B17R0.250 CCCCOCCCCOCCCC(=O)OCC 34a_200000760531_100009991533 [0,1,1,0,0,0|1,0,0]=3 7074 B17R0.250 CCCCOCCCCOCCCC(=O)OCC 7a_200000760531_100011215271 [0,1,1,0,0,0|1,0,0]=3 7075 B17R0.250 CCCCOCCCCOCCNC(=O)OCC 7a_200000760531_200011445536 [0,1,1,0,0,0|2,0,0]=4 7076 B17R0.250 CCCCOCCCNCCCCC(=O)OCC 2230a_200000211371_100000750268 [0,1,1,0,0,0|1,0,0]=3 7077 B17R0.250 CCCCOCCCNCCCCC(=O)OCC 34a_200000211371_100000750268 [0,1,1,0,0,0|1,0,0]=3 7078 B17R0.250 CCCCOCCCNCCOCC(=O)OCC 2230a_200000211371_100000088970 [0,1,1,0,0,0|2,0,0]=4 7079 B17R0.250 CCCCOCCCNCCOCC(=O)OCC 34a_200000211371_100000088970 [0,1,1,0,0,0|2,0,0]=4 7080 B17R0.250 CCCCOCCCOCCCCC(=O)OCC 34a_200011215613_100000750268 [0,1,1,0,0,0|1,0,0]=3 7081 B17R0.250 CCCCOCCCOCCCCC(=O)OCC 7a_200011215613_100000750268 [0,1,1,0,0,0|1,0,0]=3 7082 B17R0.250 CCCCOCCCOCCOCC(=O)OCC 34a_200011215613_100000088970 [0,1,1,0,0,0|2,0,0]=4 7083 B17R0.250 CCCCOCCCOCCOCC(=O)OCC 7a_200011215613_100000088970 [0,1,1,0,0,0|2,0,0]=4 7084 B17R0.250 CCCCOCCOCCCCCC(=O)OCC 34a_100000210238_100000755133 [0,1,1,0,0,0|1,0,0]=3 7085 B17R0.250 CCCCOCCOCCCCCC(=O)OCC 7a_100000210238_100000755133 [0,1,1,0,0,0|1,0,0]=3 7086 B17R0.250 CCCCOCCOCCCCCC(=O)OCC 7a_100011214988_100000743108 [0,1,1,0,0,0|1,0,0]=3 7087 B17R0.250 CCCCOCCOCCCOCC(=O)OCC 34a_100000210238_100009893628 [0,1,1,0,0,0|2,0,0]=4 7088 B17R0.250 CCCCOCCOCCCOCC(=O)OCC 7a_100000210238_100009893628 [0,1,1,0,0,0|2,0,0]=4 7089 B17R0.250 CCCCOCCOCCOCCC(=O)OCC 34a_100010737887_100000210210 [0,1,1,0,0,0|2,0,0]=4 7090 B17R0.250 CCCCOCCOCCOCCC(=O)OCC 34a_100011215186_100000765890 [0,1,1,0,0,0|2,0,0]=4 7091 B17R0.250 CCCCOCCOCCOCCC(=O)OCC 7a_100010737887_100000210211 [0,1,1,0,0,0|2,0,0]=4 7092 B17R0.250 CCCCOCCOCCOCCC(=O)OCC 7a_100011215186_100011206558 [0,1,1,0,0,0|2,0,0]=4 7093 B17R0.250 CCCCOCCOCCOCOC(=O)CCC 34a_100011215186_100000034017 [0,1,1,0,0,0|2,0,0]=4 7094 B17R0.250 CCCCOCCSCCCCCC(=O)OCC 62a_100000743108_100000755133 [0,1,1,0,0,0|1,0,0]=3 7095 B17R0.250 CCCCOCCSCCCCCC(=O)OCC 62a_100000755133_100000743108 [0,1,1,0,0,0|1,0,0]=3 7096 B17R0.250 CCCCOCCSCCCOCC(=O)OCC 62a_100000743108_100009893628 [0,1,1,0,0,0|2,0,0]=4 7097 B17R0.250 CCCCOCCSCCCOCC(=O)OCC 62a_100009893628_100000743108 [0,1,1,0,0,0|2,0,0]=4 7098 B17R0.250 CCCCOCSCCCCCCC(=O)OCC 62a_100011995733_100009814379 [0,1,1,0,0,0|1,0,0]=3 7099 B17R0.250 CCCCSCCCCCCCCC(=O)OCC 62a_100000210211_100010175975 [0,1,1,0,0,0|0,0,0]=2 7100 B17R0.250 CCCCSCCNCCCCCC(=O)OCC 2230a_100025743550_100000755133 [0,1,1,0,0,0|1,0,0]=3 7101 B17R0.250 CCCCSCCNCCCOCC(=O)OCC 2230a_100025743550_100009893628 [0,1,1,0,0,0|2,0,0]=4 7102 B17R0.250 CCCCSCCOCCCCCC(=O)OCC 34a_200000230436_100000755133 [0,1,1,0,0,0|1,0,0]=3 7103 B17R0.250 CCCCSCCOCCCCCC(=O)OCC 7a_200000230436_100000755133 [0,1,1,0,0,0|1,0,0]=3 7104 B17R0.250 CCCCSCCOCCCOCC(=O)OCC 34a_200000230436_100009893628 [0,1,1,0,0,0|2,0,0]=4 7105 B17R0.250 CCCCSCCOCCCOCC(=O)OCC 7a_200000230436_100009893628 [0,1,1,0,0,0|2,0,0]=4 7106 B17R0.250 CCCNN=CCCCCCCCC(=O)OCC 4a_100000740057_100102623289 [0,1,1,0,0,0|1,0,1]=4 7107 B17R0.250 CCCOCCCCCCCCCC(=O)OCC 34a_100000210258_100009828014 [0,1,1,0,0,0|0,0,0]=2 7108 B17R0.250 CCCOCCCNCCCCCC(=O)OCC 2230a_100011217757_100000755133 [0,1,1,0,0,0|1,0,0]=3 7109 B17R0.250 CCCOCCCNCCCCCC(=O)OCC 34a_100011217757_100000755133 [0,1,1,0,0,0|1,0,0]=3 7110 B17R0.250 CCCOCCCNCCCOCC(=O)OCC 2230a_100011217757_100009893628 [0,1,1,0,0,0|2,0,0]=4 7111 B17R0.250 CCCOCCCNCCCOCC(=O)OCC 34a_100011217757_100009893628 [0,1,1,0,0,0|2,0,0]=4 7112 B17R0.250 CCCOCCNCCCCCCC(=O)OCC 2230a_100161115042_100009814379 [0,1,1,0,0,0|1,0,0]=3 7113 B17R0.250 CCCOCCNCCCCCCC(=O)OCC 34a_100161115042_100009814379 [0,1,1,0,0,0|1,0,0]=3 7114 B17R0.250 CCCOCCOCCCCCCC(=O)OCC 34a_100000752267_100009814379 [0,1,1,0,0,0|1,0,0]=3 7115 B17R0.250 CCCOCCOCCCCCCC(=O)OCC 7a_100000752267_100009814379 [0,1,1,0,0,0|1,0,0]=3 7116 B17R0.250 CCCOCCOCCNCCCC(=O)OCC 2230a_200011904461_100009991533 [0,1,1,0,0,0|2,0,0]=4 7117 B17R0.250 CCCOCCOCCNCCCC(=O)OCC 34a_200011904461_100009991533 [0,1,1,0,0,0|2,0,0]=4 7118 B17R0.250 CCCOCCSCCCCCCC(=O)OCC 62a_100011215938_100009814379 [0,1,1,0,0,0|1,0,0]=3 7119 B17R0.250 CCCSCCCCCCCCCC(=O)OCC 62a_100000210303_100009828014 [0,1,1,0,0,0|0,0,0]=2 7120 B17R0.250 CCCSCCNCCCCCCC(=O)OCC 2230a_100020603323_100009814379 [0,1,1,0,0,0|1,0,0]=3 7121 B17R0.250 CCCSCCOCCCCCCC(=O)OCC 34a_200000230433_100009814379 [0,1,1,0,0,0|1,0,0]=3 7122 B17R0.250 CCCSCCOCCCCCCC(=O)OCC 7a_200000230433_100009814379 [0,1,1,0,0,0|1,0,0]=3 7123 B17R0.250 CCNC(=O)CCCCCCCCCCCCO 240690a_100015525214_100102582631 [0,1,1,0,0,0|1,0,0]=3 7124 B17R0.250 CCNC(=O)CCNCCCCCCCCCO 2230a_100000078944_100000737597 [0,1,1,0,0,0|2,0,0]=4 7125 B17R0.250 CCNC(=O)CCNCCCCCCCCCO 34a_100025743525_100009813782 [0,1,1,0,0,0|2,0,0]=4 7126 B17R0.250 CCNC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000737597 [0,1,1,0,0,0|2,0,0]=4 7127 B17R0.250 CCNC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000737597 [0,1,1,0,0,0|2,0,0]=4 7128 B17R0.250 CCNC(=O)CCSCCCCCCCCCO 62a_100000737597_100009813782 [0,1,1,0,0,0|2,0,0]=4 7129 B17R0.250 CCNC(=O)CCSCCCCCCCCCO 62a_100009813782_100000737597 [0,1,1,0,0,0|2,0,0]=4 7130 B17R0.250 CCNC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000183381 [0,1,1,0,0,0|2,0,0]=4 7131 B17R0.250 CCNC(=O)CNCCCCCCCCCCO 2230a_100016988866_100009813290 [0,1,1,0,0,0|2,0,0]=4 7132 B17R0.250 CCNC(=O)CNCCCCCCCCCCO 34a_100000066964_100000183381 [0,1,1,0,0,0|2,0,0]=4 7133 B17R0.250 CCNC(=O)COCCCCCCCCCCBr 34a_100009813290_100000183381 [0,1,1,0,0,0|2,0,0]=4 7134 B17R0.250 CCNC(=O)COCCCCCCCCCCBr 7a_100009813290_100000183381 [0,1,1,0,0,0|2,0,0]=4 7135 B17R0.250 CCNC(=O)COCCCCCCCCCCCl 34a_200000033068_100000183381 [0,1,1,0,0,0|2,0,0]=4 7136 B17R0.250 CCNC(=O)COCCCCCCCCCCCl 7a_200000033068_100000183381 [0,1,1,0,0,0|2,0,0]=4 7137 B17R0.250 CCNC(=O)COCCCCCCCCCCN 34a_100000066964_100000183381 [0,1,1,0,0,0|2,0,0]=4 7138 B17R0.250 CCNC(=O)CSCCCCCCCCCCO 62a_100000183381_200000033068 [0,1,1,0,0,0|2,0,0]=4 7139 B17R0.250 CCNC(=O)CSCCCCCCCCCCO 62a_100009813290_100000183381 [0,1,1,0,0,0|2,0,0]=4 7140 B17R0.250 CCNCCCCCCCCCCC(=O)OCC 2230a_100015525214_100009827693 [0,1,1,0,0,0|0,0,0]=2 7141 B17R0.250 CCOC(=O)CCCCCCCCCCCNC 2230a_106832991635_100103168309 [0,1,1,0,0,0|0,0,0]=2 7142 B17R0.250 CCOC(=O)CCCCCCCCCCCNC 34a_100102657272_100103168309 [0,1,1,0,0,0|0,0,0]=2 7143 B17R0.250 CCOC(=O)CCCCCCCCCCCNC 7a_106832991635_100103168309 [0,1,1,0,0,0|0,0,0]=2 7144 B17R0.250 CCOC(=O)CCCCCCCCCCCOC 34a_100138415774_100103168309 [0,1,1,0,0,0|0,0,0]=2 7145 B17R0.250 CCOC(=O)CCCCCCCCCCCSC 62a_200000210301_100103168309 [0,1,1,0,0,0|0,0,0]=2 7146 B17R0.250 CCOC(=O)CCCCCCCCCCCS[13CH3] 62a_200025704644_100103168309 [0,1,1,0,0,0|0,0,0]=2 7147 B17R0.250 CCOC(=O)CCCCCCCCCCSCC 62a_100000210202_100009827693 [0,1,1,0,0,0|0,0,0]=2 7148 B17R0.250 CCOC(=O)CCCCCCCCCCSCF 62a_100015361967_100009827693 [0,1,1,0,0,0|1,0,0]=3 7149 B17R0.250 CCOC(=O)CCCCCCCCCNCCF 34a_100000724931_100009828014 [0,1,1,0,0,0|1,0,0]=3 7150 B17R0.250 CCOC(=O)CCCCCCCCCNCCO 2230a_100016997473_100009828014 [0,1,1,0,0,0|1,0,0]=3 7151 B17R0.250 CCOC(=O)CCCCCCCCCNCCO 34a_100016990907_100009828014 [0,1,1,0,0,0|1,0,0]=3 7152 B17R0.250 CCOC(=O)CCCCCCCCCOCCBr 34a_100000211926_100009828014 [0,1,1,0,0,0|1,0,0]=3 7153 B17R0.250 CCOC(=O)CCCCCCCCCOCCN 34a_100000210304_100009828014 [0,1,1,0,0,0|1,0,0]=3 7154 B17R0.250 CCOC(=O)CCCCCCCCCSCC#N 62a_100011215382_100009828014 [0,1,1,0,0,0|1,0,1]=4 7155 B17R0.250 CCOC(=O)CCCCCCCCCSCC=O 62a_200015260668_100009828014 [0,1,1,0,0,0|1,0,1]=4 7156 B17R0.250 CCOC(=O)CCCCCCCCCSCCF 62a_100011217306_100009828014 [0,1,1,0,0,0|1,0,0]=3 7157 B17R0.250 CCOC(=O)CCCCCCCCCSCCO 62a_100000211926_100009828014 [0,1,1,0,0,0|1,0,0]=3 7158 B17R0.250 CCOC(=O)CCCCCCCCCSCOC 62a_100000766300_100009828014 [0,1,1,0,0,0|1,0,0]=3 7159 B17R0.250 CCOC(=O)CCCCCCCCCSCSC 62a_100011218213_100009828014 [0,1,1,0,0,0|1,0,0]=3 7160 B17R0.250 CCOC(=O)CCCCCCCCNCCCF 2230a_100015189416_100010175975 [0,1,1,0,0,0|1,0,0]=3 7161 B17R0.250 CCOC(=O)CCCCCCCCNCCCF 34a_100015189416_100010175975 [0,1,1,0,0,0|1,0,0]=3 7162 B17R0.250 CCOC(=O)CCCCCCCCNCCOC 2230a_100000209980_100010175975 [0,1,1,0,0,0|1,0,0]=3 7163 B17R0.250 CCOC(=O)CCCCCCCCNCCSC 2230a_100020590264_100010175975 [0,1,1,0,0,0|1,0,0]=3 7164 B17R0.250 CCOC(=O)CCCCCCCCOCCCBr 34a_100011217188_100010175975 [0,1,1,0,0,0|1,0,0]=3 7165 B17R0.250 CCOC(=O)CCCCCCCCOCCCCl 34a_100000230001_100010175975 [0,1,1,0,0,0|1,0,0]=3 7166 B17R0.250 CCOC(=O)CCCCCCCCOCCCF 34a_100000759539_100010175975 [0,1,1,0,0,0|1,0,0]=3 7167 B17R0.250 CCOC(=O)CCCCCCCCOCCCN 34a_100000182051_100010175975 [0,1,1,0,0,0|1,0,0]=3 7168 B17R0.250 CCOC(=O)CCCCCCCCOCCOC 34a_100000210237_100010175975 [0,1,1,0,0,0|1,0,0]=3 7169 B17R0.250 CCOC(=O)CCCCCCCCOCCON 34a_100000700252_100010175975 [0,1,1,0,0,0|2,0,0]=4 7170 B17R0.250 CCOC(=O)CCCCCCCCOCCSC 34a_100000230434_100010175975 [0,1,1,0,0,0|1,0,0]=3 7171 B17R0.250 CCOC(=O)CCCCCCCCOCCSC 7a_100000230434_100010175975 [0,1,1,0,0,0|1,0,0]=3 7172 B17R0.250 CCOC(=O)CCCCCCCCSCCC#N 62a_100011215226_100010175975 [0,1,1,0,0,0|1,0,1]=4 7173 B17R0.250 CCOC(=O)CCCCCCCCSCCCF 62a_100011934791_100010175975 [0,1,1,0,0,0|1,0,0]=3 7174 B17R0.250 CCOC(=O)CCCCCCCCSCCCO 62a_100011215043_100010175975 [0,1,1,0,0,0|1,0,0]=3 7175 B17R0.250 CCOC(=O)CCCCCCCCSCCOC 62a_100000233755_100010175975 [0,1,1,0,0,0|1,0,0]=3 7176 B17R0.250 CCOC(=O)CCCCCCCCSCCSC 62a_100000212216_100010175975 [0,1,1,0,0,0|1,0,0]=3 7177 B17R0.250 CCOC(=O)CCCCCCCNCCCCO 2230a_100000750430_100009991516 [0,1,1,0,0,0|1,0,0]=3 7178 B17R0.250 CCOC(=O)CCCCCCCNCCCCO 34a_100000750430_100009991516 [0,1,1,0,0,0|1,0,0]=3 7179 B17R0.250 CCOC(=O)CCCCCCCNCCCOC 34a_100150723488_100009991516 [0,1,1,0,0,0|1,0,0]=3 7180 B17R0.250 CCOC(=O)CCCCCCCNCCCSC 2230a_100000749238_100009991516 [0,1,1,0,0,0|1,0,0]=3 7181 B17R0.250 CCOC(=O)CCCCCCCNCCSCC 2230a_100000106463_100009991516 [0,1,1,0,0,0|1,0,0]=3 7182 B17R0.250 CCOC(=O)CCCCCCCOCCCCBr 34a_100011216708_100009991516 [0,1,1,0,0,0|1,0,0]=3 7183 B17R0.250 CCOC(=O)CCCCCCCOCCCCCl 34a_100000210776_100009991516 [0,1,1,0,0,0|1,0,0]=3 7184 B17R0.250 CCOC(=O)CCCCCCCOCCCCCl 7a_100000210776_100009991516 [0,1,1,0,0,0|1,0,0]=3 7185 B17R0.250 CCOC(=O)CCCCCCCOCCCCF 34a_100011995726_100009991516 [0,1,1,0,0,0|1,0,0]=3 7186 B17R0.250 CCOC(=O)CCCCCCCOCCCCF 7a_100011995726_100009991516 [0,1,1,0,0,0|1,0,0]=3 7187 B17R0.250 CCOC(=O)CCCCCCCOCCCCI 34a_200012148704_100009991516 [0,1,1,0,0,0|1,0,0]=3 7188 B17R0.250 CCOC(=O)CCCCCCCOCCCCN 34a_100000750430_100009991516 [0,1,1,0,0,0|1,0,0]=3 7189 B17R0.250 CCOC(=O)CCCCCCCOCCCNC 34a_100000213112_100009991516 [0,1,1,0,0,0|1,0,0]=3 7190 B17R0.250 CCOC(=O)CCCCCCCOCCCOC 34a_100000740835_100009991516 [0,1,1,0,0,0|1,0,0]=3 7191 B17R0.250 CCOC(=O)CCCCCCCOCCCSC 34a_100000690336_100009991516 [0,1,1,0,0,0|1,0,0]=3 7192 B17R0.250 CCOC(=O)CCCCCCCOCCCSC 7a_100000690336_100009991516 [0,1,1,0,0,0|1,0,0]=3 7193 B17R0.250 CCOC(=O)CCCCCCCOCCSCC 34a_100000212035_100009991516 [0,1,1,0,0,0|1,0,0]=3 7194 B17R0.250 CCOC(=O)CCCCCCCOCCSCC 7a_100000212035_100009991516 [0,1,1,0,0,0|1,0,0]=3 7195 B17R0.250 CCOC(=O)CCCCCCCSCCCC#N 62a_100000687738_100009991516 [0,1,1,0,0,0|1,0,1]=4 7196 B17R0.250 CCOC(=O)CCCCCCCSCCCC=O 62a_200011292268_100009991516 [0,1,1,0,0,0|1,0,1]=4 7197 B17R0.250 CCOC(=O)CCCCCCCSCCCCF 62a_100000729493_100009991516 [0,1,1,0,0,0|1,0,0]=3 7198 B17R0.250 CCOC(=O)CCCCCCCSCCCCO 62a_100000210776_100009991516 [0,1,1,0,0,0|1,0,0]=3 7199 B17R0.250 CCOC(=O)CCCCCCCSCCCOC 62a_100000709357_100009991516 [0,1,1,0,0,0|1,0,0]=3 7200 B17R0.250 CCOC(=O)CCCCCCCSCCSCC 62a_100000757381_100009991516 [0,1,1,0,0,0|1,0,0]=3 7201 B17R0.250 CCOC(=O)CCCCCCNCCCCCO 2230a_100000762737_100009814379 [0,1,1,0,0,0|1,0,0]=3 7202 B17R0.250 CCOC(=O)CCCCCCNCCCCCO 34a_100000762737_100009814379 [0,1,1,0,0,0|1,0,0]=3 7203 B17R0.250 CCOC(=O)CCCCCCNCCOCCO 2230a_100000211614_100009814379 [0,1,1,0,0,0|2,0,0]=4 7204 B17R0.250 CCOC(=O)CCCCCCNCCOCCO 34a_100000211614_100009814379 [0,1,1,0,0,0|2,0,0]=4 7205 B17R0.250 CCOC(=O)CCCCCCNCCSCCO 2230a_100011219999_100009814379 [0,1,1,0,0,0|2,0,0]=4 7206 B17R0.250 CCOC(=O)CCCCCCOCCCCCBr 34a_100000746331_100009814379 [0,1,1,0,0,0|1,0,0]=3 7207 B17R0.250 CCOC(=O)CCCCCCOCCCCCBr 7a_100000746331_100009814379 [0,1,1,0,0,0|1,0,0]=3 7208 B17R0.250 CCOC(=O)CCCCCCOCCCCCCl 34a_100000746330_100009814379 [0,1,1,0,0,0|1,0,0]=3 7209 B17R0.250 CCOC(=O)CCCCCCOCCCCCCl 7a_100000746330_100009814379 [0,1,1,0,0,0|1,0,0]=3 7210 B17R0.250 CCOC(=O)CCCCCCOCCCCCI 34a_200012148887_100009814379 [0,1,1,0,0,0|1,0,0]=3 7211 B17R0.250 CCOC(=O)CCCCCCOCCCCCI 7a_200012148887_100009814379 [0,1,1,0,0,0|1,0,0]=3 7212 B17R0.250 CCOC(=O)CCCCCCOCCCCCN 34a_100000762737_100009814379 [0,1,1,0,0,0|1,0,0]=3 7213 B17R0.250 CCOC(=O)CCCCCCOCCCCOC 34a_100000740925_100009814379 [0,1,1,0,0,0|1,0,0]=3 7214 B17R0.250 CCOC(=O)CCCCCCOCCCCSC 34a_100011217163_100009814379 [0,1,1,0,0,0|1,0,0]=3 7215 B17R0.250 CCOC(=O)CCCCCCOCCCCSC 7a_100011217163_100009814379 [0,1,1,0,0,0|1,0,0]=3 7216 B17R0.250 CCOC(=O)CCCCCCOCCCSCC 34a_100011216438_100009814379 [0,1,1,0,0,0|1,0,0]=3 7217 B17R0.250 CCOC(=O)CCCCCCOCCCSCC 7a_100011216438_100009814379 [0,1,1,0,0,0|1,0,0]=3 7218 B17R0.250 CCOC(=O)CCCCCCOCCOCCBr 34a_100000692535_100009814379 [0,1,1,0,0,0|2,0,0]=4 7219 B17R0.250 CCOC(=O)CCCCCCOCCOCCBr 7a_100000692535_100009814379 [0,1,1,0,0,0|2,0,0]=4 7220 B17R0.250 CCOC(=O)CCCCCCOCCOCCCl 34a_100011215305_100009814379 [0,1,1,0,0,0|2,0,0]=4 7221 B17R0.250 CCOC(=O)CCCCCCOCCOCCCl 7a_100011215305_100009814379 [0,1,1,0,0,0|2,0,0]=4 7222 B17R0.250 CCOC(=O)CCCCCCOCCOCCF 34a_200015357709_100009814379 [0,1,1,0,0,0|2,0,0]=4 7223 B17R0.250 CCOC(=O)CCCCCCOCCOCCF 7a_200015357709_100009814379 [0,1,1,0,0,0|2,0,0]=4 7224 B17R0.250 CCOC(=O)CCCCCCOCCOCCI 34a_100012149058_100009814379 [0,1,1,0,0,0|2,0,0]=4 7225 B17R0.250 CCOC(=O)CCCCCCOCCOCCI 7a_100012149058_100009814379 [0,1,1,0,0,0|2,0,0]=4 7226 B17R0.250 CCOC(=O)CCCCCCOCCOCCN 34a_100000211614_100009814379 [0,1,1,0,0,0|2,0,0]=4 7227 B17R0.250 CCOC(=O)CCCCCCSCCCCC#N 62a_100011219923_100009814379 [0,1,1,0,0,0|1,0,1]=4 7228 B17R0.250 CCOC(=O)CCCCCCSCCCCC=O 62a_100000139335_100009814379 [0,1,1,0,0,0|1,0,1]=4 7229 B17R0.250 CCOC(=O)CCCCCCSCCCCCF 62a_100000729378_100009814379 [0,1,1,0,0,0|1,0,0]=3 7230 B17R0.250 CCOC(=O)CCCCCCSCCCCCO 62a_100000746330_100009814379 [0,1,1,0,0,0|1,0,0]=3 7231 B17R0.250 CCOC(=O)CCCCCCSCCCCOC 62a_100000730899_100009814379 [0,1,1,0,0,0|1,0,0]=3 7232 B17R0.250 CCOC(=O)CCCCCCSCCOCCO 62a_100011215305_100009814379 [0,1,1,0,0,0|2,0,0]=4 7233 B17R0.250 CCOC(=O)CCCCCCSCOCCOC 62a_100000231047_100009814379 [0,1,1,0,0,0|2,0,0]=4 7234 B17R0.250 CCOC(=O)CCCCCNCCCCCCO 2230a_100000686447_100000755133 [0,1,1,0,0,0|1,0,0]=3 7235 B17R0.250 CCOC(=O)CCCCCNCCCCCCO 34a_100000686447_100000755133 [0,1,1,0,0,0|1,0,0]=3 7236 B17R0.250 CCOC(=O)CCCCCNCCCCCOC 2230a_100000747528_100000755133 [0,1,1,0,0,0|1,0,0]=3 7237 B17R0.250 CCOC(=O)CCCCCNCCCCCOC 34a_100000747528_100000755133 [0,1,1,0,0,0|1,0,0]=3 7238 B17R0.250 CCOC(=O)CCCCCNCCOCCOC 2230a_100000745349_100000755133 [0,1,1,0,0,0|2,0,0]=4 7239 B17R0.250 CCOC(=O)CCCCCNCCOCCOC 34a_100000745349_100000755133 [0,1,1,0,0,0|2,0,0]=4 7240 B17R0.250 CCOC(=O)CCCCCOCCCCCC#N 7a_100011214988_100009813376 [0,1,1,0,0,0|1,0,1]=4 7241 B17R0.250 CCOC(=O)CCCCCOCCCCCC=O 7a_100011214988_100000139337 [0,1,1,0,0,0|1,0,1]=4 7242 B17R0.250 CCOC(=O)CCCCCOCCCCCCBr 34a_100011215345_100000755133 [0,1,1,0,0,0|1,0,0]=3 7243 B17R0.250 CCOC(=O)CCCCCOCCCCCCBr 7a_100011215345_100000755133 [0,1,1,0,0,0|1,0,0]=3 7244 B17R0.250 CCOC(=O)CCCCCOCCCCCCCl 34a_100000766143_100000755133 [0,1,1,0,0,0|1,0,0]=3 7245 B17R0.250 CCOC(=O)CCCCCOCCCCCCCl 7a_100000766143_100000755133 [0,1,1,0,0,0|1,0,0]=3 7246 B17R0.250 CCOC(=O)CCCCCOCCCCCCF 34a_100000732779_100000755133 [0,1,1,0,0,0|1,0,0]=3 7247 B17R0.250 CCOC(=O)CCCCCOCCCCCCF 7a_100000732779_100000755133 [0,1,1,0,0,0|1,0,0]=3 7248 B17R0.250 CCOC(=O)CCCCCOCCCCCCF 7a_100011214988_100015922095 [0,1,1,0,0,0|1,0,0]=3 7249 B17R0.250 CCOC(=O)CCCCCOCCCCCCN 34a_100000686447_100000755133 [0,1,1,0,0,0|1,0,0]=3 7250 B17R0.250 CCOC(=O)CCCCCOCCCCCCO 7a_100011214988_100000766143 [0,1,1,0,0,0|1,0,0]=3 7251 B17R0.250 CCOC(=O)CCCCCOCCCCCNC 34a_100000722520_100000755133 [0,1,1,0,0,0|1,0,0]=3 7252 B17R0.250 CCOC(=O)CCCCCOCCOCCNC 34a_100000228057_100000755133 [0,1,1,0,0,0|2,0,0]=4 7253 B17R0.250 CCOC(=O)CCCCCOCCOCCOC 34a_100011215163_100000755133 [0,1,1,0,0,0|2,0,0]=4 7254 B17R0.250 CCOC(=O)CCCCCOCCOCCOC 7a_100011214988_100000695917 [0,1,1,0,0,0|2,0,0]=4 7255 B17R0.250 CCOC(=O)CCCCCOCCOCCOC 7a_100011215163_100000755133 [0,1,1,0,0,0|2,0,0]=4 7256 B17R0.250 CCOC(=O)CCCCCSCCCCCC#N 62a_100000755133_100009813376 [0,1,1,0,0,0|1,0,1]=4 7257 B17R0.250 CCOC(=O)CCCCCSCCCCCC#N 62a_100009813376_100000755133 [0,1,1,0,0,0|1,0,1]=4 7258 B17R0.250 CCOC(=O)CCCCCSCCCCCC=O 62a_100000139337_100000755133 [0,1,1,0,0,0|1,0,1]=4 7259 B17R0.250 CCOC(=O)CCCCCSCCCCCC=O 62a_100000755133_100000139337 [0,1,1,0,0,0|1,0,1]=4 7260 B17R0.250 CCOC(=O)CCCCCSCCCCCCF 62a_100000755133_100015922095 [0,1,1,0,0,0|1,0,0]=3 7261 B17R0.250 CCOC(=O)CCCCCSCCCCCCF 62a_100015922095_100000755133 [0,1,1,0,0,0|1,0,0]=3 7262 B17R0.250 CCOC(=O)CCCCCSCCCCCCO 62a_100000755133_100000766143 [0,1,1,0,0,0|1,0,0]=3 7263 B17R0.250 CCOC(=O)CCCCCSCCCCCCO 62a_100000766143_100000755133 [0,1,1,0,0,0|1,0,0]=3 7264 B17R0.250 CCOC(=O)CCCCCSCCOCCOC 62a_100000695917_100000755133 [0,1,1,0,0,0|2,0,0]=4 7265 B17R0.250 CCOC(=O)CCCCCSCCOCCOC 62a_100000755133_100000695917 [0,1,1,0,0,0|2,0,0]=4 7266 B17R0.250 CCOC(=O)CCCCNCCCCCCCO 2230a_100011996573_100000750268 [0,1,1,0,0,0|1,0,0]=3 7267 B17R0.250 CCOC(=O)CCCCNCCCCCCCO 34a_100011996573_100000750268 [0,1,1,0,0,0|1,0,0]=3 7268 B17R0.250 CCOC(=O)CCCCNCCCOCCCO 2230a_100011310245_100000750268 [0,1,1,0,0,0|2,0,0]=4 7269 B17R0.250 CCOC(=O)CCCCNCCCOCCCO 34a_100011310245_100000750268 [0,1,1,0,0,0|2,0,0]=4 7270 B17R0.250 CCOC(=O)CCCCNCCCOCCOC 2230a_100000206027_100000750268 [0,1,1,0,0,0|2,0,0]=4 7271 B17R0.250 CCOC(=O)CCCCNCCCOCCOC 34a_100000206027_100000750268 [0,1,1,0,0,0|2,0,0]=4 7272 B17R0.250 CCOC(=O)CCCCOCCCCCCCBr 34a_100000760002_100000750268 [0,1,1,0,0,0|1,0,0]=3 7273 B17R0.250 CCOC(=O)CCCCOCCCCCCCBr 7a_100000760002_100000750268 [0,1,1,0,0,0|1,0,0]=3 7274 B17R0.250 CCOC(=O)CCCCOCCCCCCCN 34a_100011996573_100000750268 [0,1,1,0,0,0|1,0,0]=3 7275 B17R0.250 CCOC(=O)CCCCOCCCCCCOC 34a_200012092642_100000750268 [0,1,1,0,0,0|1,0,0]=3 7276 B17R0.250 CCOC(=O)CCCCOCCCCCCOC 7a_200012092642_100000750268 [0,1,1,0,0,0|1,0,0]=3 7277 B17R0.250 CCOC(=O)CCCCOCCCOCCCN 34a_100011310245_100000750268 [0,1,1,0,0,0|2,0,0]=4 7278 B17R0.250 CCOC(=O)CCCCSCCCCCCC#N 62a_100000750268_100009813337 [0,1,1,0,0,0|1,0,1]=4 7279 B17R0.250 CCOC(=O)CCCCSCCCCCCC#N 62a_100009813337_100000750268 [0,1,1,0,0,0|1,0,1]=4 7280 B17R0.250 CCOC(=O)CCCCSCCCCCCCO 62a_100000750268_100000760002 [0,1,1,0,0,0|1,0,0]=3 7281 B17R0.250 CCOC(=O)CCCCSCCCCCCCO 62a_100000760002_100000750268 [0,1,1,0,0,0|1,0,0]=3 7282 B17R0.250 CCOC(=O)CCCCSCCCCCCOC 62a_100000750268_100011998445 [0,1,1,0,0,0|1,0,0]=3 7283 B17R0.250 CCOC(=O)CCCCSCCCCCCOC 62a_100011998445_100000750268 [0,1,1,0,0,0|1,0,0]=3 7284 B17R0.250 CCOC(=O)CCCCSCCCOCCOC 62a_100000750268_100011216529 [0,1,1,0,0,0|2,0,0]=4 7285 B17R0.250 CCOC(=O)CCCCSCCCOCCOC 62a_100011216529_100000750268 [0,1,1,0,0,0|2,0,0]=4 7286 B17R0.250 CCOC(=O)CCCNCCCCCCCCO 2230a_102515433106_100009991533 [0,1,1,0,0,0|1,0,0]=3 7287 B17R0.250 CCOC(=O)CCCNCCCCCCCCO 34a_102515433106_100009991533 [0,1,1,0,0,0|1,0,0]=3 7288 B17R0.250 CCOC(=O)CCCOCCCCCCCCBr 34a_100009813846_100009991533 [0,1,1,0,0,0|1,0,0]=3 7289 B17R0.250 CCOC(=O)CCCOCCCCCCCCBr 7a_100009813846_100011215271 [0,1,1,0,0,0|1,0,0]=3 7290 B17R0.250 CCOC(=O)CCCOCCCCCCCCCl 34a_100000033203_100009991533 [0,1,1,0,0,0|1,0,0]=3 7291 B17R0.250 CCOC(=O)CCCOCCCCCCCCCl 7a_100000033203_100011215271 [0,1,1,0,0,0|1,0,0]=3 7292 B17R0.250 CCOC(=O)CCCOCCCCCCCCN 34a_102515433106_100009991533 [0,1,1,0,0,0|1,0,0]=3 7293 B17R0.250 CCOC(=O)CCCOCCCCCCCCO 7a_100012001163_100000033203 [0,1,1,0,0,0|1,0,0]=3 7294 B17R0.250 CCOC(=O)CCCOCCCCCNCCN 34a_103619048469_100009991533 [0,1,1,0,0,0|2,0,0]=4 7295 B17R0.250 CCOC(=O)CCCOCCCOCCCOC 34a_200011215475_100009991533 [0,1,1,0,0,0|2,0,0]=4 7296 B17R0.250 CCOC(=O)CCCOCCCOCCCOC 7a_200011215475_100011215271 [0,1,1,0,0,0|2,0,0]=4 7297 B17R0.250 CCOC(=O)CCCSCCCCCCCCO 62a_100000033203_100009991533 [0,1,1,0,0,0|1,0,0]=3 7298 B17R0.250 CCOC(=O)CCCSCCCCCCCCO 62a_100009991533_100000033203 [0,1,1,0,0,0|1,0,0]=3 7299 B17R0.250 CCOC(=O)CCNCCCCCCCCCO 2230a_100000078944_100011206558 [0,1,1,0,0,0|1,0,0]=3 7300 B17R0.250 CCOC(=O)CCNCCCCCCCCCO 34a_100000078944_100000765890 [0,1,1,0,0,0|1,0,0]=3 7301 B17R0.250 CCOC(=O)CCOCCCCCCCCCBr 34a_100009813782_100000765890 [0,1,1,0,0,0|1,0,0]=3 7302 B17R0.250 CCOC(=O)CCOCCCCCCCCCBr 7a_100009813782_100011206558 [0,1,1,0,0,0|1,0,0]=3 7303 B17R0.250 CCOC(=O)CCOCCCCCCCCCCl 34a_100009868337_100000765890 [0,1,1,0,0,0|1,0,0]=3 7304 B17R0.250 CCOC(=O)CCOCCCCCCCCCCl 7a_100009868337_100011206558 [0,1,1,0,0,0|1,0,0]=3 7305 B17R0.250 CCOC(=O)CCOCCCCCCCCCN 34a_100000078944_100000765890 [0,1,1,0,0,0|1,0,0]=3 7306 B17R0.250 CCOC(=O)CCSCCCCCCCCCO 62a_100000765890_100009813782 [0,1,1,0,0,0|1,0,0]=3 7307 B17R0.250 CCOC(=O)CCSCCCCCCCCCO 62a_100009813782_100000765890 [0,1,1,0,0,0|1,0,0]=3 7308 B17R0.250 CCOC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000188475 [0,1,1,0,0,0|1,0,0]=3 7309 B17R0.250 CCOC(=O)CNCCCCCCCCCCO 34a_100000066964_100000188475 [0,1,1,0,0,0|1,0,0]=3 7310 B17R0.250 CCOC(=O)COCCCCCCCCCCBr 34a_100009813290_100000188475 [0,1,1,0,0,0|1,0,0]=3 7311 B17R0.250 CCOC(=O)COCCCCCCCCCCBr 7a_100009813290_100000188475 [0,1,1,0,0,0|1,0,0]=3 7312 B17R0.250 CCOC(=O)COCCCCCCCCCCCl 34a_200000033068_100000188475 [0,1,1,0,0,0|1,0,0]=3 7313 B17R0.250 CCOC(=O)COCCCCCCCCCCCl 7a_200000033068_100000188475 [0,1,1,0,0,0|1,0,0]=3 7314 B17R0.250 CCOC(=O)COCCCCCCCCCCN 34a_100000066964_100000188475 [0,1,1,0,0,0|1,0,0]=3 7315 B17R0.250 CCOC(=O)COCCCNCCCCCCO 2230a_100000686447_100009893628 [0,1,1,0,0,0|2,0,0]=4 7316 B17R0.250 CCOC(=O)COCCCNCCCCCCO 34a_100000686447_100009893628 [0,1,1,0,0,0|2,0,0]=4 7317 B17R0.250 CCOC(=O)COCCCNCCCCCOC 2230a_100000747528_100009893628 [0,1,1,0,0,0|2,0,0]=4 7318 B17R0.250 CCOC(=O)COCCCNCCCCCOC 34a_100000747528_100009893628 [0,1,1,0,0,0|2,0,0]=4 7319 B17R0.250 CCOC(=O)COCCCOCCCCCCBr 34a_100011215345_100009893628 [0,1,1,0,0,0|2,0,0]=4 7320 B17R0.250 CCOC(=O)COCCCOCCCCCCBr 7a_100011215345_100009893628 [0,1,1,0,0,0|2,0,0]=4 7321 B17R0.250 CCOC(=O)COCCCOCCCCCCCl 34a_100000766143_100009893628 [0,1,1,0,0,0|2,0,0]=4 7322 B17R0.250 CCOC(=O)COCCCOCCCCCCCl 7a_100000766143_100009893628 [0,1,1,0,0,0|2,0,0]=4 7323 B17R0.250 CCOC(=O)COCCCOCCCCCCF 34a_100000732779_100009893628 [0,1,1,0,0,0|2,0,0]=4 7324 B17R0.250 CCOC(=O)COCCCOCCCCCCF 7a_100000732779_100009893628 [0,1,1,0,0,0|2,0,0]=4 7325 B17R0.250 CCOC(=O)COCCCOCCCCCCN 34a_100000686447_100009893628 [0,1,1,0,0,0|2,0,0]=4 7326 B17R0.250 CCOC(=O)COCCCOCCCCCNC 34a_100000722520_100009893628 [0,1,1,0,0,0|2,0,0]=4 7327 B17R0.250 CCOC(=O)COCCCSCCCCCCF 62a_100009893628_100015922095 [0,1,1,0,0,0|2,0,0]=4 7328 B17R0.250 CCOC(=O)COCCCSCCCCCCF 62a_100015922095_100009893628 [0,1,1,0,0,0|2,0,0]=4 7329 B17R0.250 CCOC(=O)COCCCSCCCCCCO 62a_100000766143_100009893628 [0,1,1,0,0,0|2,0,0]=4 7330 B17R0.250 CCOC(=O)COCCCSCCCCCCO 62a_100009893628_100000766143 [0,1,1,0,0,0|2,0,0]=4 7331 B17R0.250 CCOC(=O)COCCNCCCCCCCO 2230a_100011996573_100000088970 [0,1,1,0,0,0|2,0,0]=4 7332 B17R0.250 CCOC(=O)COCCNCCCCCCCO 34a_100011996573_100000088970 [0,1,1,0,0,0|2,0,0]=4 7333 B17R0.250 CCOC(=O)COCCOCCCCCCCBr 34a_100000760002_100000088970 [0,1,1,0,0,0|2,0,0]=4 7334 B17R0.250 CCOC(=O)COCCOCCCCCCCBr 7a_100000760002_100000088970 [0,1,1,0,0,0|2,0,0]=4 7335 B17R0.250 CCOC(=O)COCCOCCCCCCCN 34a_100011996573_100000088970 [0,1,1,0,0,0|2,0,0]=4 7336 B17R0.250 CCOC(=O)COCCOCCCCCCOC 34a_200012092642_100000088970 [0,1,1,0,0,0|2,0,0]=4 7337 B17R0.250 CCOC(=O)COCCOCCCCCCOC 7a_200012092642_100000088970 [0,1,1,0,0,0|2,0,0]=4 7338 B17R0.250 CCOC(=O)COCCSCCCCCCCO 62a_100000088970_100000760002 [0,1,1,0,0,0|2,0,0]=4 7339 B17R0.250 CCOC(=O)COCCSCCCCCCCO 62a_100000760002_100000088970 [0,1,1,0,0,0|2,0,0]=4 7340 B17R0.250 CCOC(=O)COCCSCCCCCCOC 62a_100000088970_100011998445 [0,1,1,0,0,0|2,0,0]=4 7341 B17R0.250 CCOC(=O)COCCSCCCCCCOC 62a_100011998445_100000088970 [0,1,1,0,0,0|2,0,0]=4 7342 B17R0.250 CCOC(=O)CSCCCCCCCCCCO 62a_100000188475_200000033068 [0,1,1,0,0,0|1,0,0]=3 7343 B17R0.250 CCOC(=O)CSCCCCCCCCCCO 62a_100009813290_100000188475 [0,1,1,0,0,0|1,0,0]=3 7344 B17R0.250 CCOC(=O)CSCCOCCCCCCCO 7a_200000230590_100000760002 [0,1,1,0,0,0|2,0,0]=4 7345 B17R0.250 CCOC(=O)CSCCOCCCCCCOC 7a_200000230590_100011998445 [0,1,1,0,0,0|2,0,0]=4 7346 B17R0.250 CCOC(=O)NCCOCCCCCCCCBr 7a_100009813846_200011445536 [0,1,1,0,0,0|2,0,0]=4 7347 B17R0.250 CCOC(=O)NCCOCCCCCCCCCl 7a_100000033203_200011445536 [0,1,1,0,0,0|2,0,0]=4 7348 B17R0.250 CCOC(=O)NCCOCCCCCCCCO 34a_100000158857_100000033203 [0,1,1,0,0,0|2,0,0]=4 7349 B17R0.250 CCOC(=O)NCCSCCCCCCCCO 62a_100000033203_200011445536 [0,1,1,0,0,0|2,0,0]=4 7350 B17R0.250 CCOC(=O)OCSCCCCCCCCCO 62a_100009813782_100000075025 [0,1,1,0,0,0|2,0,0]=4 7351 B17R0.250 CCOCCCCCCCCCCC(=O)OCC 34a_100121572206_100009827693 [0,1,1,0,0,0|0,0,0]=2 7352 B17R0.250 CCOCCCNCCCCCCC(=O)OCC 2230a_100000210961_100009814379 [0,1,1,0,0,0|1,0,0]=3 7353 B17R0.250 CCOCCCNCCCCCCC(=O)OCC 34a_100000210961_100009814379 [0,1,1,0,0,0|1,0,0]=3 7354 B17R0.250 CCOCCCOCCCCCCC(=O)OCC 34a_100000757476_100009814379 [0,1,1,0,0,0|1,0,0]=3 7355 B17R0.250 CCOCCCOCCCCCCC(=O)OCC 7a_100000757476_100009814379 [0,1,1,0,0,0|1,0,0]=3 7356 B17R0.250 CCOCCCSCCCCCCC(=O)OCC 62a_100012232248_100009814379 [0,1,1,0,0,0|1,0,0]=3 7357 B17R0.250 CCOCCNCCCCCCCC(=O)OCC 2230a_102516460346_100009991516 [0,1,1,0,0,0|1,0,0]=3 7358 B17R0.250 CCOCCNCCCCCCCC(=O)OCC 34a_102516460346_100009991516 [0,1,1,0,0,0|1,0,0]=3 7359 B17R0.250 CCOCCOCCCCCCCC(=O)OCC 34a_100000210136_100009991516 [0,1,1,0,0,0|1,0,0]=3 7360 B17R0.250 CCOCCOCCCCCCCC(=O)OCC 7a_100000210136_100009991516 [0,1,1,0,0,0|1,0,0]=3 7361 B17R0.250 CCOCCOCCNCCCCC(=O)OCC 2230a_100102712874_100000750268 [0,1,1,0,0,0|2,0,0]=4 7362 B17R0.250 CCOCCOCCNCCCCC(=O)OCC 34a_100102712874_100000750268 [0,1,1,0,0,0|2,0,0]=4 7363 B17R0.250 CCOCCOCCOCCCCC(=O)OCC 34a_100000210240_100000750268 [0,1,1,0,0,0|2,0,0]=4 7364 B17R0.250 CCOCCOCCOCCCCC(=O)OCC 7a_100000210240_100000750268 [0,1,1,0,0,0|2,0,0]=4 7365 B17R0.250 CCOCCOCCSCCCCC(=O)OCC 62a_100000750268_100011211534 [0,1,1,0,0,0|2,0,0]=4 7366 B17R0.250 CCOCCOCCSCCCCC(=O)OCC 62a_100011211534_100000750268 [0,1,1,0,0,0|2,0,0]=4 7367 B17R0.250 CCOCCSCCCCCCCC(=O)OCC 62a_100000210147_100009991516 [0,1,1,0,0,0|1,0,0]=3 7368 B17R0.250 CCOCSCCCCCCCCC(=O)OCC 62a_100000739092_100010175975 [0,1,1,0,0,0|1,0,0]=3 7369 B17R0.250 CNNC(=O)CCCCCCCCCCCCO 22a_100016993582_100102582631 [0,1,1,0,0,0|2,0,0]=4 7370 B17R0.250 COCC(=O)CCCCCCCCCCCCO 1458a_100000210968_100009813331 [0,1,1,0,0,0|2,0,0]=4 7371 B17R0.250 CSCC(=O)CCCCCCCCCCCCO 1458a_100000184570_100009813331 [0,1,1,0,0,0|2,0,0]=4 7372 B17R0.250 O=C(CCO)CCCCCCCCCCCCO 1458a_100011216618_100009813331 [0,1,1,0,0,0|2,0,0]=4 7373 B17R0.256 C=C(C)CCOCCCCCCCC(=O)OCC 34a_100000764851_100009991516 [0,1,1,0,0,0|1,0,1]=4 7374 B17R0.256 C=C(C)CCSCCCCCCCC(=O)OCC 62a_100000730704_100009991516 [0,1,1,0,0,0|1,0,1]=4 7375 B17R0.256 C=C(C)COCCCCCCCCC(=O)OCC 34a_100000210245_100010175975 [0,1,1,0,0,0|1,0,1]=4 7376 B17R0.256 C=C(C)CSCCCCCCCCC(=O)OCC 62a_100000748629_100010175975 [0,1,1,0,0,0|1,0,1]=4 7377 B17R0.256 CCCC(=O)OCOCCCCCCCC(C)C 34a_200000210741_100000034017 [0,1,1,0,0,0|1,0,0]=3 7378 B17R0.256 CCNC(=O)CCOCCCCCCCC(C)C 7a_200000210741_100000737597 [0,1,1,0,0,0|2,0,0]=4 7379 B17R0.256 CCOC(=O)CCCCCCCCCCC(=O)C 1458a_100000070787_100009827693 [0,1,1,0,0,0|0,0,1]=3 7380 B17R0.256 CCOC(=O)CCCCCCCCCCC(=O)C 1458a_200020656980_200000210301 [0,1,1,0,0,0|0,0,1]=3 7381 B17R0.256 CCOC(=O)CCCCCCCCCCC(=O)[13CH3] 1458a_200020656980_200025704644 [0,1,1,0,0,0|0,0,1]=3 7382 B17R0.256 CCOC(=O)CCCCCCCCCCN(C)C 2230a_100102631434_100009827693 [0,1,1,0,0,0|1,0,0]=3 7383 B17R0.256 CCOC(=O)CCCCCCCCCCN(C)C 269982a_100102631434_100009827693 [0,1,1,0,0,0|1,0,0]=3 7384 B17R0.256 CCOC(=O)CCCCCCCCCNC(C)C 2230a_100138425928_100009828014 [0,1,1,0,0,0|1,0,0]=3 7385 B17R0.256 CCOC(=O)CCCCCCCCCNC(C)C 34a_100138425928_100009828014 [0,1,1,0,0,0|1,0,0]=3 7386 B17R0.256 CCOC(=O)CCCCCCCCCOC(C)C 34a_100000212225_100009828014 [0,1,1,0,0,0|1,0,0]=3 7387 B17R0.256 CCOC(=O)CCCCCCCCCSC(C)C 62a_100000210206_100009828014 [0,1,1,0,0,0|1,0,0]=3 7388 B17R0.256 CCOC(=O)CCCCCCCCNCC(C)C 2230a_100000210953_100010175975 [0,1,1,0,0,0|1,0,0]=3 7389 B17R0.256 CCOC(=O)CCCCCCCCNCC(C)C 34a_100000210953_100010175975 [0,1,1,0,0,0|1,0,0]=3 7390 B17R0.256 CCOC(=O)CCCCCCCCNCC(C)O 2230a_100000210904_100010175975 [0,1,1,0,0,0|1,0,0]=3 7391 B17R0.256 CCOC(=O)CCCCCCCCNCC(C)O 34a_100000210904_100010175975 [0,1,1,0,0,0|1,0,0]=3 7392 B17R0.256 CCOC(=O)CCCCCCCCNCC(F)F 34a_100000765723_100010175975 [0,1,1,0,0,0|2,0,0]=4 7393 B17R0.256 CCOC(=O)CCCCCCCCOCC(=O)C 34a_100000211253_100010175975 [0,1,1,0,0,0|1,0,1]=4 7394 B17R0.256 CCOC(=O)CCCCCCCCOCC(C)Br 34a_100012180447_100010175975 [0,1,1,0,0,0|1,0,0]=3 7395 B17R0.256 CCOC(=O)CCCCCCCCOCC(C)C 34a_100000210257_100010175975 [0,1,1,0,0,0|1,0,0]=3 7396 B17R0.256 CCOC(=O)CCCCCCCCOCC(C)F 34a_100015925927_100010175975 [0,1,1,0,0,0|1,0,0]=3 7397 B17R0.256 CCOC(=O)CCCCCCCCOCC(F)F 34a_100000743014_100010175975 [0,1,1,0,0,0|2,0,0]=4 7398 B17R0.256 CCOC(=O)CCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100010175975 [0,1,1,0,0,0|1,0,0]=3 7399 B17R0.256 CCOC(=O)CCCCCCCCOC[C@@H](C)N 34a_100000737577_100010175975 [0,1,1,0,0,0|1,0,0]=3 7400 B17R0.256 CCOC(=O)CCCCCCCCSCC(C)C 62a_100000210624_100010175975 [0,1,1,0,0,0|1,0,0]=3 7401 B17R0.256 CCOC(=O)CCCCCCCCSCC(C)O 62a_100011218427_100010175975 [0,1,1,0,0,0|1,0,0]=3 7402 B17R0.256 CCOC(=O)CCCCCCCCSCC(F)F 62a_100011934356_100010175975 [0,1,1,0,0,0|2,0,0]=4 7403 B17R0.256 CCOC(=O)CCCCCCCCSC[C@@H](C)O 62a_100009817552_100010175975 [0,1,1,0,0,0|1,0,0]=3 7404 B17R0.256 CCOC(=O)CCCCCCCNCCC(C)O 2230a_200000755665_100009991516 [0,1,1,0,0,0|1,0,0]=3 7405 B17R0.256 CCOC(=O)CCCCCCCOCCC(=O)C 34a_100000759926_100009991516 [0,1,1,0,0,0|1,0,1]=4 7406 B17R0.256 CCOC(=O)CCCCCCCOCCC(=O)C 7a_100000759926_100009991516 [0,1,1,0,0,0|1,0,1]=4 7407 B17R0.256 CCOC(=O)CCCCCCCOCCC(C)Br 34a_100009893172_100009991516 [0,1,1,0,0,0|1,0,0]=3 7408 B17R0.256 CCOC(=O)CCCCCCCOCCC(C)C 34a_100000210254_100009991516 [0,1,1,0,0,0|1,0,0]=3 7409 B17R0.256 CCOC(=O)CCCCCCCOCCC(C)C 7a_100000210254_100009991516 [0,1,1,0,0,0|1,0,0]=3 7410 B17R0.256 CCOC(=O)CCCCCCCOCCC(F)F 34a_100103093639_100009991516 [0,1,1,0,0,0|2,0,0]=4 7411 B17R0.256 CCOC(=O)CCCCCCCOCC[C@@H](C)N 34a_100000706166_100009991516 [0,1,1,0,0,0|1,0,0]=3 7412 B17R0.256 CCOC(=O)CCCCCCCSCCC(=O)C 62a_100000053229_100009991516 [0,1,1,0,0,0|1,0,1]=4 7413 B17R0.256 CCOC(=O)CCCCCCCSCCC(C)C 62a_100000210312_100009991516 [0,1,1,0,0,0|1,0,0]=3 7414 B17R0.256 CCOC(=O)CCCCCCCSCCC(C)O 62a_100012276601_100009991516 [0,1,1,0,0,0|1,0,0]=3 7415 B17R0.256 CCOC(=O)CCCCCCCSCOC(C)C 62a_100000709892_100009991516 [0,1,1,0,0,0|2,0,0]=4 7416 B17R0.256 CCOC(=O)CCCCCCNCCCC(C)C 2230a_200000737386_100009814379 [0,1,1,0,0,0|1,0,0]=3 7417 B17R0.256 CCOC(=O)CCCCCCNCCCC(C)C 34a_200000737386_100009814379 [0,1,1,0,0,0|1,0,0]=3 7418 B17R0.256 CCOC(=O)CCCCCCNCCCS(=O)C 2230a_200000753449_100009814379 [0,1,1,0,0,0|2,0,0]=4 7419 B17R0.256 CCOC(=O)CCCCCCNCCOC(C)C 2230a_100000701111_100009814379 [0,1,1,0,0,0|2,0,0]=4 7420 B17R0.256 CCOC(=O)CCCCCCNCCOC(C)C 34a_100000701111_100009814379 [0,1,1,0,0,0|2,0,0]=4 7421 B17R0.256 CCOC(=O)CCCCCCNCCSC(C)C 2230a_100000731138_100009814379 [0,1,1,0,0,0|2,0,0]=4 7422 B17R0.256 CCOC(=O)CCCCCCNCCSC(C)C 34a_100000731138_100009814379 [0,1,1,0,0,0|2,0,0]=4 7423 B17R0.256 CCOC(=O)CCCCCCOCCCC(=O)C 34a_100000759063_100009814379 [0,1,1,0,0,0|1,0,1]=4 7424 B17R0.256 CCOC(=O)CCCCCCOCCCC(=O)C 7a_100000759063_100009814379 [0,1,1,0,0,0|1,0,1]=4 7425 B17R0.256 CCOC(=O)CCCCCCOCCCC(C)C 34a_100000210774_100009814379 [0,1,1,0,0,0|1,0,0]=3 7426 B17R0.256 CCOC(=O)CCCCCCOCCCC(C)C 7a_100000210774_100009814379 [0,1,1,0,0,0|1,0,0]=3 7427 B17R0.256 CCOC(=O)CCCCCCOCCNC(C)C 34a_100000224655_100009814379 [0,1,1,0,0,0|2,0,0]=4 7428 B17R0.256 CCOC(=O)CCCCCCOCCOC(C)C 34a_100000211219_100009814379 [0,1,1,0,0,0|2,0,0]=4 7429 B17R0.256 CCOC(=O)CCCCCCOCCOC(C)C 7a_100000211219_100009814379 [0,1,1,0,0,0|2,0,0]=4 7430 B17R0.256 CCOC(=O)CCCCCCOCCSC(C)C 34a_200011212901_100009814379 [0,1,1,0,0,0|2,0,0]=4 7431 B17R0.256 CCOC(=O)CCCCCCOCCSC(C)C 7a_200011212901_100009814379 [0,1,1,0,0,0|2,0,0]=4 7432 B17R0.256 CCOC(=O)CCCCCCSCCCC(=O)C 62a_100011215641_100009814379 [0,1,1,0,0,0|1,0,1]=4 7433 B17R0.256 CCOC(=O)CCCCCCSCCCC(C)C 62a_100011214892_100009814379 [0,1,1,0,0,0|1,0,0]=3 7434 B17R0.256 CCOC(=O)CCCCCCSCCCC(C)O 62a_200000718107_100009814379 [0,1,1,0,0,0|1,0,0]=3 7435 B17R0.256 CCOC(=O)CCCCCCSCCOC(C)C 62a_100000211751_100009814379 [0,1,1,0,0,0|2,0,0]=4 7436 B17R0.256 CCOC(=O)CCCCCCSCCSC(C)C 62a_100000730970_100009814379 [0,1,1,0,0,0|2,0,0]=4 7437 B17R0.256 CCOC(=O)CCCCCNCCCOC(C)C 2230a_100000737246_100000755133 [0,1,1,0,0,0|2,0,0]=4 7438 B17R0.256 CCOC(=O)CCCCCNCCCOC(C)C 34a_100000737246_100000755133 [0,1,1,0,0,0|2,0,0]=4 7439 B17R0.256 CCOC(=O)CCCCCOCCCCC(=O)C 7a_100011214988_100000735457 [0,1,1,0,0,0|1,0,1]=4 7440 B17R0.256 CCOC(=O)CCCCCOCCCCC(C)C 34a_100011214890_100000755133 [0,1,1,0,0,0|1,0,0]=3 7441 B17R0.256 CCOC(=O)CCCCCOCCCCC(C)C 7a_100011214890_100000755133 [0,1,1,0,0,0|1,0,0]=3 7442 B17R0.256 CCOC(=O)CCCCCOCCCCC(C)C 7a_100011214988_100011216152 [0,1,1,0,0,0|1,0,0]=3 7443 B17R0.256 CCOC(=O)CCCCCOCCCNC(C)C 34a_100000182298_100000755133 [0,1,1,0,0,0|2,0,0]=4 7444 B17R0.256 CCOC(=O)CCCCCOCCNCC(C)C 34a_100015185251_100000755133 [0,1,1,0,0,0|2,0,0]=4 7445 B17R0.256 CCOC(=O)CCCCCOCCOCC(C)C 34a_100000703358_100000755133 [0,1,1,0,0,0|2,0,0]=4 7446 B17R0.256 CCOC(=O)CCCCCOCCOCC(C)C 7a_100000703358_100000755133 [0,1,1,0,0,0|2,0,0]=4 7447 B17R0.256 CCOC(=O)CCCCCOCCSCC(C)C 34a_200000230437_100000755133 [0,1,1,0,0,0|2,0,0]=4 7448 B17R0.256 CCOC(=O)CCCCCOCCSCC(C)C 7a_200000230437_100000755133 [0,1,1,0,0,0|2,0,0]=4 7449 B17R0.256 CCOC(=O)CCCCCSCCCCC(=O)C 62a_100000735457_100000755133 [0,1,1,0,0,0|1,0,1]=4 7450 B17R0.256 CCOC(=O)CCCCCSCCCCC(=O)C 62a_100000755133_100000735457 [0,1,1,0,0,0|1,0,1]=4 7451 B17R0.256 CCOC(=O)CCCCCSCCCCC(C)C 62a_100000755133_100011216152 [0,1,1,0,0,0|1,0,0]=3 7452 B17R0.256 CCOC(=O)CCCCCSCCCCC(C)C 62a_100011216152_100000755133 [0,1,1,0,0,0|1,0,0]=3 7453 B17R0.256 CCOC(=O)CCCCCSCCCCN(C)C 62a_100000755133_100000690147 [0,1,1,0,0,0|2,0,0]=4 7454 B17R0.256 CCOC(=O)CCCCNCCCCCC(C)C 2230a_100011290863_100000750268 [0,1,1,0,0,0|1,0,0]=3 7455 B17R0.256 CCOC(=O)CCCCNCCCCCC(C)C 34a_100011290863_100000750268 [0,1,1,0,0,0|1,0,0]=3 7456 B17R0.256 CCOC(=O)CCCCNCCCOCC(C)C 2230a_100000205972_100000750268 [0,1,1,0,0,0|2,0,0]=4 7457 B17R0.256 CCOC(=O)CCCCNCCCOCC(C)C 34a_100000205972_100000750268 [0,1,1,0,0,0|2,0,0]=4 7458 B17R0.256 CCOC(=O)CCCCOCCCCCC(C)C 34a_100011995859_100000750268 [0,1,1,0,0,0|1,0,0]=3 7459 B17R0.256 CCOC(=O)CCCCOCCCCCC(C)C 7a_100011995859_100000750268 [0,1,1,0,0,0|1,0,0]=3 7460 B17R0.256 CCOC(=O)CCCCOCCCCNC(C)C 34a_100011521146_100000750268 [0,1,1,0,0,0|2,0,0]=4 7461 B17R0.256 CCOC(=O)CCCCSCCCCCC(C)C 62a_100000210682_100000750268 [0,1,1,0,0,0|1,0,0]=3 7462 B17R0.256 CCOC(=O)CCCCSCCCCCC(C)C 62a_100000750268_100000210682 [0,1,1,0,0,0|1,0,0]=3 7463 B17R0.256 CCOC(=O)CCCNCCCCCCC(C)C 2230a_100000211014_100009991533 [0,1,1,0,0,0|1,0,0]=3 7464 B17R0.256 CCOC(=O)CCCNCCCCCCC(C)C 34a_100000211014_100009991533 [0,1,1,0,0,0|1,0,0]=3 7465 B17R0.256 CCOC(=O)CCCOCCCCCNC(C)C 34a_100011629493_100009991533 [0,1,1,0,0,0|2,0,0]=4 7466 B17R0.256 CCOC(=O)CCOCCCCCCCC(C)C 34a_200000210741_100000765890 [0,1,1,0,0,0|1,0,0]=3 7467 B17R0.256 CCOC(=O)CCOCCCCCCCC(C)C 7a_200000210741_100011206558 [0,1,1,0,0,0|1,0,0]=3 7468 B17R0.256 CCOC(=O)COCCCOCCCCC(C)C 34a_100011214890_100009893628 [0,1,1,0,0,0|2,0,0]=4 7469 B17R0.256 CCOC(=O)COCCCOCCCCC(C)C 7a_100011214890_100009893628 [0,1,1,0,0,0|2,0,0]=4 7470 B17R0.256 CCOC(=O)COCCCSCCCCC(C)C 62a_100009893628_100011216152 [0,1,1,0,0,0|2,0,0]=4 7471 B17R0.256 CCOC(=O)COCCCSCCCCC(C)C 62a_100011216152_100009893628 [0,1,1,0,0,0|2,0,0]=4 7472 B17R0.256 CCOC(=O)COCCNCCCCCC(C)C 2230a_100011290863_100000088970 [0,1,1,0,0,0|2,0,0]=4 7473 B17R0.256 CCOC(=O)COCCNCCCCCC(C)C 34a_100011290863_100000088970 [0,1,1,0,0,0|2,0,0]=4 7474 B17R0.256 CCOC(=O)COCCOCCCCCC(C)C 34a_100011995859_100000088970 [0,1,1,0,0,0|2,0,0]=4 7475 B17R0.256 CCOC(=O)COCCOCCCCCC(C)C 7a_100011995859_100000088970 [0,1,1,0,0,0|2,0,0]=4 7476 B17R0.256 CCOC(=O)COCCSCCCCCC(C)C 62a_100000088970_100000210682 [0,1,1,0,0,0|2,0,0]=4 7477 B17R0.256 CCOC(=O)COCCSCCCCCC(C)C 62a_100000210682_100000088970 [0,1,1,0,0,0|2,0,0]=4 7478 B17R0.256 CCOC(=O)CSCCOCCCCCC(C)C 7a_200000230590_100000210682 [0,1,1,0,0,0|2,0,0]=4 7479 B17R0.285 CCCC(=O)CCCCCCCCC(=O)OCC 1458a_100000211992_100010175975 [0,1,1,0,0,0|0,0,1]=3 7480 B17R0.285 CCCC(=O)CCCCCCCCC(=O)OCC 1458a_200000016031_100000210303 [0,1,1,0,0,0|0,0,1]=3 7481 B17R0.285 CCCC(=O)CSCCCCCCC(=O)OCC 62a_100000747444_100009814379 [0,1,1,0,0,0|1,0,1]=4 7482 B17R0.285 CCCC(C)CCCOCCCCC(=O)OCC 34a_100011713154_100000750268 [0,1,1,0,0,0|1,0,0]=3 7483 B17R0.285 CCCC(C)CCCOCCCCC(=O)OCC 7a_100011713154_100000750268 [0,1,1,0,0,0|1,0,0]=3 7484 B17R0.285 CCCC(C)CCCOCCOCC(=O)OCC 34a_100011713154_100000088970 [0,1,1,0,0,0|2,0,0]=4 7485 B17R0.285 CCCC(C)CCCOCCOCC(=O)OCC 7a_100011713154_100000088970 [0,1,1,0,0,0|2,0,0]=4 7486 B17R0.285 CCCC(C)CCOCCCCCC(=O)OCC 34a_100011217855_100000755133 [0,1,1,0,0,0|1,0,0]=3 7487 B17R0.285 CCCC(C)CCOCCCCCC(=O)OCC 7a_100011217855_100000755133 [0,1,1,0,0,0|1,0,0]=3 7488 B17R0.285 CCCC(C)CCOCCCOCC(=O)OCC 34a_100011217855_100009893628 [0,1,1,0,0,0|2,0,0]=4 7489 B17R0.285 CCCC(C)CCOCCCOCC(=O)OCC 7a_100011217855_100009893628 [0,1,1,0,0,0|2,0,0]=4 7490 B17R0.285 CCCC(C)COCCCCCCC(=O)OCC 34a_100000688023_100009814379 [0,1,1,0,0,0|1,0,0]=3 7491 B17R0.285 CCCC(C)COCCCCCCC(=O)OCC 7a_100000688023_100009814379 [0,1,1,0,0,0|1,0,0]=3 7492 B17R0.285 CCCC(C)CSCCCCCCC(=O)OCC 62a_100011216630_100009814379 [0,1,1,0,0,0|1,0,0]=3 7493 B17R0.285 CCCC(C)NCCCCCCCC(=O)OCC 2230a_100000741246_100009991516 [0,1,1,0,0,0|1,0,0]=3 7494 B17R0.285 CCCC(C)OCCCCCCCC(=O)OCC 34a_100000764384_100009991516 [0,1,1,0,0,0|1,0,0]=3 7495 B17R0.285 CCCC(C)OCCCCCCCC(=O)OCC 7a_100000764384_100009991516 [0,1,1,0,0,0|1,0,0]=3 7496 B17R0.285 CCCC(C)SCCCCCCCC(=O)OCC 62a_100000766640_100009991516 [0,1,1,0,0,0|1,0,0]=3 7497 B17R0.285 CCCN(C)CCCCCCCCC(=O)OCC 2230a_100000747261_100010175975 [0,1,1,0,0,0|1,0,0]=3 7498 B17R0.285 CCCN(C)CCCCCCCCC(=O)OCC 269982a_100000747261_100010175975 [0,1,1,0,0,0|1,0,0]=3 7499 B17R0.285 CCC[C@H](N)CCOCCCCCC(=O)OCC 34a_100015193777_100000755133 [0,1,1,0,0,0|1,0,0]=3 7500 B17R0.285 CCC[C@H](N)CCOCCCOCC(=O)OCC 34a_100015193777_100009893628 [0,1,1,0,0,0|2,0,0]=4 7501 B17R0.285 CCC[C@H](N)COCCCCCCC(=O)OCC 34a_100000732646_100009814379 [0,1,1,0,0,0|1,0,0]=3 7502 B17R0.285 CCNC(=O)CCCCCCCCC(=O)OCC 11a_100015525214_200000016031 [0,1,1,0,0,0|1,0,1]=4 7503 B17R0.285 CCNC(=O)CCCCCCCCC(=O)OCC 240690a_100015525214_200000016031 [0,1,1,0,0,0|1,0,1]=4 7504 B17R0.285 CCNC(=O)CCCCCCCCC(=O)OCC 527a_100015525214_200000016031 [0,1,1,0,0,0|1,0,1]=4 7505 B17R0.285 CCOC(=O)CCCCCCCCC(=O)CCF 1458a_200000016031_100011217306 [0,1,1,0,0,0|1,0,1]=4 7506 B17R0.285 CCOC(=O)CCCCCCCCC(=O)CCO 1458a_100011216618_100010175975 [0,1,1,0,0,0|1,0,1]=4 7507 B17R0.285 CCOC(=O)CCCCCCCCC(=O)CCO 1458a_200000016031_100000211926 [0,1,1,0,0,0|1,0,1]=4 7508 B17R0.285 CCOC(=O)CCCCCCCCC(=O)COC 1458a_100000210968_100010175975 [0,1,1,0,0,0|1,0,1]=4 7509 B17R0.285 CCOC(=O)CCCCCCCCC(=O)CSC 1458a_100000184570_100010175975 [0,1,1,0,0,0|1,0,1]=4 7510 B17R0.285 CCOC(=O)CCCCCCCCN(C)CCO 2230a_100000210263_100010175975 [0,1,1,0,0,0|2,0,0]=4 7511 B17R0.285 CCOC(=O)CCCCCCCCN(C)CCO 269982a_100000210263_100010175975 [0,1,1,0,0,0|2,0,0]=4 7512 B17R0.285 CCOC(=O)CCCCCCCN[C@H](C)CCO 2230a_100000706166_100009991516 [0,1,1,0,0,0|2,0,0]=4 7513 B17R0.285 CCOC(=O)CCCCCCCN[C@H](C)CCO 34a_100000706166_100009991516 [0,1,1,0,0,0|2,0,0]=4 7514 B17R0.285 CCOC(=O)CCCCCCCN[C@H](C)COC 2230a_100000764878_100009991516 [0,1,1,0,0,0|2,0,0]=4 7515 B17R0.285 CCOC(=O)CCCCCCCOC(C)CCBr 34a_100012276601_100009991516 [0,1,1,0,0,0|2,0,0]=4 7516 B17R0.285 CCOC(=O)CCCCCCCO[C@H](C)COC 34a_100011934205_100009991516 [0,1,1,0,0,0|2,0,0]=4 7517 B17R0.285 CCOC(=O)CCCCCCCSC(C)CCO 62a_100009893172_100009991516 [0,1,1,0,0,0|2,0,0]=4 7518 B17R0.285 CCOC(=O)CCCCCCCSC(C)COC 62a_100000765312_100009991516 [0,1,1,0,0,0|2,0,0]=4 7519 B17R0.285 CCOC(=O)CCCCCCNCC(O)COC 2230a_100000756049_100009814379 [0,1,1,0,0,0|2,0,0]=4 7520 B17R0.285 CCOC(=O)CCCCCCNCC(O)COC 34a_100000756049_100009814379 [0,1,1,0,0,0|2,0,0]=4 7521 B17R0.285 CCOC(=O)CCCCCCOCC(C)CCN 34a_106354213184_100009814379 [0,1,1,0,0,0|2,0,0]=4 7522 B17R0.285 CCOC(=O)CCCCCCOCC(N)COC 34a_100000724102_100009814379 [0,1,1,0,0,0|2,0,0]=4 7523 B17R0.285 CCOC(=O)CCCCCCSCC(O)COC 62a_100011215053_100009814379 [0,1,1,0,0,0|2,0,0]=4 7524 B17R0.383 CCCCCC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100000210326 [0,1,1,0,0,0|0,0,1]=3 7525 B17R0.383 CCCCCC(=O)CCCCCCC(=O)OCC 1458a_100000212188_100009814379 [0,1,1,0,0,0|0,0,1]=3 7526 B17R0.383 CCCCCC(=O)CSCCCCC(=O)OCC 62a_100000750268_200012276598 [0,1,1,0,0,0|1,0,1]=4 7527 B17R0.383 CCCCCC(=O)CSCCCCC(=O)OCC 62a_200012276598_100000750268 [0,1,1,0,0,0|1,0,1]=4 7528 B17R0.383 CCCCCC(=O)NCCCCCC(=O)OCC 188690a_100000062434_100000212188 [0,1,1,0,0,0|1,0,1]=4 7529 B17R0.383 CCCCCC(C)NCCCCCC(=O)OCC 2230a_100000211957_100000755133 [0,1,1,0,0,0|1,0,0]=3 7530 B17R0.383 CCCCCC(C)NCCCOCC(=O)OCC 2230a_100000211957_100009893628 [0,1,1,0,0,0|2,0,0]=4 7531 B17R0.383 CCCCCC(C)OCCCCCC(=O)OCC 34a_100011215632_100000755133 [0,1,1,0,0,0|1,0,0]=3 7532 B17R0.383 CCCCCC(C)OCCCCCC(=O)OCC 7a_100011214988_200011218191 [0,1,1,0,0,0|1,0,0]=3 7533 B17R0.383 CCCCCC(C)OCCCCCC(=O)OCC 7a_100011215632_100000755133 [0,1,1,0,0,0|1,0,0]=3 7534 B17R0.383 CCCCCC(C)OCCCOCC(=O)OCC 34a_100011215632_100009893628 [0,1,1,0,0,0|2,0,0]=4 7535 B17R0.383 CCCCCC(C)OCCCOCC(=O)OCC 7a_100011215632_100009893628 [0,1,1,0,0,0|2,0,0]=4 7536 B17R0.383 CCCCCC(C)SCCCCCC(=O)OCC 62a_100000755133_200011218191 [0,1,1,0,0,0|1,0,0]=3 7537 B17R0.383 CCCCCC(C)SCCCCCC(=O)OCC 62a_200011218191_100000755133 [0,1,1,0,0,0|1,0,0]=3 7538 B17R0.383 CCCCCC(C)SCCCOCC(=O)OCC 62a_100009893628_200011218191 [0,1,1,0,0,0|2,0,0]=4 7539 B17R0.383 CCCCCC(C)SCCCOCC(=O)OCC 62a_200011218191_100009893628 [0,1,1,0,0,0|2,0,0]=4 7540 B17R0.383 CCCCCN(C)CCCCCCC(=O)OCC 2230a_100000223495_100009814379 [0,1,1,0,0,0|1,0,0]=3 7541 B17R0.383 CCCCCN(C)CCCCCCC(=O)OCC 269982a_100000223495_100009814379 [0,1,1,0,0,0|1,0,0]=3 7542 B17R0.383 CCCCNC(=O)CCCCCCC(=O)OCC 11a_100000102301_100000031895 [0,1,1,0,0,0|1,0,1]=4 7543 B17R0.383 CCCCNC(=O)CCCCCCC(=O)OCC 1626a_100000102301_100000031895 [0,1,1,0,0,0|1,0,1]=4 7544 B17R0.383 CCCCNC(=O)CCCCCCC(=O)OCC 240690a_100000102301_100000031895 [0,1,1,0,0,0|1,0,1]=4 7545 B17R0.383 CCCCNC(=O)CCCCCCC(=O)OCC 527a_100000102301_100000031895 [0,1,1,0,0,0|1,0,1]=4 7546 B17R0.383 CCCOCC(=O)CCCCCCC(=O)OCC 1458a_100000745993_100009814379 [0,1,1,0,0,0|1,0,1]=4 7547 B17R0.383 CCCSCC(=O)CCCCCCC(=O)OCC 1458a_100000217233_100009814379 [0,1,1,0,0,0|1,0,1]=4 7548 B17R0.383 CCOC(=O)CCCCCCC(=O)CCCCF 1458a_100000031895_100000729493 [0,1,1,0,0,0|1,0,1]=4 7549 B17R0.383 CCOC(=O)CCCCCCC(=O)CCCCO 1458a_100000031895_100000210776 [0,1,1,0,0,0|1,0,1]=4 7550 B17R0.383 CCOC(=O)CCCCCCC(=O)CCCCO 1458a_100000695505_100009814379 [0,1,1,0,0,0|1,0,1]=4 7551 B17R0.383 CCOC(=O)CCCCCCC(=O)CCCOC 1458a_100000031895_100000740836 [0,1,1,0,0,0|1,0,1]=4 7552 B17R0.383 CCOC(=O)CCCCCCC(=O)CCCOC 1458a_100000741012_100009814379 [0,1,1,0,0,0|1,0,1]=4 7553 B17R0.383 CCOC(=O)CCCCCCC(=O)CCCSC 1458a_100000173376_100009814379 [0,1,1,0,0,0|1,0,1]=4 7554 B17R0.383 CCOC(=O)CCCCCCC(=O)CCSCC 1458a_100000031895_100000757381 [0,1,1,0,0,0|1,0,1]=4 7555 B17R0.383 CCOC(=O)CCCCCCC(=O)CCSCC 1458a_100000230768_100009814379 [0,1,1,0,0,0|1,0,1]=4 7556 B17R0.383 CCOC(=O)CCCCCCN(C)CCCCO 2230a_100000717598_100009814379 [0,1,1,0,0,0|2,0,0]=4 7557 B17R0.383 CCOC(=O)CCCCCCN(C)CCCCO 269982a_100000717598_100009814379 [0,1,1,0,0,0|2,0,0]=4 7558 B17R0.383 CCOC(=O)CCCCCCN(C)CCCOC 2230a_100000224831_100009814379 [0,1,1,0,0,0|2,0,0]=4 7559 B17R0.383 CCOC(=O)CCCCCCN(C)CCCOC 269982a_100000224831_100009814379 [0,1,1,0,0,0|2,0,0]=4 7560 B17R0.383 CCOC(=O)CCCCCOC(C)CCCOC 34a_200011539412_100000755133 [0,1,1,0,0,0|2,0,0]=4 7561 B17R0.383 CCOC(=O)CCCCCOC(C)CCCOC 7a_200011539412_100000755133 [0,1,1,0,0,0|2,0,0]=4 7562 B17R0.383 CCOC(=O)CCCCOC[C@@H](N)CCCCN 34a_100016993712_100000750268 [0,1,1,0,0,0|2,0,0]=4 7563 B17R0.383 CCOCCC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100011215890 [0,1,1,0,0,0|1,0,1]=4 7564 B17R0.383 CCOCCC(=O)CCCCCCC(=O)OCC 1458a_100000749530_100009814379 [0,1,1,0,0,0|1,0,1]=4 7565 B17R0.1022 CCCCCCCCC(=O)CCCC(=O)NCC 1458a_100000199580_100000210759 [0,1,1,0,0,0|1,0,1]=4 7566 B17R0.1022 CCCCCCCCC(=O)CCCC(=O)OCC 1458a_100000210188_100011215271 [0,1,1,0,0,0|0,0,1]=3 7567 B17R0.1022 CCCCCCCCC(=O)CCCC(=O)OCC 1458a_100000210991_100000210759 [0,1,1,0,0,0|0,0,1]=3 7568 B17R0.1022 CCCCCCCCC(=O)CCNC(=O)OCC 1458a_100000210188_200011445536 [0,1,1,0,0,0|1,0,1]=4 7569 B17R0.1022 CCCCCCCCC(=O)NCCC(=O)OCC 188690a_100000746078_100000210188 [0,1,1,0,0,0|1,0,1]=4 7570 B17R0.1022 CCCCCCCCC(C)CNCC(=O)NCC 270004a_100016988866_100011995885 [0,1,1,0,0,0|2,0,0]=4 7571 B17R0.1022 CCCCCCCCC(C)COCC(=O)CCC 7a_200012125181_100000747444 [0,1,1,0,0,0|2,0,0]=4 7572 B17R0.1022 CCCCCCCCC(C)COCC(=O)NCC 34a_200012125181_100000183381 [0,1,1,0,0,0|2,0,0]=4 7573 B17R0.1022 CCCCCCCCC(C)COCC(=O)NCC 7a_200012125181_100000183381 [0,1,1,0,0,0|2,0,0]=4 7574 B17R0.1022 CCCCCCCCC(C)COCC(=O)OCC 34a_200012125181_100000188475 [0,1,1,0,0,0|1,0,0]=3 7575 B17R0.1022 CCCCCCCCC(C)COCC(=O)OCC 7a_200012125181_100000188475 [0,1,1,0,0,0|1,0,0]=3 7576 B17R0.1022 CCCCCCCCC(C)NCCC(=O)NCC 270004a_100025743525_100011216694 [0,1,1,0,0,0|2,0,0]=4 7577 B17R0.1022 CCCCCCCCC(C)OCCC(=O)NCC 7a_100000210740_100000737597 [0,1,1,0,0,0|2,0,0]=4 7578 B17R0.1022 CCCCCCCCC(C)OCCC(=O)OCC 34a_100000210740_100000765890 [0,1,1,0,0,0|1,0,0]=3 7579 B17R0.1022 CCCCCCCCC(C)OCCC(=O)OCC 7a_100000210740_100011206558 [0,1,1,0,0,0|1,0,0]=3 7580 B17R0.1022 CCCCCCCCC(C)OCOC(=O)CCC 34a_100000210740_100000034017 [0,1,1,0,0,0|1,0,0]=3 7581 B17R0.1022 CCCCCCCCN(C)CCCC(=O)OCC 2230a_100000207567_100009991533 [0,1,1,0,0,0|1,0,0]=3 7582 B17R0.1022 CCCCCCCCN(C)CCCC(=O)OCC 269982a_100000207567_100009991533 [0,1,1,0,0,0|1,0,0]=3 7583 B17R0.1022 CCCCCCCCN(C)CCNC(=O)OCC 269982a_100000207567_200011445536 [0,1,1,0,0,0|2,0,0]=4 7584 B17R0.1022 CCCCCCCNC(=O)CCCC(=O)OCC 11a_100000229938_100000210991 [0,1,1,0,0,0|1,0,1]=4 7585 B17R0.1022 CCCCCCCNC(=O)CCCC(=O)OCC 1626a_100000229938_100000210991 [0,1,1,0,0,0|1,0,1]=4 7586 B17R0.1022 CCCCCCCNC(=O)CCCC(=O)OCC 240690a_100000229938_100000210991 [0,1,1,0,0,0|1,0,1]=4 7587 B17R0.1022 CCCCCCCNC(=O)CCCC(=O)OCC 527a_100000229938_100000210991 [0,1,1,0,0,0|1,0,1]=4 7588 B17R0.1022 CCOC(=O)CCCC(=O)CCCCCCCO 1458a_100000210991_100000760002 [0,1,1,0,0,0|1,0,1]=4 7589 B17R0.1022 CCOC(=O)CCCC(=O)CCCCCCCO 1458a_100011219782_100011215271 [0,1,1,0,0,0|1,0,1]=4 7590 B17R0.1022 CCOC(=O)CCCC(=O)CCCCCCOC 1458a_100000210991_100011998445 [0,1,1,0,0,0|1,0,1]=4 7591 B17R0.3112 C/C=C(\C)/C(=O)CCCCCCCCCCCC 1458a_100020587367_100000759014 [0,1,1,0,0,0|1,0,1]=4 7592 B17R0.3112 CCC(C)C(=O)CCCCCCCCCCCO 1458a_100011192722_100009812471 [0,1,1,0,0,0|2,0,0]=4 7593 B17R0.3112 CCC(C)C(=O)NCCCCCCCCCCO 240690a_100000066964_100011192722 [0,1,1,0,0,0|2,0,0]=4 7594 B17R0.3112 CCC(O)C(=O)CCCCCCCCCCCO 1458a_100011196387_100009812471 [0,1,1,0,0,0|2,0,0]=4 7595 B17R0.3112 CCC(O)C(=O)NCCCCCCCCCCO 240690a_100000066964_100011196387 [0,1,1,0,0,0|2,0,0]=4 7596 B17R0.3112 CCCCCCCCCCCCC(=O)C(=O)NC 1458a_100011218921_100000759014 [0,1,1,0,0,0|2,0,0]=4 7597 B17R0.3112 CCCCCCCCCCCCC(=O)C(C)CC 1458a_100011192722_100000759014 [0,1,1,0,0,0|1,0,0]=3 7598 B17R0.3112 CCCCCCCCCCCCC(=O)C(C)CC 1458a_100011215791_100000758301 [0,1,1,0,0,0|1,0,0]=3 7599 B17R0.3112 CCCCCCCCCCCCC(=O)C(C)OC 1458a_100000743197_100000759014 [0,1,1,0,0,0|2,0,0]=4 7600 B17R0.3112 CCCCCCCCCCCCC(=O)C(C)SC 1458a_100000149566_100000759014 [0,1,1,0,0,0|2,0,0]=4 7601 B17R0.3112 CCCCCCCCCCCCC(=O)C(O)CC 1458a_100011196387_100000759014 [0,1,1,0,0,0|1,0,0]=3 7602 B17R0.3112 CCCCCCCCCCCCC(=O)C(O)CO 1458a_100011215603_100000759014 [0,1,1,0,0,0|2,0,0]=4 7603 B17R0.3112 CCCCCCCCCCCCC(=O)N(C)CC 11a_100000225621_100011215791 [0,1,1,0,0,0|1,0,0]=3 7604 B17R0.3112 CCCCCCCCCCCCC(=O)N(C)CC 1626a_100000225621_100011215791 [0,1,1,0,0,0|1,0,0]=3 7605 B17R0.3112 CCCCCCCCCCCCC(=O)N(C)CC 240690a_100000225621_100011215791 [0,1,1,0,0,0|1,0,0]=3 7606 B17R0.3112 CCCCCCCCCCCNC(=O)C(C)CC 11a_200011215754_100011192722 [0,1,1,0,0,0|1,0,0]=3 7607 B17R0.3112 CCCCCCCCCCCNC(=O)C(C)CC 1626a_200011215754_100011192722 [0,1,1,0,0,0|1,0,0]=3 7608 B17R0.3112 CCCCCCCCCCCNC(=O)C(C)CC 240690a_200011215754_100011192722 [0,1,1,0,0,0|1,0,0]=3 7609 B17R0.3112 CCCCCCCCCCCNC(=O)C(C)CC 527a_200011215754_100011192722 [0,1,1,0,0,0|1,0,0]=3 7610 B17R0.3112 CCCCCCCCCCCNC(=O)C(C)OC 11a_200011215754_100000743197 [0,1,1,0,0,0|2,0,0]=4 7611 B17R0.3112 CCCCCCCCCCCNC(=O)C(C)OC 1626a_200011215754_100000743197 [0,1,1,0,0,0|2,0,0]=4 7612 B17R0.3112 CCCCCCCCCCCNC(=O)C(C)OC 240690a_200011215754_100000743197 [0,1,1,0,0,0|2,0,0]=4 7613 B17R0.3112 CCCCCCCCCCCNC(=O)C(C)OC 527a_200011215754_100000743197 [0,1,1,0,0,0|2,0,0]=4 7614 B17R0.3112 CCCCCCCCCCCNC(=O)C(C)SC 11a_200011215754_100000149566 [0,1,1,0,0,0|2,0,0]=4 7615 B17R0.3112 CCCCCCCCCCCNC(=O)C(C)SC 1626a_200011215754_100000149566 [0,1,1,0,0,0|2,0,0]=4 7616 B17R0.3112 CCCCCCCCCCCNC(=O)C(C)SC 240690a_200011215754_100000149566 [0,1,1,0,0,0|2,0,0]=4 7617 B17R0.3112 CCCCCCCCCCCNC(=O)C(C)SC 527a_200011215754_100000149566 [0,1,1,0,0,0|2,0,0]=4 7618 B17R0.3112 CCCCCCCCCCCNC(=O)C(O)CC 240690a_200011215754_100011196387 [0,1,1,0,0,0|1,0,0]=3 7619 B17R0.3112 CCCCCCCCCCCNC(=O)C(O)CO 240690a_200011215754_100011215603 [0,1,1,0,0,0|2,0,0]=4 7620 B17R0.3112 CCCCCCCCCCCNC(=O)N(C)CC 2708a_200011215754_100000225621 [0,1,1,0,0,0|2,0,0]=4 7621 B17R0.3112 CCCCCCCCCCCNC(=O)N(C)CC 273464a_200011215754_100000225621 [0,1,1,0,0,0|2,0,0]=4 7622 B17R0.3112 CCCCCCCCCCCOC(C)C(C)CC 7a_100011215189_100011215454 [0,1,1,0,0,0|1,0,1]=4 7623 B17R0.3112 CCCCCCCCCCNCC(=O)N(C)CC 2230a_100000684558_100000738999 [0,1,1,0,0,0|2,0,0]=4 7624 B17R0.3112 CCCCCCCCCCNCC(=O)N(C)CC 34a_100000684558_100000738999 [0,1,1,0,0,0|2,0,0]=4 7625 B17R0.3112 CCCCCCCCCCOCC(=O)N(C)CC 34a_100000210711_100000738999 [0,1,1,0,0,0|2,0,0]=4 7626 B17R0.3112 CCCCCCCCCCOCC(=O)N(C)CC 7a_100000210711_100000738999 [0,1,1,0,0,0|2,0,0]=4 7627 B17R0.3112 CCCCCCCCCCSCC(=O)N(C)CC 62a_100000738999_100000210320 [0,1,1,0,0,0|2,0,0]=4 7628 B17R0.3112 CCN(C)C(=O)CCCCCCCCCCCO 240690a_100000225621_100000037981 [0,1,1,0,0,0|2,0,0]=4 7629 B17R0.3167 CCOC(=O)CCCCCCCCCC(=O)CC 1458a_100000210414_100009828014 [0,1,1,0,0,0|0,0,1]=3 7630 B17R0.3167 CCOC(=O)CCCCCCCCCC(=O)CO 1458a_100000210174_100009828014 [0,1,1,0,0,0|1,0,1]=4 7631 B17R0.3167 CCOC(=O)CCCCCCCCCN(C)CC 2230a_100000225621_100009828014 [0,1,1,0,0,0|1,0,0]=3 7632 B17R0.3167 CCOC(=O)CCCCCCCCCN(C)CC 269982a_100000225621_100009828014 [0,1,1,0,0,0|1,0,0]=3 7633 B17R0.3167 CCOC(=O)CCCCCCCCNC(C)CC 2230a_100000209981_100010175975 [0,1,1,0,0,0|1,0,0]=3 7634 B17R0.3167 CCOC(=O)CCCCCCCCN[C@H](C)CO 2230a_100000737577_100010175975 [0,1,1,0,0,0|2,0,0]=4 7635 B17R0.3167 CCOC(=O)CCCCCCCCOC(C)CC 7a_100000210228_100010175975 [0,1,1,0,0,0|1,0,0]=3 7636 B17R0.3167 CCOC(=O)CCCCCCCCOC(C)CF 34a_100016041109_100010175975 [0,1,1,0,0,0|2,0,0]=4 7637 B17R0.3167 CCOC(=O)CCCCCCCCOC(C)CF 7a_100016041109_100010175975 [0,1,1,0,0,0|2,0,0]=4 7638 B17R0.3167 CCOC(=O)CCCCCCCCOC(C)CN 34a_100000210904_100010175975 [0,1,1,0,0,0|2,0,0]=4 7639 B17R0.3167 CCOC(=O)CCCCCCCCSC(C)CC 62a_100000758301_100010175975 [0,1,1,0,0,0|1,0,0]=3 7640 B17R0.3167 CCOC(=O)CCCCCCCCSC(C)CO 62a_100012180447_100010175975 [0,1,1,0,0,0|2,0,0]=4 7641 B17R0.3167 CCOC(=O)CCCCCCCCSC(C)OC 62a_100009879195_100010175975 [0,1,1,0,0,0|2,0,0]=4 7642 B17R0.3167 CCOC(=O)CCCCCCCCS[C@H](C)CO 62a_100016084084_100010175975 [0,1,1,0,0,0|2,0,0]=4 7643 B17R0.3167 CCOC(=O)CCCCCCCNCC(C)CC 2230a_100020588543_100009991516 [0,1,1,0,0,0|1,0,0]=3 7644 B17R0.3167 CCOC(=O)CCCCCCCNCC(C)CO 34a_100000744482_100009991516 [0,1,1,0,0,0|2,0,0]=4 7645 B17R0.3167 CCOC(=O)CCCCCCCNCC(O)CC 2230a_100011218483_100009991516 [0,1,1,0,0,0|1,0,0]=3 7646 B17R0.3167 CCOC(=O)CCCCCCCNC[C@@H](C)OC 2230a_100020591295_100009991516 [0,1,1,0,0,0|2,0,0]=4 7647 B17R0.3167 CCOC(=O)CCCCCCCNC[C@@H](F)CO 34a_100015665980_100009991516 [0,1,1,0,0,0|2,0,0]=4 7648 B17R0.3167 CCOC(=O)CCCCCCCNC[C@H](O)CO 2230a_100020644852_100009991516 [0,1,1,0,0,0|2,0,0]=4 7649 B17R0.3167 CCOC(=O)CCCCCCCOCC(=O)CC 34a_100000725409_100009991516 [0,1,1,0,0,0|1,0,1]=4 7650 B17R0.3167 CCOC(=O)CCCCCCCOCC(C)CN 34a_100000744482_100009991516 [0,1,1,0,0,0|2,0,0]=4 7651 B17R0.3167 CCOC(=O)CCCCCCCOCC(C)OC 34a_100000690652_100009991516 [0,1,1,0,0,0|2,0,0]=4 7652 B17R0.3167 CCOC(=O)CCCCCCCOCC(Cl)CCl 34a_100000033668_100009991516 [0,1,1,0,0,0|2,0,0]=4 7653 B17R0.3167 CCOC(=O)CCCCCCCOC[C@@H](C)CC 7a_100009816381_100009991516 [0,1,1,0,0,0|1,0,0]=3 7654 B17R0.3167 CCOC(=O)CCCCCCCOC[C@H](F)CN 34a_100015665980_100009991516 [0,1,1,0,0,0|2,0,0]=4 7655 B17R0.3167 CCOC(=O)CCCCCCCSCC(=O)CC 62a_100000747405_100009991516 [0,1,1,0,0,0|1,0,1]=4 7656 B17R0.3167 CCOC(=O)CCCCCCCSCC(C)CC 62a_100000748023_100009991516 [0,1,1,0,0,0|1,0,0]=3 7657 B17R0.3167 CCOC(=O)CCCCCCCSCC(O)CC 62a_100011218378_100009991516 [0,1,1,0,0,0|1,0,0]=3 7658 B17R0.3167 CCOC(=O)CCCCCCCSCC(O)CO 62a_100011219619_100009991516 [0,1,1,0,0,0|2,0,0]=4 7659 B17R0.3167 CCOC(=O)CCCCCCCSC[C@@H](C)CC 62a_100009816398_100009991516 [0,1,1,0,0,0|1,0,0]=3 7660 B17R0.3167 CCOC(=O)CCCCCCCSC[C@@H](C)CO 62a_100000059175_100009991516 [0,1,1,0,0,0|2,0,0]=4 7661 B17R0.3167 CCOC(=O)CCCCCCCSC[C@@H](O)CF 62a_100015614560_100009991516 [0,1,1,0,0,0|2,0,0]=4 7662 B17R0.3167 CCOC(=O)CCCCCCCSC[C@@H](O)CO 62a_100009815848_100009991516 [0,1,1,0,0,0|2,0,0]=4 7663 B17R0.3167 CCOC(=O)CCCCCCNCCC(C)CC 2230a_100020591266_100009814379 [0,1,1,0,0,0|1,0,0]=3 7664 B17R0.3167 CCOC(=O)CCCCCCNCCC(C)CO 2230a_106354213184_100009814379 [0,1,1,0,0,0|2,0,0]=4 7665 B17R0.3167 CCOC(=O)CCCCCCNCCC(C)CO 34a_106354213184_100009814379 [0,1,1,0,0,0|2,0,0]=4 7666 B17R0.3167 CCOC(=O)CCCCCCOCCC(C)CC 7a_100011215188_100009814379 [0,1,1,0,0,0|1,0,0]=3 7667 B17R0.3167 CCOC(=O)CCCCCCOCCC(C)OC 7a_100000764861_100009814379 [0,1,1,0,0,0|2,0,0]=4 7668 B17R0.3167 CCOC(=O)CCCCCOCCCC(C)CC 7a_100011216074_100000755133 [0,1,1,0,0,0|1,0,0]=3 7669 B17R0.3167 CCOC(=O)CCCCCOCCCN(C)CC 7a_100011214988_100015186262 [0,1,1,0,0,0|2,0,0]=4 7670 B17R0.3167 CCOC(=O)CCCCCOCCC[C@@H](C)CN 34a_100160569302_100000755133 [0,1,1,0,0,0|2,0,0]=4 7671 B17R0.3167 CCOC(=O)CCCCCSCCCN(C)CC 62a_100000755133_100015186262 [0,1,1,0,0,0|2,0,0]=4 7672 B17R0.3167 CCOC(=O)CCCOCCCCCC(C)CC 7a_200000035636_100011215271 [0,1,1,0,0,0|1,0,0]=3 7673 B17R0.3167 CCOC(=O)COCCCOCCCC(C)CC 7a_100011216074_100009893628 [0,1,1,0,0,0|2,0,0]=4 7674 B17R0.3167 CCOC(=O)NCCOCCCCCC(C)CC 7a_200000035636_200011445536 [0,1,1,0,0,0|2,0,0]=4 7675 B17R0.10075 CCCCCCCCCCCCS(=O)(=O)NCC 270084a_100015525214_100011216125 [0,1,1,0,0,0|2,0,0]=4 7676 B17R0.10075 CCCCCCCCCCCCS(=O)(=O)NCC 274078a_100015525214_100011216125 [0,1,1,0,0,0|2,0,0]=4 7677 B17R0.10075 CCCCCCCCCCCNS(=O)(=O)CCC 270084a_200011215754_100000211391 [0,1,1,0,0,0|2,0,0]=4 7678 B17R0.10075 CCCCCCCCCCCNS(=O)(=O)CCC 274078a_200011215754_100000211391 [0,1,1,0,0,0|2,0,0]=4 7679 B17R0.10075 CCCCCCCCCCCNS(=O)(=O)CCC 40a_200011215754_100000054278 [0,1,1,0,0,0|2,0,0]=4 7680 B17R0.13602 C=C(CNCCCCCCCCC)C(=O)OCC 34a_100000212291_100000755967 [0,1,1,0,0,0|1,0,1]=4 7681 B17R0.13602 C=C(COCCCCCCCCC)C(=O)OCC 34a_100000210712_100000755967 [0,1,1,0,0,0|1,0,1]=4 7682 B17R0.13602 C=C(COCCCCCCCCC)C(=O)OCC 7a_100000210712_100000755967 [0,1,1,0,0,0|1,0,1]=4 7683 B17R0.13602 C=C(CSCCCCCCCCC)C(=O)OCC 62a_100000755967_100000210670 [0,1,1,0,0,0|1,0,1]=4 7684 B17R0.13602 CCCCCCCCCCCC(=O)C(=O)NCC 1458a_200011297158_100011215454 [0,1,1,0,0,0|1,0,1]=4 7685 B17R0.13602 CCCCCCCCCCNC(=O)C(=O)OCC 11a_100000684558_100014798877 [0,1,1,0,0,0|1,0,1]=4 7686 B17R0.13602 CCCCCCCCCCNC(=O)C(=O)OCC 1626a_100000684558_100014798877 [0,1,1,0,0,0|1,0,1]=4 7687 B17R0.13602 CCCCCCCCCCNC(=O)C(=O)OCC 240690a_100000684558_100014798877 [0,1,1,0,0,0|1,0,1]=4 7688 B17R0.13602 CCCCCCCCCCNC(C)C(=O)NCC 2230a_100000684558_100000230173 [0,1,1,0,0,0|2,0,0]=4 7689 B17R0.13602 CCCCCCCCCCNC(C)C(=O)NCC 2230a_100000736553_100000210320 [0,1,1,0,0,0|2,0,0]=4 7690 B17R0.13602 CCCCCCCCCCNC(C)C(=O)NCC 34a_100000684558_100000230173 [0,1,1,0,0,0|2,0,0]=4 7691 B17R0.13602 CCCCCCCCCCNC(C)C(=O)NCC 34a_100000736553_100000210320 [0,1,1,0,0,0|2,0,0]=4 7692 B17R0.13602 CCCCCCCCCCNC(C)C(=O)OCC 2230a_100000684558_100011215307 [0,1,1,0,0,0|1,0,0]=3 7693 B17R0.13602 CCCCCCCCCCNC(C)C(=O)OCC 34a_100000684558_100011216346 [0,1,1,0,0,0|1,0,0]=3 7694 B17R0.13602 CCCCCCCCCCNC(F)C(=O)OCC 2230a_100000684558_100000760018 [0,1,1,0,0,0|1,0,0]=3 7695 B17R0.13602 CCCCCCCCCCNC(F)C(=O)OCC 34a_100000684558_100000760018 [0,1,1,0,0,0|1,0,0]=3 7696 B17R0.13602 CCCCCCCCCCN[C@@H](C)C(=O)SCC 2230a_100103168634_100000210320 [0,1,1,0,0,0|1,1,0]=4 7697 B17R0.13602 CCCCCCCCCCOC(C)C(=O)NCC 34a_100000210711_100000230173 [0,1,1,0,0,0|2,0,0]=4 7698 B17R0.13602 CCCCCCCCCCOC(C)C(=O)NCC 7a_100000210711_100000230173 [0,1,1,0,0,0|2,0,0]=4 7699 B17R0.13602 CCCCCCCCCCOC(C)C(=O)OCC 34a_100000210711_100011216346 [0,1,1,0,0,0|1,0,0]=3 7700 B17R0.13602 CCCCCCCCCCOC(C)C(=O)OCC 7a_100000210711_100011216346 [0,1,1,0,0,0|1,0,0]=3 7701 B17R0.13602 CCCCCCCCCCOC(F)C(=O)OCC 34a_100000210711_100000760018 [0,1,1,0,0,0|1,0,0]=3 7702 B17R0.13602 CCCCCCCCCCOC(F)C(=O)OCC 7a_100000210711_100000040065 [0,1,1,0,0,0|1,0,0]=3 7703 B17R0.13602 CCCCCCCCCCO[C@@H](C)C(=O)OCC 7a_100000751109_100000210320 [0,1,1,0,0,0|1,0,0]=3 7704 B17R0.13602 CCCCCCCCCCSC(C)C(=O)NCC 62a_100000230173_100000210320 [0,1,1,0,0,0|2,0,0]=4 7705 B17R0.13602 CCCCCCCCCCSC(C)C(=O)OCC 62a_100011216346_100000210320 [0,1,1,0,0,0|1,0,0]=3 7706 B17R0.13602 CCCCCCCCCCSC(F)C(=O)OCC 62a_100000760018_100000210320 [0,1,1,0,0,0|1,0,0]=3 7707 B17R0.13602 CCCCCCCCCSCC(=O)C(=O)OCC 62a_100000211299_100000210670 [0,1,1,0,0,0|1,0,1]=4 7708 B17R0.13602 CCCCCNCCCCCC(=O)C(=O)OCC 2230a_100000209983_100000068741 [0,1,1,0,0,0|1,0,1]=4 7709 B17R0.13602 CCCCCSCCCCCC(=O)C(=O)OCC 62a_100000210326_100000068741 [0,1,1,0,0,0|1,0,1]=4 7710 B17R0.13602 CCOC(=O)C(C)NCCCCCCCCCO 2230a_100000078944_100011215307 [0,1,1,0,0,0|2,0,0]=4 7711 B17R0.13602 CCOC(=O)C(C)NCCCCCCCCCO 34a_100000078944_100011216346 [0,1,1,0,0,0|2,0,0]=4 7712 B17R0.13602 CCOC(=O)C(C)OCCCCCCCCCBr 34a_100009813782_100011216346 [0,1,1,0,0,0|2,0,0]=4 7713 B17R0.13602 CCOC(=O)C(C)OCCCCCCCCCBr 7a_100009813782_100011216346 [0,1,1,0,0,0|2,0,0]=4 7714 B17R0.13602 CCOC(=O)C(C)OCCCCCCCCCCl 34a_100009868337_100011216346 [0,1,1,0,0,0|2,0,0]=4 7715 B17R0.13602 CCOC(=O)C(C)OCCCCCCCCCCl 7a_100009868337_100011216346 [0,1,1,0,0,0|2,0,0]=4 7716 B17R0.13602 CCOC(=O)C(C)OCCCCCCCCCN 34a_100000078944_100011216346 [0,1,1,0,0,0|2,0,0]=4 7717 B17R0.13602 CCOC(=O)C(C)SCCCCCCCCCO 62a_100009813782_100011216346 [0,1,1,0,0,0|2,0,0]=4 7718 B17R0.13602 CCOC(=O)C(C)SCCCCCCCCCO 62a_100011216346_100009813782 [0,1,1,0,0,0|2,0,0]=4 7719 B17R0.13602 CCOC(=O)C(F)NCCCCCCCCCO 2230a_100000078944_100000760018 [0,1,1,0,0,0|2,0,0]=4 7720 B17R0.13602 CCOC(=O)C(F)NCCCCCCCCCO 34a_100000078944_100000760018 [0,1,1,0,0,0|2,0,0]=4 7721 B17R0.13602 CCOC(=O)C(F)OCCCCCCCCCBr 34a_100009813782_100000760018 [0,1,1,0,0,0|2,0,0]=4 7722 B17R0.13602 CCOC(=O)C(F)OCCCCCCCCCBr 7a_100009813782_100000040065 [0,1,1,0,0,0|2,0,0]=4 7723 B17R0.13602 CCOC(=O)C(F)OCCCCCCCCCCl 34a_100009868337_100000760018 [0,1,1,0,0,0|2,0,0]=4 7724 B17R0.13602 CCOC(=O)C(F)OCCCCCCCCCCl 7a_100009868337_100000040065 [0,1,1,0,0,0|2,0,0]=4 7725 B17R0.13602 CCOC(=O)C(F)OCCCCCCCCCN 34a_100000078944_100000760018 [0,1,1,0,0,0|2,0,0]=4 7726 B17R0.13602 CCOC(=O)C(F)SCCCCCCCCCO 62a_100000760018_100009813782 [0,1,1,0,0,0|2,0,0]=4 7727 B17R0.13602 CCOC(=O)C(F)SCCCCCCCCCO 62a_100009813782_100000760018 [0,1,1,0,0,0|2,0,0]=4 7728 B17R0.13602 CCOC(=O)[C@H](C)OCCCCCCCCCO 7a_100000751109_100009813782 [0,1,1,0,0,0|2,0,0]=4 7729 B17R0.13608 C#CC(CCC)OCCCCCCCCCCC 34a_200011217317_100011215454 [0,1,1,0,0,0|1,0,1]=4 7730 B17R0.13608 C#CC(CCC)OCCCCCCCCCCC 7a_200011217317_100011215454 [0,1,1,0,0,0|1,0,1]=4 7731 B17R0.13608 C=CC(CCC)OCCCCCCCCCCC 34a_100011216692_100011215454 [0,1,1,0,0,0|1,0,1]=4 7732 B17R0.13608 C=CC(CCC)OCCCCCCCCCCC 7a_100011216692_100011215454 [0,1,1,0,0,0|1,0,1]=4 7733 B17R0.13608 CCCCCCCCCCCOC(C#N)CCC 34a_100000686963_100011215454 [0,1,1,0,0,0|1,0,1]=4 7734 B17R0.13608 CCCCCCCCCCCOC(C#N)CCC 7a_100000686963_100011215454 [0,1,1,0,0,0|1,0,1]=4 7735 B17R0.14267 CCCCCCCCCC(=O)CCC(=O)NCC 1458a_100000199579_100000210670 [0,1,1,0,0,0|1,0,1]=4 7736 B17R0.14267 CCCCCCCCCC(=O)CCC(=O)OCC 1458a_100000183558_100000210670 [0,1,1,0,0,0|0,0,1]=3 7737 B17R0.14267 CCCCCCCCCC(=O)CNC(=O)OCC 1458a_100000190774_100000210670 [0,1,1,0,0,0|1,0,1]=4 7738 B17R0.14267 CCCCCCCCCC(=O)COC(=O)CCC 1458a_100000210558_100000034017 [0,1,1,0,0,0|0,0,1]=3 7739 B17R0.14267 CCCCCCCCCC(=O)NCC(=O)OCC 188690a_100000741813_100000210558 [0,1,1,0,0,0|1,0,1]=4 7740 B17R0.14267 CCCCCCCCCC(C)NCC(=O)NCC 270004a_100016988866_100011215753 [0,1,1,0,0,0|2,0,0]=4 7741 B17R0.14267 CCCCCCCCCC(C)OCC(=O)CCC 7a_100011218016_100000747444 [0,1,1,0,0,0|2,0,0]=4 7742 B17R0.14267 CCCCCCCCCC(C)OCC(=O)NCC 34a_100011218016_100000183381 [0,1,1,0,0,0|2,0,0]=4 7743 B17R0.14267 CCCCCCCCCC(C)OCC(=O)NCC 7a_100011218016_100000183381 [0,1,1,0,0,0|2,0,0]=4 7744 B17R0.14267 CCCCCCCCCC(C)OCC(=O)OCC 34a_100011218016_100000188475 [0,1,1,0,0,0|1,0,0]=3 7745 B17R0.14267 CCCCCCCCCC(C)OCC(=O)OCC 7a_100011218016_100000188475 [0,1,1,0,0,0|1,0,0]=3 7746 B17R0.14267 CCCCCCCCCN(C)CCC(=O)NCC 2230a_100000232482_100000737597 [0,1,1,0,0,0|2,0,0]=4 7747 B17R0.14267 CCCCCCCCCN(C)CCC(=O)NCC 269982a_100000232482_100000737597 [0,1,1,0,0,0|2,0,0]=4 7748 B17R0.14267 CCCCCCCCCN(C)CCC(=O)OCC 2230a_100000232482_100011206558 [0,1,1,0,0,0|1,0,0]=3 7749 B17R0.14267 CCCCCCCCCN(C)CCC(=O)OCC 2230a_100000745921_100011214924 [0,1,1,0,0,0|1,0,0]=3 7750 B17R0.14267 CCCCCCCCCN(C)CCC(=O)OCC 269982a_100000232482_100011206558 [0,1,1,0,0,0|1,0,0]=3 7751 B17R0.14267 CCCCCCCCCN(C)CCC(=O)OCC 269982a_100000745921_100000210670 [0,1,1,0,0,0|1,0,0]=3 7752 B17R0.14267 CCCCCCCCCN(C)COC(=O)CCC 2230a_100000232482_100000034017 [0,1,1,0,0,0|1,0,0]=3 7753 B17R0.14267 CCCCCCCCCN(C)COC(=O)CCC 269982a_100000232482_100000034017 [0,1,1,0,0,0|1,0,0]=3 7754 B17R0.14267 CCCCCCCCNC(=O)CCC(=O)OCC 11a_100000229939_100000183558 [0,1,1,0,0,0|1,0,1]=4 7755 B17R0.14267 CCCCCCCCNC(=O)CCC(=O)OCC 1626a_100000229939_100000183558 [0,1,1,0,0,0|1,0,1]=4 7756 B17R0.14267 CCCCCCCCNC(=O)CCC(=O)OCC 240690a_100000229939_100000183558 [0,1,1,0,0,0|1,0,1]=4 7757 B17R0.14267 CCCCCCCCNC(C)CCC(=O)OCC 2230a_100000229939_100000748298 [0,1,1,0,0,0|1,0,0]=3 7758 B17R0.14267 CCCCCCCCNC(C)CCC(=O)OCC 34a_100000229939_100000748298 [0,1,1,0,0,0|1,0,0]=3 7759 B17R0.14267 CCCCCCCCOC(C)CCC(=O)OCC 34a_100000210232_100000748298 [0,1,1,0,0,0|1,0,0]=3 7760 B17R0.14267 CCCCCCCCOC(C)CCC(=O)OCC 7a_100000210232_100000748298 [0,1,1,0,0,0|1,0,0]=3 7761 B17R0.14267 CCCCCCCCSC(C)CCC(=O)OCC 62a_100000210759_100000748298 [0,1,1,0,0,0|1,0,0]=3 7762 B17R0.14267 CCCCCCCCSC(C)CCC(=O)OCC 62a_100000748298_100000210317 [0,1,1,0,0,0|1,0,0]=3 7763 B17R0.14267 CCCCCNCCOC(C)CCC(=O)OCC 34a_100000224656_100000748298 [0,1,1,0,0,0|2,0,0]=4 7764 B17R0.14267 CCCCCOCCOC(C)CCC(=O)OCC 34a_100011215259_100000748298 [0,1,1,0,0,0|2,0,0]=4 7765 B17R0.14267 CCCCCOCCOC(C)CCC(=O)OCC 7a_100011215259_100000748298 [0,1,1,0,0,0|2,0,0]=4 7766 B17R0.14267 CCCCOCCCNC(C)CCC(=O)OCC 2230a_200000211371_100000748298 [0,1,1,0,0,0|2,0,0]=4 7767 B17R0.14267 CCCCOCCCNC(C)CCC(=O)OCC 34a_200000211371_100000748298 [0,1,1,0,0,0|2,0,0]=4 7768 B17R0.14267 CCCCOCCCOC(C)CCC(=O)OCC 34a_200011215613_100000748298 [0,1,1,0,0,0|2,0,0]=4 7769 B17R0.14267 CCCCOCCCOC(C)CCC(=O)OCC 7a_200011215613_100000748298 [0,1,1,0,0,0|2,0,0]=4 7770 B17R0.14267 CCOC(=O)CCC(=O)CCCCCCCCO 1458a_100000183558_100000033203 [0,1,1,0,0,0|1,0,1]=4 7771 B17R0.14267 CCOC(=O)CCC(C)NCCCCCCCO 2230a_100011996573_100000748298 [0,1,1,0,0,0|2,0,0]=4 7772 B17R0.14267 CCOC(=O)CCC(C)NCCCCCCCO 34a_100011996573_100000748298 [0,1,1,0,0,0|2,0,0]=4 7773 B17R0.14267 CCOC(=O)CCC(C)OCCCCCCCBr 34a_100000760002_100000748298 [0,1,1,0,0,0|2,0,0]=4 7774 B17R0.14267 CCOC(=O)CCC(C)OCCCCCCCBr 7a_100000760002_100000748298 [0,1,1,0,0,0|2,0,0]=4 7775 B17R0.14267 CCOC(=O)CCC(C)OCCCCCCCN 34a_100011996573_100000748298 [0,1,1,0,0,0|2,0,0]=4 7776 B17R0.14267 CCOC(=O)CCC(C)OCCCCCCOC 34a_200012092642_100000748298 [0,1,1,0,0,0|2,0,0]=4 7777 B17R0.14267 CCOC(=O)CCC(C)OCCCCCCOC 7a_200012092642_100000748298 [0,1,1,0,0,0|2,0,0]=4 7778 B17R0.14267 CCOC(=O)CCC(C)SCCCCCCCO 62a_100000748298_100000760002 [0,1,1,0,0,0|2,0,0]=4 7779 B17R0.14267 CCOC(=O)CCC(C)SCCCCCCCO 62a_100000760002_100000748298 [0,1,1,0,0,0|2,0,0]=4 7780 B17R0.14267 CCOC(=O)CCC(C)SCCCCCCOC 62a_100000748298_100011998445 [0,1,1,0,0,0|2,0,0]=4 7781 B17R0.14267 CCOC(=O)CCC(C)SCCCCCCOC 62a_100011998445_100000748298 [0,1,1,0,0,0|2,0,0]=4 7782 B17R0.14267 CCOC(=O)CCN(C)CCCCCCCCO 2230a_100000745921_100000033203 [0,1,1,0,0,0|2,0,0]=4 7783 B17R0.14267 CCOC(=O)CCN(C)CCCCCCCCO 269982a_100000745921_100000033203 [0,1,1,0,0,0|2,0,0]=4 7784 B17R0.11 CCCCCCC(C)CCOC(C)CCCCC 34a_200011024964_200011218191 [0,1,1,0,0,0|1,0,1]=4 7785 B17R0.11 CCCCCCC(C)CCOC(C)CCCCC 7a_200011024964_200011218191 [0,1,1,0,0,0|1,0,1]=4 7786 B17R0.38 CC(C)CCCC(=O)CCCCCCCCCF 1458a_200009909015_100011214892 [0,1,1,0,0,0|2,0,0]=4 7787 B17R0.38 CC(C)CCCC(=O)CCCCCCCCCO 1458a_100011216857_100009813782 [0,1,1,0,0,0|2,0,0]=4 7788 B17R0.38 CC(C)CCCC(=O)NCCCCCCCCO 240690a_102515433106_100011216857 [0,1,1,0,0,0|2,0,0]=4 7789 B17R0.38 CC(C)CCNC(=O)CCCCCCCCCF 11a_100000210545_200009909015 [0,1,1,0,0,0|2,0,0]=4 7790 B17R0.38 CC(C)CCNC(=O)CCCCCCCCCF 240690a_100000210545_200009909015 [0,1,1,0,0,0|2,0,0]=4 7791 B17R0.38 CC(C)CCNC(=O)CCCCCCCCCF 527a_100000210545_200009909015 [0,1,1,0,0,0|2,0,0]=4 7792 B17R0.38 CC(C)CCNC(=O)CCCCCCCCCO 240690a_100000210545_100000032657 [0,1,1,0,0,0|2,0,0]=4 7793 B17R0.38 CC(O)CCCC(=O)CCCCCCCCCF 1458a_200009909015_200000718107 [0,1,1,0,0,0|2,0,0]=4 7794 B17R0.38 CC(O)CCNC(=O)CCCCCCCCCF 240690a_200000755665_200009909015 [0,1,1,0,0,0|2,0,0]=4 7795 B17R0.38 CC(O)CCNC(=O)CCCCCCCCCF 527a_200000755665_200009909015 [0,1,1,0,0,0|2,0,0]=4 7796 B17R0.38 CC(O)CCNC(=O)CCCCCCCCCO 240690a_200000755665_100000032657 [0,1,1,0,0,0|2,0,0]=4 7797 B17R0.38 CCCCCCCCC=CC(=O)CCCC(C)C 1458a_100015345288_100011214892 [0,1,1,0,0,0|1,0,1]=4 7798 B17R0.38 CCCCCCCCC=CC(=O)CCCC(C)O 1458a_100015345288_200000718107 [0,1,1,0,0,0|1,0,1]=4 7799 B17R0.38 CCCCCCCCCCC(=O)CCCC(=O)C 1458a_100000210375_100011215641 [0,1,1,0,0,0|1,0,1]=4 7800 B17R0.38 CCCCCCCCCCC(=O)CCCC(C)C 1458a_100000210375_100011214892 [0,1,1,0,0,0|1,0,0]=3 7801 B17R0.38 CCCCCCCCCCC(=O)CCCC(C)C 1458a_100011216857_100000210319 [0,1,1,0,0,0|1,0,0]=3 7802 B17R0.38 CCCCCCCCCCC(=O)CCCC(C)O 1458a_100000210375_200000718107 [0,1,1,0,0,0|1,0,0]=3 7803 B17R0.38 CCCCCCCCCCC(=O)CCCN(C)C 1458a_100000210375_100000695564 [0,1,1,0,0,0|2,0,0]=4 7804 B17R0.38 CCCCCCCCCCC(=O)CCOC(C)C 1458a_100000210375_100000211751 [0,1,1,0,0,0|2,0,0]=4 7805 B17R0.38 CCCCCCCCCCC(=O)CCSC(C)C 1458a_100000210375_100000730970 [0,1,1,0,0,0|2,0,0]=4 7806 B17R0.38 CCCCCCCCCCC(=O)COCC(C)C 1458a_100011223364_100000210319 [0,1,1,0,0,0|2,0,0]=4 7807 B17R0.38 CCCCCCCCCCC(=O)NCCC(C)C 11a_100000210545_100000210375 [0,1,1,0,0,0|1,0,0]=3 7808 B17R0.38 CCCCCCCCCCC(=O)NCCC(C)C 1626a_100000210545_100000210375 [0,1,1,0,0,0|1,0,0]=3 7809 B17R0.38 CCCCCCCCCCC(=O)NCCC(C)C 240690a_100000210545_100000210375 [0,1,1,0,0,0|1,0,0]=3 7810 B17R0.38 CCCCCCCCCCC(=O)NCCC(C)O 240690a_200000755665_100000210375 [0,1,1,0,0,0|1,0,0]=3 7811 B17R0.38 CCCCCCCCCCC(=O)NCCN(C)C 240690a_100000210585_100000210375 [0,1,1,0,0,0|2,0,0]=4 7812 B17R0.38 CCCCCCCCCCC(=O)NNCC(C)C 22a_100000696102_100000210375 [0,1,1,0,0,0|2,0,0]=4 7813 B17R0.38 CCCCCCCCCCC(=O)NNCC(C)O 22a_200000730056_100000210375 [0,1,1,0,0,0|2,0,0]=4 7814 B17R0.38 CCCCCCCCCCC(C)OCCC(C)C 34a_100011215000_100000210312 [0,1,1,0,0,0|1,0,1]=4 7815 B17R0.38 CCCCCCCCCCC(C)OCCC(C)C 7a_100011215000_100000210626 [0,1,1,0,0,0|1,0,1]=4 7816 B17R0.38 CCCCCCCCCCC(C)OCCC(C)O 34a_100011215000_100012276601 [0,1,1,0,0,0|1,0,1]=4 7817 B17R0.38 CCCCCCCCCCC(C)OCCC(C)O 7a_100011215000_100012276601 [0,1,1,0,0,0|1,0,1]=4 7818 B17R0.38 CCCCCCCCCNC(=O)CCCC(C)C 11a_100000212291_100011216857 [0,1,1,0,0,0|1,0,0]=3 7819 B17R0.38 CCCCCCCCCNC(=O)CCCC(C)C 1626a_100000212291_100011216857 [0,1,1,0,0,0|1,0,0]=3 7820 B17R0.38 CCCCCCCCCNC(=O)CCCC(C)C 240690a_100000212291_100011216857 [0,1,1,0,0,0|1,0,0]=3 7821 B17R0.38 CCCCCCCCCNC(=O)CCCC(C)C 527a_100000212291_100011216857 [0,1,1,0,0,0|1,0,0]=3 7822 B17R0.38 CCCCCCCCCNC(=O)CCCC(C)O 1626a_100000212291_100000761597 [0,1,1,0,0,0|1,0,0]=3 7823 B17R0.38 CCCCCCCCCNC(=O)CCCC(C)O 527a_100000212291_100000761597 [0,1,1,0,0,0|1,0,0]=3 7824 B17R0.38 CCCCCCCCCNC(=O)CCCN(C)C 11a_100000212291_100000740757 [0,1,1,0,0,0|2,0,0]=4 7825 B17R0.38 CCCCCCCCCNC(=O)CCCN(C)C 240690a_100000212291_100000740757 [0,1,1,0,0,0|2,0,0]=4 7826 B17R0.38 CCCCCCCCCNC(=O)COCC(C)C 11a_100000212291_100011223364 [0,1,1,0,0,0|2,0,0]=4 7827 B17R0.38 CCCCCCCCCNC(=O)COCC(C)C 1626a_100000212291_100011223364 [0,1,1,0,0,0|2,0,0]=4 7828 B17R0.38 CCCCCCCCCNC(=O)COCC(C)C 240690a_100000212291_100011223364 [0,1,1,0,0,0|2,0,0]=4 7829 B17R0.38 CCCCCCCCCNC(=O)COCC(C)C 527a_100000212291_100011223364 [0,1,1,0,0,0|2,0,0]=4 7830 B17R0.38 CCCCCCCCCNC(=O)NCCC(C)C 2708a_100000210545_100000212291 [0,1,1,0,0,0|2,0,0]=4 7831 B17R0.38 CCCCCCCCCNC(=O)NCCC(C)C 2708a_100000212291_100000210545 [0,1,1,0,0,0|2,0,0]=4 7832 B17R0.38 CCCCCCCCCNC(=O)NCCC(C)C 273464a_100000210545_100000212291 [0,1,1,0,0,0|2,0,0]=4 7833 B17R0.38 CCCCCCCCCNC(=O)NCCC(C)C 273464a_100000212291_100000210545 [0,1,1,0,0,0|2,0,0]=4 7834 B17R0.38 CCCCCCCCCNC(=O)NCCC(C)C 512a_100000210545_100000212291 [0,1,1,0,0,0|2,0,0]=4 7835 B17R0.38 CCCCCCCCCNC(=O)NCCC(C)C 512a_100000212291_100000210545 [0,1,1,0,0,0|2,0,0]=4 7836 B17R0.38 CCCCCCCCCNC(=O)NCCC(C)O 2708a_100000212291_200000755665 [0,1,1,0,0,0|2,0,0]=4 7837 B17R0.38 CCCCCCCCCNC(=O)NCCC(C)O 273464a_200000755665_100000212291 [0,1,1,0,0,0|2,0,0]=4 7838 B17R0.38 CCCCCCCCCNC(=O)NCCC(C)O 512a_100000212291_200000755665 [0,1,1,0,0,0|2,0,0]=4 7839 B17R0.38 CCCCCCCCCNC(=O)NCCC(C)O 512a_200000755665_100000212291 [0,1,1,0,0,0|2,0,0]=4 7840 B17R0.38 CCCCCCCCCOC(C)CCCC(C)C 34a_200011218570_100011214924 [0,1,1,0,0,0|1,0,1]=4 7841 B17R0.38 CCCCCCCCCOC(C)CCCC(C)C 7a_200011218570_100000210328 [0,1,1,0,0,0|1,0,1]=4 7842 B17R0.38 CCCCCCCCOCC(=O)CCCC(C)C 1458a_100000759886_100011214892 [0,1,1,0,0,0|2,0,0]=4 7843 B17R0.38 CCCCCCCCOCC(=O)CCCC(C)O 1458a_100000759886_200000718107 [0,1,1,0,0,0|2,0,0]=4 7844 B17R0.38 CCCCCCCCOCC(=O)NCCC(C)C 11a_100000210545_100000759886 [0,1,1,0,0,0|2,0,0]=4 7845 B17R0.38 CCCCCCCCOCC(=O)NCCC(C)C 1626a_100000210545_100000759886 [0,1,1,0,0,0|2,0,0]=4 7846 B17R0.38 CCCCCCCCOCC(=O)NCCC(C)C 240690a_100000210545_100000759886 [0,1,1,0,0,0|2,0,0]=4 7847 B17R0.38 CCCCCCCCOCC(=O)NCCC(C)C 527a_100000210545_100000759886 [0,1,1,0,0,0|2,0,0]=4 7848 B17R0.38 CCCCCCCCOCC(=O)NCCC(C)O 240690a_200000755665_100000759886 [0,1,1,0,0,0|2,0,0]=4 7849 B17R0.38 CCCCCCCCOCC(=O)NCCC(C)O 527a_200000755665_100000759886 [0,1,1,0,0,0|2,0,0]=4 7850 B17R0.179 CCCCCC(=O)CNCCCCCCC(C)C 2230a_100000211014_200012276598 [0,1,1,0,0,0|2,0,0]=4 7851 B17R0.179 CCCCCC(=O)CNCCCCCCC(C)C 34a_100000211014_200012276598 [0,1,1,0,0,0|2,0,0]=4 7852 B17R0.179 CCCCCC(C)OCCCCCCCC(C)C 34a_200000210741_200011218191 [0,1,1,0,0,0|1,0,1]=4 7853 B17R0.179 CCCCCC(C)OCCCCCCCC(C)C 7a_200000210741_200011218191 [0,1,1,0,0,0|1,0,1]=4 7854 B17R0.179 CCCCNC(=O)CNCCCCCCC(C)C 2230a_100000211014_100000182744 [0,1,1,0,0,0|2,0,0]=4 7855 B17R0.179 CCCCNC(=O)CNCCCCCCC(C)C 34a_100000211014_100000182744 [0,1,1,0,0,0|2,0,0]=4 7856 B17R0.179 CCCCOC(=O)CNCCCCCCC(C)C 2230a_100000211014_100000211628 [0,1,1,0,0,0|1,0,0]=3 7857 B17R0.179 CCCCOC(=O)CNCCCCCCC(C)C 34a_100000211014_100000211628 [0,1,1,0,0,0|1,0,0]=3 7858 B17R0.179 CCCCOC(=O)COCCCCCNC(C)C 34a_100011629493_100000211628 [0,1,1,0,0,0|2,0,0]=4 7859 B17R0.179 COCCOC(=O)CNCCCCCCC(C)C 2230a_100000211014_200000040189 [0,1,1,0,0,0|2,0,0]=4 7860 B17R0.179 COCCOC(=O)CNCCCCCCC(C)C 34a_100000211014_200000040189 [0,1,1,0,0,0|2,0,0]=4 7861 B17R0.454 CCCCCCCCCN(C)C(=O)CCCCC 11a_100000232482_100000212188 [0,1,1,0,0,0|1,0,0]=3 7862 B17R0.454 CCCCCCCCCN(C)C(=O)CCCCC 1626a_100000232482_100000212188 [0,1,1,0,0,0|1,0,0]=3 7863 B17R0.454 CCCCCCCCCN(C)C(=O)CCCCC 240690a_100000232482_100000212188 [0,1,1,0,0,0|1,0,0]=3 7864 B17R0.454 CCCCCCCCCN(C)C(=O)CCCCC 527a_100000232482_100000212188 [0,1,1,0,0,0|1,0,0]=3 7865 B17R0.454 CCCCCCCCCN(C)C(=O)CCCCO 1626a_100000232482_100000695505 [0,1,1,0,0,0|2,0,0]=4 7866 B17R0.454 CCCCCCCCCN(C)C(=O)CCCOC 11a_100000232482_100000741012 [0,1,1,0,0,0|2,0,0]=4 7867 B17R0.454 CCCCCCCCCN(C)C(=O)CCCOC 1626a_100000232482_100000741012 [0,1,1,0,0,0|2,0,0]=4 7868 B17R0.454 CCCCCCCCCN(C)C(=O)CCCOC 240690a_100000232482_100000741012 [0,1,1,0,0,0|2,0,0]=4 7869 B17R0.454 CCCCCCCCCN(C)C(=O)CCCOC 527a_100000232482_100000741012 [0,1,1,0,0,0|2,0,0]=4 7870 B17R0.454 CCCCCCCCCN(C)C(=O)CCCSC 11a_100000232482_100000173376 [0,1,1,0,0,0|2,0,0]=4 7871 B17R0.454 CCCCCCCCCN(C)C(=O)CCCSC 1626a_100000232482_100000173376 [0,1,1,0,0,0|2,0,0]=4 7872 B17R0.454 CCCCCCCCCN(C)C(=O)CCCSC 240690a_100000232482_100000173376 [0,1,1,0,0,0|2,0,0]=4 7873 B17R0.454 CCCCCCCCCN(C)C(=O)CCCSC 527a_100000232482_100000173376 [0,1,1,0,0,0|2,0,0]=4 7874 B17R0.454 CCCCCCCCCN(C)C(=O)CCOCC 11a_100000232482_100000749530 [0,1,1,0,0,0|2,0,0]=4 7875 B17R0.454 CCCCCCCCCN(C)C(=O)CCOCC 1626a_100000232482_100000749530 [0,1,1,0,0,0|2,0,0]=4 7876 B17R0.454 CCCCCCCCCN(C)C(=O)CCOCC 240690a_100000232482_100000749530 [0,1,1,0,0,0|2,0,0]=4 7877 B17R0.454 CCCCCCCCCN(C)C(=O)CCOCC 527a_100000232482_100000749530 [0,1,1,0,0,0|2,0,0]=4 7878 B17R0.454 CCCCCCCCCN(C)C(=O)CCSCC 11a_100000232482_100000230768 [0,1,1,0,0,0|2,0,0]=4 7879 B17R0.454 CCCCCCCCCN(C)C(=O)CCSCC 1626a_100000232482_100000230768 [0,1,1,0,0,0|2,0,0]=4 7880 B17R0.454 CCCCCCCCCN(C)C(=O)CCSCC 240690a_100000232482_100000230768 [0,1,1,0,0,0|2,0,0]=4 7881 B17R0.454 CCCCCCCCCN(C)C(=O)CCSCC 527a_100000232482_100000230768 [0,1,1,0,0,0|2,0,0]=4 7882 B17R0.454 CCCCCCCCCN(C)C(=O)COCCC 11a_100000232482_100000745993 [0,1,1,0,0,0|2,0,0]=4 7883 B17R0.454 CCCCCCCCCN(C)C(=O)COCCC 1626a_100000232482_100000745993 [0,1,1,0,0,0|2,0,0]=4 7884 B17R0.454 CCCCCCCCCN(C)C(=O)COCCC 240690a_100000232482_100000745993 [0,1,1,0,0,0|2,0,0]=4 7885 B17R0.454 CCCCCCCCCN(C)C(=O)COCCC 527a_100000232482_100000745993 [0,1,1,0,0,0|2,0,0]=4 7886 B17R0.454 CCCCCCCCCN(C)C(=O)CSCCC 11a_100000232482_100000217233 [0,1,1,0,0,0|2,0,0]=4 7887 B17R0.454 CCCCCCCCCN(C)C(=O)CSCCC 1626a_100000232482_100000217233 [0,1,1,0,0,0|2,0,0]=4 7888 B17R0.454 CCCCCCCCCN(C)C(=O)CSCCC 240690a_100000232482_100000217233 [0,1,1,0,0,0|2,0,0]=4 7889 B17R0.454 CCCCCCCCCN(C)C(=O)CSCCC 527a_100000232482_100000217233 [0,1,1,0,0,0|2,0,0]=4 7890 B17R0.454 CCCCCCCCCN(C)C(=O)NCCCC 2708a_100000102301_100000232482 [0,1,1,0,0,0|2,0,0]=4 7891 B17R0.454 CCCCCCCCCN(C)C(=O)NCCCC 273464a_100000102301_100000232482 [0,1,1,0,0,0|2,0,0]=4 7892 B17R0.454 CCCCCCCCNC(C)C(=O)NCCCC 2230a_100000229939_100000735917 [0,1,1,0,0,0|2,0,0]=4 7893 B17R0.454 CCCCCCCCNC(C)C(=O)NCCCC 34a_100000229939_100000735917 [0,1,1,0,0,0|2,0,0]=4 7894 B17R0.454 CCCCCCCCNC(C)C(=O)OCCCC 2230a_100000229939_100000759602 [0,1,1,0,0,0|1,0,0]=3 7895 B17R0.454 CCCCCCCCNC(C)C(=O)OCCCC 34a_100000229939_100000759602 [0,1,1,0,0,0|1,0,0]=3 7896 B17R0.454 CCCCCCCCOC(C)C(=O)NCCCC 34a_100000210232_100000735917 [0,1,1,0,0,0|2,0,0]=4 7897 B17R0.454 CCCCCCCCOC(C)C(=O)NCCCC 7a_100000210232_100000735917 [0,1,1,0,0,0|2,0,0]=4 7898 B17R0.454 CCCCCCCCOC(C)C(=O)OCCCC 34a_100000038973_100000210759 [0,1,1,0,0,0|1,0,0]=3 7899 B17R0.454 CCCCCCCCOC(C)C(=O)OCCCC 34a_100000210232_100000759602 [0,1,1,0,0,0|1,0,0]=3 7900 B17R0.454 CCCCCCCCOC(C)C(=O)OCCCC 7a_100000038973_100000210759 [0,1,1,0,0,0|1,0,0]=3 7901 B17R0.454 CCCCCCCCOC(C)C(=O)OCCCC 7a_100000210232_100000759602 [0,1,1,0,0,0|1,0,0]=3 7902 B17R0.454 CCCCCCCCSC(C)C(=O)NCCCC 62a_100000210759_100000735917 [0,1,1,0,0,0|2,0,0]=4 7903 B17R0.454 CCCCCCCCSC(C)C(=O)NCCCC 62a_100000735917_100000210317 [0,1,1,0,0,0|2,0,0]=4 7904 B17R0.454 CCCCCCCCSC(C)C(=O)OCCCC 62a_100000210759_100000759602 [0,1,1,0,0,0|1,0,0]=3 7905 B17R0.454 CCCCCCCCSC(C)C(=O)OCCCC 62a_100000759602_100000210317 [0,1,1,0,0,0|1,0,0]=3 7906 B17R0.454 CCCCCNCCOC(C)C(=O)OCCCC 34a_100000224656_100000759602 [0,1,1,0,0,0|2,0,0]=4 7907 B17R0.454 CCCCCOCCOC(C)C(=O)OCCCC 34a_100011215259_100000759602 [0,1,1,0,0,0|2,0,0]=4 7908 B17R0.454 CCCCCOCCOC(C)C(=O)OCCCC 7a_100011215259_100000759602 [0,1,1,0,0,0|2,0,0]=4 7909 B17R0.454 CCCCOC(=O)C(C)NCCCCCCCO 2230a_100011996573_100000759602 [0,1,1,0,0,0|2,0,0]=4 7910 B17R0.454 CCCCOC(=O)C(C)NCCCCCCCO 34a_100011996573_100000759602 [0,1,1,0,0,0|2,0,0]=4 7911 B17R0.454 CCCCOC(=O)C(C)OCCCCCCCBr 34a_100000760002_100000759602 [0,1,1,0,0,0|2,0,0]=4 7912 B17R0.454 CCCCOC(=O)C(C)OCCCCCCCBr 7a_100000760002_100000759602 [0,1,1,0,0,0|2,0,0]=4 7913 B17R0.454 CCCCOC(=O)C(C)OCCCCCCCN 34a_100011996573_100000759602 [0,1,1,0,0,0|2,0,0]=4 7914 B17R0.454 CCCCOC(=O)C(C)OCCCCCCCO 34a_100000038973_100000760002 [0,1,1,0,0,0|2,0,0]=4 7915 B17R0.454 CCCCOC(=O)C(C)OCCCCCCCO 7a_100000038973_100000760002 [0,1,1,0,0,0|2,0,0]=4 7916 B17R0.454 CCCCOC(=O)C(C)OCCCCCCOC 34a_100000038973_100011998445 [0,1,1,0,0,0|2,0,0]=4 7917 B17R0.454 CCCCOC(=O)C(C)OCCCCCCOC 34a_200012092642_100000759602 [0,1,1,0,0,0|2,0,0]=4 7918 B17R0.454 CCCCOC(=O)C(C)OCCCCCCOC 7a_100000038973_100011998445 [0,1,1,0,0,0|2,0,0]=4 7919 B17R0.454 CCCCOC(=O)C(C)OCCCCCCOC 7a_200012092642_100000759602 [0,1,1,0,0,0|2,0,0]=4 7920 B17R0.454 CCCCOC(=O)C(C)SCCCCCCCO 62a_100000759602_100000760002 [0,1,1,0,0,0|2,0,0]=4 7921 B17R0.454 CCCCOC(=O)C(C)SCCCCCCCO 62a_100000760002_100000759602 [0,1,1,0,0,0|2,0,0]=4 7922 B17R0.454 CCCCOC(=O)C(C)SCCCCCCOC 62a_100000759602_100011998445 [0,1,1,0,0,0|2,0,0]=4 7923 B17R0.454 CCCCOC(=O)C(C)SCCCCCCOC 62a_100011998445_100000759602 [0,1,1,0,0,0|2,0,0]=4 7924 B17R0.454 CCCCOCCCNC(C)C(=O)OCCCC 2230a_200000211371_100000759602 [0,1,1,0,0,0|2,0,0]=4 7925 B17R0.454 CCCCOCCCNC(C)C(=O)OCCCC 34a_200000211371_100000759602 [0,1,1,0,0,0|2,0,0]=4 7926 B17R0.454 CCCCOCCCOC(C)C(=O)OCCCC 34a_200011215613_100000759602 [0,1,1,0,0,0|2,0,0]=4 7927 B17R0.454 CCCCOCCCOC(C)C(=O)OCCCC 7a_200011215613_100000759602 [0,1,1,0,0,0|2,0,0]=4 7928 B17R0.3062 CCC(C)CCCCCOCC(=O)OCCOC 7a_200000035636_200000040189 [0,1,1,0,0,0|2,0,0]=4 7929 B17R0.3062 CCCCCC(=O)COCCCCCC(C)CC 7a_200000035636_200012276598 [0,1,1,0,0,0|2,0,0]=4 7930 B17R0.3062 CCCCNC(=O)COCCCCCC(C)CC 7a_200000035636_100000182744 [0,1,1,0,0,0|2,0,0]=4 7931 B17R0.3062 CCCCOC(=O)COCCCCCC(C)CC 7a_200000035636_100000211628 [0,1,1,0,0,0|1,0,0]=3 7932 B17R0.3110 C#CCCCCCCCOCC(=O)CCCCC 34a_100000054614_200012276598 [0,1,1,0,0,0|0,0,2]=4 7933 B17R0.3110 C#CCCCCCCCOCC(=O)CCCCC 7a_100000054614_200012276598 [0,1,1,0,0,0|0,0,2]=4 7934 B17R0.3110 C#CCCCCCCCOCC(=O)OCCCC 34a_100000054614_100000211628 [0,1,1,0,0,0|0,0,2]=4 7935 B17R0.3110 C#CCCCCCCCOCC(=O)OCCCC 7a_100000054614_100000211628 [0,1,1,0,0,0|0,0,2]=4 7936 B17R0.3110 C#CCCCCCCCSCC(=O)OCCCC 62a_100000211628_100153394163 [0,1,1,0,0,0|0,0,2]=4 7937 B17R0.3110 C#CCCCCCCCSCC(=O)OCCCC 62a_100153394163_100000211628 [0,1,1,0,0,0|0,0,2]=4 7938 B17R0.3110 C=CCCCCCCCCCC(=O)CCCCC 1458a_100000212188_100009814027 [0,1,1,0,0,0|1,0,1]=4 7939 B17R0.3110 C=CCCCCCCCOCC(=O)CCCCC 34a_100000730831_200012276598 [0,1,1,0,0,0|0,0,2]=4 7940 B17R0.3110 C=CCCCCCCCOCC(=O)CCCCC 7a_100000730831_200012276598 [0,1,1,0,0,0|0,0,2]=4 7941 B17R0.3110 C=CCCCCCCCOCC(=O)OCCCC 34a_100000730831_100000211628 [0,1,1,0,0,0|0,0,2]=4 7942 B17R0.3110 C=CCCCCCCCOCC(=O)OCCCC 7a_100000730831_100000211628 [0,1,1,0,0,0|0,0,2]=4 7943 B17R0.3110 C=CCCCCCCCSCC(=O)OCCCC 62a_100000211628_100012355270 [0,1,1,0,0,0|0,0,2]=4 7944 B17R0.3110 C=CCCCCCCCSCC(=O)OCCCC 62a_100012355270_100000211628 [0,1,1,0,0,0|0,0,2]=4 7945 B17R0.3110 CC/C=C\CCCCCOCC(=O)CCCCC 34a_100016268722_200012276598 [0,1,1,0,0,0|0,0,2]=4 7946 B17R0.3110 CC/C=C\CCCCCOCC(=O)CCCCC 7a_100016268722_200012276598 [0,1,1,0,0,0|0,0,2]=4 7947 B17R0.3110 CC/C=C\CCCCCOCC(=O)OCCCC 34a_100016268722_100000211628 [0,1,1,0,0,0|0,0,2]=4 7948 B17R0.3110 CC/C=C\CCCCCOCC(=O)OCCCC 7a_100016268722_100000211628 [0,1,1,0,0,0|0,0,2]=4 7949 B17R0.3110 CCCC#CC(=O)CCCCCCCCCCC 1458a_200011218047_100011215454 [0,1,1,0,0,0|1,0,1]=4 7950 B17R0.3110 CCCC#CC(=O)CCCCCCCCCCO 1458a_200011218047_100009813290 [0,1,1,0,0,0|1,0,1]=4 7951 B17R0.3110 CCCC#CC(=O)NCCCCCCCCCC 240690a_100000684558_200011218047 [0,1,1,0,0,0|1,0,1]=4 7952 B17R0.3110 CCCC=CC(=O)CCCCCCCCCCC 1458a_100000212230_100011215454 [0,1,1,0,0,0|1,0,1]=4 7953 B17R0.3110 CCCC=CC(=O)CCCCCCCCCCO 1458a_100000212230_100009813290 [0,1,1,0,0,0|1,0,1]=4 7954 B17R0.3110 CCCC=CC(=O)NCCCCCCCCCC 11a_100000684558_100000212230 [0,1,1,0,0,0|1,0,1]=4 7955 B17R0.3110 CCCC=CC(=O)NCCCCCCCCCC 1626a_100000684558_100000212230 [0,1,1,0,0,0|1,0,1]=4 7956 B17R0.3110 CCCC=CC(=O)NCCCCCCCCCC 240690a_100000684558_100000212230 [0,1,1,0,0,0|1,0,1]=4 7957 B17R0.3110 CCCCC#CCCCSCC(=O)OCCCC 62a_100000211628_200000047210 [0,1,1,0,0,0|0,0,2]=4 7958 B17R0.3110 CCCCC#CCCCSCC(=O)OCCCC 62a_200000047210_100000211628 [0,1,1,0,0,0|0,0,2]=4 7959 B17R0.3110 CCCCC/C=C\CCOCC(=O)CCCCC 34a_100016277358_200012276598 [0,1,1,0,0,0|0,0,2]=4 7960 B17R0.3110 CCCCC/C=C\CCOCC(=O)CCCCC 7a_100016277358_200012276598 [0,1,1,0,0,0|0,0,2]=4 7961 B17R0.3110 CCCCC/C=C\CCOCC(=O)OCCCC 34a_100016277358_100000211628 [0,1,1,0,0,0|0,0,2]=4 7962 B17R0.3110 CCCCC/C=C\CCOCC(=O)OCCCC 7a_100016277358_100000211628 [0,1,1,0,0,0|0,0,2]=4 7963 B17R0.3110 CCCCCC#CCCOCC(=O)CCCCC 34a_200000042877_200012276598 [0,1,1,0,0,0|0,0,2]=4 7964 B17R0.3110 CCCCCC#CCCOCC(=O)CCCCC 7a_200000042877_200012276598 [0,1,1,0,0,0|0,0,2]=4 7965 B17R0.3110 CCCCCC#CCCOCC(=O)OCCCC 34a_200000042877_100000211628 [0,1,1,0,0,0|0,0,2]=4 7966 B17R0.3110 CCCCCC#CCCOCC(=O)OCCCC 7a_200000042877_100000211628 [0,1,1,0,0,0|0,0,2]=4 7967 B17R0.3110 CCCCCC(=O)CCCCCCCCCCO 1458a_100000212188_100009813290 [0,1,1,0,0,0|1,0,0]=3 7968 B17R0.3110 CCCCCC(=O)CNCCCCCCCCO 2230a_102515433106_200012276598 [0,1,1,0,0,0|2,0,0]=4 7969 B17R0.3110 CCCCCC(=O)CNCCCCCCCCO 34a_102515433106_200012276598 [0,1,1,0,0,0|2,0,0]=4 7970 B17R0.3110 CCCCCC(=O)COCCCCCCCCBr 34a_100009813846_200012276598 [0,1,1,0,0,0|1,0,0]=3 7971 B17R0.3110 CCCCCC(=O)COCCCCCCCCBr 7a_100009813846_200012276598 [0,1,1,0,0,0|1,0,0]=3 7972 B17R0.3110 CCCCCC(=O)COCCCCCCCCCl 34a_100000033203_200012276598 [0,1,1,0,0,0|1,0,0]=3 7973 B17R0.3110 CCCCCC(=O)COCCCCCCCCCl 7a_100000033203_200012276598 [0,1,1,0,0,0|1,0,0]=3 7974 B17R0.3110 CCCCCC(=O)COCCCCCCCCN 34a_102515433106_200012276598 [0,1,1,0,0,0|1,0,0]=3 7975 B17R0.3110 CCCCCC(=O)COCCCCCNCCN 34a_103619048469_200012276598 [0,1,1,0,0,0|2,0,0]=4 7976 B17R0.3110 CCCCCC(=O)COCCCCNCCCC 34a_200011216965_200012276598 [0,1,1,0,0,0|1,0,0]=3 7977 B17R0.3110 CCCCCC(=O)COCCCCOCCCC 34a_200000760531_200012276598 [0,1,1,0,0,0|1,0,0]=3 7978 B17R0.3110 CCCCCC(=O)COCCCCOCCCC 7a_200000760531_200012276598 [0,1,1,0,0,0|1,0,0]=3 7979 B17R0.3110 CCCCCC(=O)COCCCOCCCOC 34a_200011215475_200012276598 [0,1,1,0,0,0|2,0,0]=4 7980 B17R0.3110 CCCCCC(=O)COCCCOCCCOC 7a_200011215475_200012276598 [0,1,1,0,0,0|2,0,0]=4 7981 B17R0.3110 CCCCCC(=O)CSCCCCCCCCO 62a_100000033203_200012276598 [0,1,1,0,0,0|1,1,0]=4 7982 B17R0.3110 CCCCCC(=O)CSCCCCCCCCO 62a_200012276598_100000033203 [0,1,1,0,0,0|1,1,0]=4 7983 B17R0.3110 CCCCCC(=O)NCCCCCCCCCO 240690a_100000078944_100000212188 [0,1,1,0,0,0|1,0,0]=3 7984 B17R0.3110 CCCCCC(C)OCCCCCCCCCCl 34a_100009868337_200011218191 [0,1,1,0,0,0|1,0,1]=4 7985 B17R0.3110 CCCCCC(C)OCCCCCCCCCCl 7a_100009868337_200011218191 [0,1,1,0,0,0|1,0,1]=4 7986 B17R0.3110 CCCCCC(C)OCCCCCCCCCN 34a_100000078944_200011218191 [0,1,1,0,0,0|1,0,1]=4 7987 B17R0.3110 CCCCCC(C)OCCCCCCCCCO 34a_100011215632_100009813782 [0,1,1,0,0,0|1,0,1]=4 7988 B17R0.3110 CCCCCC(C)OCCCCCCCCCO 7a_100011215632_100009813782 [0,1,1,0,0,0|1,0,1]=4 7989 B17R0.3110 CCCCCC/C=C/COCC(=O)CCCCC 34a_200016276170_200012276598 [0,1,1,0,0,0|0,0,2]=4 7990 B17R0.3110 CCCCCC/C=C/COCC(=O)CCCCC 7a_200016276170_200012276598 [0,1,1,0,0,0|0,0,2]=4 7991 B17R0.3110 CCCCCC/C=C/COCC(=O)OCCCC 34a_200016276170_100000211628 [0,1,1,0,0,0|0,0,2]=4 7992 B17R0.3110 CCCCCC/C=C/COCC(=O)OCCCC 7a_200016276170_100000211628 [0,1,1,0,0,0|0,0,2]=4 7993 B17R0.3110 CCCCCCC#CCOCC(=O)CCCCC 34a_200000037284_200012276598 [0,1,1,0,0,0|0,0,2]=4 7994 B17R0.3110 CCCCCCC#CCOCC(=O)CCCCC 7a_200000037284_200012276598 [0,1,1,0,0,0|0,0,2]=4 7995 B17R0.3110 CCCCCCC#CCOCC(=O)OCCCC 34a_200000037284_100000211628 [0,1,1,0,0,0|0,0,2]=4 7996 B17R0.3110 CCCCCCC#CCOCC(=O)OCCCC 7a_200000037284_100000211628 [0,1,1,0,0,0|0,0,2]=4 7997 B17R0.3110 CCCCCCCCC=NNC(=O)CCCCC 4a_100000189784_100011218696 [0,1,1,0,0,0|1,0,1]=4 7998 B17R0.3110 CCCCCCCCCC=CC(=O)CCCCC 1458a_200015352897_100000210326 [0,1,1,0,0,0|1,0,0]=3 7999 B17R0.3110 CCCCCCCCCC=CC(=O)CCCCF 1458a_200015352897_100000729493 [0,1,1,0,0,0|2,0,0]=4 8000 B17R0.3110 CCCCCCCCCC=CC(=O)CCCCO 1458a_200015352897_100000210776 [0,1,1,0,0,0|2,0,0]=4 8001 B17R0.3110 CCCCCCCCCC=CC(=O)CCCOC 1458a_200015352897_100000740836 [0,1,1,0,0,0|2,0,0]=4 8002 B17R0.3110 CCCCCCCCCC=CC(=O)CCOCC 1458a_200015352897_100011215890 [0,1,1,0,0,0|2,0,0]=4 8003 B17R0.3110 CCCCCCCCCC=CC(=O)CCSCC 1458a_200015352897_100000757381 [0,1,1,0,0,0|2,0,0]=4 8004 B17R0.3110 CCCCCCCCCC=CC(=O)NCCCC 11a_100000102301_200015352897 [0,1,1,0,0,0|1,0,1]=4 8005 B17R0.3110 CCCCCCCCCC=CC(=O)NCCCC 1626a_100000102301_200015352897 [0,1,1,0,0,0|1,0,1]=4 8006 B17R0.3110 CCCCCCCCCC=CC(=O)NCCCC 240690a_100000102301_200015352897 [0,1,1,0,0,0|1,0,1]=4 8007 B17R0.3110 CCCCCCCCCCCC(=O)CCCCF 1458a_100000210736_100000729493 [0,1,1,0,0,0|2,0,0]=4 8008 B17R0.3110 CCCCCCCCCCCC(=O)CCCCO 1458a_100000210736_100000210776 [0,1,1,0,0,0|2,0,0]=4 8009 B17R0.3110 CCCCCCCCCCCC(=O)CCCCO 1458a_100000695505_100011215454 [0,1,1,0,0,0|2,0,0]=4 8010 B17R0.3110 CCCCCCCCCCCC(=O)CCCOC 1458a_100000210736_100000740836 [0,1,1,0,0,0|2,0,0]=4 8011 B17R0.3110 CCCCCCCCCCCC(=O)CCCOC 1458a_100000741012_100011215454 [0,1,1,0,0,0|2,0,0]=4 8012 B17R0.3110 CCCCCCCCCCCC(=O)CCCSC 1458a_100000173376_100011215454 [0,1,1,0,0,0|2,0,0]=4 8013 B17R0.3110 CCCCCCCCCCCC(=O)CCOCC 1458a_100000210736_100011215890 [0,1,1,0,0,0|2,0,0]=4 8014 B17R0.3110 CCCCCCCCCCCC(=O)CCOCC 1458a_100000749530_100011215454 [0,1,1,0,0,0|2,0,0]=4 8015 B17R0.3110 CCCCCCCCCCCC(=O)CCSCC 1458a_100000210736_100000757381 [0,1,1,0,0,0|2,0,0]=4 8016 B17R0.3110 CCCCCCCCCCCC(=O)CCSCC 1458a_100000230768_100011215454 [0,1,1,0,0,0|2,0,0]=4 8017 B17R0.3110 CCCCCCCCCCCC(=O)COCCC 1458a_100000745993_100011215454 [0,1,1,0,0,0|2,0,0]=4 8018 B17R0.3110 CCCCCCCCCCCC(=O)CSCCC 1458a_100000217233_100011215454 [0,1,1,0,0,0|2,0,0]=4 8019 B17R0.3110 CCCCCCCCCCCC(=O)NCCCC 11a_100000102301_100000210736 [0,1,1,0,0,0|1,0,0]=3 8020 B17R0.3110 CCCCCCCCCCCC(=O)NCCCC 1626a_100000102301_100000210736 [0,1,1,0,0,0|1,0,0]=3 8021 B17R0.3110 CCCCCCCCCCCC(=O)NCCCC 240690a_100000102301_100000210736 [0,1,1,0,0,0|1,0,0]=3 8022 B17R0.3110 CCCCCCCCCCCC(=O)NCCCF 11a_100015189416_100000210736 [0,1,1,0,0,0|2,0,0]=4 8023 B17R0.3110 CCCCCCCCCCCC(=O)NCCCF 1626a_100015189416_100000210736 [0,1,1,0,0,0|2,0,0]=4 8024 B17R0.3110 CCCCCCCCCCCC(=O)NCCCF 240690a_100015189416_100000210736 [0,1,1,0,0,0|2,0,0]=4 8025 B17R0.3110 CCCCCCCCCCCC(=O)NCCCO 240690a_100000182051_100000210736 [0,1,1,0,0,0|2,0,0]=4 8026 B17R0.3110 CCCCCCCCCCCC(=O)NCCOC 1626a_100000209980_100000210736 [0,1,1,0,0,0|2,0,0]=4 8027 B17R0.3110 CCCCCCCCCCCC(=O)NCCOC 240690a_100000209980_100000210736 [0,1,1,0,0,0|2,0,0]=4 8028 B17R0.3110 CCCCCCCCCCCC(=O)NCCOC 34a_100007860320_200000210301 [0,1,1,0,0,0|2,0,0]=4 8029 B17R0.3110 CCCCCCCCCCCC(=O)NCCOC 7a_100007860320_200000210301 [0,1,1,0,0,0|2,0,0]=4 8030 B17R0.3110 CCCCCCCCCCCC(=O)NCCO[13CH3] 34a_100007860320_200025704644 [0,1,1,0,0,0|2,0,0]=4 8031 B17R0.3110 CCCCCCCCCCCC(=O)NCCO[13CH3] 7a_100007860320_200025704644 [0,1,1,0,0,0|2,0,0]=4 8032 B17R0.3110 CCCCCCCCCCCC(=O)NCCSC 11a_100020590264_100000210736 [0,1,1,0,0,0|2,0,0]=4 8033 B17R0.3110 CCCCCCCCCCCC(=O)NCCSC 1626a_100020590264_100000210736 [0,1,1,0,0,0|2,0,0]=4 8034 B17R0.3110 CCCCCCCCCCCC(=O)NCCSC 240690a_100020590264_100000210736 [0,1,1,0,0,0|2,0,0]=4 8035 B17R0.3110 CCCCCCCCCCCC(=O)NNCCC 22a_100000740057_100000210736 [0,1,1,0,0,0|2,0,0]=4 8036 B17R0.3110 CCCCCCCCCCCC(=O)OCCNC 2230a_106832991635_100000091854 [0,1,1,0,0,0|1,0,0]=3 8037 B17R0.3110 CCCCCCCCCCCC(=O)OCCNC 34a_100102657272_100000091854 [0,1,1,0,0,0|1,0,0]=3 8038 B17R0.3110 CCCCCCCCCCCC(=O)OCCNC 7a_106832991635_100000091854 [0,1,1,0,0,0|1,0,0]=3 8039 B17R0.3110 CCCCCCCCCCCC(=O)OCCOC 34a_100138415774_100000091854 [0,1,1,0,0,0|1,0,0]=3 8040 B17R0.3110 CCCCCCCCCCCC(=O)OCCSC 62a_200000210301_100000091854 [0,1,1,0,0,0|1,0,0]=3 8041 B17R0.3110 CCCCCCCCCCCC(=O)OCCS[13CH3] 62a_200025704644_100000091854 [0,1,1,0,0,0|1,0,0]=3 8042 B17R0.3110 CCCCCCCCCCCC(=O)OCNCC 2230a_100015525214_100020644155 [0,1,1,0,0,0|1,0,0]=3 8043 B17R0.3110 CCCCCCCCCCCC(=O)OCOCC 34a_100121572206_100020644155 [0,1,1,0,0,0|1,0,0]=3 8044 B17R0.3110 CCCCCCCCCCCC(=O)OCSCC 62a_100000210202_100020644155 [0,1,1,0,0,0|1,0,0]=3 8045 B17R0.3110 CCCCCCCCCCCC(=O)OCSCF 62a_100015361967_100020644155 [0,1,1,0,0,0|2,0,0]=4 8046 B17R0.3110 CCCCCCCCCCNC(=O)CCCCC 11a_100000684558_100000212188 [0,1,1,0,0,0|1,0,0]=3 8047 B17R0.3110 CCCCCCCCCCNC(=O)CCCCC 1626a_100000684558_100000212188 [0,1,1,0,0,0|1,0,0]=3 8048 B17R0.3110 CCCCCCCCCCNC(=O)CCCCC 240690a_100000684558_100000212188 [0,1,1,0,0,0|1,0,0]=3 8049 B17R0.3110 CCCCCCCCCCNC(=O)CCCCC 527a_100000684558_100000212188 [0,1,1,0,0,0|1,0,0]=3 8050 B17R0.3110 CCCCCCCCCCNC(=O)CCCCO 1626a_100000684558_100000695505 [0,1,1,0,0,0|2,0,0]=4 8051 B17R0.3110 CCCCCCCCCCNC(=O)CCCOC 11a_100000684558_100000741012 [0,1,1,0,0,0|2,0,0]=4 8052 B17R0.3110 CCCCCCCCCCNC(=O)CCCOC 1626a_100000684558_100000741012 [0,1,1,0,0,0|2,0,0]=4 8053 B17R0.3110 CCCCCCCCCCNC(=O)CCCOC 240690a_100000684558_100000741012 [0,1,1,0,0,0|2,0,0]=4 8054 B17R0.3110 CCCCCCCCCCNC(=O)CCCOC 527a_100000684558_100000741012 [0,1,1,0,0,0|2,0,0]=4 8055 B17R0.3110 CCCCCCCCCCNC(=O)CCCSC 11a_100000684558_100000173376 [0,1,1,0,0,0|2,0,0]=4 8056 B17R0.3110 CCCCCCCCCCNC(=O)CCCSC 1626a_100000684558_100000173376 [0,1,1,0,0,0|2,0,0]=4 8057 B17R0.3110 CCCCCCCCCCNC(=O)CCCSC 240690a_100000684558_100000173376 [0,1,1,0,0,0|2,0,0]=4 8058 B17R0.3110 CCCCCCCCCCNC(=O)CCCSC 527a_100000684558_100000173376 [0,1,1,0,0,0|2,0,0]=4 8059 B17R0.3110 CCCCCCCCCCNC(=O)CCOCC 11a_100000684558_100000749530 [0,1,1,0,0,0|2,0,0]=4 8060 B17R0.3110 CCCCCCCCCCNC(=O)CCOCC 1626a_100000684558_100000749530 [0,1,1,0,0,0|2,0,0]=4 8061 B17R0.3110 CCCCCCCCCCNC(=O)CCOCC 240690a_100000684558_100000749530 [0,1,1,0,0,0|2,0,0]=4 8062 B17R0.3110 CCCCCCCCCCNC(=O)CCOCC 527a_100000684558_100000749530 [0,1,1,0,0,0|2,0,0]=4 8063 B17R0.3110 CCCCCCCCCCNC(=O)CCSCC 11a_100000684558_100000230768 [0,1,1,0,0,0|2,0,0]=4 8064 B17R0.3110 CCCCCCCCCCNC(=O)CCSCC 1626a_100000684558_100000230768 [0,1,1,0,0,0|2,0,0]=4 8065 B17R0.3110 CCCCCCCCCCNC(=O)CCSCC 240690a_100000684558_100000230768 [0,1,1,0,0,0|2,0,0]=4 8066 B17R0.3110 CCCCCCCCCCNC(=O)CCSCC 527a_100000684558_100000230768 [0,1,1,0,0,0|2,0,0]=4 8067 B17R0.3110 CCCCCCCCCCNC(=O)COCCC 11a_100000684558_100000745993 [0,1,1,0,0,0|2,0,0]=4 8068 B17R0.3110 CCCCCCCCCCNC(=O)COCCC 1626a_100000684558_100000745993 [0,1,1,0,0,0|2,0,0]=4 8069 B17R0.3110 CCCCCCCCCCNC(=O)COCCC 240690a_100000684558_100000745993 [0,1,1,0,0,0|2,0,0]=4 8070 B17R0.3110 CCCCCCCCCCNC(=O)COCCC 527a_100000684558_100000745993 [0,1,1,0,0,0|2,0,0]=4 8071 B17R0.3110 CCCCCCCCCCNC(=O)CSCCC 11a_100000684558_100000217233 [0,1,1,0,0,0|2,0,0]=4 8072 B17R0.3110 CCCCCCCCCCNC(=O)CSCCC 1626a_100000684558_100000217233 [0,1,1,0,0,0|2,0,0]=4 8073 B17R0.3110 CCCCCCCCCCNC(=O)CSCCC 240690a_100000684558_100000217233 [0,1,1,0,0,0|2,0,0]=4 8074 B17R0.3110 CCCCCCCCCCNC(=O)CSCCC 527a_100000684558_100000217233 [0,1,1,0,0,0|2,0,0]=4 8075 B17R0.3110 CCCCCCCCCCNC(=O)NCCCC 2708a_100000102301_100000684558 [0,1,1,0,0,0|1,0,0]=3 8076 B17R0.3110 CCCCCCCCCCNC(=O)NCCCC 2708a_100000684558_100000102301 [0,1,1,0,0,0|1,0,0]=3 8077 B17R0.3110 CCCCCCCCCCNC(=O)NCCCC 273464a_100000102301_100000684558 [0,1,1,0,0,0|1,0,0]=3 8078 B17R0.3110 CCCCCCCCCCNC(=O)NCCCC 273464a_100000684558_100000102301 [0,1,1,0,0,0|1,0,0]=3 8079 B17R0.3110 CCCCCCCCCCNC(=O)NCCCC 512a_100000102301_100000684558 [0,1,1,0,0,0|1,0,0]=3 8080 B17R0.3110 CCCCCCCCCCNC(=O)NCCCC 512a_100000684558_100000102301 [0,1,1,0,0,0|1,0,0]=3 8081 B17R0.3110 CCCCCCCCCCNC(=O)NCCCF 2708a_100000684558_100015189416 [0,1,1,0,0,0|2,0,0]=4 8082 B17R0.3110 CCCCCCCCCCNC(=O)NCCCF 2708a_100015189416_100000684558 [0,1,1,0,0,0|2,0,0]=4 8083 B17R0.3110 CCCCCCCCCCNC(=O)NCCCF 273464a_100000684558_100015189416 [0,1,1,0,0,0|2,0,0]=4 8084 B17R0.3110 CCCCCCCCCCNC(=O)NCCCF 273464a_100015189416_100000684558 [0,1,1,0,0,0|2,0,0]=4 8085 B17R0.3110 CCCCCCCCCCNC(=O)NCCCF 512a_100000684558_100015189416 [0,1,1,0,0,0|2,0,0]=4 8086 B17R0.3110 CCCCCCCCCCNC(=O)NCCCF 512a_100015189416_100000684558 [0,1,1,0,0,0|2,0,0]=4 8087 B17R0.3110 CCCCCCCCCCNC(=O)NCCCO 2708a_100000684558_100000182051 [0,1,1,0,0,0|2,0,0]=4 8088 B17R0.3110 CCCCCCCCCCNC(=O)NCCCO 273464a_100000182051_100000684558 [0,1,1,0,0,0|2,0,0]=4 8089 B17R0.3110 CCCCCCCCCCNC(=O)NCCCO 273464a_100000684558_100000182051 [0,1,1,0,0,0|2,0,0]=4 8090 B17R0.3110 CCCCCCCCCCNC(=O)NCCCO 512a_100000684558_100000182051 [0,1,1,0,0,0|2,0,0]=4 8091 B17R0.3110 CCCCCCCCCCNC(=O)NCCOC 2708a_100000684558_100000209980 [0,1,1,0,0,0|2,0,0]=4 8092 B17R0.3110 CCCCCCCCCCNC(=O)NCCOC 273464a_100000209980_100000684558 [0,1,1,0,0,0|2,0,0]=4 8093 B17R0.3110 CCCCCCCCCCNC(=O)NCCOC 273464a_100000684558_100000209980 [0,1,1,0,0,0|2,0,0]=4 8094 B17R0.3110 CCCCCCCCCCNC(=O)NCCSC 2708a_100000684558_100020590264 [0,1,1,0,0,0|2,0,0]=4 8095 B17R0.3110 CCCCCCCCCCNC(=O)NCCSC 2708a_100020590264_100000684558 [0,1,1,0,0,0|2,0,0]=4 8096 B17R0.3110 CCCCCCCCCCNC(=O)NCCSC 273464a_100000684558_100020590264 [0,1,1,0,0,0|2,0,0]=4 8097 B17R0.3110 CCCCCCCCCCNC(=O)NCCSC 273464a_100020590264_100000684558 [0,1,1,0,0,0|2,0,0]=4 8098 B17R0.3110 CCCCCCCCCCNC(=O)NCCSC 512a_100000684558_100020590264 [0,1,1,0,0,0|2,0,0]=4 8099 B17R0.3110 CCCCCCCCCCNC(=O)NCCSC 512a_100020590264_100000684558 [0,1,1,0,0,0|2,0,0]=4 8100 B17R0.3110 CCCCCCCCCCNC(=O)NNCCC 273464a_100000684558_100000740057 [0,1,1,0,0,0|2,0,0]=4 8101 B17R0.3110 CCCCCCCCCCNC(=O)NNCCC 512a_100000684558_100000740057 [0,1,1,0,0,0|2,0,0]=4 8102 B17R0.3110 CCCCCCCCCCNC(=O)NNCCC 512a_100000740057_100000684558 [0,1,1,0,0,0|2,0,0]=4 8103 B17R0.3110 CCCCCCCCCCOC(=O)CNCCF 34a_100000724931_100000210668 [0,1,1,0,0,0|2,0,0]=4 8104 B17R0.3110 CCCCCCCCCCOC(=O)CNCCO 2230a_100016997473_100000210668 [0,1,1,0,0,0|2,0,0]=4 8105 B17R0.3110 CCCCCCCCCCOC(=O)CNCCO 34a_100016990907_100000210668 [0,1,1,0,0,0|2,0,0]=4 8106 B17R0.3110 CCCCCCCCCCOC(=O)COCCBr 34a_100000211926_100000210668 [0,1,1,0,0,0|2,0,0]=4 8107 B17R0.3110 CCCCCCCCCCOC(=O)COCCC 34a_100000210258_100000210668 [0,1,1,0,0,0|1,0,0]=3 8108 B17R0.3110 CCCCCCCCCCOC(=O)COCCN 34a_100000210304_100000210668 [0,1,1,0,0,0|2,0,0]=4 8109 B17R0.3110 CCCCCCCCCCOC(=O)CSCCC 62a_100000210303_100000680656 [0,1,1,0,0,0|1,0,0]=3 8110 B17R0.3110 CCCCCCCCCCOC(=O)CSCCC 62a_100000680656_100000210303 [0,1,1,0,0,0|1,0,0]=3 8111 B17R0.3110 CCCCCCCCCCOC(=O)CSCCF 62a_100000680656_100011217306 [0,1,1,0,0,0|2,0,0]=4 8112 B17R0.3110 CCCCCCCCCCOC(=O)CSCCF 62a_100011217306_100000680656 [0,1,1,0,0,0|2,0,0]=4 8113 B17R0.3110 CCCCCCCCCCOC(=O)CSCCO 62a_100000211926_100000680656 [0,1,1,0,0,0|2,0,0]=4 8114 B17R0.3110 CCCCCCCCCCOC(=O)CSCCO 62a_100000680656_100000211926 [0,1,1,0,0,0|2,0,0]=4 8115 B17R0.3110 CCCCCCCCCCOC(=O)CSCOC 62a_100000680656_100000766300 [0,1,1,0,0,0|2,0,0]=4 8116 B17R0.3110 CCCCCCCCCCOC(=O)CSCOC 62a_100000766300_100000680656 [0,1,1,0,0,0|2,0,0]=4 8117 B17R0.3110 CCCCCCCCCCOC(=O)CSCSC 62a_100000680656_100011218213 [0,1,1,0,0,0|2,0,0]=4 8118 B17R0.3110 CCCCCCCCCCOC(=O)CSCSC 62a_100011218213_100000680656 [0,1,1,0,0,0|2,0,0]=4 8119 B17R0.3110 CCCCCCCCCNCC(=O)CCCCC 2230a_100000212291_200012276598 [0,1,1,0,0,0|1,0,0]=3 8120 B17R0.3110 CCCCCCCCCNCC(=O)CCCCC 34a_100000212291_200012276598 [0,1,1,0,0,0|1,0,0]=3 8121 B17R0.3110 CCCCCCCCCNCC(=O)NCCCC 2230a_100000212291_100000182744 [0,1,1,0,0,0|1,0,0]=3 8122 B17R0.3110 CCCCCCCCCNCC(=O)NCCCC 34a_100000212291_100000182744 [0,1,1,0,0,0|1,0,0]=3 8123 B17R0.3110 CCCCCCCCCNCC(=O)NCCOC 2230a_100000212291_100000183275 [0,1,1,0,0,0|2,0,0]=4 8124 B17R0.3110 CCCCCCCCCNCC(=O)NCCOC 2230a_100000754632_100011214924 [0,1,1,0,0,0|2,0,0]=4 8125 B17R0.3110 CCCCCCCCCNCC(=O)NCCOC 34a_100000212291_100000183275 [0,1,1,0,0,0|2,0,0]=4 8126 B17R0.3110 CCCCCCCCCNCC(=O)OCCCC 2230a_100000212291_100000211628 [0,1,1,0,0,0|0,0,0]=2 8127 B17R0.3110 CCCCCCCCCNCC(=O)OCCCC 34a_100000212291_100000211628 [0,1,1,0,0,0|0,0,0]=2 8128 B17R0.3110 CCCCCCCCCNCC(=O)OCCOC 2230a_100000212291_200000040189 [0,1,1,0,0,0|1,0,0]=3 8129 B17R0.3110 CCCCCCCCCNCC(=O)OCCOC 34a_100000212291_200000040189 [0,1,1,0,0,0|1,0,0]=3 8130 B17R0.3110 CCCCCCCCCOCC(=O)CCCCC 34a_100000210712_200012276598 [0,1,1,0,0,0|0,0,0]=2 8131 B17R0.3110 CCCCCCCCCOCC(=O)CCCCC 7a_100000210712_200012276598 [0,1,1,0,0,0|0,0,0]=2 8132 B17R0.3110 CCCCCCCCCOCC(=O)NCCCC 34a_100000210712_100000182744 [0,1,1,0,0,0|1,0,0]=3 8133 B17R0.3110 CCCCCCCCCOCC(=O)NCCCC 7a_100000210712_100000182744 [0,1,1,0,0,0|1,0,0]=3 8134 B17R0.3110 CCCCCCCCCOCC(=O)NCCOC 34a_100000210712_100000183275 [0,1,1,0,0,0|2,0,0]=4 8135 B17R0.3110 CCCCCCCCCOCC(=O)NCCOC 7a_100000210712_100000183275 [0,1,1,0,0,0|2,0,0]=4 8136 B17R0.3110 CCCCCCCCCOCC(=O)OCCCC 34a_100000210712_100000211628 [0,1,1,0,0,0|0,0,0]=2 8137 B17R0.3110 CCCCCCCCCOCC(=O)OCCCC 7a_100000210712_100000211628 [0,1,1,0,0,0|0,0,0]=2 8138 B17R0.3110 CCCCCCCCCOCC(=O)OCCOC 34a_100000210712_200000040189 [0,1,1,0,0,0|1,0,0]=3 8139 B17R0.3110 CCCCCCCCCOCC(=O)OCCOC 7a_100000210712_200000040189 [0,1,1,0,0,0|1,0,0]=3 8140 B17R0.3110 CCCCCCCCCSCC(=O)CCCCC 62a_200012276598_100000210670 [0,1,1,0,0,0|0,1,0]=3 8141 B17R0.3110 CCCCCCCCCSCC(=O)NCCCC 62a_100000182744_100000210670 [0,1,1,0,0,0|1,0,0]=3 8142 B17R0.3110 CCCCCCCCCSCC(=O)NCCOC 62a_100000183275_100000210670 [0,1,1,0,0,0|2,0,0]=4 8143 B17R0.3110 CCCCCCCCCSCC(=O)OCCCC 62a_100000211628_100000210670 [0,1,1,0,0,0|0,0,0]=2 8144 B17R0.3110 CCCCCCCCCSCC(=O)OCCOC 62a_200000040189_100000210670 [0,1,1,0,0,0|1,0,0]=3 8145 B17R0.3110 CCCCCCOCCOCC(=O)CCCCC 34a_100000691444_200012276598 [0,1,1,0,0,0|1,0,0]=3 8146 B17R0.3110 CCCCCCOCCOCC(=O)CCCCC 7a_100000691444_200012276598 [0,1,1,0,0,0|1,0,0]=3 8147 B17R0.3110 CCCCCCOCCOCC(=O)NCCCC 34a_100000691444_100000182744 [0,1,1,0,0,0|2,0,0]=4 8148 B17R0.3110 CCCCCCOCCOCC(=O)NCCCC 7a_100000691444_100000182744 [0,1,1,0,0,0|2,0,0]=4 8149 B17R0.3110 CCCCCCOCCOCC(=O)OCCCC 34a_100000691444_100000211628 [0,1,1,0,0,0|1,0,0]=3 8150 B17R0.3110 CCCCCCOCCOCC(=O)OCCCC 7a_100000691444_100000211628 [0,1,1,0,0,0|1,0,0]=3 8151 B17R0.3110 CCCCCCOCCOCC(=O)OCCOC 34a_100000691444_200000040189 [0,1,1,0,0,0|2,0,0]=4 8152 B17R0.3110 CCCCCCOCCOCC(=O)OCCOC 7a_100000691444_200000040189 [0,1,1,0,0,0|2,0,0]=4 8153 B17R0.3110 CCCCNC(=O)CCCCCCCCCCO 240690a_100000102301_200000016029 [0,1,1,0,0,0|1,0,0]=3 8154 B17R0.3110 CCCCNC(=O)CNCCCCCCCCO 2230a_102515433106_100000182744 [0,1,1,0,0,0|2,0,0]=4 8155 B17R0.3110 CCCCNC(=O)CNCCCCCCCCO 34a_102515433106_100000182744 [0,1,1,0,0,0|2,0,0]=4 8156 B17R0.3110 CCCCNC(=O)COCCCCCCCCBr 34a_100009813846_100000182744 [0,1,1,0,0,0|2,0,0]=4 8157 B17R0.3110 CCCCNC(=O)COCCCCCCCCBr 7a_100009813846_100000182744 [0,1,1,0,0,0|2,0,0]=4 8158 B17R0.3110 CCCCNC(=O)COCCCCCCCCCl 34a_100000033203_100000182744 [0,1,1,0,0,0|2,0,0]=4 8159 B17R0.3110 CCCCNC(=O)COCCCCCCCCCl 7a_100000033203_100000182744 [0,1,1,0,0,0|2,0,0]=4 8160 B17R0.3110 CCCCNC(=O)COCCCCCCCCN 34a_102515433106_100000182744 [0,1,1,0,0,0|2,0,0]=4 8161 B17R0.3110 CCCCNC(=O)COCCCCOCCCC 34a_200000760531_100000182744 [0,1,1,0,0,0|2,0,0]=4 8162 B17R0.3110 CCCCNC(=O)COCCCCOCCCC 7a_200000760531_100000182744 [0,1,1,0,0,0|2,0,0]=4 8163 B17R0.3110 CCCCNC(=O)CSCCCCCCCCO 62a_100000033203_100000182744 [0,1,1,0,0,0|2,0,0]=4 8164 B17R0.3110 CCCCNC(=O)CSCCCCCCCCO 62a_100000182744_100000033203 [0,1,1,0,0,0|2,0,0]=4 8165 B17R0.3110 CCCCNC(=O)NCCCCCCCCCO 2708a_100000078944_100000102301 [0,1,1,0,0,0|2,0,0]=4 8166 B17R0.3110 CCCCNC(=O)NCCCCCCCCCO 2708a_100000102301_100000078944 [0,1,1,0,0,0|2,0,0]=4 8167 B17R0.3110 CCCCNC(=O)NCCCCCCCCCO 273464a_100000078944_100000102301 [0,1,1,0,0,0|2,0,0]=4 8168 B17R0.3110 CCCCNC(=O)NCCCCCCCCCO 273464a_100000102301_100000078944 [0,1,1,0,0,0|2,0,0]=4 8169 B17R0.3110 CCCCNC(=O)NCCCCCCCCCO 512a_100000078944_100000102301 [0,1,1,0,0,0|2,0,0]=4 8170 B17R0.3110 CCCCNC(=O)NCCCCCCCCCO 512a_100000102301_100000078944 [0,1,1,0,0,0|2,0,0]=4 8171 B17R0.3110 CCCCNCCCCOCC(=O)NCCCC 34a_200011216965_100000182744 [0,1,1,0,0,0|2,0,0]=4 8172 B17R0.3110 CCCCNCCCCOCC(=O)OCCCC 34a_200011216965_100000211628 [0,1,1,0,0,0|1,0,0]=3 8173 B17R0.3110 CCCCNCCCCOCC(=O)OCCOC 34a_200011216965_200000040189 [0,1,1,0,0,0|2,0,0]=4 8174 B17R0.3110 CCCCOC(=O)CNCCCCCCCCO 2230a_102515433106_100000211628 [0,1,1,0,0,0|1,0,0]=3 8175 B17R0.3110 CCCCOC(=O)CNCCCCCCCCO 34a_102515433106_100000211628 [0,1,1,0,0,0|1,0,0]=3 8176 B17R0.3110 CCCCOC(=O)CNCCOCCOCCC 2230a_200011904461_100000211628 [0,1,1,0,0,0|2,0,0]=4 8177 B17R0.3110 CCCCOC(=O)CNCCOCCOCCC 34a_200011904461_100000211628 [0,1,1,0,0,0|2,0,0]=4 8178 B17R0.3110 CCCCOC(=O)COCCCCCCCCBr 34a_100009813846_100000211628 [0,1,1,0,0,0|1,0,0]=3 8179 B17R0.3110 CCCCOC(=O)COCCCCCCCCBr 7a_100009813846_100000211628 [0,1,1,0,0,0|1,0,0]=3 8180 B17R0.3110 CCCCOC(=O)COCCCCCCCCCl 34a_100000033203_100000211628 [0,1,1,0,0,0|1,0,0]=3 8181 B17R0.3110 CCCCOC(=O)COCCCCCCCCCl 7a_100000033203_100000211628 [0,1,1,0,0,0|1,0,0]=3 8182 B17R0.3110 CCCCOC(=O)COCCCCCCCCN 34a_102515433106_100000211628 [0,1,1,0,0,0|1,0,0]=3 8183 B17R0.3110 CCCCOC(=O)COCCCCCNCCN 34a_103619048469_100000211628 [0,1,1,0,0,0|2,0,0]=4 8184 B17R0.3110 CCCCOC(=O)COCCCOCCCOC 34a_200011215475_100000211628 [0,1,1,0,0,0|2,0,0]=4 8185 B17R0.3110 CCCCOC(=O)COCCCOCCCOC 7a_200011215475_100000211628 [0,1,1,0,0,0|2,0,0]=4 8186 B17R0.3110 CCCCOC(=O)CSCCCCCCCCO 62a_100000033203_100000211628 [0,1,1,0,0,0|1,0,0]=3 8187 B17R0.3110 CCCCOC(=O)CSCCCCCCCCO 62a_100000211628_100000033203 [0,1,1,0,0,0|1,0,0]=3 8188 B17R0.3110 CCCCOCCCCOCC(=O)OCCCC 34a_200000760531_100000211628 [0,1,1,0,0,0|1,0,0]=3 8189 B17R0.3110 CCCCOCCCCOCC(=O)OCCCC 7a_200000760531_100000211628 [0,1,1,0,0,0|1,0,0]=3 8190 B17R0.3110 CCCCOCCCCOCC(=O)OCCOC 34a_200000760531_200000040189 [0,1,1,0,0,0|2,0,0]=4 8191 B17R0.3110 CCCCOCCCCOCC(=O)OCCOC 7a_200000760531_200000040189 [0,1,1,0,0,0|2,0,0]=4 8192 B17R0.3110 CCCNNC(=O)CCCCCCCCCCO 22a_100000740057_200000016029 [0,1,1,0,0,0|2,0,0]=4 8193 B17R0.3110 CCCOCC(=O)CCCCCCCCCCO 1458a_100000745993_100009813290 [0,1,1,0,0,0|2,0,0]=4 8194 B17R0.3110 CCCOCC(=O)NCCCCCCCCCO 240690a_100000078944_100000745993 [0,1,1,0,0,0|2,0,0]=4 8195 B17R0.3110 CCCSCC(=O)CCCCCCCCCCO 1458a_100000217233_100009813290 [0,1,1,0,0,0|2,0,0]=4 8196 B17R0.3110 CCCSCC(=O)NCCCCCCCCCO 240690a_100000078944_100000217233 [0,1,1,0,0,0|2,0,0]=4 8197 B17R0.3110 CCOCCC(=O)CCCCCCCCCCO 1458a_100000749530_100009813290 [0,1,1,0,0,0|2,0,0]=4 8198 B17R0.3110 CCOCCC(=O)NCCCCCCCCCO 240690a_100000078944_100000749530 [0,1,1,0,0,0|2,0,0]=4 8199 B17R0.3110 CCSCCC(=O)CCCCCCCCCCO 1458a_100000230768_100009813290 [0,1,1,0,0,0|2,0,0]=4 8200 B17R0.3110 CCSCCC(=O)NCCCCCCCCCO 240690a_100000078944_100000230768 [0,1,1,0,0,0|2,0,0]=4 8201 B17R0.3110 COCCCC(=O)CCCCCCCCCCO 1458a_100000741012_100009813290 [0,1,1,0,0,0|2,0,0]=4 8202 B17R0.3110 COCCCC(=O)NCCCCCCCCCO 240690a_100000078944_100000741012 [0,1,1,0,0,0|2,0,0]=4 8203 B17R0.3110 COCCNC(=O)CCCCCCCCCCO 240690a_100000209980_200000016029 [0,1,1,0,0,0|2,0,0]=4 8204 B17R0.3110 COCCOC(=O)CNCCCCCCCCO 2230a_102515433106_200000040189 [0,1,1,0,0,0|2,0,0]=4 8205 B17R0.3110 COCCOC(=O)CNCCCCCCCCO 34a_102515433106_200000040189 [0,1,1,0,0,0|2,0,0]=4 8206 B17R0.3110 COCCOC(=O)COCCCCCCCCBr 34a_100009813846_200000040189 [0,1,1,0,0,0|2,0,0]=4 8207 B17R0.3110 COCCOC(=O)COCCCCCCCCBr 7a_100009813846_200000040189 [0,1,1,0,0,0|2,0,0]=4 8208 B17R0.3110 COCCOC(=O)COCCCCCCCCCl 34a_100000033203_200000040189 [0,1,1,0,0,0|2,0,0]=4 8209 B17R0.3110 COCCOC(=O)COCCCCCCCCCl 7a_100000033203_200000040189 [0,1,1,0,0,0|2,0,0]=4 8210 B17R0.3110 COCCOC(=O)COCCCCCCCCN 34a_102515433106_200000040189 [0,1,1,0,0,0|2,0,0]=4 8211 B17R0.3110 COCCOC(=O)CSCCCCCCCCO 62a_100000033203_200000040189 [0,1,1,0,0,0|2,0,0]=4 8212 B17R0.3110 COCCOC(=O)CSCCCCCCCCO 62a_200000040189_100000033203 [0,1,1,0,0,0|2,0,0]=4 8213 B17R0.3110 CSCCCC(=O)CCCCCCCCCCO 1458a_100000173376_100009813290 [0,1,1,0,0,0|2,0,0]=4 8214 B17R0.3110 CSCCCC(=O)NCCCCCCCCCO 240690a_100000078944_100000173376 [0,1,1,0,0,0|2,0,0]=4 8215 B17R0.3110 CSCCNC(=O)CCCCCCCCCCO 240690a_100020590264_200000016029 [0,1,1,0,0,0|2,0,0]=4 8216 B17R0.3110 O=C(CCCCCCCCCCO)NCCCF 240690a_100015189416_200000016029 [0,1,1,0,0,0|2,0,0]=4 8217 B17R0.3110 O=C(CCCCCCCCCCO)NCCCO 240690a_100000182051_200000016029 [0,1,1,0,0,0|2,0,0]=4 8218 B17R0.3110 O=C(CCCCO)CCCCCCCCCCO 1458a_100000695505_100009813290 [0,1,1,0,0,0|2,0,0]=4 8219 B17R0.6195 CCCCCCCC(C)OCC(=O)CCCCC 34a_200011215852_200012276598 [0,1,1,0,0,0|2,0,0]=4 8220 B17R0.6195 CCCCCCCC(C)OCC(=O)CCCCC 7a_200011215852_200012276598 [0,1,1,0,0,0|2,0,0]=4 8221 B17R0.6195 CCCCCCCC(C)OCC(=O)NCCCC 34a_200011215852_100000182744 [0,1,1,0,0,0|2,0,0]=4 8222 B17R0.6195 CCCCCCCC(C)OCC(=O)NCCCC 7a_200011215852_100000182744 [0,1,1,0,0,0|2,0,0]=4 8223 B17R0.6195 CCCCCCCC(C)OCC(=O)OCCCC 34a_200011215852_100000211628 [0,1,1,0,0,0|1,0,0]=3 8224 B17R0.6195 CCCCCCCC(C)OCC(=O)OCCCC 7a_200011215852_100000211628 [0,1,1,0,0,0|1,0,0]=3 8225 B17R0.6195 CCCCCCCC(C)OCC(=O)OCCOC 34a_200011215852_200000040189 [0,1,1,0,0,0|2,0,0]=4 8226 B17R0.6195 CCCCCCCC(C)OCC(=O)OCCOC 7a_200011215852_200000040189 [0,1,1,0,0,0|2,0,0]=4 8227 B17R0.6195 CCCCCCCC(C)SCC(=O)CCCCC 62a_200011218727_200012276598 [0,1,1,0,0,0|2,0,0]=4 8228 B17R0.6195 CCCCCCCC(C)SCC(=O)CCCCC 62a_200012276598_200011218727 [0,1,1,0,0,0|2,0,0]=4 8229 B17R0.6195 CCCCCCCC(C)SCC(=O)NCCCC 62a_100000182744_200011218727 [0,1,1,0,0,0|2,0,0]=4 8230 B17R0.6195 CCCCCCCC(C)SCC(=O)NCCCC 62a_200011218727_100000182744 [0,1,1,0,0,0|2,0,0]=4 8231 B17R0.6195 CCCCCCCC(C)SCC(=O)OCCCC 62a_100000211628_200011218727 [0,1,1,0,0,0|1,0,0]=3 8232 B17R0.6195 CCCCCCCC(C)SCC(=O)OCCCC 62a_200011218727_100000211628 [0,1,1,0,0,0|1,0,0]=3 8233 B17R0.6195 CCCCCCCC(C)SCC(=O)OCCOC 62a_200000040189_200011218727 [0,1,1,0,0,0|2,0,0]=4 8234 B17R0.6195 CCCCCCCC(C)SCC(=O)OCCOC 62a_200011218727_200000040189 [0,1,1,0,0,0|2,0,0]=4 8235 B17R0.12319 CCCCCCCCCCS(=O)(=O)NCCCC 270084a_100000102301_200011217601 [0,1,1,0,0,0|2,0,0]=4 8236 B17R0.12319 CCCCCCCCCCS(=O)(=O)NCCCC 274078a_100000102301_200011217601 [0,1,1,0,0,0|2,0,0]=4 8237 B17R0.12319 CCCCCCCCCNS(=O)(=O)CCCCC 270084a_100000212291_100000753860 [0,1,1,0,0,0|2,0,0]=4 8238 B17R0.12319 CCCCCCCCCNS(=O)(=O)CCCCC 274078a_100000212291_100000753860 [0,1,1,0,0,0|2,0,0]=4 8239 B17R0.12412 C#CCCCCC(=O)CCCCCCCCCC 1458a_100000210375_100010269958 [0,1,1,0,0,0|1,0,1]=4 8240 B17R0.12412 C#CCCCCC(=O)CCCCCCCCCC 1458a_100000696528_100000210319 [0,1,1,0,0,0|1,0,1]=4 8241 B17R0.12412 C#CCCCCC(=O)NCCCCCCCCC 11a_100000212291_100000696528 [0,1,1,0,0,0|1,0,1]=4 8242 B17R0.12412 C#CCCCCC(=O)NCCCCCCCCC 1626a_100000212291_100000696528 [0,1,1,0,0,0|1,0,1]=4 8243 B17R0.12412 C#CCCCCC(=O)NCCCCCCCCC 240690a_100000212291_100000696528 [0,1,1,0,0,0|1,0,1]=4 8244 B17R0.12412 C#CCCCCC(=O)NCCCCCCCCC 527a_100000212291_100000696528 [0,1,1,0,0,0|1,0,1]=4 8245 B17R0.12412 C#CCCCCCCCCC(=O)COCCCC 1458a_100000029693_100011995733 [0,1,1,0,0,0|0,0,2]=4 8246 B17R0.12412 C#CCCCNC(=O)CCCCCCCCCC 11a_100000718082_100000210375 [0,1,1,0,0,0|1,0,1]=4 8247 B17R0.12412 C#CCCCNC(=O)CCCCCCCCCC 1626a_100000718082_100000210375 [0,1,1,0,0,0|1,0,1]=4 8248 B17R0.12412 C#CCCCNC(=O)CCCCCCCCCC 240690a_100000718082_100000210375 [0,1,1,0,0,0|1,0,1]=4 8249 B17R0.12412 C=CCCCCC(=O)CCCCCCCCCC 1458a_100000210375_100011215482 [0,1,1,0,0,0|1,0,1]=4 8250 B17R0.12412 C=CCCCCC(=O)CCCCCCCCCC 1458a_100011215552_100000210319 [0,1,1,0,0,0|1,0,1]=4 8251 B17R0.12412 C=CCCCCC(=O)NCCCCCCCCC 11a_100000212291_100011215552 [0,1,1,0,0,0|1,0,1]=4 8252 B17R0.12412 C=CCCCCC(=O)NCCCCCCCCC 1626a_100000212291_100011215552 [0,1,1,0,0,0|1,0,1]=4 8253 B17R0.12412 C=CCCCCC(=O)NCCCCCCCCC 240690a_100000212291_100011215552 [0,1,1,0,0,0|1,0,1]=4 8254 B17R0.12412 C=CCCCCC(=O)NCCCCCCCCC 527a_100000212291_100011215552 [0,1,1,0,0,0|1,0,1]=4 8255 B17R0.12412 C=CCCCCCCCCC(=O)COCCCC 1458a_100000211349_100011995733 [0,1,1,0,0,0|0,0,2]=4 8256 B17R0.12412 C=CCCCCCCCCC(=O)COCCCC 1458a_100000757543_100011933949 [0,1,1,0,0,0|0,0,2]=4 8257 B17R0.12412 C=CCCCNC(=O)CCCCCCCCCC 11a_100000700776_100000210375 [0,1,1,0,0,0|1,0,1]=4 8258 B17R0.12412 C=CCCCNC(=O)CCCCCCCCCC 1626a_100000700776_100000210375 [0,1,1,0,0,0|1,0,1]=4 8259 B17R0.12412 C=CCCCNC(=O)CCCCCCCCCC 240690a_100000700776_100000210375 [0,1,1,0,0,0|1,0,1]=4 8260 B17R0.12412 CC#CCCCCCCCC(=O)COCCCC 1458a_100000066323_100011995733 [0,1,1,0,0,0|0,0,2]=4 8261 B17R0.12412 CC/C=C\CCC(=O)CCCCCCCCCC 1458a_100000210375_100015370543 [0,1,1,0,0,0|1,0,1]=4 8262 B17R0.12412 CCC#CCCCCCCC(=O)COCCCC 1458a_100000757543_200000036426 [0,1,1,0,0,0|0,0,2]=4 8263 B17R0.12412 CCC/C=C/CC(=O)CCCCCCCCCC 1458a_200016266809_100000210319 [0,1,1,0,0,0|1,0,1]=4 8264 B17R0.12412 CCC/C=C/CC(=O)NCCCCCCCCC 11a_100000212291_200016266809 [0,1,1,0,0,0|1,0,1]=4 8265 B17R0.12412 CCC/C=C/CC(=O)NCCCCCCCCC 1626a_100000212291_200016266809 [0,1,1,0,0,0|1,0,1]=4 8266 B17R0.12412 CCC/C=C/CC(=O)NCCCCCCCCC 240690a_100000212291_200016266809 [0,1,1,0,0,0|1,0,1]=4 8267 B17R0.12412 CCC/C=C/CC(=O)NCCCCCCCCC 527a_100000212291_200016266809 [0,1,1,0,0,0|1,0,1]=4 8268 B17R0.12412 CCCCC=CC(=O)CCCCCCCCCC 1458a_100016266645_100000210319 [0,1,1,0,0,0|1,0,0]=3 8269 B17R0.12412 CCCCC=CC(=O)CCCCCCCCCO 1458a_100016266645_100009813782 [0,1,1,0,0,0|2,0,0]=4 8270 B17R0.12412 CCCCC=CC(=O)NCCCCCCCCC 11a_100000212291_100016266645 [0,1,1,0,0,0|1,0,1]=4 8271 B17R0.12412 CCCCC=CC(=O)NCCCCCCCCC 1626a_100000212291_100016266645 [0,1,1,0,0,0|1,0,1]=4 8272 B17R0.12412 CCCCC=CC(=O)NCCCCCCCCC 240690a_100000212291_100016266645 [0,1,1,0,0,0|1,0,1]=4 8273 B17R0.12412 CCCCCCC(=O)CCCCCCCCCF 1458a_200009909015_100000210757 [0,1,1,0,0,0|2,0,0]=4 8274 B17R0.12412 CCCCCCC(=O)CCCCCCCCCO 1458a_100102632555_100009813782 [0,1,1,0,0,0|2,0,0]=4 8275 B17R0.12412 CCCCCCC(=O)NCCCCCCCCO 240690a_102515433106_100102632555 [0,1,1,0,0,0|2,0,0]=4 8276 B17R0.12412 CCCCCCCCC=CC(=O)CCCCCC 1458a_100015345288_100000210757 [0,1,1,0,0,0|1,0,1]=4 8277 B17R0.12412 CCCCCCCCC=CC(=O)CCCCCF 1458a_100015345288_100000729378 [0,1,1,0,0,0|1,0,1]=4 8278 B17R0.12412 CCCCCCCCC=CC(=O)CCCCCO 1458a_100015345288_100000746330 [0,1,1,0,0,0|1,0,1]=4 8279 B17R0.12412 CCCCCCCCC=CC(=O)CCCCOC 1458a_100015345288_100000755781 [0,1,1,0,0,0|1,0,1]=4 8280 B17R0.12412 CCCCCCCCC=CC(=O)CCCOCC 1458a_100015345288_100012232248 [0,1,1,0,0,0|1,0,1]=4 8281 B17R0.12412 CCCCCCCCC=CC(=O)CCOCCC 1458a_100015345288_100011215938 [0,1,1,0,0,0|1,0,1]=4 8282 B17R0.12412 CCCCCCCCC=CC(=O)COCCCC 1458a_100015345288_100011995733 [0,1,1,0,0,0|0,0,2]=4 8283 B17R0.12412 CCCCCCCCC=CC(=O)NCCCCC 11a_100000209983_100015345288 [0,1,1,0,0,0|1,0,1]=4 8284 B17R0.12412 CCCCCCCCC=CC(=O)NCCCCC 1626a_100000209983_100015345288 [0,1,1,0,0,0|1,0,1]=4 8285 B17R0.12412 CCCCCCCCC=CC(=O)NCCCCC 240690a_100000209983_100015345288 [0,1,1,0,0,0|1,0,1]=4 8286 B17R0.12412 CCCCCCCCCCC(=NNCCCC)C 4a_100025702795_200011219864 [0,1,1,0,0,0|2,0,0]=4 8287 B17R0.12412 CCCCCCCCCCC(=O)CCCCC#N 1458a_100000210375_100000211819 [0,1,1,0,0,0|1,0,1]=4 8288 B17R0.12412 CCCCCCCCCCC(=O)CCCCCF 1458a_100000210375_100000729378 [0,1,1,0,0,0|1,0,0]=3 8289 B17R0.12412 CCCCCCCCCCC(=O)CCCCCO 1458a_100000210375_100000746330 [0,1,1,0,0,0|1,0,0]=3 8290 B17R0.12412 CCCCCCCCCCC(=O)CCCCCO 1458a_100102619762_100000210319 [0,1,1,0,0,0|1,0,0]=3 8291 B17R0.12412 CCCCCCCCCCC(=O)CCCCOC 1458a_100000210375_100000755781 [0,1,1,0,0,0|1,0,0]=3 8292 B17R0.12412 CCCCCCCCCCC(=O)CCCOCC 1458a_100000210375_100012232248 [0,1,1,0,0,0|1,0,0]=3 8293 B17R0.12412 CCCCCCCCCCC(=O)CCOCCC 1458a_100000210375_100011215938 [0,1,1,0,0,0|1,0,0]=3 8294 B17R0.12412 CCCCCCCCCCC(=O)CCOCCO 1458a_100000210375_100011215305 [0,1,1,0,0,0|2,0,0]=4 8295 B17R0.12412 CCCCCCCCCCC(=O)CCOCCO 1458a_100011229844_100000210319 [0,1,1,0,0,0|2,0,0]=4 8296 B17R0.12412 CCCCCCCCCCC(=O)COCCCC 1458a_100000210375_100011995733 [0,1,1,0,0,0|0,0,0]=2 8297 B17R0.12412 CCCCCCCCCCC(=O)COCCCC 1458a_100000757543_100000210319 [0,1,1,0,0,0|0,0,0]=2 8298 B17R0.12412 CCCCCCCCCCC(=O)COCCOC 1458a_100000211095_100000210319 [0,1,1,0,0,0|1,0,0]=3 8299 B17R0.12412 CCCCCCCCCCC(=O)CSCCCC 1458a_100000191162_100000210319 [0,1,1,0,0,0|0,1,0]=3 8300 B17R0.12412 CCCCCCCCCCC(=O)NCCCCC 11a_100000209983_100000210375 [0,1,1,0,0,0|1,0,0]=3 8301 B17R0.12412 CCCCCCCCCCC(=O)NCCCCC 1626a_100000209983_100000210375 [0,1,1,0,0,0|1,0,0]=3 8302 B17R0.12412 CCCCCCCCCCC(=O)NCCCCC 240690a_100000209983_100000210375 [0,1,1,0,0,0|1,0,0]=3 8303 B17R0.12412 CCCCCCCCCCC(=O)NCCCCO 240690a_100000750430_100000210375 [0,1,1,0,0,0|1,0,0]=3 8304 B17R0.12412 CCCCCCCCCCC(=O)NCCCOC 1626a_100150723488_100000210375 [0,1,1,0,0,0|1,0,0]=3 8305 B17R0.12412 CCCCCCCCCCC(=O)NCCCOC 240690a_100150723488_100000210375 [0,1,1,0,0,0|1,0,0]=3 8306 B17R0.12412 CCCCCCCCCCC(=O)NCCCSC 11a_100000749238_100000210375 [0,1,1,0,0,0|1,0,0]=3 8307 B17R0.12412 CCCCCCCCCCC(=O)NCCCSC 1626a_100000749238_100000210375 [0,1,1,0,0,0|1,0,0]=3 8308 B17R0.12412 CCCCCCCCCCC(=O)NCCCSC 240690a_100000749238_100000210375 [0,1,1,0,0,0|1,0,0]=3 8309 B17R0.12412 CCCCCCCCCCC(=O)NCCOCC 11a_100011200944_100000210375 [0,1,1,0,0,0|1,0,0]=3 8310 B17R0.12412 CCCCCCCCCCC(=O)NCCOCC 1626a_102516460346_100000210375 [0,1,1,0,0,0|1,0,0]=3 8311 B17R0.12412 CCCCCCCCCCC(=O)NCCOCC 240690a_100011200944_100000210375 [0,1,1,0,0,0|1,0,0]=3 8312 B17R0.12412 CCCCCCCCCCC(=O)NCCSCC 11a_100000106463_100000210375 [0,1,1,0,0,0|1,0,0]=3 8313 B17R0.12412 CCCCCCCCCCC(=O)NCCSCC 1626a_100000106463_100000210375 [0,1,1,0,0,0|1,0,0]=3 8314 B17R0.12412 CCCCCCCCCCC(=O)NCCSCC 240690a_100000106463_100000210375 [0,1,1,0,0,0|1,0,0]=3 8315 B17R0.12412 CCCCCCCCCCC(=O)NNCCCC 22a_100025702795_100000210375 [0,1,1,0,0,0|1,0,0]=3 8316 B17R0.12412 CCCCCCCCCCC(=O)NNCCOC 22a_100000741390_100000210375 [0,1,1,0,0,0|2,0,0]=4 8317 B17R0.12412 CCCCCCCCCCC(C)OCCCCF 34a_100011215000_100000729493 [0,1,1,0,0,0|1,0,1]=4 8318 B17R0.12412 CCCCCCCCCCC(C)OCCCCF 7a_100011215000_100000729493 [0,1,1,0,0,0|1,0,1]=4 8319 B17R0.12412 CCCCCCCCCCC(C)OCCCCO 34a_100011215000_100011216708 [0,1,1,0,0,0|1,0,1]=4 8320 B17R0.12412 CCCCCCCCCCC(C)OCCCCO 7a_100011215000_100000210776 [0,1,1,0,0,0|1,0,1]=4 8321 B17R0.12412 CCCCCCCCCCC(C)OCCCOC 34a_100011215000_100000740836 [0,1,1,0,0,0|1,0,1]=4 8322 B17R0.12412 CCCCCCCCCCC(C)OCCCOC 7a_100011215000_100000740836 [0,1,1,0,0,0|1,0,1]=4 8323 B17R0.12412 CCCCCCCCCCC(C)OCCOCC 34a_100011215000_100000210147 [0,1,1,0,0,0|1,0,1]=4 8324 B17R0.12412 CCCCCCCCCCC(C)OCCOCC 7a_100011215000_100011215890 [0,1,1,0,0,0|1,0,1]=4 8325 B17R0.12412 CCCCCCCCCCC(C)OCCSCC 34a_100011215000_100000757381 [0,1,1,0,0,0|1,0,1]=4 8326 B17R0.12412 CCCCCCCCCCC(C)OCCSCC 7a_100011215000_100000757381 [0,1,1,0,0,0|1,0,1]=4 8327 B17R0.12412 CCCCCCCCCCN(C)COCCCC 2230a_100000207566_100011995733 [0,1,1,0,0,0|2,0,0]=4 8328 B17R0.12412 CCCCCCCCCCN(C)COCCCC 269982a_100000207566_100011995733 [0,1,1,0,0,0|2,0,0]=4 8329 B17R0.12412 CCCCCCCCCNC(=O)CCCCCC 11a_100000212291_100102632555 [0,1,1,0,0,0|1,0,0]=3 8330 B17R0.12412 CCCCCCCCCNC(=O)CCCCCC 1626a_100000212291_100102632555 [0,1,1,0,0,0|1,0,0]=3 8331 B17R0.12412 CCCCCCCCCNC(=O)CCCCCC 240690a_100000212291_100102632555 [0,1,1,0,0,0|1,0,0]=3 8332 B17R0.12412 CCCCCCCCCNC(=O)CCCCCC 527a_100000212291_100102632555 [0,1,1,0,0,0|1,0,0]=3 8333 B17R0.12412 CCCCCCCCCNC(=O)CCCCCO 240690a_100000212291_100102619762 [0,1,1,0,0,0|1,0,0]=3 8334 B17R0.12412 CCCCCCCCCNC(=O)CCOCCO 1626a_100000212291_100011229844 [0,1,1,0,0,0|2,0,0]=4 8335 B17R0.12412 CCCCCCCCCNC(=O)CCOCCO 240690a_100000212291_100011229844 [0,1,1,0,0,0|2,0,0]=4 8336 B17R0.12412 CCCCCCCCCNC(=O)COCCCC 11a_100000212291_100000757543 [0,1,1,0,0,0|1,0,0]=3 8337 B17R0.12412 CCCCCCCCCNC(=O)COCCCC 1626a_100000212291_100000757543 [0,1,1,0,0,0|1,0,0]=3 8338 B17R0.12412 CCCCCCCCCNC(=O)COCCCC 240690a_100000212291_100000757543 [0,1,1,0,0,0|1,0,0]=3 8339 B17R0.12412 CCCCCCCCCNC(=O)COCCCC 527a_100000212291_100000757543 [0,1,1,0,0,0|1,0,0]=3 8340 B17R0.12412 CCCCCCCCCNC(=O)COCCOC 11a_100000212291_100000211095 [0,1,1,0,0,0|2,0,0]=4 8341 B17R0.12412 CCCCCCCCCNC(=O)COCCOC 1626a_100000212291_100000211095 [0,1,1,0,0,0|2,0,0]=4 8342 B17R0.12412 CCCCCCCCCNC(=O)COCCOC 240690a_100000212291_100000211095 [0,1,1,0,0,0|2,0,0]=4 8343 B17R0.12412 CCCCCCCCCNC(=O)COCCOC 527a_100000212291_100000211095 [0,1,1,0,0,0|2,0,0]=4 8344 B17R0.12412 CCCCCCCCCNC(=O)CSCCCC 11a_100000212291_100000191162 [0,1,1,0,0,0|1,0,0]=3 8345 B17R0.12412 CCCCCCCCCNC(=O)CSCCCC 1626a_100000212291_100000191162 [0,1,1,0,0,0|1,0,0]=3 8346 B17R0.12412 CCCCCCCCCNC(=O)CSCCCC 240690a_100000212291_100000191162 [0,1,1,0,0,0|1,0,0]=3 8347 B17R0.12412 CCCCCCCCCNC(=O)CSCCCC 527a_100000212291_100000191162 [0,1,1,0,0,0|1,0,0]=3 8348 B17R0.12412 CCCCCCCCCNC(=O)NCCCCC 2708a_100000209983_100000212291 [0,1,1,0,0,0|1,0,0]=3 8349 B17R0.12412 CCCCCCCCCNC(=O)NCCCCC 2708a_100000212291_100000209983 [0,1,1,0,0,0|1,0,0]=3 8350 B17R0.12412 CCCCCCCCCNC(=O)NCCCCC 273464a_100000209983_100000212291 [0,1,1,0,0,0|1,0,0]=3 8351 B17R0.12412 CCCCCCCCCNC(=O)NCCCCC 273464a_100000212291_100000209983 [0,1,1,0,0,0|1,0,0]=3 8352 B17R0.12412 CCCCCCCCCNC(=O)NCCCCC 512a_100000209983_100000212291 [0,1,1,0,0,0|1,0,0]=3 8353 B17R0.12412 CCCCCCCCCNC(=O)NCCCCC 512a_100000212291_100000209983 [0,1,1,0,0,0|1,0,0]=3 8354 B17R0.12412 CCCCCCCCCNC(=O)NCCCCO 2708a_100000212291_100000750430 [0,1,1,0,0,0|2,0,0]=4 8355 B17R0.12412 CCCCCCCCCNC(=O)NCCCCO 2708a_100000750430_100000212291 [0,1,1,0,0,0|2,0,0]=4 8356 B17R0.12412 CCCCCCCCCNC(=O)NCCCCO 273464a_100000212291_100000750430 [0,1,1,0,0,0|2,0,0]=4 8357 B17R0.12412 CCCCCCCCCNC(=O)NCCCCO 273464a_100000750430_100000212291 [0,1,1,0,0,0|2,0,0]=4 8358 B17R0.12412 CCCCCCCCCNC(=O)NCCCCO 512a_100000212291_100000750430 [0,1,1,0,0,0|2,0,0]=4 8359 B17R0.12412 CCCCCCCCCNC(=O)NCCCCO 512a_100000750430_100000212291 [0,1,1,0,0,0|2,0,0]=4 8360 B17R0.12412 CCCCCCCCCNC(=O)NCCCOC 2708a_100000212291_100150723488 [0,1,1,0,0,0|2,0,0]=4 8361 B17R0.12412 CCCCCCCCCNC(=O)NCCCOC 2708a_100150723488_100000212291 [0,1,1,0,0,0|2,0,0]=4 8362 B17R0.12412 CCCCCCCCCNC(=O)NCCCOC 273464a_100000212291_100150723488 [0,1,1,0,0,0|2,0,0]=4 8363 B17R0.12412 CCCCCCCCCNC(=O)NCCCOC 273464a_100150723488_100000212291 [0,1,1,0,0,0|2,0,0]=4 8364 B17R0.12412 CCCCCCCCCNC(=O)NCCCOC 512a_100000212291_100150723488 [0,1,1,0,0,0|2,0,0]=4 8365 B17R0.12412 CCCCCCCCCNC(=O)NCCCSC 2708a_100000212291_100000749238 [0,1,1,0,0,0|2,0,0]=4 8366 B17R0.12412 CCCCCCCCCNC(=O)NCCCSC 2708a_100000749238_100000212291 [0,1,1,0,0,0|2,0,0]=4 8367 B17R0.12412 CCCCCCCCCNC(=O)NCCCSC 273464a_100000212291_100000749238 [0,1,1,0,0,0|2,0,0]=4 8368 B17R0.12412 CCCCCCCCCNC(=O)NCCCSC 273464a_100000749238_100000212291 [0,1,1,0,0,0|2,0,0]=4 8369 B17R0.12412 CCCCCCCCCNC(=O)NCCCSC 512a_100000212291_100000749238 [0,1,1,0,0,0|2,0,0]=4 8370 B17R0.12412 CCCCCCCCCNC(=O)NCCCSC 512a_100000749238_100000212291 [0,1,1,0,0,0|2,0,0]=4 8371 B17R0.12412 CCCCCCCCCNC(=O)NCCOCC 2708a_100000212291_100011200944 [0,1,1,0,0,0|2,0,0]=4 8372 B17R0.12412 CCCCCCCCCNC(=O)NCCOCC 2708a_100011200944_100000212291 [0,1,1,0,0,0|2,0,0]=4 8373 B17R0.12412 CCCCCCCCCNC(=O)NCCOCC 273464a_100000212291_102516460346 [0,1,1,0,0,0|2,0,0]=4 8374 B17R0.12412 CCCCCCCCCNC(=O)NCCOCC 273464a_102516460346_100000212291 [0,1,1,0,0,0|2,0,0]=4 8375 B17R0.12412 CCCCCCCCCNC(=O)NCCOCC 512a_100000212291_100011200944 [0,1,1,0,0,0|2,0,0]=4 8376 B17R0.12412 CCCCCCCCCNC(=O)NCCOCC 512a_100011200944_100000212291 [0,1,1,0,0,0|2,0,0]=4 8377 B17R0.12412 CCCCCCCCCNC(=O)NCCSCC 2708a_100000106463_100000212291 [0,1,1,0,0,0|2,0,0]=4 8378 B17R0.12412 CCCCCCCCCNC(=O)NCCSCC 2708a_100000212291_100000106463 [0,1,1,0,0,0|2,0,0]=4 8379 B17R0.12412 CCCCCCCCCNC(=O)NCCSCC 273464a_100000106463_100000212291 [0,1,1,0,0,0|2,0,0]=4 8380 B17R0.12412 CCCCCCCCCNC(=O)NCCSCC 273464a_100000212291_100000106463 [0,1,1,0,0,0|2,0,0]=4 8381 B17R0.12412 CCCCCCCCCNC(=O)NCCSCC 512a_100000106463_100000212291 [0,1,1,0,0,0|2,0,0]=4 8382 B17R0.12412 CCCCCCCCCNC(=O)NCCSCC 512a_100000212291_100000106463 [0,1,1,0,0,0|2,0,0]=4 8383 B17R0.12412 CCCCCCCCCNC(=O)NNCCCC 273464a_100000212291_100025702795 [0,1,1,0,0,0|2,0,0]=4 8384 B17R0.12412 CCCCCCCCCNC(=O)NNCCCC 512a_100000212291_100025702795 [0,1,1,0,0,0|2,0,0]=4 8385 B17R0.12412 CCCCCCCCCNC(=O)NNCCCC 512a_100025702795_100000212291 [0,1,1,0,0,0|2,0,0]=4 8386 B17R0.12412 CCCCCCCCCOC(C)COCCCC 34a_100011217071_100011214924 [0,1,1,0,0,0|1,0,1]=4 8387 B17R0.12412 CCCCCCCCCOC(C)COCCCC 7a_100011217071_100000210328 [0,1,1,0,0,0|1,0,1]=4 8388 B17R0.12412 CCCCCCCCNCC(=O)NCCCCC 2230a_100000229939_100000230301 [0,1,1,0,0,0|2,0,0]=4 8389 B17R0.12412 CCCCCCCCNCC(=O)NCCCCC 34a_100000229939_100000230301 [0,1,1,0,0,0|2,0,0]=4 8390 B17R0.12412 CCCCCCCCNCC(=O)NCCCOC 2230a_100000229939_100000183178 [0,1,1,0,0,0|2,0,0]=4 8391 B17R0.12412 CCCCCCCCNCC(=O)NCCCOC 34a_100000229939_100000183178 [0,1,1,0,0,0|2,0,0]=4 8392 B17R0.12412 CCCCCCCCNCC(=O)OCCOCC 2230a_100000229939_200000101388 [0,1,1,0,0,0|1,0,0]=3 8393 B17R0.12412 CCCCCCCCNCC(=O)OCCOCC 34a_100000229939_200000101388 [0,1,1,0,0,0|1,0,0]=3 8394 B17R0.12412 CCCCCCCCOCC(=O)CCCCCC 1458a_100000759886_100000210757 [0,1,1,0,0,0|2,0,0]=4 8395 B17R0.12412 CCCCCCCCOCC(=O)CCCCCF 1458a_100000759886_100000729378 [0,1,1,0,0,0|2,0,0]=4 8396 B17R0.12412 CCCCCCCCOCC(=O)CCCCCO 1458a_100000759886_100000746330 [0,1,1,0,0,0|2,0,0]=4 8397 B17R0.12412 CCCCCCCCOCC(=O)CCCCOC 1458a_100000759886_100000755781 [0,1,1,0,0,0|2,0,0]=4 8398 B17R0.12412 CCCCCCCCOCC(=O)CCCOCC 1458a_100000759886_100012232248 [0,1,1,0,0,0|2,0,0]=4 8399 B17R0.12412 CCCCCCCCOCC(=O)CCOCCC 1458a_100000759886_100011215938 [0,1,1,0,0,0|2,0,0]=4 8400 B17R0.12412 CCCCCCCCOCC(=O)COCCCC 1458a_100000759886_100011995733 [0,1,1,0,0,0|1,0,0]=3 8401 B17R0.12412 CCCCCCCCOCC(=O)NCCCCC 11a_100000209983_100000759886 [0,1,1,0,0,0|2,0,0]=4 8402 B17R0.12412 CCCCCCCCOCC(=O)NCCCCC 1626a_100000209983_100000759886 [0,1,1,0,0,0|2,0,0]=4 8403 B17R0.12412 CCCCCCCCOCC(=O)NCCCCC 240690a_100000209983_100000759886 [0,1,1,0,0,0|2,0,0]=4 8404 B17R0.12412 CCCCCCCCOCC(=O)NCCCCC 34a_100000210232_100000230301 [0,1,1,0,0,0|2,0,0]=4 8405 B17R0.12412 CCCCCCCCOCC(=O)NCCCCC 527a_100000209983_100000759886 [0,1,1,0,0,0|2,0,0]=4 8406 B17R0.12412 CCCCCCCCOCC(=O)NCCCCC 7a_100000210232_100000230301 [0,1,1,0,0,0|2,0,0]=4 8407 B17R0.12412 CCCCCCCCOCC(=O)NCCCCO 240690a_100000750430_100000759886 [0,1,1,0,0,0|2,0,0]=4 8408 B17R0.12412 CCCCCCCCOCC(=O)NCCCCO 527a_100000750430_100000759886 [0,1,1,0,0,0|2,0,0]=4 8409 B17R0.12412 CCCCCCCCOCC(=O)NCCCOC 1626a_100150723488_100000759886 [0,1,1,0,0,0|2,0,0]=4 8410 B17R0.12412 CCCCCCCCOCC(=O)NCCCOC 240690a_100150723488_100000759886 [0,1,1,0,0,0|2,0,0]=4 8411 B17R0.12412 CCCCCCCCOCC(=O)NCCCOC 34a_100000210232_100000183178 [0,1,1,0,0,0|2,0,0]=4 8412 B17R0.12412 CCCCCCCCOCC(=O)NCCCOC 527a_100150723488_100000759886 [0,1,1,0,0,0|2,0,0]=4 8413 B17R0.12412 CCCCCCCCOCC(=O)NCCCOC 7a_100000210232_100000183178 [0,1,1,0,0,0|2,0,0]=4 8414 B17R0.12412 CCCCCCCCOCC(=O)NCCCSC 11a_100000749238_100000759886 [0,1,1,0,0,0|2,0,0]=4 8415 B17R0.12412 CCCCCCCCOCC(=O)NCCCSC 1626a_100000749238_100000759886 [0,1,1,0,0,0|2,0,0]=4 8416 B17R0.12412 CCCCCCCCOCC(=O)NCCCSC 240690a_100000749238_100000759886 [0,1,1,0,0,0|2,0,0]=4 8417 B17R0.12412 CCCCCCCCOCC(=O)NCCCSC 527a_100000749238_100000759886 [0,1,1,0,0,0|2,0,0]=4 8418 B17R0.12412 CCCCCCCCOCC(=O)NCCOCC 11a_100011200944_100000759886 [0,1,1,0,0,0|2,0,0]=4 8419 B17R0.12412 CCCCCCCCOCC(=O)NCCOCC 1626a_102516460346_100000759886 [0,1,1,0,0,0|2,0,0]=4 8420 B17R0.12412 CCCCCCCCOCC(=O)NCCOCC 240690a_100011200944_100000759886 [0,1,1,0,0,0|2,0,0]=4 8421 B17R0.12412 CCCCCCCCOCC(=O)NCCOCC 527a_100011200944_100000759886 [0,1,1,0,0,0|2,0,0]=4 8422 B17R0.12412 CCCCCCCCOCC(=O)NCCSCC 11a_100000106463_100000759886 [0,1,1,0,0,0|2,0,0]=4 8423 B17R0.12412 CCCCCCCCOCC(=O)NCCSCC 1626a_100000106463_100000759886 [0,1,1,0,0,0|2,0,0]=4 8424 B17R0.12412 CCCCCCCCOCC(=O)NCCSCC 240690a_100000106463_100000759886 [0,1,1,0,0,0|2,0,0]=4 8425 B17R0.12412 CCCCCCCCOCC(=O)NCCSCC 527a_100000106463_100000759886 [0,1,1,0,0,0|2,0,0]=4 8426 B17R0.12412 CCCCCCCCOCC(=O)NNCCCC 22a_100025702795_100000759886 [0,1,1,0,0,0|2,0,0]=4 8427 B17R0.12412 CCCCCCCCOCC(=O)OCCOCC 34a_100000210232_200000101388 [0,1,1,0,0,0|1,0,0]=3 8428 B17R0.12412 CCCCCCCCOCC(=O)OCCOCC 7a_100000210232_200000101388 [0,1,1,0,0,0|1,0,0]=3 8429 B17R0.12412 CCCCCCCCSCC(=O)NCCCCC 62a_100000210759_100000230301 [0,1,1,0,0,0|2,0,0]=4 8430 B17R0.12412 CCCCCCCCSCC(=O)NCCCCC 62a_100000230301_100000210317 [0,1,1,0,0,0|2,0,0]=4 8431 B17R0.12412 CCCCCCCCSCC(=O)NCCCOC 62a_100000183178_100000210317 [0,1,1,0,0,0|2,0,0]=4 8432 B17R0.12412 CCCCCCCCSCC(=O)OCCOCC 62a_100000210759_200000101388 [0,1,1,0,0,0|1,0,0]=3 8433 B17R0.12412 CCCCCCCCSCC(=O)OCCOCC 62a_200000101388_100000210317 [0,1,1,0,0,0|1,0,0]=3 8434 B17R0.12412 CCCCCNC(=O)CCCCCCCCCF 11a_100000209983_200009909015 [0,1,1,0,0,0|2,0,0]=4 8435 B17R0.12412 CCCCCNC(=O)CCCCCCCCCF 240690a_100000209983_200009909015 [0,1,1,0,0,0|2,0,0]=4 8436 B17R0.12412 CCCCCNC(=O)CCCCCCCCCF 527a_100000209983_200009909015 [0,1,1,0,0,0|2,0,0]=4 8437 B17R0.12412 CCCCCNC(=O)CCCCCCCCCO 240690a_100000209983_100000032657 [0,1,1,0,0,0|2,0,0]=4 8438 B17R0.12412 CCCCCNC(=O)NCCCCCCCCO 2708a_100000209983_102515433106 [0,1,1,0,0,0|2,0,0]=4 8439 B17R0.12412 CCCCCNC(=O)NCCCCCCCCO 2708a_102515433106_100000209983 [0,1,1,0,0,0|2,0,0]=4 8440 B17R0.12412 CCCCCNC(=O)NCCCCCCCCO 273464a_100000209983_102515433106 [0,1,1,0,0,0|2,0,0]=4 8441 B17R0.12412 CCCCCNC(=O)NCCCCCCCCO 273464a_102515433106_100000209983 [0,1,1,0,0,0|2,0,0]=4 8442 B17R0.12412 CCCCCNC(=O)NCCCCCCCCO 512a_100000209983_102515433106 [0,1,1,0,0,0|2,0,0]=4 8443 B17R0.12412 CCCCCNC(=O)NCCCCCCCCO 512a_102515433106_100000209983 [0,1,1,0,0,0|2,0,0]=4 8444 B17R0.12412 CCCCCNCCOCC(=O)OCCOCC 34a_100000224656_200000101388 [0,1,1,0,0,0|2,0,0]=4 8445 B17R0.12412 CCCCCOCCOCC(=O)OCCOCC 34a_100011215259_200000101388 [0,1,1,0,0,0|2,0,0]=4 8446 B17R0.12412 CCCCCOCCOCC(=O)OCCOCC 7a_100011215259_200000101388 [0,1,1,0,0,0|2,0,0]=4 8447 B17R0.12412 CCCCNNC(=O)CCCCCCCCCF 22a_100025702795_200009909015 [0,1,1,0,0,0|2,0,0]=4 8448 B17R0.12412 CCCCNNC(=O)CCCCCCCCCO 22a_100025702795_100000032657 [0,1,1,0,0,0|2,0,0]=4 8449 B17R0.12412 CCCCOCC(=O)CCCCCCCCCF 1458a_200009909015_100011995733 [0,1,1,0,0,0|1,0,0]=3 8450 B17R0.12412 CCCCOCC(=O)CCCCCCCCCO 1458a_100000757543_100009813782 [0,1,1,0,0,0|1,0,0]=3 8451 B17R0.12412 CCCCOCC(=O)NCCCCCCCCO 240690a_102515433106_100000757543 [0,1,1,0,0,0|2,0,0]=4 8452 B17R0.12412 CCCCOCCCNCC(=O)OCCOCC 2230a_200000211371_200000101388 [0,1,1,0,0,0|2,0,0]=4 8453 B17R0.12412 CCCCOCCCNCC(=O)OCCOCC 34a_200000211371_200000101388 [0,1,1,0,0,0|2,0,0]=4 8454 B17R0.12412 CCCCOCCCOCC(=O)OCCOCC 34a_200011215613_200000101388 [0,1,1,0,0,0|2,0,0]=4 8455 B17R0.12412 CCCCOCCCOCC(=O)OCCOCC 7a_200011215613_200000101388 [0,1,1,0,0,0|2,0,0]=4 8456 B17R0.12412 CCCCSCC(=O)CCCCCCCCCO 1458a_100000191162_100009813782 [0,1,1,0,0,0|1,1,0]=4 8457 B17R0.12412 CCCCSCC(=O)NCCCCCCCCO 240690a_102515433106_100000191162 [0,1,1,0,0,0|2,0,0]=4 8458 B17R0.12412 CCCOCCC(=O)CCCCCCCCCF 1458a_200009909015_100011215938 [0,1,1,0,0,0|2,0,0]=4 8459 B17R0.12412 CCOCCCC(=O)CCCCCCCCCF 1458a_200009909015_100012232248 [0,1,1,0,0,0|2,0,0]=4 8460 B17R0.12412 CCOCCNC(=O)CCCCCCCCCF 11a_100011200944_200009909015 [0,1,1,0,0,0|2,0,0]=4 8461 B17R0.12412 CCOCCNC(=O)CCCCCCCCCF 240690a_100011200944_200009909015 [0,1,1,0,0,0|2,0,0]=4 8462 B17R0.12412 CCOCCNC(=O)CCCCCCCCCF 527a_100011200944_200009909015 [0,1,1,0,0,0|2,0,0]=4 8463 B17R0.12412 CCOCCNC(=O)CCCCCCCCCO 240690a_100011200944_100000032657 [0,1,1,0,0,0|2,0,0]=4 8464 B17R0.12412 CCOCCOC(=O)CNCCCCCCCO 2230a_100011996573_200000101388 [0,1,1,0,0,0|2,0,0]=4 8465 B17R0.12412 CCOCCOC(=O)CNCCCCCCCO 34a_100011996573_200000101388 [0,1,1,0,0,0|2,0,0]=4 8466 B17R0.12412 CCOCCOC(=O)COCCCCCCCBr 34a_100000760002_200000101388 [0,1,1,0,0,0|2,0,0]=4 8467 B17R0.12412 CCOCCOC(=O)COCCCCCCCBr 7a_100000760002_200000101388 [0,1,1,0,0,0|2,0,0]=4 8468 B17R0.12412 CCOCCOC(=O)COCCCCCCCN 34a_100011996573_200000101388 [0,1,1,0,0,0|2,0,0]=4 8469 B17R0.12412 CCOCCOC(=O)COCCCCCCOC 34a_200012092642_200000101388 [0,1,1,0,0,0|2,0,0]=4 8470 B17R0.12412 CCOCCOC(=O)COCCCCCCOC 7a_200012092642_200000101388 [0,1,1,0,0,0|2,0,0]=4 8471 B17R0.12412 CCOCCOC(=O)CSCCCCCCCO 62a_100000760002_200000101388 [0,1,1,0,0,0|2,0,0]=4 8472 B17R0.12412 CCOCCOC(=O)CSCCCCCCCO 62a_200000101388_100000760002 [0,1,1,0,0,0|2,0,0]=4 8473 B17R0.12412 CCOCCOC(=O)CSCCCCCCOC 62a_100011998445_200000101388 [0,1,1,0,0,0|2,0,0]=4 8474 B17R0.12412 CCOCCOC(=O)CSCCCCCCOC 62a_200000101388_100011998445 [0,1,1,0,0,0|2,0,0]=4 8475 B17R0.12412 CCSCCNC(=O)CCCCCCCCCF 11a_100000106463_200009909015 [0,1,1,0,0,0|2,0,0]=4 8476 B17R0.12412 CCSCCNC(=O)CCCCCCCCCF 240690a_100000106463_200009909015 [0,1,1,0,0,0|2,0,0]=4 8477 B17R0.12412 CCSCCNC(=O)CCCCCCCCCF 527a_100000106463_200009909015 [0,1,1,0,0,0|2,0,0]=4 8478 B17R0.12412 CCSCCNC(=O)CCCCCCCCCO 240690a_100000106463_100000032657 [0,1,1,0,0,0|2,0,0]=4 8479 B17R0.12412 COCCCCC(=O)CCCCCCCCCF 1458a_200009909015_100000755781 [0,1,1,0,0,0|2,0,0]=4 8480 B17R0.12412 COCCCNC(=O)CCCCCCCCCF 240690a_100150723488_200009909015 [0,1,1,0,0,0|2,0,0]=4 8481 B17R0.12412 COCCCNC(=O)CCCCCCCCCF 527a_100150723488_200009909015 [0,1,1,0,0,0|2,0,0]=4 8482 B17R0.12412 COCCCNC(=O)CCCCCCCCCO 240690a_100150723488_100000032657 [0,1,1,0,0,0|2,0,0]=4 8483 B17R0.12412 COCCOCC(=O)CCCCCCCCCO 1458a_100000211095_100009813782 [0,1,1,0,0,0|2,0,0]=4 8484 B17R0.12412 CSCCCNC(=O)CCCCCCCCCF 11a_100000749238_200009909015 [0,1,1,0,0,0|2,0,0]=4 8485 B17R0.12412 CSCCCNC(=O)CCCCCCCCCF 240690a_100000749238_200009909015 [0,1,1,0,0,0|2,0,0]=4 8486 B17R0.12412 CSCCCNC(=O)CCCCCCCCCF 527a_100000749238_200009909015 [0,1,1,0,0,0|2,0,0]=4 8487 B17R0.12412 CSCCCNC(=O)CCCCCCCCCO 240690a_100000749238_100000032657 [0,1,1,0,0,0|2,0,0]=4 8488 B17R0.12412 O=C(CCCCCCCCCF)NCCCCO 240690a_100000750430_200009909015 [0,1,1,0,0,0|2,0,0]=4 8489 B17R0.12412 O=C(CCCCCCCCCF)NCCCCO 527a_100000750430_200009909015 [0,1,1,0,0,0|2,0,0]=4 8490 B17R0.12412 O=C(CCCCCCCCCO)NCCCCO 240690a_100000750430_100000032657 [0,1,1,0,0,0|2,0,0]=4 8491 B17R0.12412 O=C(CCCCCF)CCCCCCCCCF 1458a_200009909015_100000729378 [0,1,1,0,0,0|2,0,0]=4 8492 B17R0.12412 O=C(CCCCCO)CCCCCCCCCF 1458a_200009909015_100000746330 [0,1,1,0,0,0|2,0,0]=4 8493 B17R0.12412 O=C(CCCCCO)CCCCCCCCCO 1458a_100102619762_100009813782 [0,1,1,0,0,0|2,0,0]=4 8494 B17R0.12412 O=C(CCCCCO)NCCCCCCCCO 240690a_102515433106_100102619762 [0,1,1,0,0,0|2,0,0]=4 8495 B17R0.12415 CCC(C)CCC(=O)CCCCCCCCCO 1458a_100000701222_100009813782 [0,1,1,0,0,0|2,0,0]=4 8496 B17R0.12415 CCC(C)CCC(=O)NCCCCCCCCO 240690a_102515433106_100000701222 [0,1,1,0,0,0|2,0,0]=4 8497 B17R0.12415 CCC(C)CNC(=O)CCCCCCCCCF 11a_100020588543_200009909015 [0,1,1,0,0,0|2,0,0]=4 8498 B17R0.12415 CCC(C)CNC(=O)CCCCCCCCCF 240690a_100020588543_200009909015 [0,1,1,0,0,0|2,0,0]=4 8499 B17R0.12415 CCC(C)CNC(=O)CCCCCCCCCF 527a_100020588543_200009909015 [0,1,1,0,0,0|2,0,0]=4 8500 B17R0.12415 CCC(C)CNC(=O)CCCCCCCCCO 240690a_100020588543_100000032657 [0,1,1,0,0,0|2,0,0]=4 8501 B17R0.12415 CCC(O)CCC(=O)NCCCCCCCCO 240690a_102515433106_203496584001 [0,1,1,0,0,0|2,0,0]=4 8502 B17R0.12415 CCC(O)CNC(=O)CCCCCCCCCF 11a_100011218483_200009909015 [0,1,1,0,0,0|2,0,0]=4 8503 B17R0.12415 CCC(O)CNC(=O)CCCCCCCCCF 240690a_100011218483_200009909015 [0,1,1,0,0,0|2,0,0]=4 8504 B17R0.12415 CCC(O)CNC(=O)CCCCCCCCCF 527a_100011218483_200009909015 [0,1,1,0,0,0|2,0,0]=4 8505 B17R0.12415 CCC(O)CNC(=O)CCCCCCCCCO 240690a_100011218483_100000032657 [0,1,1,0,0,0|2,0,0]=4 8506 B17R0.12415 CCCCCCCCCCC(=O)CCC(C)CC 1458a_100000701222_100000210319 [0,1,1,0,0,0|1,0,0]=3 8507 B17R0.12415 CCCCCCCCCCC(=O)CCN(C)CC 1458a_100000755305_100000210319 [0,1,1,0,0,0|2,0,0]=4 8508 B17R0.12415 CCCCCCCCCCC(=O)CCS(=O)CC 1458a_100011387550_100000210319 [0,1,1,0,0,0|2,0,0]=4 8509 B17R0.12415 CCCCCCCCCCC(=O)NCC(C)CC 11a_100020588543_100000210375 [0,1,1,0,0,0|1,0,0]=3 8510 B17R0.12415 CCCCCCCCCCC(=O)NCC(C)CC 1626a_100020588543_100000210375 [0,1,1,0,0,0|1,0,0]=3 8511 B17R0.12415 CCCCCCCCCCC(=O)NCC(C)CC 240690a_100020588543_100000210375 [0,1,1,0,0,0|1,0,0]=3 8512 B17R0.12415 CCCCCCCCCCC(=O)NCC(C)CO 240690a_100000744482_100000210375 [0,1,1,0,0,0|2,0,0]=4 8513 B17R0.12415 CCCCCCCCCCC(=O)NCC(O)CC 11a_100011218483_100000210375 [0,1,1,0,0,0|1,0,0]=3 8514 B17R0.12415 CCCCCCCCCCC(=O)NCC(O)CC 240690a_100011218483_100000210375 [0,1,1,0,0,0|1,0,0]=3 8515 B17R0.12415 CCCCCCCCCCC(=O)NC[C@@H](C)OC 11a_100020591295_100000210375 [0,1,1,0,0,0|2,0,0]=4 8516 B17R0.12415 CCCCCCCCCCC(=O)NC[C@@H](C)OC 1626a_100020591295_100000210375 [0,1,1,0,0,0|2,0,0]=4 8517 B17R0.12415 CCCCCCCCCCC(=O)NC[C@@H](C)OC 240690a_100020591295_100000210375 [0,1,1,0,0,0|2,0,0]=4 8518 B17R0.12415 CCCCCCCCCCC(=O)NC[C@@H](F)CO 240690a_100015665980_100000210375 [0,1,1,0,0,0|2,0,0]=4 8519 B17R0.12415 CCCCCCCCCCC(=O)NC[C@H](O)CO 240690a_100020644852_100000210375 [0,1,1,0,0,0|2,0,0]=4 8520 B17R0.12415 CCCCCCCCCCC(=O)NNC(C)CC 22a_100000718999_100000210375 [0,1,1,0,0,0|2,0,0]=4 8521 B17R0.12415 CCCCCCCCCCC(C)OCC(C)CC 34a_100011215000_100000748023 [0,1,1,0,0,0|1,0,1]=4 8522 B17R0.12415 CCCCCCCCCCC(C)OCC(C)CC 7a_100011215000_100000748023 [0,1,1,0,0,0|1,0,1]=4 8523 B17R0.12415 CCCCCCCCCCC(C)OCC(O)CC 34a_100011215000_100011218378 [0,1,1,0,0,0|1,0,1]=4 8524 B17R0.12415 CCCCCCCCCCC(C)OCC(O)CC 7a_100011215000_100011218378 [0,1,1,0,0,0|1,0,1]=4 8525 B17R0.12415 CCCCCCCCCCC(C)OC[C@@H](C)CC 34a_100011215000_100009816398 [0,1,1,0,0,0|1,0,1]=4 8526 B17R0.12415 CCCCCCCCCCC(C)OC[C@@H](C)CC 7a_100011215000_100009816398 [0,1,1,0,0,0|1,0,1]=4 8527 B17R0.12415 CCCCCCCCCNC(=O)CCC(C)CC 11a_100000212291_100000701222 [0,1,1,0,0,0|1,0,0]=3 8528 B17R0.12415 CCCCCCCCCNC(=O)CCC(C)CC 1626a_100000212291_100000701222 [0,1,1,0,0,0|1,0,0]=3 8529 B17R0.12415 CCCCCCCCCNC(=O)CCC(C)CC 240690a_100000212291_100000701222 [0,1,1,0,0,0|1,0,0]=3 8530 B17R0.12415 CCCCCCCCCNC(=O)CCC(C)CC 527a_100000212291_100000701222 [0,1,1,0,0,0|1,0,0]=3 8531 B17R0.12415 CCCCCCCCCNC(=O)CCC(O)CC 1626a_100000212291_203496584001 [0,1,1,0,0,0|1,0,0]=3 8532 B17R0.12415 CCCCCCCCCNC(=O)CCC(O)CC 240690a_100000212291_203496584001 [0,1,1,0,0,0|1,0,0]=3 8533 B17R0.12415 CCCCCCCCCNC(=O)CCN(C)CC 240690a_100000212291_100000755305 [0,1,1,0,0,0|2,0,0]=4 8534 B17R0.12415 CCCCCCCCCNC(=O)CCS(=O)CC 11a_100000212291_100011387550 [0,1,1,0,0,0|2,0,0]=4 8535 B17R0.12415 CCCCCCCCCNC(=O)CCS(=O)CC 1626a_100000212291_100011387550 [0,1,1,0,0,0|2,0,0]=4 8536 B17R0.12415 CCCCCCCCCNC(=O)CCS(=O)CC 240690a_100000212291_100011387550 [0,1,1,0,0,0|2,0,0]=4 8537 B17R0.12415 CCCCCCCCCNC(=O)CCS(=O)CC 527a_100000212291_100011387550 [0,1,1,0,0,0|2,0,0]=4 8538 B17R0.12415 CCCCCCCCCNC(=O)NCC(C)CC 2708a_100000212291_100020588543 [0,1,1,0,0,0|2,0,0]=4 8539 B17R0.12415 CCCCCCCCCNC(=O)NCC(C)CC 2708a_100020588543_100000212291 [0,1,1,0,0,0|2,0,0]=4 8540 B17R0.12415 CCCCCCCCCNC(=O)NCC(C)CC 273464a_100000212291_100020588543 [0,1,1,0,0,0|2,0,0]=4 8541 B17R0.12415 CCCCCCCCCNC(=O)NCC(C)CC 273464a_100020588543_100000212291 [0,1,1,0,0,0|2,0,0]=4 8542 B17R0.12415 CCCCCCCCCNC(=O)NCC(C)CC 512a_100000212291_100020588543 [0,1,1,0,0,0|2,0,0]=4 8543 B17R0.12415 CCCCCCCCCNC(=O)NCC(C)CC 512a_100020588543_100000212291 [0,1,1,0,0,0|2,0,0]=4 8544 B17R0.12415 CCCCCCCCCNC(=O)NCC(O)CC 2708a_100000212291_100011218483 [0,1,1,0,0,0|2,0,0]=4 8545 B17R0.12415 CCCCCCCCCNC(=O)NCC(O)CC 273464a_100000212291_100011218483 [0,1,1,0,0,0|2,0,0]=4 8546 B17R0.12415 CCCCCCCCCNC(=O)NCC(O)CC 273464a_100011218483_100000212291 [0,1,1,0,0,0|2,0,0]=4 8547 B17R0.12415 CCCCCCCCCNC(=O)NCC(O)CC 512a_100011218483_100000212291 [0,1,1,0,0,0|2,0,0]=4 8548 B17R0.12415 CCCCCCCCCOC(C)CCC(C)CC 7a_200011216552_100000210328 [0,1,1,0,0,0|1,0,1]=4 8549 B17R0.12415 CCCCCCCCOCC(=O)NCC(C)CC 11a_100020588543_100000759886 [0,1,1,0,0,0|2,0,0]=4 8550 B17R0.12415 CCCCCCCCOCC(=O)NCC(C)CC 1626a_100020588543_100000759886 [0,1,1,0,0,0|2,0,0]=4 8551 B17R0.12415 CCCCCCCCOCC(=O)NCC(C)CC 240690a_100020588543_100000759886 [0,1,1,0,0,0|2,0,0]=4 8552 B17R0.12415 CCCCCCCCOCC(=O)NCC(C)CC 527a_100020588543_100000759886 [0,1,1,0,0,0|2,0,0]=4 8553 B17R0.12415 CCCCCCCCOCC(=O)NCC(O)CC 11a_100011218483_100000759886 [0,1,1,0,0,0|2,0,0]=4 8554 B17R0.12415 CCCCCCCCOCC(=O)NCC(O)CC 240690a_100011218483_100000759886 [0,1,1,0,0,0|2,0,0]=4 8555 B17R0.12415 CCCCCCCCOCC(=O)NCC(O)CC 527a_100011218483_100000759886 [0,1,1,0,0,0|2,0,0]=4 8556 B17R0.12416 CCC/C=C(\C)/C(=O)CCCCCCCCCC 1458a_200020648666_100000210319 [0,1,1,0,0,0|1,0,1]=4 8557 B17R0.12416 CCCCC(C)C(=O)CCCCCCCCCF 1458a_200009909015_200011215066 [0,1,1,0,0,0|2,0,0]=4 8558 B17R0.12416 CCCCC(C)C(=O)CCCCCCCCCO 1458a_100000725509_100009813782 [0,1,1,0,0,0|2,0,0]=4 8559 B17R0.12416 CCCCC(C)C(=O)NCCCCCCCCO 240690a_102515433106_100000725509 [0,1,1,0,0,0|2,0,0]=4 8560 B17R0.12416 CCCCC(O)C(=O)CCCCCCCCCO 1458a_100000720857_100009813782 [0,1,1,0,0,0|2,0,0]=4 8561 B17R0.12416 CCCCC(O)C(=O)NCCCCCCCCO 240690a_102515433106_100000720857 [0,1,1,0,0,0|2,0,0]=4 8562 B17R0.12416 CCCCCCCCC=CC(=O)C(C)CCCC 1458a_100015345288_200011215066 [0,1,1,0,0,0|1,0,1]=4 8563 B17R0.12416 CCCCCCCCCCC(=O)C(=O)NCCC 1458a_200011297150_100000210319 [0,1,1,0,0,0|2,0,0]=4 8564 B17R0.12416 CCCCCCCCCCC(=O)C(C)CCCC 1458a_100000210375_200011215066 [0,1,1,0,0,0|1,0,0]=3 8565 B17R0.12416 CCCCCCCCCCC(=O)C(C)CCCC 1458a_100000725509_100000210319 [0,1,1,0,0,0|1,0,0]=3 8566 B17R0.12416 CCCCCCCCCCC(=O)C(O)CCCC 1458a_100000720857_100000210319 [0,1,1,0,0,0|1,0,0]=3 8567 B17R0.12416 CCCCCCCCCCC(=O)C(O)CCSC 1458a_100000685904_100000210319 [0,1,1,0,0,0|2,0,0]=4 8568 B17R0.12416 CCCCCCCCCCC(=O)N(C)CCCC 11a_100000207549_100000210375 [0,1,1,0,0,0|1,0,0]=3 8569 B17R0.12416 CCCCCCCCCCC(=O)N(C)CCCC 1626a_100000207549_100000210375 [0,1,1,0,0,0|1,0,0]=3 8570 B17R0.12416 CCCCCCCCCCC(=O)N(C)CCCC 240690a_100000207549_100000210375 [0,1,1,0,0,0|1,0,0]=3 8571 B17R0.12416 CCCCCCCCCCC(=O)N(C)CCCO 240690a_100000213112_100000210375 [0,1,1,0,0,0|2,0,0]=4 8572 B17R0.12416 CCCCCCCCCCC(=O)N(C)CCOC 11a_100000743101_100000210375 [0,1,1,0,0,0|2,0,0]=4 8573 B17R0.12416 CCCCCCCCCCC(=O)N(C)CCOC 1626a_100000743101_100000210375 [0,1,1,0,0,0|2,0,0]=4 8574 B17R0.12416 CCCCCCCCCCC(=O)N(C)CCOC 240690a_100000743101_100000210375 [0,1,1,0,0,0|2,0,0]=4 8575 B17R0.12416 CCCCCCCCCCC(=O)N(C)CCSC 11a_100000686725_100000210375 [0,1,1,0,0,0|2,0,0]=4 8576 B17R0.12416 CCCCCCCCCCC(=O)N(C)CCSC 1626a_100000686725_100000210375 [0,1,1,0,0,0|2,0,0]=4 8577 B17R0.12416 CCCCCCCCCCC(=O)N(C)CCSC 240690a_100000686725_100000210375 [0,1,1,0,0,0|2,0,0]=4 8578 B17R0.12416 CCCCCCCCCNC(=O)C(C)CCCC 11a_100000212291_100000725509 [0,1,1,0,0,0|1,0,0]=3 8579 B17R0.12416 CCCCCCCCCNC(=O)C(C)CCCC 1626a_100000212291_100000725509 [0,1,1,0,0,0|1,0,0]=3 8580 B17R0.12416 CCCCCCCCCNC(=O)C(C)CCCC 240690a_100000212291_100000725509 [0,1,1,0,0,0|1,0,0]=3 8581 B17R0.12416 CCCCCCCCCNC(=O)C(C)CCCC 527a_100000212291_100000725509 [0,1,1,0,0,0|1,0,0]=3 8582 B17R0.12416 CCCCCCCCCNC(=O)C(O)CCCC 240690a_100000212291_100000720857 [0,1,1,0,0,0|1,0,0]=3 8583 B17R0.12416 CCCCCCCCCNC(=O)C(O)CCCC 527a_100000212291_100000720857 [0,1,1,0,0,0|1,0,0]=3 8584 B17R0.12416 CCCCCCCCCNC(=O)C(O)CCSC 240690a_100000212291_100000685904 [0,1,1,0,0,0|2,0,0]=4 8585 B17R0.12416 CCCCCCCCCNC(=O)N(C)CCCC 2708a_100000212291_100000207549 [0,1,1,0,0,0|2,0,0]=4 8586 B17R0.12416 CCCCCCCCCNC(=O)N(C)CCCC 273464a_100000212291_100000207549 [0,1,1,0,0,0|2,0,0]=4 8587 B17R0.12416 CCCCCCCCNCC(=O)N(C)CCCC 2230a_100000229939_100000230175 [0,1,1,0,0,0|2,0,0]=4 8588 B17R0.12416 CCCCCCCCNCC(=O)N(C)CCCC 34a_100000229939_100000230175 [0,1,1,0,0,0|2,0,0]=4 8589 B17R0.12416 CCCCCCCCOCC(=O)C(C)CCCC 1458a_100000759886_200011215066 [0,1,1,0,0,0|2,0,0]=4 8590 B17R0.12416 CCCCCCCCOCC(=O)N(C)CCCC 11a_100000207549_100000759886 [0,1,1,0,0,0|2,0,0]=4 8591 B17R0.12416 CCCCCCCCOCC(=O)N(C)CCCC 1626a_100000207549_100000759886 [0,1,1,0,0,0|2,0,0]=4 8592 B17R0.12416 CCCCCCCCOCC(=O)N(C)CCCC 240690a_100000207549_100000759886 [0,1,1,0,0,0|2,0,0]=4 8593 B17R0.12416 CCCCCCCCOCC(=O)N(C)CCCC 34a_100000210232_100000230175 [0,1,1,0,0,0|2,0,0]=4 8594 B17R0.12416 CCCCCCCCOCC(=O)N(C)CCCC 527a_100000207549_100000759886 [0,1,1,0,0,0|2,0,0]=4 8595 B17R0.12416 CCCCCCCCOCC(=O)N(C)CCCC 7a_100000210232_100000230175 [0,1,1,0,0,0|2,0,0]=4 8596 B17R0.12416 CCCCCCCCSCC(=O)N(C)CCCC 62a_100000210759_100000230175 [0,1,1,0,0,0|2,0,0]=4 8597 B17R0.12416 CCCCCCCCSCC(=O)N(C)CCCC 62a_100000230175_100000210317 [0,1,1,0,0,0|2,0,0]=4 8598 B17R0.12416 CCCCN(C)C(=O)CCCCCCCCCF 11a_100000207549_200009909015 [0,1,1,0,0,0|2,0,0]=4 8599 B17R0.12416 CCCCN(C)C(=O)CCCCCCCCCF 240690a_100000207549_200009909015 [0,1,1,0,0,0|2,0,0]=4 8600 B17R0.12416 CCCCN(C)C(=O)CCCCCCCCCF 527a_100000207549_200009909015 [0,1,1,0,0,0|2,0,0]=4 8601 B17R0.12416 CCCCN(C)C(=O)CCCCCCCCCO 240690a_100000207549_100000032657 [0,1,1,0,0,0|2,0,0]=4 8602 B17R0.13605 C#CC(CCCCC)OCCCCCCCCC 34a_100011216489_100011214924 [0,1,1,0,0,0|1,0,1]=4 8603 B17R0.13605 C#CC(CCCCC)OCCCCCCCCC 7a_100011216489_100000210328 [0,1,1,0,0,0|1,0,1]=4 8604 B17R0.13605 C=CC(CCCCC)OCCCCCCCCC 34a_100011216863_100011214924 [0,1,1,0,0,0|1,0,1]=4 8605 B17R0.13605 C=CC(CCCCC)OCCCCCCCCC 7a_100011216863_100000210328 [0,1,1,0,0,0|1,0,1]=4 8606 B17R0.13714 CCCCCC(C)OCCCCC(C)CCCC 34a_200011021034_200011218191 [0,1,1,0,0,0|1,0,1]=4 8607 B17R0.13714 CCCCCC(C)OCCCCC(C)CCCC 7a_200011021034_200011218191 [0,1,1,0,0,0|1,0,1]=4 8608 B17R0.14341 CCCCCCCCC(=O)CC(=O)CCCCC 1458a_100000210188_200012276598 [0,1,1,0,0,0|1,0,1]=4 8609 B17R0.14341 CCCCCCCCC(=O)CC(=O)NCCCC 1458a_100000210188_100000182744 [0,1,1,0,0,0|1,0,1]=4 8610 B17R0.14341 CCCCCCCCC(=O)CC(=O)OCCCC 1458a_100000210188_100000211628 [0,1,1,0,0,0|0,0,1]=3 8611 B17R0.14341 CCCCCCCCC(=O)CC(=O)OCCOC 1458a_100000210188_200000040189 [0,1,1,0,0,0|1,0,1]=4 8612 B17R0.14341 CCCCCCCCN(C)CC(=O)CCCCC 2230a_100000207567_200012276598 [0,1,1,0,0,0|2,0,0]=4 8613 B17R0.14341 CCCCCCCCN(C)CC(=O)CCCCC 269982a_100000207567_200012276598 [0,1,1,0,0,0|2,0,0]=4 8614 B17R0.14341 CCCCCCCCN(C)CC(=O)NCCCC 2230a_100000207567_100000182744 [0,1,1,0,0,0|2,0,0]=4 8615 B17R0.14341 CCCCCCCCN(C)CC(=O)NCCCC 2230a_200000213093_100000210759 [0,1,1,0,0,0|2,0,0]=4 8616 B17R0.14341 CCCCCCCCN(C)CC(=O)NCCCC 269982a_100000207567_100000182744 [0,1,1,0,0,0|2,0,0]=4 8617 B17R0.14341 CCCCCCCCN(C)CC(=O)NCCCC 269982a_200000213093_100000210759 [0,1,1,0,0,0|2,0,0]=4 8618 B17R0.14341 CCCCCCCCN(C)CC(=O)OCCCC 2230a_100000207567_100000211628 [0,1,1,0,0,0|1,0,0]=3 8619 B17R0.14341 CCCCCCCCN(C)CC(=O)OCCCC 269982a_100000207567_100000211628 [0,1,1,0,0,0|1,0,0]=3 8620 B17R0.14341 CCCCCCCCN(C)CC(=O)OCCOC 2230a_100000207567_200000040189 [0,1,1,0,0,0|2,0,0]=4 8621 B17R0.14341 CCCCCCCCN(C)CC(=O)OCCOC 269982a_100000207567_200000040189 [0,1,1,0,0,0|2,0,0]=4 8622 B17R0.14341 CCCCOC(=O)CC(=O)CCCCCCCO 1458a_100011219782_100000211628 [0,1,1,0,0,0|1,0,1]=4 8623 B17R0.77 CCCCCCCC(=O)OCNCCC(C)CC 2230a_100020591266_100009852258 [0,1,1,0,0,0|1,0,0]=3 8624 B17R0.77 CCCCCCCC(=O)OCNCCC(C)CO 2230a_106354213184_100009852258 [0,1,1,0,0,0|2,0,0]=4 8625 B17R0.77 CCCCCCCC(=O)OCNCCC(C)CO 34a_106354213184_100009852258 [0,1,1,0,0,0|2,0,0]=4 8626 B17R0.77 CCCCCCCC(=O)OCOCCC(C)CC 7a_100011215188_100009852258 [0,1,1,0,0,0|1,0,0]=3 8627 B17R0.77 CCCCCCCC(=O)OCOCCC(C)OC 7a_100000764861_100009852258 [0,1,1,0,0,0|2,0,0]=4 8628 B17R0.77 CCCCCCNC(=O)COCCCC(C)CC 7a_100011216074_100000230325 [0,1,1,0,0,0|2,0,0]=4 8629 B17R0.78 CC(C)CCCCCCC(=O)CCCCCCF 1458a_100000040743_100015922095 [0,1,1,0,0,0|2,0,0]=4 8630 B17R0.78 CC(C)CCCCCCC(=O)CCCCCCO 1458a_100000040743_100000766143 [0,1,1,0,0,0|2,0,0]=4 8631 B17R0.78 CC(C)CCCCCCC(=O)NCCCCCO 240690a_100000762737_100000040743 [0,1,1,0,0,0|2,0,0]=4 8632 B17R0.78 CC(C)CCCCCNC(=O)CCCCCCO 240690a_100011290863_100011996774 [0,1,1,0,0,0|2,0,0]=4 8633 B17R0.78 CCCCCCCC(=O)CCCCCCC(C)C 1458a_100000040743_100000210614 [0,1,1,0,0,0|1,0,0]=3 8634 B17R0.78 CCCCCCCC(=O)NCCCCCC(C)C 1626a_100011290863_100000211969 [0,1,1,0,0,0|1,0,0]=3 8635 B17R0.78 CCCCCCCC(=O)NCCCCCC(C)C 240690a_100011290863_100000211969 [0,1,1,0,0,0|1,0,0]=3 8636 B17R0.78 CCCCCCCC(=O)NCCCCCC(C)C 527a_100011290863_100000211969 [0,1,1,0,0,0|1,0,0]=3 8637 B17R0.78 CCCCCCCC(=O)NCCCCCN(C)C 240690a_100020635752_100000211969 [0,1,1,0,0,0|2,0,0]=4 8638 B17R0.78 CCCCCCCC(=O)NCCCOCC(C)C 11a_100000205972_100000211969 [0,1,1,0,0,0|2,0,0]=4 8639 B17R0.78 CCCCCCCC(=O)NCCCOCC(C)C 1626a_100000205972_100000211969 [0,1,1,0,0,0|2,0,0]=4 8640 B17R0.78 CCCCCCCC(=O)NCCCOCC(C)C 240690a_100000205972_100000211969 [0,1,1,0,0,0|2,0,0]=4 8641 B17R0.78 CCCCCCCC(=O)NCCCOCC(C)C 527a_100000205972_100000211969 [0,1,1,0,0,0|2,0,0]=4 8642 B17R0.78 CCCCCCCC(=O)OCNCCCC(C)C 2230a_200000737386_100009852258 [0,1,1,0,0,0|1,0,0]=3 8643 B17R0.78 CCCCCCCC(=O)OCNCCCC(C)C 34a_200000737386_100009852258 [0,1,1,0,0,0|1,0,0]=3 8644 B17R0.78 CCCCCCCC(=O)OCNCCCS(=O)C 2230a_200000753449_100009852258 [0,1,1,0,0,0|2,0,0]=4 8645 B17R0.78 CCCCCCCC(=O)OCNCCOC(C)C 2230a_100000701111_100009852258 [0,1,1,0,0,0|2,0,0]=4 8646 B17R0.78 CCCCCCCC(=O)OCNCCOC(C)C 34a_100000701111_100009852258 [0,1,1,0,0,0|2,0,0]=4 8647 B17R0.78 CCCCCCCC(=O)OCNCCSC(C)C 2230a_100000731138_100009852258 [0,1,1,0,0,0|2,0,0]=4 8648 B17R0.78 CCCCCCCC(=O)OCNCCSC(C)C 34a_100000731138_100009852258 [0,1,1,0,0,0|2,0,0]=4 8649 B17R0.78 CCCCCCCC(=O)OCOCCCC(=O)C 34a_100000759063_100009852258 [0,1,1,0,0,0|1,0,1]=4 8650 B17R0.78 CCCCCCCC(=O)OCOCCCC(=O)C 7a_100000759063_100009852258 [0,1,1,0,0,0|1,0,1]=4 8651 B17R0.78 CCCCCCCC(=O)OCOCCCC(C)C 34a_100000210774_100009852258 [0,1,1,0,0,0|1,0,0]=3 8652 B17R0.78 CCCCCCCC(=O)OCOCCCC(C)C 7a_100000210774_100009852258 [0,1,1,0,0,0|1,0,0]=3 8653 B17R0.78 CCCCCCCC(=O)OCOCCNC(C)C 34a_100000224655_100009852258 [0,1,1,0,0,0|2,0,0]=4 8654 B17R0.78 CCCCCCCC(=O)OCOCCOC(C)C 34a_100000211219_100009852258 [0,1,1,0,0,0|2,0,0]=4 8655 B17R0.78 CCCCCCCC(=O)OCOCCOC(C)C 7a_100000211219_100009852258 [0,1,1,0,0,0|2,0,0]=4 8656 B17R0.78 CCCCCCCC(=O)OCOCCSC(C)C 34a_200011212901_100009852258 [0,1,1,0,0,0|2,0,0]=4 8657 B17R0.78 CCCCCCCC(=O)OCOCCSC(C)C 7a_200011212901_100009852258 [0,1,1,0,0,0|2,0,0]=4 8658 B17R0.78 CCCCCCCC(=O)OCSCCCC(=O)C 62a_100011215641_100009852258 [0,1,1,0,0,0|1,0,1]=4 8659 B17R0.78 CCCCCCCC(=O)OCSCCCC(C)C 62a_100011214892_100009852258 [0,1,1,0,0,0|1,0,0]=3 8660 B17R0.78 CCCCCCCC(=O)OCSCCCC(C)O 62a_200000718107_100009852258 [0,1,1,0,0,0|1,0,0]=3 8661 B17R0.78 CCCCCCCC(=O)OCSCCOC(C)C 62a_100000211751_100009852258 [0,1,1,0,0,0|2,0,0]=4 8662 B17R0.78 CCCCCCCC(=O)OCSCCSC(C)C 62a_100000730970_100009852258 [0,1,1,0,0,0|2,0,0]=4 8663 B17R0.78 CCCCCCCC(C)OCCCCCC(C)C 34a_100011995859_200011218727 [0,1,1,0,0,0|1,0,1]=4 8664 B17R0.78 CCCCCCCC(C)OCCCCCC(C)C 34a_200011215852_100000210682 [0,1,1,0,0,0|1,0,1]=4 8665 B17R0.78 CCCCCCCC(C)OCCCCCC(C)C 7a_100011995859_200011218727 [0,1,1,0,0,0|1,0,1]=4 8666 B17R0.78 CCCCCCCC(C)OCCCCCC(C)C 7a_200011215852_100000210682 [0,1,1,0,0,0|1,0,1]=4 8667 B17R0.78 CCCCCCNC(=O)CCCCCCC(C)C 11a_100000210581_100000040743 [0,1,1,0,0,0|1,0,0]=3 8668 B17R0.78 CCCCCCNC(=O)CCCCCCC(C)C 1626a_100000210581_100000040743 [0,1,1,0,0,0|1,0,0]=3 8669 B17R0.78 CCCCCCNC(=O)CCCCCCC(C)C 240690a_100000210581_100000040743 [0,1,1,0,0,0|1,0,0]=3 8670 B17R0.78 CCCCCCNC(=O)CCCCCCC(C)C 527a_100000210581_100000040743 [0,1,1,0,0,0|1,0,0]=3 8671 B17R0.78 CCCCCCNC(=O)COCCCCC(C)C 34a_100011214890_100000230325 [0,1,1,0,0,0|2,0,0]=4 8672 B17R0.78 CCCCCCNC(=O)COCCCCC(C)C 7a_100011214890_100000230325 [0,1,1,0,0,0|2,0,0]=4 8673 B17R0.78 CCCCCCNC(=O)CSCCCCC(C)C 62a_100000230325_100011216152 [0,1,1,0,0,0|2,0,0]=4 8674 B17R0.78 CCCCCCNC(=O)NCCCCCC(C)C 2708a_100000210581_100011290863 [0,1,1,0,0,0|2,0,0]=4 8675 B17R0.78 CCCCCCNC(=O)NCCCCCC(C)C 2708a_100011290863_100000210581 [0,1,1,0,0,0|2,0,0]=4 8676 B17R0.78 CCCCCCNC(=O)NCCCCCC(C)C 273464a_100000210581_100011290863 [0,1,1,0,0,0|2,0,0]=4 8677 B17R0.78 CCCCCCNC(=O)NCCCCCC(C)C 273464a_100011290863_100000210581 [0,1,1,0,0,0|2,0,0]=4 8678 B17R0.78 CCCCCCNC(=O)NCCCCCC(C)C 512a_100000210581_100011290863 [0,1,1,0,0,0|2,0,0]=4 8679 B17R0.78 CCCCCCNC(=O)NCCCCCC(C)C 512a_100011290863_100000210581 [0,1,1,0,0,0|2,0,0]=4 8680 B17R0.78 CCCCCNNC(=O)CCCCCCC(C)C 22a_100000694160_100000040743 [0,1,1,0,0,0|2,0,0]=4 8681 B17R0.78 CCCCOCCC(=O)CCCCCCC(C)C 1458a_100000040743_100000743108 [0,1,1,0,0,0|2,0,0]=4 8682 B17R0.78 CCCOCCNC(=O)CCCCCCC(C)C 1626a_100161115042_100000040743 [0,1,1,0,0,0|2,0,0]=4 8683 B17R0.78 CCCOCCNC(=O)CCCCCCC(C)C 240690a_100161115042_100000040743 [0,1,1,0,0,0|2,0,0]=4 8684 B17R0.78 CCCOCCNC(=O)CCCCCCC(C)C 527a_100161115042_100000040743 [0,1,1,0,0,0|2,0,0]=4 8685 B17R0.78 CCCSCCNC(=O)CCCCCCC(C)C 11a_100020603323_100000040743 [0,1,1,0,0,0|2,0,0]=4 8686 B17R0.78 CCCSCCNC(=O)CCCCCCC(C)C 240690a_100020603323_100000040743 [0,1,1,0,0,0|2,0,0]=4 8687 B17R0.78 CCCSCCNC(=O)CCCCCCC(C)C 527a_100020603323_100000040743 [0,1,1,0,0,0|2,0,0]=4 8688 B17R0.78 CCOCCCNC(=O)CCCCCCC(C)C 11a_100000210961_100000040743 [0,1,1,0,0,0|2,0,0]=4 8689 B17R0.78 CCOCCCNC(=O)CCCCCCC(C)C 1626a_100000210961_100000040743 [0,1,1,0,0,0|2,0,0]=4 8690 B17R0.78 CCOCCCNC(=O)CCCCCCC(C)C 240690a_100000210961_100000040743 [0,1,1,0,0,0|2,0,0]=4 8691 B17R0.78 CCOCCCNC(=O)CCCCCCC(C)C 527a_100000210961_100000040743 [0,1,1,0,0,0|2,0,0]=4 8692 B17R0.78 COCCCCCC(=O)NCCCCCC(C)C 1626a_100011290863_100011935119 [0,1,1,0,0,0|2,0,0]=4 8693 B17R0.78 COCCCCCC(=O)NCCCCCC(C)C 240690a_100011290863_100011935119 [0,1,1,0,0,0|2,0,0]=4 8694 B17R0.78 COCCCCCC(=O)NCCCCCC(C)C 527a_100011290863_100011935119 [0,1,1,0,0,0|2,0,0]=4 8695 B17R0.101 CC(C)CCCCCC(=O)CCCCCCCO 1458a_100000766313_100000760002 [0,1,1,0,0,0|2,0,0]=4 8696 B17R0.101 CC(C)CCCCCC(=O)CCCCCCCO 1458a_100011219782_100000210682 [0,1,1,0,0,0|2,0,0]=4 8697 B17R0.101 CC(C)CCCCCC(=O)NCCCCCCO 240690a_100000686447_100000766313 [0,1,1,0,0,0|2,0,0]=4 8698 B17R0.101 CC(C)CCCCCC(=O)NCCCCCCO 527a_100000686447_100000766313 [0,1,1,0,0,0|2,0,0]=4 8699 B17R0.101 CCCCCCC=CC(=O)CCCCCC(C)C 1458a_200015324643_100000210682 [0,1,1,0,0,0|1,0,1]=4 8700 B17R0.101 CCCCCCCCC(=O)CCCCCC(C)C 1458a_100000210188_100000210682 [0,1,1,0,0,0|1,0,0]=3 8701 B17R0.101 CCCCCCCCC(=O)CCCCCC(C)C 1458a_100000766313_100000210759 [0,1,1,0,0,0|1,0,0]=3 8702 B17R0.101 CCCCCCCCC(=O)NCCCCN(C)C 240690a_100025707445_100000210188 [0,1,1,0,0,0|2,0,0]=4 8703 B17R0.101 CCCCCCCCC(=O)NCCCOC(C)C 11a_100000737246_100000210188 [0,1,1,0,0,0|2,0,0]=4 8704 B17R0.101 CCCCCCCCC(=O)NCCCOC(C)C 1626a_100000737246_100000210188 [0,1,1,0,0,0|2,0,0]=4 8705 B17R0.101 CCCCCCCCC(=O)NCCCOC(C)C 240690a_100000737246_100000210188 [0,1,1,0,0,0|2,0,0]=4 8706 B17R0.101 CCCCCCCCC(=O)NCCCOC(C)C 527a_100000737246_100000210188 [0,1,1,0,0,0|2,0,0]=4 8707 B17R0.101 CCCCCCCCC(C)OCCCCC(C)C 34a_100000210740_100011216152 [0,1,1,0,0,0|1,0,1]=4 8708 B17R0.101 CCCCCCCCC(C)OCCCCC(C)C 7a_100000210740_100011216152 [0,1,1,0,0,0|1,0,1]=4 8709 B17R0.101 CCCCCCCNC(=O)CCCCCC(C)C 11a_100000229938_100000766313 [0,1,1,0,0,0|1,0,0]=3 8710 B17R0.101 CCCCCCCNC(=O)CCCCCC(C)C 1626a_100000229938_100000766313 [0,1,1,0,0,0|1,0,0]=3 8711 B17R0.101 CCCCCCCNC(=O)CCCCCC(C)C 240690a_100000229938_100000766313 [0,1,1,0,0,0|1,0,0]=3 8712 B17R0.101 CCCCCCCNC(=O)CCCCCC(C)C 527a_100000229938_100000766313 [0,1,1,0,0,0|1,0,0]=3 8713 B17R0.101 CCCCSCCNC(=O)CCCCCC(C)C 11a_100025743550_100000766313 [0,1,1,0,0,0|2,0,0]=4 8714 B17R0.101 CCCCSCCNC(=O)CCCCCC(C)C 1626a_100025743550_100000766313 [0,1,1,0,0,0|2,0,0]=4 8715 B17R0.101 CCCCSCCNC(=O)CCCCCC(C)C 240690a_100025743550_100000766313 [0,1,1,0,0,0|2,0,0]=4 8716 B17R0.101 CCCCSCCNC(=O)CCCCCC(C)C 527a_100025743550_100000766313 [0,1,1,0,0,0|2,0,0]=4 8717 B17R0.101 CCCOCCCNC(=O)CCCCCC(C)C 1626a_100011217757_100000766313 [0,1,1,0,0,0|2,0,0]=4 8718 B17R0.101 CCCOCCCNC(=O)CCCCCC(C)C 240690a_100011217757_100000766313 [0,1,1,0,0,0|2,0,0]=4 8719 B17R0.101 CCCOCCCNC(=O)CCCCCC(C)C 527a_100011217757_100000766313 [0,1,1,0,0,0|2,0,0]=4 8720 B17R0.101 COCCCCCCC(=O)CCCCCC(C)C 1458a_100000766313_100011998445 [0,1,1,0,0,0|2,0,0]=4 8721 B17R0.101 COCCCCCNC(=O)CCCCCC(C)C 11a_100000747528_100000766313 [0,1,1,0,0,0|2,0,0]=4 8722 B17R0.101 COCCCCCNC(=O)CCCCCC(C)C 1626a_100000747528_100000766313 [0,1,1,0,0,0|2,0,0]=4 8723 B17R0.101 COCCCCCNC(=O)CCCCCC(C)C 240690a_100000747528_100000766313 [0,1,1,0,0,0|2,0,0]=4 8724 B17R0.101 COCCCCCNC(=O)CCCCCC(C)C 527a_100000747528_100000766313 [0,1,1,0,0,0|2,0,0]=4 8725 B17R0.104 C#CCCCCCCC(=O)CCCCCCCC 1458a_100000034748_100000210759 [0,1,1,0,0,0|1,0,1]=4 8726 B17R0.104 C#CCCCCCCC(=O)CCCCCCCC 1458a_100000210188_100012276617 [0,1,1,0,0,0|1,0,1]=4 8727 B17R0.104 C#CCCCCCCC(=O)NCCCCCCC 11a_100000229938_100000034748 [0,1,1,0,0,0|1,0,1]=4 8728 B17R0.104 C#CCCCCCCC(=O)NCCCCCCC 1626a_100000229938_100000034748 [0,1,1,0,0,0|1,0,1]=4 8729 B17R0.104 C#CCCCCCCC(=O)NCCCCCCC 240690a_100000229938_100000034748 [0,1,1,0,0,0|1,0,1]=4 8730 B17R0.104 C#CCCCCCCC(=O)NCCCCCCC 527a_100000229938_100000034748 [0,1,1,0,0,0|1,0,1]=4 8731 B17R0.104 C=CCCCCCCC(=O)CCCCCCCC 1458a_100000210188_100011215473 [0,1,1,0,0,0|1,0,1]=4 8732 B17R0.104 C=CCCCCCCC(=O)CCCCCCCC 1458a_100011809334_100000210759 [0,1,1,0,0,0|1,0,1]=4 8733 B17R0.104 C=CCCCCCCC(=O)NCCCCCCC 11a_100000229938_100011809334 [0,1,1,0,0,0|1,0,1]=4 8734 B17R0.104 C=CCCCCCCC(=O)NCCCCCCC 1626a_100000229938_100011809334 [0,1,1,0,0,0|1,0,1]=4 8735 B17R0.104 C=CCCCCCCC(=O)NCCCCCCC 240690a_100000229938_100011809334 [0,1,1,0,0,0|1,0,1]=4 8736 B17R0.104 C=CCCCCCCC(=O)NCCCCCCC 527a_100000229938_100011809334 [0,1,1,0,0,0|1,0,1]=4 8737 B17R0.104 CCCCC/C=C/CC(=O)CCCCCCCC 1458a_100020675968_100000210759 [0,1,1,0,0,0|1,0,1]=4 8738 B17R0.104 CCCCC/C=C/CC(=O)NCCCCCCC 11a_100000229938_100020675968 [0,1,1,0,0,0|1,0,1]=4 8739 B17R0.104 CCCCC/C=C/CC(=O)NCCCCCCC 1626a_100000229938_100020675968 [0,1,1,0,0,0|1,0,1]=4 8740 B17R0.104 CCCCC/C=C/CC(=O)NCCCCCCC 240690a_100000229938_100020675968 [0,1,1,0,0,0|1,0,1]=4 8741 B17R0.104 CCCCCC#CCC(=O)CCCCCCCC 1458a_100000210188_100009816472 [0,1,1,0,0,0|1,0,1]=4 8742 B17R0.104 CCCCCCC=CC(=O)CCCCCCCC 1458a_200015324643_100000210759 [0,1,1,0,0,0|1,0,0]=3 8743 B17R0.104 CCCCCCC=CC(=O)CCCCCCCO 1458a_200015324643_100000760002 [0,1,1,0,0,0|1,0,1]=4 8744 B17R0.104 CCCCCCC=CC(=O)CCCCCCOC 1458a_200015324643_100011998445 [0,1,1,0,0,0|1,0,1]=4 8745 B17R0.104 CCCCCCC=CC(=O)NCCCCCCC 11a_100000229938_200015324643 [0,1,1,0,0,0|1,0,1]=4 8746 B17R0.104 CCCCCCC=CC(=O)NCCCCCCC 1626a_100000229938_200015324643 [0,1,1,0,0,0|1,0,1]=4 8747 B17R0.104 CCCCCCC=CC(=O)NCCCCCCC 240690a_100000229938_200015324643 [0,1,1,0,0,0|1,0,1]=4 8748 B17R0.104 CCCCCCCCC(=O)CCCCCCC#N 1458a_100000210188_100009813337 [0,1,1,0,0,0|1,0,1]=4 8749 B17R0.104 CCCCCCCCC(=O)CCCCCCCO 1458a_100000210188_100000760002 [0,1,1,0,0,0|1,0,0]=3 8750 B17R0.104 CCCCCCCCC(=O)CCCCCCCO 1458a_100011219782_100000210759 [0,1,1,0,0,0|1,0,0]=3 8751 B17R0.104 CCCCCCCCC(=O)CCCCCCOC 1458a_100000210188_100011998445 [0,1,1,0,0,0|1,0,0]=3 8752 B17R0.104 CCCCCCCCC(=O)CCCOCCOC 1458a_100000210188_100011216529 [0,1,1,0,0,0|2,0,0]=4 8753 B17R0.104 CCCCCCCCC(=O)CCOCCOCC 1458a_100000210188_100011211534 [0,1,1,0,0,0|2,0,0]=4 8754 B17R0.104 CCCCCCCCC(=O)COCCOCCO 1458a_106645077154_100000210759 [0,1,1,0,0,0|2,0,0]=4 8755 B17R0.104 CCCCCCCCC(=O)NCCCCCC#N 11a_100000061152_100000210188 [0,1,1,0,0,0|1,0,1]=4 8756 B17R0.104 CCCCCCCCC(=O)NCCCCCC#N 1626a_100000061152_100000210188 [0,1,1,0,0,0|1,0,1]=4 8757 B17R0.104 CCCCCCCCC(=O)NCCCCCC#N 240690a_100000061152_100000210188 [0,1,1,0,0,0|1,0,1]=4 8758 B17R0.104 CCCCCCCCC(=O)NCCCCCC#N 527a_100000061152_100000210188 [0,1,1,0,0,0|1,0,1]=4 8759 B17R0.104 CCCCCCCCC(=O)NCCCCCCC 11a_100000229938_100000210188 [0,1,1,0,0,0|1,0,0]=3 8760 B17R0.104 CCCCCCCCC(=O)NCCCCCCC 1626a_100000229938_100000210188 [0,1,1,0,0,0|1,0,0]=3 8761 B17R0.104 CCCCCCCCC(=O)NCCCCCCC 240690a_100000229938_100000210188 [0,1,1,0,0,0|1,0,0]=3 8762 B17R0.104 CCCCCCCCC(=O)NCCCCCCC 527a_100000229938_100000210188 [0,1,1,0,0,0|1,0,0]=3 8763 B17R0.104 CCCCCCCCC(=O)NCCCCCCO 240690a_100000686447_100000210188 [0,1,1,0,0,0|1,0,0]=3 8764 B17R0.104 CCCCCCCCC(=O)NCCCCCCO 527a_100000686447_100000210188 [0,1,1,0,0,0|1,0,0]=3 8765 B17R0.104 CCCCCCCCC(=O)NCCCCCOC 11a_100000747528_100000210188 [0,1,1,0,0,0|1,0,0]=3 8766 B17R0.104 CCCCCCCCC(=O)NCCCCCOC 1626a_100000747528_100000210188 [0,1,1,0,0,0|1,0,0]=3 8767 B17R0.104 CCCCCCCCC(=O)NCCCCCOC 240690a_100000747528_100000210188 [0,1,1,0,0,0|1,0,0]=3 8768 B17R0.104 CCCCCCCCC(=O)NCCCCCOC 527a_100000747528_100000210188 [0,1,1,0,0,0|1,0,0]=3 8769 B17R0.104 CCCCCCCCC(=O)NCCCOCCC 1626a_100011217757_100000210188 [0,1,1,0,0,0|1,0,0]=3 8770 B17R0.104 CCCCCCCCC(=O)NCCCOCCC 240690a_100011217757_100000210188 [0,1,1,0,0,0|1,0,0]=3 8771 B17R0.104 CCCCCCCCC(=O)NCCCOCCC 527a_100011217757_100000210188 [0,1,1,0,0,0|1,0,0]=3 8772 B17R0.104 CCCCCCCCC(=O)NCCOCCOC 11a_100000745349_100000210188 [0,1,1,0,0,0|2,0,0]=4 8773 B17R0.104 CCCCCCCCC(=O)NCCOCCOC 1626a_100000745349_100000210188 [0,1,1,0,0,0|2,0,0]=4 8774 B17R0.104 CCCCCCCCC(=O)NCCOCCOC 240690a_100000745349_100000210188 [0,1,1,0,0,0|2,0,0]=4 8775 B17R0.104 CCCCCCCCC(=O)NCCOCCOC 527a_100000745349_100000210188 [0,1,1,0,0,0|2,0,0]=4 8776 B17R0.104 CCCCCCCCC(=O)NCCSCCCC 11a_100025743550_100000210188 [0,1,1,0,0,0|1,0,0]=3 8777 B17R0.104 CCCCCCCCC(=O)NCCSCCCC 1626a_100025743550_100000210188 [0,1,1,0,0,0|1,0,0]=3 8778 B17R0.104 CCCCCCCCC(=O)NCCSCCCC 240690a_100025743550_100000210188 [0,1,1,0,0,0|1,0,0]=3 8779 B17R0.104 CCCCCCCCC(=O)NCCSCCCC 527a_100025743550_100000210188 [0,1,1,0,0,0|1,0,0]=3 8780 B17R0.104 CCCCCCCCC(C)COCCCCCC 34a_200012125181_100000210314 [0,1,1,0,0,0|1,0,1]=4 8781 B17R0.104 CCCCCCCCC(C)COCCCCCC 7a_200012125181_100000210314 [0,1,1,0,0,0|1,0,1]=4 8782 B17R0.104 CCCCCCCCC(C)OCCCCCCF 34a_100000210740_100015922095 [0,1,1,0,0,0|1,0,1]=4 8783 B17R0.104 CCCCCCCCC(C)OCCCCCCF 7a_100000210740_100015922095 [0,1,1,0,0,0|1,0,1]=4 8784 B17R0.104 CCCCCCCCC(C)OCCCCCCO 34a_100000210740_100000766143 [0,1,1,0,0,0|1,0,1]=4 8785 B17R0.104 CCCCCCCCC(C)OCCCCCCO 7a_100000210740_100000766143 [0,1,1,0,0,0|1,0,1]=4 8786 B17R0.104 CCCCCCCCC(C)OCCOCCCC 34a_100000210740_100000743108 [0,1,1,0,0,0|1,0,1]=4 8787 B17R0.104 CCCCCCCCC(C)OCCOCCCC 7a_100000210740_100000743108 [0,1,1,0,0,0|1,0,1]=4 8788 B17R0.104 CCCCCCCNC(=O)CCCCCCCO 240690a_100000229938_100011219782 [0,1,1,0,0,0|1,0,0]=3 8789 B17R0.104 CCCCCCCNC(=O)NCCCCCCC 2708a_100000229938_100000229938 [0,1,1,0,0,0|1,0,0]=3 8790 B17R0.104 CCCCCCCNC(=O)NCCCCCCC 273464a_100000229938_100000229938 [0,1,1,0,0,0|1,0,0]=3 8791 B17R0.104 CCCCCCCNC(=O)NCCCCCCC 512a_100000229938_100000229938 [0,1,1,0,0,0|1,0,0]=3 8792 B17R0.104 CCCCCCCNC(=O)NCCCCCCO 2708a_100000229938_100000686447 [0,1,1,0,0,0|2,0,0]=4 8793 B17R0.104 CCCCCCCNC(=O)NCCCCCCO 273464a_100000229938_100000686447 [0,1,1,0,0,0|2,0,0]=4 8794 B17R0.104 CCCCCCCNC(=O)NCCCCCCO 273464a_100000686447_100000229938 [0,1,1,0,0,0|2,0,0]=4 8795 B17R0.104 CCCCCCCNC(=O)NCCCCCCO 512a_100000229938_100000686447 [0,1,1,0,0,0|2,0,0]=4 8796 B17R0.104 CCCCCCCNC(=O)NCCCCCCO 512a_100000686447_100000229938 [0,1,1,0,0,0|2,0,0]=4 8797 B17R0.104 CCCCCCCNC(=O)NCCCCCOC 2708a_100000229938_100000747528 [0,1,1,0,0,0|2,0,0]=4 8798 B17R0.104 CCCCCCCNC(=O)NCCCCCOC 2708a_100000747528_100000229938 [0,1,1,0,0,0|2,0,0]=4 8799 B17R0.104 CCCCCCCNC(=O)NCCCCCOC 273464a_100000229938_100000747528 [0,1,1,0,0,0|2,0,0]=4 8800 B17R0.104 CCCCCCCNC(=O)NCCCCCOC 273464a_100000747528_100000229938 [0,1,1,0,0,0|2,0,0]=4 8801 B17R0.104 CCCCCCCNC(=O)NCCCCCOC 512a_100000229938_100000747528 [0,1,1,0,0,0|2,0,0]=4 8802 B17R0.104 CCCCCCCNC(=O)NCCCCCOC 512a_100000747528_100000229938 [0,1,1,0,0,0|2,0,0]=4 8803 B17R0.104 CCCCCCCNC(=O)NCCCOCCC 2708a_100000229938_100011217757 [0,1,1,0,0,0|2,0,0]=4 8804 B17R0.104 CCCCCCCNC(=O)NCCCOCCC 2708a_100011217757_100000229938 [0,1,1,0,0,0|2,0,0]=4 8805 B17R0.104 CCCCCCCNC(=O)NCCCOCCC 273464a_100000229938_100011217757 [0,1,1,0,0,0|2,0,0]=4 8806 B17R0.104 CCCCCCCNC(=O)NCCCOCCC 273464a_100011217757_100000229938 [0,1,1,0,0,0|2,0,0]=4 8807 B17R0.104 CCCCCCCNC(=O)NCCCOCCC 512a_100000229938_100011217757 [0,1,1,0,0,0|2,0,0]=4 8808 B17R0.104 CCCCCCCNC(=O)NCCCOCCC 512a_100011217757_100000229938 [0,1,1,0,0,0|2,0,0]=4 8809 B17R0.104 CCCCCCCNC(=O)NCCSCCCC 2708a_100000229938_100025743550 [0,1,1,0,0,0|2,0,0]=4 8810 B17R0.104 CCCCCCCNC(=O)NCCSCCCC 2708a_100025743550_100000229938 [0,1,1,0,0,0|2,0,0]=4 8811 B17R0.104 CCCCCCCNC(=O)NCCSCCCC 273464a_100000229938_100025743550 [0,1,1,0,0,0|2,0,0]=4 8812 B17R0.104 CCCCCCCNC(=O)NCCSCCCC 273464a_100025743550_100000229938 [0,1,1,0,0,0|2,0,0]=4 8813 B17R0.104 CCCCCCCNC(=O)NCCSCCCC 512a_100000229938_100025743550 [0,1,1,0,0,0|2,0,0]=4 8814 B17R0.104 CCCCCCCNC(=O)NCCSCCCC 512a_100025743550_100000229938 [0,1,1,0,0,0|2,0,0]=4 8815 B17R0.104 CCCCSCCNC(=O)CCCCCCCO 240690a_100025743550_100011219782 [0,1,1,0,0,0|2,0,0]=4 8816 B17R0.104 CCCOCCCNC(=O)CCCCCCCO 240690a_100011217757_100011219782 [0,1,1,0,0,0|2,0,0]=4 8817 B17R0.104 COCCCCCCC(=O)CCCCCCCO 1458a_100011219782_100011998445 [0,1,1,0,0,0|2,0,0]=4 8818 B17R0.104 COCCCCCNC(=O)CCCCCCCO 240690a_100000747528_100011219782 [0,1,1,0,0,0|2,0,0]=4 8819 B17R0.104 O=C(CCCCCCCO)CCCCCCCO 1458a_100011219782_100000760002 [0,1,1,0,0,0|2,0,0]=4 8820 B17R0.104 O=C(CCCCCCCO)NCCCCCCO 240690a_100000686447_100011219782 [0,1,1,0,0,0|2,0,0]=4 8821 B17R0.796 CCCCCCCCS(=O)(=O)NCCCCCC 270084a_100000210581_100011218563 [0,1,1,0,0,0|2,0,0]=4 8822 B17R0.796 CCCCCCCCS(=O)(=O)NCCCCCC 274078a_100000210581_100011218563 [0,1,1,0,0,0|2,0,0]=4 8823 B17R0.3189 CCCCCCCC(=O)NCCN(C)CCCC 1626a_200000754967_100000211969 [0,1,1,0,0,0|2,0,0]=4 8824 B17R0.3189 CCCCCCCC(=O)NCCN(C)CCCC 240690a_200000754967_100000211969 [0,1,1,0,0,0|2,0,0]=4 8825 B17R0.3189 CCCCCCCC(=O)NCCN(C)CCCC 527a_200000754967_100000211969 [0,1,1,0,0,0|2,0,0]=4 8826 B17R0.3189 CCCCCCCC(=O)OCNC(C)CCCC 2230a_100000126638_100009852258 [0,1,1,0,0,0|1,0,0]=3 8827 B17R0.3189 CCCCCCCC(=O)OCOC(C)CCCC 34a_100000687866_100009852258 [0,1,1,0,0,0|1,0,0]=3 8828 B17R0.3189 CCCCCCCC(=O)OCOC(C)CCCC 7a_100000687866_100009852258 [0,1,1,0,0,0|1,0,0]=3 8829 B17R0.3189 CCCCCCCC(=O)OCOC(C)CCCCl 34a_200000718107_100009852258 [0,1,1,0,0,0|2,0,0]=4 8830 B17R0.3189 CCCCCCCC(=O)OCOC(C)CCCCl 7a_200000718107_100009852258 [0,1,1,0,0,0|2,0,0]=4 8831 B17R0.3189 CCCCCCCC(=O)OCOC(C)COCC 34a_100000718985_100009852258 [0,1,1,0,0,0|2,0,0]=4 8832 B17R0.3189 CCCCCCCC(=O)OCOC(C)COCC 7a_100000718985_100009852258 [0,1,1,0,0,0|2,0,0]=4 8833 B17R0.3189 CCCCCCCC(=O)OCSC(C)CCCC 62a_200011215066_100009852258 [0,1,1,0,0,0|1,0,0]=3 8834 B17R0.3189 CCCCCCNC(=O)COCC(C)CCCC 34a_100011995851_100000230325 [0,1,1,0,0,0|2,0,0]=4 8835 B17R0.3189 CCCCCCNC(=O)COCC(C)CCCC 7a_100011995851_100000230325 [0,1,1,0,0,0|2,0,0]=4 8836 B17R0.3189 CCCCCCNC(=O)COC[C@@H](N)CCCC 34a_100011934283_100000230325 [0,1,1,0,0,0|2,0,0]=4 8837 B17R0.5500 CCCCCCC(C)C(=O)CCCCCCCO 1458a_100011219782_100011215978 [0,1,1,0,0,0|2,0,0]=4 8838 B17R0.5500 CCCCCCC(O)C(=O)CCCCCCCO 1458a_100011215828_100000760002 [0,1,1,0,0,0|2,0,0]=4 8839 B17R0.5500 CCCCCCC(O)C(=O)CCCCCCOC 1458a_100011215828_100011998445 [0,1,1,0,0,0|2,0,0]=4 8840 B17R0.5500 CCCCCCC(O)C(=O)NCCCCCCO 240690a_100000686447_100011215828 [0,1,1,0,0,0|2,0,0]=4 8841 B17R0.5500 CCCCCCC(O)C(=O)NCCCCCOC 240690a_100000747528_100011215828 [0,1,1,0,0,0|2,0,0]=4 8842 B17R0.5500 CCCCCCC(O)C(=O)NCCCOCCC 240690a_100011217757_100011215828 [0,1,1,0,0,0|2,0,0]=4 8843 B17R0.5500 CCCCCCC(O)C(=O)NCCSCCCC 240690a_100025743550_100011215828 [0,1,1,0,0,0|2,0,0]=4 8844 B17R0.5500 CCCCCCC=CC(=O)C(C)CCCCCC 1458a_200015324643_100011215978 [0,1,1,0,0,0|1,0,1]=4 8845 B17R0.5500 CCCCCCCCC(=O)C(C)CCCCCC 1458a_100000210188_100011215978 [0,1,1,0,0,0|1,0,0]=3 8846 B17R0.5500 CCCCCCCCC(=O)C(O)CCCCCC 1458a_100011215828_100000210759 [0,1,1,0,0,0|1,0,0]=3 8847 B17R0.5500 CCCCCCCCC(=O)N(C)CCCCCC 11a_106256046315_100000210188 [0,1,1,0,0,0|1,0,0]=3 8848 B17R0.5500 CCCCCCCCC(=O)N(C)CCCCCC 1626a_106256046315_100000210188 [0,1,1,0,0,0|1,0,0]=3 8849 B17R0.5500 CCCCCCCCC(=O)N(C)CCCCCC 240690a_106256046315_100000210188 [0,1,1,0,0,0|1,0,0]=3 8850 B17R0.5500 CCCCCCCCC(=O)N(C)CCCCCC 527a_106256046315_100000210188 [0,1,1,0,0,0|1,0,0]=3 8851 B17R0.5500 CCCCCCCCC(=O)N(C)CCCCCO 240690a_100000722520_100000210188 [0,1,1,0,0,0|2,0,0]=4 8852 B17R0.5500 CCCCCCCNC(=O)C(O)CCCCCC 240690a_100000229938_100011215828 [0,1,1,0,0,0|1,0,0]=3 8853 B17R0.5500 CCCCCCCNC(=O)N(C)CCCCCC 2708a_100000229938_106256046315 [0,1,1,0,0,0|2,0,0]=4 8854 B17R0.5500 CCCCCCCNC(=O)N(C)CCCCCC 273464a_100000229938_106256046315 [0,1,1,0,0,0|2,0,0]=4 8855 B17R0.5500 CCCCCCN(C)C(=O)CCCCCCCO 240690a_106256046315_100011219782 [0,1,1,0,0,0|2,0,0]=4 8856 B17R0.5782 CCCCC(C)CCC(=O)CCCCCCCO 1458a_100000033779_100000760002 [0,1,1,0,0,0|2,0,0]=4 8857 B17R0.5782 CCCCC(C)CCC(=O)CCCCCCOC 1458a_100000033779_100011998445 [0,1,1,0,0,0|2,0,0]=4 8858 B17R0.5782 CCCCC(C)CCC(=O)NCCCCCCO 240690a_100000686447_100000033779 [0,1,1,0,0,0|2,0,0]=4 8859 B17R0.5782 CCCCC(C)CCC(=O)NCCCCCCO 527a_100000686447_100000033779 [0,1,1,0,0,0|2,0,0]=4 8860 B17R0.5782 CCCCC(C)CCC(=O)NCCCCCOC 11a_100000747528_100000033779 [0,1,1,0,0,0|2,0,0]=4 8861 B17R0.5782 CCCCC(C)CCC(=O)NCCCCCOC 1626a_100000747528_100000033779 [0,1,1,0,0,0|2,0,0]=4 8862 B17R0.5782 CCCCC(C)CCC(=O)NCCCCCOC 240690a_100000747528_100000033779 [0,1,1,0,0,0|2,0,0]=4 8863 B17R0.5782 CCCCC(C)CCC(=O)NCCCCCOC 527a_100000747528_100000033779 [0,1,1,0,0,0|2,0,0]=4 8864 B17R0.5782 CCCCC(C)CCC(=O)NCCCOCCC 1626a_100011217757_100000033779 [0,1,1,0,0,0|2,0,0]=4 8865 B17R0.5782 CCCCC(C)CCC(=O)NCCCOCCC 240690a_100011217757_100000033779 [0,1,1,0,0,0|2,0,0]=4 8866 B17R0.5782 CCCCC(C)CCC(=O)NCCCOCCC 527a_100011217757_100000033779 [0,1,1,0,0,0|2,0,0]=4 8867 B17R0.5782 CCCCCCCCC(=O)CCC(C)CCCC 1458a_100000033779_100000210759 [0,1,1,0,0,0|1,0,0]=3 8868 B17R0.5782 CCCCCCCCC(=O)NCC(C)OCCC 11a_100015185124_100000210188 [0,1,1,0,0,0|2,0,0]=4 8869 B17R0.5782 CCCCCCCCC(=O)NCC(C)OCCC 1626a_100015185124_100000210188 [0,1,1,0,0,0|2,0,0]=4 8870 B17R0.5782 CCCCCCCCC(=O)NCC(C)OCCC 240690a_100015185124_100000210188 [0,1,1,0,0,0|2,0,0]=4 8871 B17R0.5782 CCCCCCCCC(=O)NCC(C)OCCC 527a_100015185124_100000210188 [0,1,1,0,0,0|2,0,0]=4 8872 B17R0.5782 CCCCCCCCC(=O)NCC(O)COCC 240690a_102515437182_100000210188 [0,1,1,0,0,0|2,0,0]=4 8873 B17R0.5782 CCCCCCCCC(=O)NCC(O)COCC 527a_102515437182_100000210188 [0,1,1,0,0,0|2,0,0]=4 8874 B17R0.5782 CCCCCCCCC(=O)NC[C@H](C)CCCO 240690a_100160569302_100000210188 [0,1,1,0,0,0|2,0,0]=4 8875 B17R0.5782 CCCCCCCCC(=O)NC[C@H](C)CCCO 527a_100160569302_100000210188 [0,1,1,0,0,0|2,0,0]=4 8876 B17R0.5782 CCCCCCCNC(=O)CCC(C)CCCC 11a_100000229938_100000033779 [0,1,1,0,0,0|1,0,0]=3 8877 B17R0.5782 CCCCCCCNC(=O)CCC(C)CCCC 1626a_100000229938_100000033779 [0,1,1,0,0,0|1,0,0]=3 8878 B17R0.5782 CCCCCCCNC(=O)CCC(C)CCCC 240690a_100000229938_100000033779 [0,1,1,0,0,0|1,0,0]=3 8879 B17R0.5782 CCCCCCCNC(=O)CCC(C)CCCC 527a_100000229938_100000033779 [0,1,1,0,0,0|1,0,0]=3 8880 B17R0.5782 CCCCSCCNC(=O)CCC(C)CCCC 11a_100025743550_100000033779 [0,1,1,0,0,0|2,0,0]=4 8881 B17R0.5782 CCCCSCCNC(=O)CCC(C)CCCC 1626a_100025743550_100000033779 [0,1,1,0,0,0|2,0,0]=4 8882 B17R0.5782 CCCCSCCNC(=O)CCC(C)CCCC 240690a_100025743550_100000033779 [0,1,1,0,0,0|2,0,0]=4 8883 B17R0.5782 CCCCSCCNC(=O)CCC(C)CCCC 527a_100025743550_100000033779 [0,1,1,0,0,0|2,0,0]=4 8884 B17R0.7631 CCCCCCC(C)NC(=O)CCCCCCO 240690a_100000210919_100011996774 [0,1,1,0,0,0|2,0,0]=4 8885 B17R0.7631 CCCCCCC(C)NC(=O)CCCCCOC 11a_100000210919_100011935119 [0,1,1,0,0,0|2,0,0]=4 8886 B17R0.7631 CCCCCCC(C)NC(=O)CCCCCOC 1626a_100000210919_100011935119 [0,1,1,0,0,0|2,0,0]=4 8887 B17R0.7631 CCCCCCC(C)NC(=O)CCCCCOC 240690a_100000210919_100011935119 [0,1,1,0,0,0|2,0,0]=4 8888 B17R0.7631 CCCCCCC(C)NC(=O)CCCCCOC 527a_100000210919_100011935119 [0,1,1,0,0,0|2,0,0]=4 8889 B17R0.7631 CCCCCCC(C)NC(=O)CNCCCCC 2230a_100000209983_100000230341 [0,1,1,0,0,0|2,0,0]=4 8890 B17R0.7631 CCCCCCC(C)NC(=O)COCCCCC 34a_100000210253_100000230341 [0,1,1,0,0,0|2,0,0]=4 8891 B17R0.7631 CCCCCCC(C)NC(=O)COCCCCC 7a_100000210253_100000230341 [0,1,1,0,0,0|2,0,0]=4 8892 B17R0.7631 CCCCCCC(C)NC(=O)CSCCCCC 62a_100000210326_100000230341 [0,1,1,0,0,0|2,0,0]=4 8893 B17R0.7631 CCCCCCC(C)NC(=O)CSCCCCC 62a_100000230341_100000210326 [0,1,1,0,0,0|2,0,0]=4 8894 B17R0.7631 CCCCCCCC(=O)NC(C)CCCCCC 11a_100000210919_100000211969 [0,1,1,0,0,0|1,0,0]=3 8895 B17R0.7631 CCCCCCCC(=O)NC(C)CCCCCC 1626a_100000210919_100000211969 [0,1,1,0,0,0|1,0,0]=3 8896 B17R0.7631 CCCCCCCC(=O)NC(C)CCCCCC 240690a_100000210919_100000211969 [0,1,1,0,0,0|1,0,0]=3 8897 B17R0.7631 CCCCCCCC(=O)NC(C)CCCCCC 527a_100000210919_100000211969 [0,1,1,0,0,0|1,0,0]=3 8898 B17R0.7631 CCCCCCNC(=O)CC(=O)CCCCCC 1458a_100102632555_100000230325 [0,1,1,0,0,0|1,0,1]=4 8899 B17R0.7631 CCCCCCNC(=O)CN(C)CCCCCC 2230a_106256046315_100000230325 [0,1,1,0,0,0|2,0,0]=4 8900 B17R0.7631 CCCCCCNC(=O)CN(C)CCCCCC 269982a_106256046315_100000230325 [0,1,1,0,0,0|2,0,0]=4 8901 B17R0.7631 CCCCCCNC(=O)NC(C)CCCCCC 2708a_100000210581_100000210919 [0,1,1,0,0,0|2,0,0]=4 8902 B17R0.7631 CCCCCCNC(=O)NC(C)CCCCCC 2708a_100000210919_100000210581 [0,1,1,0,0,0|2,0,0]=4 8903 B17R0.7631 CCCCCCNC(=O)NC(C)CCCCCC 273464a_100000210581_100000210919 [0,1,1,0,0,0|2,0,0]=4 8904 B17R0.7631 CCCCCCNC(=O)NC(C)CCCCCC 273464a_100000210919_100000210581 [0,1,1,0,0,0|2,0,0]=4 8905 B17R0.7631 CCCCCCNC(=O)NC(C)CCCCCC 512a_100000210581_100000210919 [0,1,1,0,0,0|2,0,0]=4 8906 B17R0.7631 CCCCCCNC(=O)NC(C)CCCCCC 512a_100000210919_100000210581 [0,1,1,0,0,0|2,0,0]=4 8907 B17R0.8444 C=CC(CCCCCCC)OCCCCCCC 34a_200011934235_100000210614 [0,1,1,0,0,0|1,0,1]=4 8908 B17R0.8444 C=CC(CCCCCCC)OCCCCCCC 7a_200011934235_100000210614 [0,1,1,0,0,0|1,0,1]=4 8909 B17R0.8809 C#CCCCCCCCC(=O)CCCCCCC 1458a_100000087357_100000210614 [0,1,1,0,0,0|1,0,1]=4 8910 B17R0.8809 C#CCCCCCCCC(=O)CCCCCCC 1458a_100000211969_100153394163 [0,1,1,0,0,0|1,0,1]=4 8911 B17R0.8809 C#CCCCCCCCC(=O)NCCCCCC 11a_100000210581_100000087357 [0,1,1,0,0,0|1,0,1]=4 8912 B17R0.8809 C#CCCCCCCCC(=O)NCCCCCC 1626a_100000210581_100000087357 [0,1,1,0,0,0|1,0,1]=4 8913 B17R0.8809 C#CCCCCCCCC(=O)NCCCCCC 240690a_100000210581_100000087357 [0,1,1,0,0,0|1,0,1]=4 8914 B17R0.8809 C#CCCCCCCCC(=O)NCCCCCC 527a_100000210581_100000087357 [0,1,1,0,0,0|1,0,1]=4 8915 B17R0.8809 C#CCCCCNCOC(=O)CCCCCCC 2230a_100000706060_100009852258 [0,1,1,0,0,0|0,0,2]=4 8916 B17R0.8809 C#CCCCCNCOC(=O)CCCCCCC 34a_100000706060_100009852258 [0,1,1,0,0,0|0,0,2]=4 8917 B17R0.8809 C#CCCCCOCOC(=O)CCCCCCC 34a_100000766709_100009852258 [0,1,1,0,0,0|0,0,2]=4 8918 B17R0.8809 C#CCCCCOCOC(=O)CCCCCCC 7a_100000766709_100009852258 [0,1,1,0,0,0|0,0,2]=4 8919 B17R0.8809 C#CCCCCSCOC(=O)CCCCCCC 62a_100010269958_100009852258 [0,1,1,0,0,0|0,0,2]=4 8920 B17R0.8809 C=CCCCCCCCC(=O)CCCCCCC 1458a_100000211969_100012355270 [0,1,1,0,0,0|1,0,1]=4 8921 B17R0.8809 C=CCCCCCCCC(=O)CCCCCCC 1458a_100011216160_100000210614 [0,1,1,0,0,0|1,0,1]=4 8922 B17R0.8809 C=CCCCCCCCC(=O)NCCCCCC 11a_100000210581_100011216160 [0,1,1,0,0,0|1,0,1]=4 8923 B17R0.8809 C=CCCCCCCCC(=O)NCCCCCC 1626a_100000210581_100011216160 [0,1,1,0,0,0|1,0,1]=4 8924 B17R0.8809 C=CCCCCCCCC(=O)NCCCCCC 240690a_100000210581_100011216160 [0,1,1,0,0,0|1,0,1]=4 8925 B17R0.8809 C=CCCCCCCCC(=O)NCCCCCC 527a_100000210581_100011216160 [0,1,1,0,0,0|1,0,1]=4 8926 B17R0.8809 C=CCCCCNCOC(=O)CCCCCCC 2230a_100000703577_100009852258 [0,1,1,0,0,0|0,0,2]=4 8927 B17R0.8809 C=CCCCCNCOC(=O)CCCCCCC 34a_100000703577_100009852258 [0,1,1,0,0,0|0,0,2]=4 8928 B17R0.8809 C=CCCCCOCOC(=O)CCCCCCC 34a_100000766645_100009852258 [0,1,1,0,0,0|0,0,2]=4 8929 B17R0.8809 C=CCCCCOCOC(=O)CCCCCCC 7a_100000766645_100009852258 [0,1,1,0,0,0|0,0,2]=4 8930 B17R0.8809 C=CCCCCSCOC(=O)CCCCCCC 62a_100011215482_100009852258 [0,1,1,0,0,0|0,0,2]=4 8931 B17R0.8809 CC/C=C\CCOCOC(=O)CCCCCCC 34a_100016288707_100009852258 [0,1,1,0,0,0|0,0,2]=4 8932 B17R0.8809 CC/C=C\CCOCOC(=O)CCCCCCC 7a_100016288707_100009852258 [0,1,1,0,0,0|0,0,2]=4 8933 B17R0.8809 CC/C=C\CCSCOC(=O)CCCCCCC 62a_100015370543_100009852258 [0,1,1,0,0,0|0,0,2]=4 8934 B17R0.8809 CC=CCCCOCOC(=O)CCCCCCC 34a_100020645299_100009852258 [0,1,1,0,0,0|0,0,2]=4 8935 B17R0.8809 CCC#CCCOCOC(=O)CCCCCCC 34a_100000036655_100009852258 [0,1,1,0,0,0|0,0,2]=4 8936 B17R0.8809 CCC#CCCOCOC(=O)CCCCCCC 7a_100000036655_100009852258 [0,1,1,0,0,0|0,0,2]=4 8937 B17R0.8809 CCC/C=C/COCOC(=O)CCCCCCC 34a_100016278788_100009852258 [0,1,1,0,0,0|0,0,2]=4 8938 B17R0.8809 CCC/C=C/COCOC(=O)CCCCCCC 7a_100016278788_100009852258 [0,1,1,0,0,0|0,0,2]=4 8939 B17R0.8809 CCCC#CCOCOC(=O)CCCCCCC 34a_100000034806_100009852258 [0,1,1,0,0,0|0,0,2]=4 8940 B17R0.8809 CCCC#CCOCOC(=O)CCCCCCC 7a_100000034806_100009852258 [0,1,1,0,0,0|0,0,2]=4 8941 B17R0.8809 CCCCC#CCCCC(=O)CCCCCCC 1458a_100000211969_200000047210 [0,1,1,0,0,0|1,0,1]=4 8942 B17R0.8809 CCCCC/C=C/CCC(=O)CCCCCCC 1458a_200015255902_100000210614 [0,1,1,0,0,0|1,0,1]=4 8943 B17R0.8809 CCCCC/C=C/CCC(=O)NCCCCCC 11a_100000210581_200015255902 [0,1,1,0,0,0|1,0,1]=4 8944 B17R0.8809 CCCCC/C=C/CCC(=O)NCCCCCC 1626a_100000210581_200015255902 [0,1,1,0,0,0|1,0,1]=4 8945 B17R0.8809 CCCCC/C=C/CCC(=O)NCCCCCC 240690a_100000210581_200015255902 [0,1,1,0,0,0|1,0,1]=4 8946 B17R0.8809 CCCCC/C=C/CCC(=O)NCCCCCC 527a_100000210581_200015255902 [0,1,1,0,0,0|1,0,1]=4 8947 B17R0.8809 CCCCCC#CC(=O)CCCCCCCCC 1458a_100011215388_100000210670 [0,1,1,0,0,0|1,0,1]=4 8948 B17R0.8809 CCCCCC#CC(=O)CCCCCCCCO 1458a_100011215388_100000033203 [0,1,1,0,0,0|1,0,1]=4 8949 B17R0.8809 CCCCCC#CC(=O)NCCCCCCCC 240690a_100000229939_100011215388 [0,1,1,0,0,0|1,0,1]=4 8950 B17R0.8809 CCCCCC/C=C/CC(=O)CCCCCCC 1458a_100020681715_100000210614 [0,1,1,0,0,0|1,0,1]=4 8951 B17R0.8809 CCCCCC/C=C/CC(=O)NCCCCCC 11a_100000210581_100020681715 [0,1,1,0,0,0|1,0,1]=4 8952 B17R0.8809 CCCCCC/C=C/CC(=O)NCCCCCC 1626a_100000210581_100020681715 [0,1,1,0,0,0|1,0,1]=4 8953 B17R0.8809 CCCCCC/C=C/CC(=O)NCCCCCC 240690a_100000210581_100020681715 [0,1,1,0,0,0|1,0,1]=4 8954 B17R0.8809 CCCCCC=CC(=O)CCCCCCCCC 1458a_100016263427_100000210670 [0,1,1,0,0,0|1,0,1]=4 8955 B17R0.8809 CCCCCC=CC(=O)CCCCCCCCO 1458a_100016263427_100000033203 [0,1,1,0,0,0|1,0,1]=4 8956 B17R0.8809 CCCCCC=CC(=O)NCCCCCCCC 11a_100000229939_100016263427 [0,1,1,0,0,0|1,0,1]=4 8957 B17R0.8809 CCCCCC=CC(=O)NCCCCCCCC 1626a_100000229939_100016263427 [0,1,1,0,0,0|1,0,1]=4 8958 B17R0.8809 CCCCCC=CC(=O)NCCCCCCCC 240690a_100000229939_100016263427 [0,1,1,0,0,0|1,0,1]=4 8959 B17R0.8809 CCCCCCC=NNC(=O)CCCCCCC 4a_100000181853_100000234349 [0,1,1,0,0,0|1,0,1]=4 8960 B17R0.8809 CCCCCCCC(=O)CCCCCCCCO 1458a_100000211969_100000033203 [0,1,1,0,0,0|1,0,0]=3 8961 B17R0.8809 CCCCCCCC(=O)COCCOCCCC 1458a_100011216887_100000210614 [0,1,1,0,0,0|1,0,0]=3 8962 B17R0.8809 CCCCCCCC(=O)COCCOCCOC 1458a_100011214951_100000210614 [0,1,1,0,0,0|2,0,0]=4 8963 B17R0.8809 CCCCCCCC(=O)NCCCCCCCO 240690a_100011996573_100000211969 [0,1,1,0,0,0|1,0,0]=3 8964 B17R0.8809 CCCCCCCC(=O)NCCCOCCCC 1626a_200000211371_100000211969 [0,1,1,0,0,0|1,0,0]=3 8965 B17R0.8809 CCCCCCCC(=O)NCCCOCCCC 240690a_200000211371_100000211969 [0,1,1,0,0,0|1,0,0]=3 8966 B17R0.8809 CCCCCCCC(=O)NCCCOCCCC 527a_200000211371_100000211969 [0,1,1,0,0,0|1,0,0]=3 8967 B17R0.8809 CCCCCCCC(=O)NCCCOCCCO 240690a_100011310245_100000211969 [0,1,1,0,0,0|2,0,0]=4 8968 B17R0.8809 CCCCCCCC(=O)NCCCOCCOC 1626a_100000206027_100000211969 [0,1,1,0,0,0|2,0,0]=4 8969 B17R0.8809 CCCCCCCC(=O)NCCCOCCOC 240690a_100000206027_100000211969 [0,1,1,0,0,0|2,0,0]=4 8970 B17R0.8809 CCCCCCCC(=O)NCCOCCOCC 11a_100102712874_100000211969 [0,1,1,0,0,0|2,0,0]=4 8971 B17R0.8809 CCCCCCCC(=O)NCCOCCOCC 1626a_100102712874_100000211969 [0,1,1,0,0,0|2,0,0]=4 8972 B17R0.8809 CCCCCCCC(=O)NCCOCCOCC 240690a_100102712874_100000211969 [0,1,1,0,0,0|2,0,0]=4 8973 B17R0.8809 CCCCCCCC(=O)NCCOCCOCC 527a_100102712874_100000211969 [0,1,1,0,0,0|2,0,0]=4 8974 B17R0.8809 CCCCCCCC(=O)OCNCCCCCC 2230a_100000210581_100009852258 [0,1,1,0,0,0|0,0,0]=2 8975 B17R0.8809 CCCCCCCC(=O)OCNCCCCCO 2230a_100000762737_100009852258 [0,1,1,0,0,0|1,0,0]=3 8976 B17R0.8809 CCCCCCCC(=O)OCNCCCCCO 34a_100000762737_100009852258 [0,1,1,0,0,0|1,0,0]=3 8977 B17R0.8809 CCCCCCCC(=O)OCNCCCOCC 2230a_100000210961_100009852258 [0,1,1,0,0,0|1,0,0]=3 8978 B17R0.8809 CCCCCCCC(=O)OCNCCCOCC 34a_100000210961_100009852258 [0,1,1,0,0,0|1,0,0]=3 8979 B17R0.8809 CCCCCCCC(=O)OCNCCOCCC 2230a_100161115042_100009852258 [0,1,1,0,0,0|1,0,0]=3 8980 B17R0.8809 CCCCCCCC(=O)OCNCCOCCC 34a_100161115042_100009852258 [0,1,1,0,0,0|1,0,0]=3 8981 B17R0.8809 CCCCCCCC(=O)OCNCCOCCO 2230a_100000211614_100009852258 [0,1,1,0,0,0|2,0,0]=4 8982 B17R0.8809 CCCCCCCC(=O)OCNCCOCCO 34a_100000211614_100009852258 [0,1,1,0,0,0|2,0,0]=4 8983 B17R0.8809 CCCCCCCC(=O)OCNCCSCCC 2230a_100020603323_100009852258 [0,1,1,0,0,0|1,0,0]=3 8984 B17R0.8809 CCCCCCCC(=O)OCNCCSCCO 2230a_100011219999_100009852258 [0,1,1,0,0,0|2,0,0]=4 8985 B17R0.8809 CCCCCCCC(=O)OCOCCCCCBr 34a_100000746331_100009852258 [0,1,1,0,0,0|1,0,0]=3 8986 B17R0.8809 CCCCCCCC(=O)OCOCCCCCBr 7a_100000746331_100009852258 [0,1,1,0,0,0|1,0,0]=3 8987 B17R0.8809 CCCCCCCC(=O)OCOCCCCCC 34a_100000210259_100009852258 [0,1,1,0,0,0|0,0,0]=2 8988 B17R0.8809 CCCCCCCC(=O)OCOCCCCCC 7a_100000210259_100009852258 [0,1,1,0,0,0|0,0,0]=2 8989 B17R0.8809 CCCCCCCC(=O)OCOCCCCCCl 34a_100000746330_100009852258 [0,1,1,0,0,0|1,0,0]=3 8990 B17R0.8809 CCCCCCCC(=O)OCOCCCCCCl 7a_100000746330_100009852258 [0,1,1,0,0,0|1,0,0]=3 8991 B17R0.8809 CCCCCCCC(=O)OCOCCCCCI 34a_200012148887_100009852258 [0,1,1,0,0,0|1,0,0]=3 8992 B17R0.8809 CCCCCCCC(=O)OCOCCCCCI 7a_200012148887_100009852258 [0,1,1,0,0,0|1,0,0]=3 8993 B17R0.8809 CCCCCCCC(=O)OCOCCCCCN 34a_100000762737_100009852258 [0,1,1,0,0,0|1,0,0]=3 8994 B17R0.8809 CCCCCCCC(=O)OCOCCCCOC 34a_100000740925_100009852258 [0,1,1,0,0,0|1,0,0]=3 8995 B17R0.8809 CCCCCCCC(=O)OCOCCCCSC 34a_100011217163_100009852258 [0,1,1,0,0,0|1,0,0]=3 8996 B17R0.8809 CCCCCCCC(=O)OCOCCCCSC 7a_100011217163_100009852258 [0,1,1,0,0,0|1,0,0]=3 8997 B17R0.8809 CCCCCCCC(=O)OCOCCCOCC 34a_100000757476_100009852258 [0,1,1,0,0,0|1,0,0]=3 8998 B17R0.8809 CCCCCCCC(=O)OCOCCCOCC 7a_100000757476_100009852258 [0,1,1,0,0,0|1,0,0]=3 8999 B17R0.8809 CCCCCCCC(=O)OCOCCCSCC 34a_100011216438_100009852258 [0,1,1,0,0,0|1,0,0]=3 9000 B17R0.8809 CCCCCCCC(=O)OCOCCCSCC 7a_100011216438_100009852258 [0,1,1,0,0,0|1,0,0]=3 9001 B17R0.8809 CCCCCCCC(=O)OCOCCOCCBr 34a_100000692535_100009852258 [0,1,1,0,0,0|2,0,0]=4 9002 B17R0.8809 CCCCCCCC(=O)OCOCCOCCBr 7a_100000692535_100009852258 [0,1,1,0,0,0|2,0,0]=4 9003 B17R0.8809 CCCCCCCC(=O)OCOCCOCCC 34a_100000752267_100009852258 [0,1,1,0,0,0|1,0,0]=3 9004 B17R0.8809 CCCCCCCC(=O)OCOCCOCCC 7a_100000752267_100009852258 [0,1,1,0,0,0|1,0,0]=3 9005 B17R0.8809 CCCCCCCC(=O)OCOCCOCCCl 34a_100011215305_100009852258 [0,1,1,0,0,0|2,0,0]=4 9006 B17R0.8809 CCCCCCCC(=O)OCOCCOCCCl 7a_100011215305_100009852258 [0,1,1,0,0,0|2,0,0]=4 9007 B17R0.8809 CCCCCCCC(=O)OCOCCOCCF 34a_200015357709_100009852258 [0,1,1,0,0,0|2,0,0]=4 9008 B17R0.8809 CCCCCCCC(=O)OCOCCOCCF 7a_200015357709_100009852258 [0,1,1,0,0,0|2,0,0]=4 9009 B17R0.8809 CCCCCCCC(=O)OCOCCOCCI 34a_100012149058_100009852258 [0,1,1,0,0,0|2,0,0]=4 9010 B17R0.8809 CCCCCCCC(=O)OCOCCOCCI 7a_100012149058_100009852258 [0,1,1,0,0,0|2,0,0]=4 9011 B17R0.8809 CCCCCCCC(=O)OCOCCOCCN 34a_100000211614_100009852258 [0,1,1,0,0,0|2,0,0]=4 9012 B17R0.8809 CCCCCCCC(=O)OCOCCSCCC 34a_200000230433_100009852258 [0,1,1,0,0,0|1,0,0]=3 9013 B17R0.8809 CCCCCCCC(=O)OCOCCSCCC 7a_200000230433_100009852258 [0,1,1,0,0,0|1,0,0]=3 9014 B17R0.8809 CCCCCCCC(=O)OCSCCCCC#N 62a_100011219923_100009852258 [0,1,1,0,0,0|1,0,1]=4 9015 B17R0.8809 CCCCCCCC(=O)OCSCCCCC=O 62a_100000139335_100009852258 [0,1,1,0,0,0|1,0,1]=4 9016 B17R0.8809 CCCCCCCC(=O)OCSCCCCCC 62a_100000210314_100009852258 [0,1,1,0,0,0|0,0,0]=2 9017 B17R0.8809 CCCCCCCC(=O)OCSCCCCCF 62a_100000729378_100009852258 [0,1,1,0,0,0|1,0,0]=3 9018 B17R0.8809 CCCCCCCC(=O)OCSCCCCCO 62a_100000746330_100009852258 [0,1,1,0,0,0|1,0,0]=3 9019 B17R0.8809 CCCCCCCC(=O)OCSCCCCOC 62a_100000730899_100009852258 [0,1,1,0,0,0|1,0,0]=3 9020 B17R0.8809 CCCCCCCC(=O)OCSCCCOCC 62a_100012232248_100009852258 [0,1,1,0,0,0|1,0,0]=3 9021 B17R0.8809 CCCCCCCC(=O)OCSCCOCCC 62a_100011215938_100009852258 [0,1,1,0,0,0|1,0,0]=3 9022 B17R0.8809 CCCCCCCC(=O)OCSCCOCCO 62a_100011215305_100009852258 [0,1,1,0,0,0|2,0,0]=4 9023 B17R0.8809 CCCCCCCC(=O)OCSCOCCCC 62a_100011995733_100009852258 [0,1,1,0,0,0|1,0,0]=3 9024 B17R0.8809 CCCCCCCC(=O)OCSCOCCOC 62a_100000231047_100009852258 [0,1,1,0,0,0|2,0,0]=4 9025 B17R0.8809 CCCCCCCC(C)OCCCCCCCN 34a_100011996573_200011218727 [0,1,1,0,0,0|1,0,1]=4 9026 B17R0.8809 CCCCCCCC(C)OCCCCCCCO 34a_200011215852_100000760002 [0,1,1,0,0,0|1,0,1]=4 9027 B17R0.8809 CCCCCCCC(C)OCCCCCCCO 7a_200011215852_100000760002 [0,1,1,0,0,0|1,0,1]=4 9028 B17R0.8809 CCCCCCCC(C)OCCCCCCOC 34a_200011215852_100011998445 [0,1,1,0,0,0|1,0,1]=4 9029 B17R0.8809 CCCCCCCC(C)OCCCCCCOC 34a_200012092642_200011218727 [0,1,1,0,0,0|1,0,1]=4 9030 B17R0.8809 CCCCCCCC(C)OCCCCCCOC 7a_200011215852_100011998445 [0,1,1,0,0,0|1,0,1]=4 9031 B17R0.8809 CCCCCCCC(C)OCCCCCCOC 7a_200012092642_200011218727 [0,1,1,0,0,0|1,0,1]=4 9032 B17R0.8809 CCCCCCCC(C)OCCCOCCCC 34a_200011215613_200011218727 [0,1,1,0,0,0|1,0,1]=4 9033 B17R0.8809 CCCCCCCC(C)OCCCOCCCC 7a_200011215613_200011218727 [0,1,1,0,0,0|1,0,1]=4 9034 B17R0.8809 CCCCCCCC(C)OCCNCCCCC 34a_100000224656_200011218727 [0,1,1,0,0,0|1,0,1]=4 9035 B17R0.8809 CCCCCCCC(C)OCCOCCCCC 34a_100011215259_200011218727 [0,1,1,0,0,0|1,0,1]=4 9036 B17R0.8809 CCCCCCCC(C)OCCOCCCCC 7a_100011215259_200011218727 [0,1,1,0,0,0|1,0,1]=4 9037 B17R0.8809 CCCCCCCC=CC(=O)CCCCCCC 1458a_200015332781_100000210614 [0,1,1,0,0,0|1,0,0]=3 9038 B17R0.8809 CCCCCCCC=CC(=O)CCCCCCF 1458a_200015332781_100015922095 [0,1,1,0,0,0|2,0,0]=4 9039 B17R0.8809 CCCCCCCC=CC(=O)CCCCCCO 1458a_200015332781_100000766143 [0,1,1,0,0,0|2,0,0]=4 9040 B17R0.8809 CCCCCCCC=CC(=O)CCOCCCC 1458a_200015332781_100000743108 [0,1,1,0,0,0|2,0,0]=4 9041 B17R0.8809 CCCCCCCC=CC(=O)NCCCCCC 11a_100000210581_200015332781 [0,1,1,0,0,0|1,0,1]=4 9042 B17R0.8809 CCCCCCCC=CC(=O)NCCCCCC 1626a_100000210581_200015332781 [0,1,1,0,0,0|1,0,1]=4 9043 B17R0.8809 CCCCCCCC=CC(=O)NCCCCCC 240690a_100000210581_200015332781 [0,1,1,0,0,0|1,0,1]=4 9044 B17R0.8809 CCCCCCCCCC(=O)CCCCCCF 1458a_100000210558_100015922095 [0,1,1,0,0,0|2,0,0]=4 9045 B17R0.8809 CCCCCCCCCC(=O)CCCCCCO 1458a_100000210558_100000766143 [0,1,1,0,0,0|2,0,0]=4 9046 B17R0.8809 CCCCCCCCCC(=O)CCCCCCO 1458a_100011996774_100000210670 [0,1,1,0,0,0|2,0,0]=4 9047 B17R0.8809 CCCCCCCCCC(=O)CCCCCOC 1458a_100011935119_100000210670 [0,1,1,0,0,0|2,0,0]=4 9048 B17R0.8809 CCCCCCCCCC(=O)CCOCCCC 1458a_100000210558_100000743108 [0,1,1,0,0,0|2,0,0]=4 9049 B17R0.8809 CCCCCCCCCC(=O)NCCCCCC 11a_100000210581_100000210558 [0,1,1,0,0,0|1,0,0]=3 9050 B17R0.8809 CCCCCCCCCC(=O)NCCCCCC 1626a_100000210581_100000210558 [0,1,1,0,0,0|1,0,0]=3 9051 B17R0.8809 CCCCCCCCCC(=O)NCCCCCC 240690a_100000210581_100000210558 [0,1,1,0,0,0|1,0,0]=3 9052 B17R0.8809 CCCCCCCCCC(=O)NCCCCCC 527a_100000210581_100000210558 [0,1,1,0,0,0|1,0,0]=3 9053 B17R0.8809 CCCCCCCCCC(=O)NCCCCCO 240690a_100000762737_100000210558 [0,1,1,0,0,0|2,0,0]=4 9054 B17R0.8809 CCCCCCCCCC(=O)NCCCOCC 11a_100000210961_100000210558 [0,1,1,0,0,0|2,0,0]=4 9055 B17R0.8809 CCCCCCCCCC(=O)NCCCOCC 1626a_100000210961_100000210558 [0,1,1,0,0,0|2,0,0]=4 9056 B17R0.8809 CCCCCCCCCC(=O)NCCCOCC 240690a_100000210961_100000210558 [0,1,1,0,0,0|2,0,0]=4 9057 B17R0.8809 CCCCCCCCCC(=O)NCCCOCC 527a_100000210961_100000210558 [0,1,1,0,0,0|2,0,0]=4 9058 B17R0.8809 CCCCCCCCCC(=O)NCCOCCC 1626a_100161115042_100000210558 [0,1,1,0,0,0|2,0,0]=4 9059 B17R0.8809 CCCCCCCCCC(=O)NCCOCCC 240690a_100161115042_100000210558 [0,1,1,0,0,0|2,0,0]=4 9060 B17R0.8809 CCCCCCCCCC(=O)NCCOCCC 527a_100161115042_100000210558 [0,1,1,0,0,0|2,0,0]=4 9061 B17R0.8809 CCCCCCCCCC(=O)NCCSCCC 11a_100020603323_100000210558 [0,1,1,0,0,0|2,0,0]=4 9062 B17R0.8809 CCCCCCCCCC(=O)NCCSCCC 240690a_100020603323_100000210558 [0,1,1,0,0,0|2,0,0]=4 9063 B17R0.8809 CCCCCCCCCC(=O)NCCSCCC 527a_100020603323_100000210558 [0,1,1,0,0,0|2,0,0]=4 9064 B17R0.8809 CCCCCCCCCC(=O)NNCCCCC 22a_100000694160_100000210558 [0,1,1,0,0,0|2,0,0]=4 9065 B17R0.8809 CCCCCCCCCC(=O)OCNCCCC 2230a_100000102301_200010990708 [0,1,1,0,0,0|1,0,0]=3 9066 B17R0.8809 CCCCCCCCCC(=O)OCNCCCC 7a_106832991798_200010990708 [0,1,1,0,0,0|1,0,0]=3 9067 B17R0.8809 CCCCCCCCCC(=O)OCNCCCF 2230a_100015189416_200010990708 [0,1,1,0,0,0|2,0,0]=4 9068 B17R0.8809 CCCCCCCCCC(=O)OCNCCCF 34a_100015189416_200010990708 [0,1,1,0,0,0|2,0,0]=4 9069 B17R0.8809 CCCCCCCCCC(=O)OCNCCOC 2230a_100000209980_200010990708 [0,1,1,0,0,0|2,0,0]=4 9070 B17R0.8809 CCCCCCCCCC(=O)OCNCCSC 2230a_100020590264_200010990708 [0,1,1,0,0,0|2,0,0]=4 9071 B17R0.8809 CCCCCCCCCC(=O)OCOCCCBr 34a_100011217188_200010990708 [0,1,1,0,0,0|2,0,0]=4 9072 B17R0.8809 CCCCCCCCCC(=O)OCOCCCC 34a_100000210227_200010990708 [0,1,1,0,0,0|1,0,0]=3 9073 B17R0.8809 CCCCCCCCCC(=O)OCOCCCC 7a_100000210227_200010990708 [0,1,1,0,0,0|1,0,0]=3 9074 B17R0.8809 CCCCCCCCCC(=O)OCOCCCCl 34a_100000230001_200010990708 [0,1,1,0,0,0|2,0,0]=4 9075 B17R0.8809 CCCCCCCCCC(=O)OCOCCCF 34a_100000759539_200010990708 [0,1,1,0,0,0|2,0,0]=4 9076 B17R0.8809 CCCCCCCCCC(=O)OCOCCCN 34a_100000182051_200010990708 [0,1,1,0,0,0|2,0,0]=4 9077 B17R0.8809 CCCCCCCCCC(=O)OCOCCOC 34a_100000210237_200010990708 [0,1,1,0,0,0|2,0,0]=4 9078 B17R0.8809 CCCCCCCCCC(=O)OCOCCSC 34a_100000230434_200010990708 [0,1,1,0,0,0|2,0,0]=4 9079 B17R0.8809 CCCCCCCCCC(=O)OCOCCSC 7a_100000230434_200010990708 [0,1,1,0,0,0|2,0,0]=4 9080 B17R0.8809 CCCCCCCCCC(=O)OCSCCCC 62a_100000210211_200010990708 [0,1,1,0,0,0|1,0,0]=3 9081 B17R0.8809 CCCCCCCCCC(=O)OCSCCCF 62a_100011934791_200010990708 [0,1,1,0,0,0|2,0,0]=4 9082 B17R0.8809 CCCCCCCCCC(=O)OCSCCCO 62a_100011215043_200010990708 [0,1,1,0,0,0|2,0,0]=4 9083 B17R0.8809 CCCCCCCCCC(=O)OCSCCOC 62a_100000233755_200010990708 [0,1,1,0,0,0|2,0,0]=4 9084 B17R0.8809 CCCCCCCCCC(=O)OCSCCSC 62a_100000212216_200010990708 [0,1,1,0,0,0|2,0,0]=4 9085 B17R0.8809 CCCCCCCCCC(=O)OCSCOCC 62a_100000739092_200010990708 [0,1,1,0,0,0|2,0,0]=4 9086 B17R0.8809 CCCCCCCCNC(=O)CCCCCCC 11a_100000229939_100000211969 [0,1,1,0,0,0|1,0,0]=3 9087 B17R0.8809 CCCCCCCCNC(=O)CCCCCCC 1626a_100000229939_100000211969 [0,1,1,0,0,0|1,0,0]=3 9088 B17R0.8809 CCCCCCCCNC(=O)CCCCCCC 240690a_100000229939_100000211969 [0,1,1,0,0,0|1,0,0]=3 9089 B17R0.8809 CCCCCCCCNC(=O)CCCCCCC 527a_100000229939_100000211969 [0,1,1,0,0,0|1,0,0]=3 9090 B17R0.8809 CCCCCCCCNC(=O)CCCCCCO 240690a_100000229939_100011996774 [0,1,1,0,0,0|2,0,0]=4 9091 B17R0.8809 CCCCCCCCNC(=O)CCCCCOC 11a_100000229939_100011935119 [0,1,1,0,0,0|2,0,0]=4 9092 B17R0.8809 CCCCCCCCNC(=O)CCCCCOC 1626a_100000229939_100011935119 [0,1,1,0,0,0|2,0,0]=4 9093 B17R0.8809 CCCCCCCCNC(=O)CCCCCOC 240690a_100000229939_100011935119 [0,1,1,0,0,0|2,0,0]=4 9094 B17R0.8809 CCCCCCCCNC(=O)CCCCCOC 527a_100000229939_100011935119 [0,1,1,0,0,0|2,0,0]=4 9095 B17R0.8809 CCCCCCCCNC(=O)NCCCCCC 2708a_100000210581_100000229939 [0,1,1,0,0,0|1,0,0]=3 9096 B17R0.8809 CCCCCCCCNC(=O)NCCCCCC 2708a_100000229939_100000210581 [0,1,1,0,0,0|1,0,0]=3 9097 B17R0.8809 CCCCCCCCNC(=O)NCCCCCC 273464a_100000210581_100000229939 [0,1,1,0,0,0|1,0,0]=3 9098 B17R0.8809 CCCCCCCCNC(=O)NCCCCCC 273464a_100000229939_100000210581 [0,1,1,0,0,0|1,0,0]=3 9099 B17R0.8809 CCCCCCCCNC(=O)NCCCCCC 512a_100000210581_100000229939 [0,1,1,0,0,0|1,0,0]=3 9100 B17R0.8809 CCCCCCCCNC(=O)NCCCCCC 512a_100000229939_100000210581 [0,1,1,0,0,0|1,0,0]=3 9101 B17R0.8809 CCCCCCCCNC(=O)NCCCCCO 2708a_100000229939_100000762737 [0,1,1,0,0,0|2,0,0]=4 9102 B17R0.8809 CCCCCCCCNC(=O)NCCCCCO 273464a_100000229939_100000762737 [0,1,1,0,0,0|2,0,0]=4 9103 B17R0.8809 CCCCCCCCNC(=O)NCCCCCO 273464a_100000762737_100000229939 [0,1,1,0,0,0|2,0,0]=4 9104 B17R0.8809 CCCCCCCCNC(=O)NCCCCCO 512a_100000229939_100000762737 [0,1,1,0,0,0|2,0,0]=4 9105 B17R0.8809 CCCCCCCCNC(=O)NCCCCCO 512a_100000762737_100000229939 [0,1,1,0,0,0|2,0,0]=4 9106 B17R0.8809 CCCCCCCCNC(=O)NCCCOCC 2708a_100000210961_100000229939 [0,1,1,0,0,0|2,0,0]=4 9107 B17R0.8809 CCCCCCCCNC(=O)NCCCOCC 2708a_100000229939_100000210961 [0,1,1,0,0,0|2,0,0]=4 9108 B17R0.8809 CCCCCCCCNC(=O)NCCCOCC 273464a_100000210961_100000229939 [0,1,1,0,0,0|2,0,0]=4 9109 B17R0.8809 CCCCCCCCNC(=O)NCCCOCC 273464a_100000229939_100000210961 [0,1,1,0,0,0|2,0,0]=4 9110 B17R0.8809 CCCCCCCCNC(=O)NCCCOCC 512a_100000210961_100000229939 [0,1,1,0,0,0|2,0,0]=4 9111 B17R0.8809 CCCCCCCCNC(=O)NCCCOCC 512a_100000229939_100000210961 [0,1,1,0,0,0|2,0,0]=4 9112 B17R0.8809 CCCCCCCCNC(=O)NCCOCCC 2708a_100000229939_100161115042 [0,1,1,0,0,0|2,0,0]=4 9113 B17R0.8809 CCCCCCCCNC(=O)NCCOCCC 2708a_100161115042_100000229939 [0,1,1,0,0,0|2,0,0]=4 9114 B17R0.8809 CCCCCCCCNC(=O)NCCOCCC 273464a_100000229939_100161115042 [0,1,1,0,0,0|2,0,0]=4 9115 B17R0.8809 CCCCCCCCNC(=O)NCCOCCC 273464a_100161115042_100000229939 [0,1,1,0,0,0|2,0,0]=4 9116 B17R0.8809 CCCCCCCCNC(=O)NCCOCCC 512a_100000229939_100161115042 [0,1,1,0,0,0|2,0,0]=4 9117 B17R0.8809 CCCCCCCCNC(=O)NCCOCCC 512a_100161115042_100000229939 [0,1,1,0,0,0|2,0,0]=4 9118 B17R0.8809 CCCCCCCCNC(=O)NCCSCCC 2708a_100000229939_100020603323 [0,1,1,0,0,0|2,0,0]=4 9119 B17R0.8809 CCCCCCCCNC(=O)NCCSCCC 2708a_100020603323_100000229939 [0,1,1,0,0,0|2,0,0]=4 9120 B17R0.8809 CCCCCCCCNC(=O)NCCSCCC 273464a_100000229939_100020603323 [0,1,1,0,0,0|2,0,0]=4 9121 B17R0.8809 CCCCCCCCNC(=O)NCCSCCC 273464a_100020603323_100000229939 [0,1,1,0,0,0|2,0,0]=4 9122 B17R0.8809 CCCCCCCCNC(=O)NCCSCCC 512a_100000229939_100020603323 [0,1,1,0,0,0|2,0,0]=4 9123 B17R0.8809 CCCCCCCCNC(=O)NCCSCCC 512a_100020603323_100000229939 [0,1,1,0,0,0|2,0,0]=4 9124 B17R0.8809 CCCCCCCCNC(=O)NNCCCCC 273464a_100000229939_100000694160 [0,1,1,0,0,0|2,0,0]=4 9125 B17R0.8809 CCCCCCCCNC(=O)NNCCCCC 512a_100000229939_100000694160 [0,1,1,0,0,0|2,0,0]=4 9126 B17R0.8809 CCCCCCCCNC(=O)NNCCCCC 512a_100000694160_100000229939 [0,1,1,0,0,0|2,0,0]=4 9127 B17R0.8809 CCCCCCCNCC(=O)NCCCCCC 2230a_100000229938_100000230325 [0,1,1,0,0,0|1,0,0]=3 9128 B17R0.8809 CCCCCCCOCC(=O)NCCCCCC 34a_100000210272_100000230325 [0,1,1,0,0,0|1,0,0]=3 9129 B17R0.8809 CCCCCCCOCC(=O)NCCCCCC 7a_100000210272_100000230325 [0,1,1,0,0,0|1,0,0]=3 9130 B17R0.8809 CCCCCCCSCC(=O)NCCCCCC 62a_100000230325_100000210316 [0,1,1,0,0,0|1,0,0]=3 9131 B17R0.8809 CCCCCCNC(=O)CCCCCCCCO 240690a_100000210581_100000015970 [0,1,1,0,0,0|1,0,0]=3 9132 B17R0.8809 CCCCCCNC(=O)CNCCCCCCO 2230a_100000686447_100000230325 [0,1,1,0,0,0|2,0,0]=4 9133 B17R0.8809 CCCCCCNC(=O)CNCCCCCCO 34a_100000686447_100000230325 [0,1,1,0,0,0|2,0,0]=4 9134 B17R0.8809 CCCCCCNC(=O)CNCCCCCOC 2230a_100000747528_100000230325 [0,1,1,0,0,0|2,0,0]=4 9135 B17R0.8809 CCCCCCNC(=O)CNCCCCCOC 34a_100000747528_100000230325 [0,1,1,0,0,0|2,0,0]=4 9136 B17R0.8809 CCCCCCNC(=O)CNCCCOCCC 2230a_100011217757_100000230325 [0,1,1,0,0,0|2,0,0]=4 9137 B17R0.8809 CCCCCCNC(=O)CNCCCOCCC 34a_100011217757_100000230325 [0,1,1,0,0,0|2,0,0]=4 9138 B17R0.8809 CCCCCCNC(=O)CNCCSCCCC 2230a_100025743550_100000230325 [0,1,1,0,0,0|2,0,0]=4 9139 B17R0.8809 CCCCCCNC(=O)COCCCCCCBr 34a_100011215345_100000230325 [0,1,1,0,0,0|2,0,0]=4 9140 B17R0.8809 CCCCCCNC(=O)COCCCCCCBr 7a_100011215345_100000230325 [0,1,1,0,0,0|2,0,0]=4 9141 B17R0.8809 CCCCCCNC(=O)COCCCCCCCl 34a_100000766143_100000230325 [0,1,1,0,0,0|2,0,0]=4 9142 B17R0.8809 CCCCCCNC(=O)COCCCCCCCl 7a_100000766143_100000230325 [0,1,1,0,0,0|2,0,0]=4 9143 B17R0.8809 CCCCCCNC(=O)COCCCCCCF 34a_100000732779_100000230325 [0,1,1,0,0,0|2,0,0]=4 9144 B17R0.8809 CCCCCCNC(=O)COCCCCCCF 7a_100000732779_100000230325 [0,1,1,0,0,0|2,0,0]=4 9145 B17R0.8809 CCCCCCNC(=O)COCCCCCCN 34a_100000686447_100000230325 [0,1,1,0,0,0|2,0,0]=4 9146 B17R0.8809 CCCCCCNC(=O)COCCCCCNC 34a_100000722520_100000230325 [0,1,1,0,0,0|2,0,0]=4 9147 B17R0.8809 CCCCCCNC(=O)COCCOCCCC 11a_100000210581_100011216887 [0,1,1,0,0,0|2,0,0]=4 9148 B17R0.8809 CCCCCCNC(=O)COCCOCCCC 1626a_100000210581_100011216887 [0,1,1,0,0,0|2,0,0]=4 9149 B17R0.8809 CCCCCCNC(=O)COCCOCCCC 240690a_100000210581_100011216887 [0,1,1,0,0,0|2,0,0]=4 9150 B17R0.8809 CCCCCCNC(=O)COCCOCCCC 34a_100000210238_100000230325 [0,1,1,0,0,0|2,0,0]=4 9151 B17R0.8809 CCCCCCNC(=O)COCCOCCCC 527a_100000210581_100011216887 [0,1,1,0,0,0|2,0,0]=4 9152 B17R0.8809 CCCCCCNC(=O)COCCOCCCC 7a_100000210238_100000230325 [0,1,1,0,0,0|2,0,0]=4 9153 B17R0.8809 CCCCCCNC(=O)COCCSCCCC 34a_200000230436_100000230325 [0,1,1,0,0,0|2,0,0]=4 9154 B17R0.8809 CCCCCCNC(=O)COCCSCCCC 7a_200000230436_100000230325 [0,1,1,0,0,0|2,0,0]=4 9155 B17R0.8809 CCCCCCNC(=O)CSCCCCCCF 62a_100000230325_100015922095 [0,1,1,0,0,0|2,0,0]=4 9156 B17R0.8809 CCCCCCNC(=O)CSCCCCCCO 62a_100000230325_100000766143 [0,1,1,0,0,0|2,0,0]=4 9157 B17R0.8809 CCCCCCNC(=O)CSCCOCCCC 62a_100000230325_100000743108 [0,1,1,0,0,0|2,0,0]=4 9158 B17R0.8809 CCCCCCNC(=O)NCCCCCCCO 2708a_100000210581_100011996573 [0,1,1,0,0,0|2,0,0]=4 9159 B17R0.8809 CCCCCCNC(=O)NCCCCCCCO 2708a_100011996573_100000210581 [0,1,1,0,0,0|2,0,0]=4 9160 B17R0.8809 CCCCCCNC(=O)NCCCCCCCO 273464a_100000210581_100011996573 [0,1,1,0,0,0|2,0,0]=4 9161 B17R0.8809 CCCCCCNC(=O)NCCCCCCCO 273464a_100011996573_100000210581 [0,1,1,0,0,0|2,0,0]=4 9162 B17R0.8809 CCCCCCNC(=O)NCCCCCCCO 512a_100000210581_100011996573 [0,1,1,0,0,0|2,0,0]=4 9163 B17R0.8809 CCCCCCNC(=O)NCCCCCCCO 512a_100011996573_100000210581 [0,1,1,0,0,0|2,0,0]=4 9164 B17R0.8809 CCCCCCNC(=O)NCCCOCCCC 2708a_100000210581_200000211371 [0,1,1,0,0,0|2,0,0]=4 9165 B17R0.8809 CCCCCCNC(=O)NCCCOCCCC 2708a_200000211371_100000210581 [0,1,1,0,0,0|2,0,0]=4 9166 B17R0.8809 CCCCCCNC(=O)NCCCOCCCC 273464a_100000210581_200000211371 [0,1,1,0,0,0|2,0,0]=4 9167 B17R0.8809 CCCCCCNC(=O)NCCCOCCCC 273464a_200000211371_100000210581 [0,1,1,0,0,0|2,0,0]=4 9168 B17R0.8809 CCCCCCNC(=O)NCCCOCCCC 512a_100000210581_200000211371 [0,1,1,0,0,0|2,0,0]=4 9169 B17R0.8809 CCCCCCNC(=O)NCCCOCCCC 512a_200000211371_100000210581 [0,1,1,0,0,0|2,0,0]=4 9170 B17R0.8809 CCCCCNNC(=O)CCCCCCCCO 22a_100000694160_100000015970 [0,1,1,0,0,0|2,0,0]=4 9171 B17R0.8809 CCCCOCCCNC(=O)CCCCCCO 240690a_200000211371_100011996774 [0,1,1,0,0,0|2,0,0]=4 9172 B17R0.8809 CCCCOCCCNC(=O)CCCCCOC 1626a_200000211371_100011935119 [0,1,1,0,0,0|2,0,0]=4 9173 B17R0.8809 CCCCOCCCNC(=O)CCCCCOC 240690a_200000211371_100011935119 [0,1,1,0,0,0|2,0,0]=4 9174 B17R0.8809 CCCCOCCCNC(=O)CCCCCOC 527a_200000211371_100011935119 [0,1,1,0,0,0|2,0,0]=4 9175 B17R0.8809 CCCCOCCOCC(=O)CCCCCCF 1458a_100011216887_100015922095 [0,1,1,0,0,0|2,0,0]=4 9176 B17R0.8809 CCCCOCCOCC(=O)CCCCCCO 1458a_100011216887_100000766143 [0,1,1,0,0,0|2,0,0]=4 9177 B17R0.8809 CCCCOCCOCC(=O)CCOCCCC 1458a_100011216887_100000743108 [0,1,1,0,0,0|2,0,0]=4 9178 B17R0.8809 CCCOCCNC(=O)CCCCCCCCO 240690a_100161115042_100000015970 [0,1,1,0,0,0|2,0,0]=4 9179 B17R0.8809 CCCSCCNC(=O)CCCCCCCCO 240690a_100020603323_100000015970 [0,1,1,0,0,0|2,0,0]=4 9180 B17R0.8809 CCOCCCNC(=O)CCCCCCCCO 240690a_100000210961_100000015970 [0,1,1,0,0,0|2,0,0]=4 9181 B17R0.8809 COCCCCCC(=O)CCCCCCCCO 1458a_100011935119_100000033203 [0,1,1,0,0,0|2,0,0]=4 9182 B17R0.8809 COCCCCCC(=O)NCCCCCCCO 240690a_100011996573_100011935119 [0,1,1,0,0,0|2,0,0]=4 9183 B17R0.8809 O=C(CCCCCCCCO)NCCCCCO 240690a_100000762737_100000015970 [0,1,1,0,0,0|2,0,0]=4 9184 B17R0.8809 O=C(CCCCCCO)CCCCCCCCO 1458a_100011996774_100000033203 [0,1,1,0,0,0|2,0,0]=4 9185 B17R0.8809 O=C(CCCCCCO)NCCCCCCCO 240690a_100011996573_100011996774 [0,1,1,0,0,0|2,0,0]=4 9186 B17R0.13545 CCCCCC#CC(=O)C(C)CCCCCCC 1458a_100011215388_200011218727 [0,1,1,0,0,0|1,0,1]=4 9187 B17R0.13545 CCCCCC=CC(=O)C(C)CCCCCCC 1458a_100016263427_200011218727 [0,1,1,0,0,0|1,0,1]=4 9188 B17R0.13545 CCCCCCCC(=O)C(C)CCCCCCC 1458a_100000211969_200011218727 [0,1,1,0,0,0|1,0,0]=3 9189 B17R0.13545 CCCCCCCC(=O)N(C)CCCCCCC 11a_100000228206_100000211969 [0,1,1,0,0,0|1,0,0]=3 9190 B17R0.13545 CCCCCCCC(=O)N(C)CCCCCCC 1626a_100000228206_100000211969 [0,1,1,0,0,0|1,0,0]=3 9191 B17R0.13545 CCCCCCCC(=O)N(C)CCCCCCC 240690a_100000228206_100000211969 [0,1,1,0,0,0|1,0,0]=3 9192 B17R0.13545 CCCCCCCC(=O)N(C)CCCCCCC 527a_100000228206_100000211969 [0,1,1,0,0,0|1,0,0]=3 9193 B17R0.13545 CCCCCCCC(C)C(=O)CCCCCCO 1458a_100011996774_200011218727 [0,1,1,0,0,0|2,0,0]=4 9194 B17R0.13545 CCCCCCCC(C)C(=O)CCCCCOC 1458a_100011935119_200011218727 [0,1,1,0,0,0|2,0,0]=4 9195 B17R0.13545 CCCCCCCN(C)C(=O)CCCCCCO 240690a_100000228206_100011996774 [0,1,1,0,0,0|2,0,0]=4 9196 B17R0.13545 CCCCCCCN(C)C(=O)CCCCCOC 11a_100000228206_100011935119 [0,1,1,0,0,0|2,0,0]=4 9197 B17R0.13545 CCCCCCCN(C)C(=O)CCCCCOC 1626a_100000228206_100011935119 [0,1,1,0,0,0|2,0,0]=4 9198 B17R0.13545 CCCCCCCN(C)C(=O)CCCCCOC 240690a_100000228206_100011935119 [0,1,1,0,0,0|2,0,0]=4 9199 B17R0.13545 CCCCCCCN(C)C(=O)CCCCCOC 527a_100000228206_100011935119 [0,1,1,0,0,0|2,0,0]=4 9200 B17R0.13545 CCCCCCCN(C)C(=O)NCCCCCC 2708a_100000210581_100000228206 [0,1,1,0,0,0|2,0,0]=4 9201 B17R0.13545 CCCCCCCN(C)C(=O)NCCCCCC 273464a_100000210581_100000228206 [0,1,1,0,0,0|2,0,0]=4 9202 B17R0.133 CCCCCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000210757 [0,1,1,0,0,0|0,0,1]=3 9203 B17R0.133 CCCCCCC(=O)CCCCCCC(=O)OC 1458a_100102632555_100009815986 [0,1,1,0,0,0|0,0,1]=3 9204 B17R0.133 CCCCCCC(=O)NCCCCCC(=O)OC 188690a_100000184999_100102632555 [0,1,1,0,0,0|1,0,1]=4 9205 B17R0.133 CCCCCCC(C)CCOCCCC(=O)NC 34a_200011024964_100000741757 [0,1,1,0,0,0|2,0,0]=4 9206 B17R0.133 CCCCCCC(C)CCOCCCC(=O)NC 7a_200011024964_100000741757 [0,1,1,0,0,0|2,0,0]=4 9207 B17R0.133 CCCCCCC(C)CCOCCCC(=O)OC 34a_200011024964_100000742333 [0,1,1,0,0,0|1,0,0]=3 9208 B17R0.133 CCCCCCC(C)CCOCCCC(=O)OC 7a_200011024964_100011218270 [0,1,1,0,0,0|1,0,0]=3 9209 B17R0.133 CCCCCCC(C)CCOCCOC(=O)NC 34a_200011024964_200011997002 [0,1,1,0,0,0|2,0,0]=4 9210 B17R0.133 CCCCCCC(C)CCOCCOC(=O)NC 7a_200011024964_200011997002 [0,1,1,0,0,0|2,0,0]=4 9211 B17R0.133 CCCCCCC(C)NCCCCCC(=O)OC 2230a_100000210919_100009816466 [0,1,1,0,0,0|1,0,0]=3 9212 B17R0.133 CCCCCCC(C)NCCCCCC(=O)OC 34a_100000210919_100009816466 [0,1,1,0,0,0|1,0,0]=3 9213 B17R0.133 CCCCCCC(C)OCCCCCC(=O)OC 34a_100000074720_100011215978 [0,1,1,0,0,0|1,0,0]=3 9214 B17R0.133 CCCCCCC(C)OCCCCCC(=O)OC 34a_100000210265_100009816466 [0,1,1,0,0,0|1,0,0]=3 9215 B17R0.133 CCCCCCC(C)OCCCCCC(=O)OC 7a_100000074720_100011215978 [0,1,1,0,0,0|1,0,0]=3 9216 B17R0.133 CCCCCCC(C)OCCCCCC(=O)OC 7a_100000210265_100009816466 [0,1,1,0,0,0|1,0,0]=3 9217 B17R0.133 CCCCCCC(C)SCCCCCC(=O)OC 62a_100009816466_100011215978 [0,1,1,0,0,0|1,0,0]=3 9218 B17R0.133 CCCCCCC(C)SCCCCCC(=O)OC 62a_100011215978_100009816466 [0,1,1,0,0,0|1,0,0]=3 9219 B17R0.133 CCCCCCN(C)CCCCCCC(=O)OC 2230a_106256046315_100009815986 [0,1,1,0,0,0|1,0,0]=3 9220 B17R0.133 CCCCCCN(C)CCCCCCC(=O)OC 269982a_106256046315_100009815986 [0,1,1,0,0,0|1,0,0]=3 9221 B17R0.133 CCCCCNC(=O)CCCCCCC(=O)OC 11a_100000209983_100000036694 [0,1,1,0,0,0|1,0,1]=4 9222 B17R0.133 CCCCCNC(=O)CCCCCCC(=O)OC 1626a_100000209983_100000036694 [0,1,1,0,0,0|1,0,1]=4 9223 B17R0.133 CCCCCNC(=O)CCCCCCC(=O)OC 240690a_100000209983_100000036694 [0,1,1,0,0,0|1,0,1]=4 9224 B17R0.133 CCCCOCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100011995733 [0,1,1,0,0,0|1,0,1]=4 9225 B17R0.133 CCCCOCC(=O)CCCCCCC(=O)OC 1458a_100000757543_100009815986 [0,1,1,0,0,0|1,0,1]=4 9226 B17R0.133 CCCCOCC(C)OCCCCCC(=O)OC 34a_100011217071_100009816466 [0,1,1,0,0,0|2,0,0]=4 9227 B17R0.133 CCCCOCC(C)OCCCCCC(=O)OC 7a_100011217071_100009816466 [0,1,1,0,0,0|2,0,0]=4 9228 B17R0.133 CCCCSCC(=O)CCCCCCC(=O)OC 1458a_100000191162_100009815986 [0,1,1,0,0,0|1,0,1]=4 9229 B17R0.133 CCCOCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100011215938 [0,1,1,0,0,0|1,0,1]=4 9230 B17R0.133 CCOCCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100012232248 [0,1,1,0,0,0|1,0,1]=4 9231 B17R0.133 COC(=O)CCCCCCC(=O)CCCCCF 1458a_100000036694_100000729378 [0,1,1,0,0,0|1,0,1]=4 9232 B17R0.133 COC(=O)CCCCCCC(=O)CCCCCO 1458a_100000036694_100000746330 [0,1,1,0,0,0|1,0,1]=4 9233 B17R0.133 COC(=O)CCCCCCC(=O)CCCCCO 1458a_100102619762_100009815986 [0,1,1,0,0,0|1,0,1]=4 9234 B17R0.133 COC(=O)CCCCCCN(C)CCCCCO 2230a_100000722520_100009815986 [0,1,1,0,0,0|2,0,0]=4 9235 B17R0.133 COC(=O)CCCCCCN(C)CCCCCO 269982a_100000722520_100009815986 [0,1,1,0,0,0|2,0,0]=4 9236 B17R0.133 COCCCCC(=O)CCCCCCC(=O)OC 1458a_100000036694_100000755781 [0,1,1,0,0,0|1,0,1]=4 9237 B17R0.195 C#CC(=O)CCCCCCCCCCCCCC 1458a_100000211873_100011215471 [0,1,1,0,0,0|1,0,1]=4 9238 B17R0.195 C#CC(=O)CCCCCCCCCCCCCO 1458a_100000211873_100009812470 [0,1,1,0,0,0|1,0,1]=4 9239 B17R0.195 C#CCCCCCCCCCCOCC(=O)CC 7a_100000054667_100000747405 [0,1,1,0,0,0|0,0,2]=4 9240 B17R0.195 C#CCCCCCCCCCCOCC(=O)OC 34a_100000054667_100000747449 [0,1,1,0,0,0|0,0,2]=4 9241 B17R0.195 C#CCCCCCCCCCCOCC(=O)OC 7a_100000054667_100000747449 [0,1,1,0,0,0|0,0,2]=4 9242 B17R0.195 C#CCCCCCCCCCOCCC(=O)OC 34a_100000034437_100000742370 [0,1,1,0,0,0|0,0,2]=4 9243 B17R0.195 C#CCCCCCCCCCOCCC(=O)OC 7a_100000034437_100000204255 [0,1,1,0,0,0|0,0,2]=4 9244 B17R0.195 C#CCCCCCCCCOCCCC(=O)OC 34a_100000065265_100000742333 [0,1,1,0,0,0|0,0,2]=4 9245 B17R0.195 C#CCCCCCCCCOCCCC(=O)OC 7a_100000065265_100011218270 [0,1,1,0,0,0|0,0,2]=4 9246 B17R0.195 C#CCCCCCCCOCCCCC(=O)OC 34a_100000054614_100000204269 [0,1,1,0,0,0|0,0,2]=4 9247 B17R0.195 C#CCCCCCCCOCCCCC(=O)OC 34a_100000059025_100153394163 [0,1,1,0,0,0|0,0,2]=4 9248 B17R0.195 C#CCCCCCCCOCCCCC(=O)OC 7a_100000054614_100000204269 [0,1,1,0,0,0|0,0,2]=4 9249 B17R0.195 C#CCCCCCCCOCCCCC(=O)OC 7a_100000059025_100153394163 [0,1,1,0,0,0|0,0,2]=4 9250 B17R0.195 C#CCCCCCCCSCCCCC(=O)OC 62a_100000204269_100153394163 [0,1,1,0,0,0|0,0,2]=4 9251 B17R0.195 C#CCCCCCCCSCCCCC(=O)OC 62a_100153394163_100000204269 [0,1,1,0,0,0|0,0,2]=4 9252 B17R0.195 C#CCCCCCCOCCCCCC(=O)OC 34a_100000074720_100012276617 [0,1,1,0,0,0|0,0,2]=4 9253 B17R0.195 C#CCCCCCCOCCCCCC(=O)OC 34a_100011217361_100009816466 [0,1,1,0,0,0|0,0,2]=4 9254 B17R0.195 C#CCCCCCCOCCCCCC(=O)OC 7a_100000074720_100012276617 [0,1,1,0,0,0|0,0,2]=4 9255 B17R0.195 C#CCCCCCCOCCCCCC(=O)OC 7a_100011217361_100009816466 [0,1,1,0,0,0|0,0,2]=4 9256 B17R0.195 C#CCCCCCCSCCCCCC(=O)OC 62a_100009816466_100012276617 [0,1,1,0,0,0|0,0,2]=4 9257 B17R0.195 C#CCCCCCCSCCCCCC(=O)OC 62a_100012276617_100009816466 [0,1,1,0,0,0|0,0,2]=4 9258 B17R0.195 C#CCCCCCOCCCCCCC(=O)OC 34a_100000766912_100009815986 [0,1,1,0,0,0|0,0,2]=4 9259 B17R0.195 C#CCCCCCOCCCCCCC(=O)OC 34a_100009863599_100012094781 [0,1,1,0,0,0|0,0,2]=4 9260 B17R0.195 C#CCCCCCOCCCCCCC(=O)OC 7a_100000766912_100009815986 [0,1,1,0,0,0|0,0,2]=4 9261 B17R0.195 C#CCCCCCOCCCCCCC(=O)OC 7a_100009863599_100012094781 [0,1,1,0,0,0|0,0,2]=4 9262 B17R0.195 C#CCCCCCSCCCCCCC(=O)OC 62a_100009815986_100012094781 [0,1,1,0,0,0|0,0,2]=4 9263 B17R0.195 C#CCCCCCSCCCCCCC(=O)OC 62a_100012094781_100009815986 [0,1,1,0,0,0|0,0,2]=4 9264 B17R0.195 C#CCCCCNCCCCCCCC(=O)OC 2230a_100000706060_100010004213 [0,1,1,0,0,0|0,0,2]=4 9265 B17R0.195 C#CCCCCNCCCCCCCC(=O)OC 34a_100000706060_100010004213 [0,1,1,0,0,0|0,0,2]=4 9266 B17R0.195 C#CCCCCOCCCCCCCC(=O)OC 34a_100000766709_100010004213 [0,1,1,0,0,0|0,0,2]=4 9267 B17R0.195 C#CCCCCOCCCCCCCC(=O)OC 34a_100011022521_100010269958 [0,1,1,0,0,0|0,0,2]=4 9268 B17R0.195 C#CCCCCOCCCCCCCC(=O)OC 7a_100000766709_100010004213 [0,1,1,0,0,0|0,0,2]=4 9269 B17R0.195 C#CCCCCOCCCCCCCC(=O)OC 7a_100011022521_100010269958 [0,1,1,0,0,0|0,0,2]=4 9270 B17R0.195 C#CCCCCSCCCCCCCC(=O)OC 62a_100010004213_100010269958 [0,1,1,0,0,0|0,0,2]=4 9271 B17R0.195 C#CCCCCSCCCCCCCC(=O)OC 62a_100010269958_100010004213 [0,1,1,0,0,0|0,0,2]=4 9272 B17R0.195 C#CCCCNCCCCCCCCC(=O)OC 34a_100000718082_100010282707 [0,1,1,0,0,0|0,0,2]=4 9273 B17R0.195 C#CCCCOCCCCCCCCC(=O)OC 34a_100000035544_100000695029 [0,1,1,0,0,0|0,0,2]=4 9274 B17R0.195 C#CCCCOCCCCCCCCC(=O)OC 34a_100000215630_100010282707 [0,1,1,0,0,0|0,0,2]=4 9275 B17R0.195 C#CCCCOCCCCCCCCC(=O)OC 7a_100000035544_100011215417 [0,1,1,0,0,0|0,0,2]=4 9276 B17R0.195 C#CCCCOCCCCCCCCC(=O)OC 7a_100000215630_100010282707 [0,1,1,0,0,0|0,0,2]=4 9277 B17R0.195 C#CCCCSCCCCCCCCC(=O)OC 62a_100010282707_100011215417 [0,1,1,0,0,0|0,0,2]=4 9278 B17R0.195 C#CCCCSCCCCCCCCC(=O)OC 62a_100011215417_100010282707 [0,1,1,0,0,0|0,0,2]=4 9279 B17R0.195 C#CCCNCCCCCCCCCC(=O)OC 34a_100000755551_100009813843 [0,1,1,0,0,0|0,0,2]=4 9280 B17R0.195 C#CCCOCCCCCCCCCC(=O)OC 34a_100011215631_100009813843 [0,1,1,0,0,0|0,0,2]=4 9281 B17R0.195 C#CCCSCCCCCCCCCC(=O)OC 62a_100000688953_100009813843 [0,1,1,0,0,0|0,0,2]=4 9282 B17R0.195 C#CCNCCCCCCCCCCC(=O)OC 34a_100000212058_100009812566 [0,1,1,0,0,0|0,0,2]=4 9283 B17R0.195 C#CCOCCCCCCCCCCC(=O)OC 34a_100000210247_100009812566 [0,1,1,0,0,0|0,0,2]=4 9284 B17R0.195 C#CCOCCCCCCCCCCC(=O)OC 34a_100011003013_100000184674 [0,1,1,0,0,0|0,0,2]=4 9285 B17R0.195 C#CCOCCCCCCCCCCC(=O)OC 7a_100011003013_100000038162 [0,1,1,0,0,0|0,0,2]=4 9286 B17R0.195 C#CCSCCCCCCCCCCC(=O)OC 62a_100000038162_100009812566 [0,1,1,0,0,0|0,0,2]=4 9287 B17R0.195 C/C=C/CCOCCCCCCCCC(=O)OC 34a_100016278192_100010282707 [0,1,1,0,0,0|0,0,2]=4 9288 B17R0.195 C/C=C/COCCCCCCCCCC(=O)OC 34a_100016270725_100009813843 [0,1,1,0,0,0|0,0,2]=4 9289 B17R0.195 C/C=C/CSCCCCCCCCCC(=O)OC 62a_100102629194_100009813843 [0,1,1,0,0,0|0,0,2]=4 9290 B17R0.195 C=CC(=O)CCCCCCCCCCCCCC 1458a_100000185746_100011215471 [0,1,1,0,0,0|1,0,1]=4 9291 B17R0.195 C=CC(=O)CCCCCCCCCCCCCO 1458a_100000185746_100009812470 [0,1,1,0,0,0|1,0,1]=4 9292 B17R0.195 C=CC(=O)NCCCCCCCCCCCCC 1626a_100011215765_100000185746 [0,1,1,0,0,0|1,0,1]=4 9293 B17R0.195 C=CC(=O)NCCCCCCCCCCCCC 240690a_100011215765_200121576911 [0,1,1,0,0,0|1,0,1]=4 9294 B17R0.195 C=CC(=O)OCCCCCCNCCCCCC 2230a_100000210581_100009894100 [0,1,1,0,0,0|0,0,2]=4 9295 B17R0.195 C=CC(=O)OCCCCCCOCCCCCC 34a_100000210259_100009894100 [0,1,1,0,0,0|0,0,2]=4 9296 B17R0.195 C=CC(=O)OCCCCCCOCCCCCC 7a_100000210259_100009894100 [0,1,1,0,0,0|0,0,2]=4 9297 B17R0.195 C=CC(=O)OCCCCCCSCCCCCC 62a_100000210314_100009894100 [0,1,1,0,0,0|0,0,2]=4 9298 B17R0.195 C=CC(=O)OCCCCCCSCCCCCC 62a_100009894100_100000210757 [0,1,1,0,0,0|0,0,2]=4 9299 B17R0.195 C=CC(=O)OCCCCCOCCCCCCC 7a_200011023508_100000210614 [0,1,1,0,0,0|0,0,2]=4 9300 B17R0.195 C=CC(=O)OCCNCCCCCCCCCC 2230a_100000684558_100009813456 [0,1,1,0,0,0|0,0,2]=4 9301 B17R0.195 C=CC(=O)OCCNCCCCCCCCCC 34a_100000684558_100009813456 [0,1,1,0,0,0|0,0,2]=4 9302 B17R0.195 C=CC(=O)OCCOCCCCCCCCCC 34a_100000210711_100009813456 [0,1,1,0,0,0|0,0,2]=4 9303 B17R0.195 C=CC(=O)OCCOCCCCCCCCCC 7a_100000210711_100009813456 [0,1,1,0,0,0|0,0,2]=4 9304 B17R0.195 C=CC(=O)OCCSCCCCCCCCCC 62a_100009813456_100000210320 [0,1,1,0,0,0|0,0,2]=4 9305 B17R0.195 C=CCCCCCCCCCCOCC(=O)CC 34a_100000725409_100011093070 [0,1,1,0,0,0|0,0,2]=4 9306 B17R0.195 C=CCCCCCCCCCCSCC(=O)OC 62a_100000747449_100011093070 [0,1,1,0,0,0|0,0,2]=4 9307 B17R0.195 C=CCCCCCCCCCCSCC(=O)OC 62a_100011093070_100000747449 [0,1,1,0,0,0|0,0,2]=4 9308 B17R0.195 C=CCCCCCCCCCNCCC(=O)OC 2230a_100000081888_100000204255 [0,1,1,0,0,0|0,0,2]=4 9309 B17R0.195 C=CCCCCCCCCCNCCC(=O)OC 34a_100000081888_100000742370 [0,1,1,0,0,0|0,0,2]=4 9310 B17R0.195 C=CCCCCCCCCCOCCC(=O)OC 34a_100000038209_100000742370 [0,1,1,0,0,0|0,0,2]=4 9311 B17R0.195 C=CCCCCCCCCCOCCC(=O)OC 7a_100000038209_100000204255 [0,1,1,0,0,0|0,0,2]=4 9312 B17R0.195 C=CCCCCCCCCCSCCC(=O)OC 62a_100000204255_100009814027 [0,1,1,0,0,0|0,0,2]=4 9313 B17R0.195 C=CCCCCCCCCCSCCC(=O)OC 62a_100009814027_100000204255 [0,1,1,0,0,0|0,0,2]=4 9314 B17R0.195 C=CCCCCCCCCOCCCC(=O)OC 34a_100011215194_100000742333 [0,1,1,0,0,0|0,0,2]=4 9315 B17R0.195 C=CCCCCCCCCOCCCC(=O)OC 7a_100011215194_100011218270 [0,1,1,0,0,0|0,0,2]=4 9316 B17R0.195 C=CCCCCCCCCOCCOC(=O)CC 7a_200000031056_100011933949 [0,1,1,0,0,0|0,0,2]=4 9317 B17R0.195 C=CCCCCCCCCSCCCC(=O)OC 62a_100011218270_100011933949 [0,1,1,0,0,0|0,0,2]=4 9318 B17R0.195 C=CCCCCCCCCSCCCC(=O)OC 62a_100011933949_100011218270 [0,1,1,0,0,0|0,0,2]=4 9319 B17R0.195 C=CCCCCCCCOCCCCC(=O)OC 34a_100000059025_100012355270 [0,1,1,0,0,0|0,0,2]=4 9320 B17R0.195 C=CCCCCCCCOCCCCC(=O)OC 34a_100000730831_100000204269 [0,1,1,0,0,0|0,0,2]=4 9321 B17R0.195 C=CCCCCCCCOCCCCC(=O)OC 7a_100000059025_100012355270 [0,1,1,0,0,0|0,0,2]=4 9322 B17R0.195 C=CCCCCCCCOCCCCC(=O)OC 7a_100000730831_100000204269 [0,1,1,0,0,0|0,0,2]=4 9323 B17R0.195 C=CCCCCCCCSCCCCC(=O)OC 62a_100000204269_100012355270 [0,1,1,0,0,0|0,0,2]=4 9324 B17R0.195 C=CCCCCCCCSCCCCC(=O)OC 62a_100012355270_100000204269 [0,1,1,0,0,0|0,0,2]=4 9325 B17R0.195 C=CCCCCCCOCCCCCC(=O)OC 34a_100000074720_100011215473 [0,1,1,0,0,0|0,0,2]=4 9326 B17R0.195 C=CCCCCCCOCCCCCC(=O)OC 34a_200011216477_100009816466 [0,1,1,0,0,0|0,0,2]=4 9327 B17R0.195 C=CCCCCCCOCCCCCC(=O)OC 7a_100000074720_100011215473 [0,1,1,0,0,0|0,0,2]=4 9328 B17R0.195 C=CCCCCCCOCCCCCC(=O)OC 7a_200011216477_100009816466 [0,1,1,0,0,0|0,0,2]=4 9329 B17R0.195 C=CCCCCCCSCCCCCC(=O)OC 62a_100009816466_100011215473 [0,1,1,0,0,0|0,0,2]=4 9330 B17R0.195 C=CCCCCCCSCCCCCC(=O)OC 62a_100011215473_100009816466 [0,1,1,0,0,0|0,0,2]=4 9331 B17R0.195 C=CCCCCCOCCCCCCC(=O)OC 34a_100009863599_100000700193 [0,1,1,0,0,0|0,0,2]=4 9332 B17R0.195 C=CCCCCCOCCCCCCC(=O)OC 34a_100011216702_100009815986 [0,1,1,0,0,0|0,0,2]=4 9333 B17R0.195 C=CCCCCCOCCCCCCC(=O)OC 7a_100009863599_100000700193 [0,1,1,0,0,0|0,0,2]=4 9334 B17R0.195 C=CCCCCCOCCCCCCC(=O)OC 7a_100011216702_100009815986 [0,1,1,0,0,0|0,0,2]=4 9335 B17R0.195 C=CCCCCCSCCCCCCC(=O)OC 62a_100000700193_100009815986 [0,1,1,0,0,0|0,0,2]=4 9336 B17R0.195 C=CCCCCCSCCCCCCC(=O)OC 62a_100009815986_100000700193 [0,1,1,0,0,0|0,0,2]=4 9337 B17R0.195 C=CCCCCNCCCCCCCC(=O)OC 2230a_100000703577_100010004213 [0,1,1,0,0,0|0,0,2]=4 9338 B17R0.195 C=CCCCCNCCCCCCCC(=O)OC 34a_100000703577_100010004213 [0,1,1,0,0,0|0,0,2]=4 9339 B17R0.195 C=CCCCCOCCCCCCCC(=O)OC 34a_100000766645_100010004213 [0,1,1,0,0,0|0,0,2]=4 9340 B17R0.195 C=CCCCCOCCCCCCCC(=O)OC 34a_100011022521_100011215482 [0,1,1,0,0,0|0,0,2]=4 9341 B17R0.195 C=CCCCCOCCCCCCCC(=O)OC 7a_100000766645_100010004213 [0,1,1,0,0,0|0,0,2]=4 9342 B17R0.195 C=CCCCCOCCCCCCCC(=O)OC 7a_100011022521_100011215482 [0,1,1,0,0,0|0,0,2]=4 9343 B17R0.195 C=CCCCCSCCCCCCCC(=O)OC 62a_100010004213_100011215482 [0,1,1,0,0,0|0,0,2]=4 9344 B17R0.195 C=CCCCCSCCCCCCCC(=O)OC 62a_100011215482_100010004213 [0,1,1,0,0,0|0,0,2]=4 9345 B17R0.195 C=CCCCNCCCCCCCCC(=O)OC 2230a_100000700776_100010282707 [0,1,1,0,0,0|0,0,2]=4 9346 B17R0.195 C=CCCCNCCCCCCCCC(=O)OC 34a_100000700776_100010282707 [0,1,1,0,0,0|0,0,2]=4 9347 B17R0.195 C=CCCCOCCCCCCCCC(=O)OC 34a_100000035544_100000757094 [0,1,1,0,0,0|0,0,2]=4 9348 B17R0.195 C=CCCCOCCCCCCCCC(=O)OC 34a_100000758997_100010282707 [0,1,1,0,0,0|0,0,2]=4 9349 B17R0.195 C=CCCCOCCCCCCCCC(=O)OC 7a_100000035544_100000757094 [0,1,1,0,0,0|0,0,2]=4 9350 B17R0.195 C=CCCCOCCCCCCCCC(=O)OC 7a_100000758997_100010282707 [0,1,1,0,0,0|0,0,2]=4 9351 B17R0.195 C=CCCCSCCCCCCCCC(=O)OC 62a_100010282707_100000757094 [0,1,1,0,0,0|0,0,2]=4 9352 B17R0.195 C=CCCCSCCCCCCCCC(=O)OC 62a_100011713584_100010282707 [0,1,1,0,0,0|0,0,2]=4 9353 B17R0.195 C=CCCNCCCCCCCCCC(=O)OC 2230a_100015191253_100009813843 [0,1,1,0,0,0|0,0,2]=4 9354 B17R0.195 C=CCCOCCCCCCCCCC(=O)OC 34a_100011205117_100009813843 [0,1,1,0,0,0|0,0,2]=4 9355 B17R0.195 C=CCCSCCCCCCCCCC(=O)OC 62a_100000754431_100009813843 [0,1,1,0,0,0|0,0,2]=4 9356 B17R0.195 C=CCNCCCCCCCCCCC(=O)OC 2230a_100020586998_100009812566 [0,1,1,0,0,0|0,0,2]=4 9357 B17R0.195 C=CCOCCCCCCCCCCC(=O)OC 34a_100011003013_100015514636 [0,1,1,0,0,0|0,0,2]=4 9358 B17R0.195 C=CCOCCCCCCCCCCC(=O)OC 34a_200000210373_100009812566 [0,1,1,0,0,0|0,0,2]=4 9359 B17R0.195 C=CCOCCCCCCCCCCC(=O)OC 7a_100011003013_100015514636 [0,1,1,0,0,0|0,0,2]=4 9360 B17R0.195 C=CCSCCCCCCCCCCC(=O)OC 62a_100000210623_100009812566 [0,1,1,0,0,0|0,0,2]=4 9361 B17R0.195 CC#CCCOCCCCCCCCC(=O)OC 34a_100000750427_100010282707 [0,1,1,0,0,0|0,0,2]=4 9362 B17R0.195 CC#CCNCCCCCCCCCC(=O)OC 2230a_100000685387_100009813843 [0,1,1,0,0,0|0,0,2]=4 9363 B17R0.195 CC#CCNCCCCCCCCCC(=O)OC 34a_100000685387_100009813843 [0,1,1,0,0,0|0,0,2]=4 9364 B17R0.195 CC#CCOCCCCCCCCCC(=O)OC 34a_100000761923_100009813843 [0,1,1,0,0,0|0,0,2]=4 9365 B17R0.195 CC#CCSCCCCCCCCCC(=O)OC 62a_100000748600_100009813843 [0,1,1,0,0,0|0,0,2]=4 9366 B17R0.195 CC/C=C/CCCOCCCCCCC(=O)OC 34a_100016287902_100009815986 [0,1,1,0,0,0|0,0,2]=4 9367 B17R0.195 CC/C=C/CCCOCCCCCCC(=O)OC 7a_100016287902_100009815986 [0,1,1,0,0,0|0,0,2]=4 9368 B17R0.195 CC/C=C\CCCCCOCCCCC(=O)OC 34a_100016268722_100000204269 [0,1,1,0,0,0|0,0,2]=4 9369 B17R0.195 CC/C=C\CCCCCOCCCCC(=O)OC 7a_100016268722_100000204269 [0,1,1,0,0,0|0,0,2]=4 9370 B17R0.195 CC/C=C\CCCCOCCCCCC(=O)OC 34a_100016287862_100009816466 [0,1,1,0,0,0|0,0,2]=4 9371 B17R0.195 CC/C=C\CCCCOCCCCCC(=O)OC 7a_100016287862_100009816466 [0,1,1,0,0,0|0,0,2]=4 9372 B17R0.195 CC/C=C\CCOCCCCCCCC(=O)OC 34a_100011022521_100015370543 [0,1,1,0,0,0|0,0,2]=4 9373 B17R0.195 CC/C=C\CCOCCCCCCCC(=O)OC 34a_100016288707_100010004213 [0,1,1,0,0,0|0,0,2]=4 9374 B17R0.195 CC/C=C\CCOCCCCCCCC(=O)OC 7a_100011022521_100015370543 [0,1,1,0,0,0|0,0,2]=4 9375 B17R0.195 CC/C=C\CCOCCCCCCCC(=O)OC 7a_100016288707_100010004213 [0,1,1,0,0,0|0,0,2]=4 9376 B17R0.195 CC/C=C\CCSCCCCCCCC(=O)OC 62a_100010004213_100015370543 [0,1,1,0,0,0|0,0,2]=4 9377 B17R0.195 CC/C=C\CCSCCCCCCCC(=O)OC 62a_100015370543_100010004213 [0,1,1,0,0,0|0,0,2]=4 9378 B17R0.195 CC/C=C\COCCCCCCCCC(=O)OC 34a_100000035544_100103147603 [0,1,1,0,0,0|0,0,2]=4 9379 B17R0.195 CC/C=C\COCCCCCCCCC(=O)OC 34a_100016268518_100010282707 [0,1,1,0,0,0|0,0,2]=4 9380 B17R0.195 CC/C=C\COCCCCCCCCC(=O)OC 7a_100000035544_100103147603 [0,1,1,0,0,0|0,0,2]=4 9381 B17R0.195 CC/C=C\CSCCCCCCCCC(=O)OC 62a_100010282707_100103147603 [0,1,1,0,0,0|0,0,2]=4 9382 B17R0.195 CC/C=C\CSCCCCCCCCC(=O)OC 62a_100103147603_100010282707 [0,1,1,0,0,0|0,0,2]=4 9383 B17R0.195 CC=CCCCOCCCCCCCC(=O)OC 34a_100020645299_100010004213 [0,1,1,0,0,0|0,0,2]=4 9384 B17R0.195 CC=CCSCCCCCCCCCC(=O)OC 62a_100000070051_100009813843 [0,1,1,0,0,0|0,0,2]=4 9385 B17R0.195 CCC#CCCCCCCCCOCC(=O)CC 7a_200000031908_100000747405 [0,1,1,0,0,0|0,0,2]=4 9386 B17R0.195 CCC#CCCCCCCCCOCC(=O)OC 34a_200000031908_100000747449 [0,1,1,0,0,0|0,0,2]=4 9387 B17R0.195 CCC#CCCCCCCCCOCC(=O)OC 7a_200000031908_100000747449 [0,1,1,0,0,0|0,0,2]=4 9388 B17R0.195 CCC#CCCCCCCOCCOC(=O)CC 7a_200000031056_200000036426 [0,1,1,0,0,0|0,0,2]=4 9389 B17R0.195 CCC#CCCCCCCSCCCC(=O)OC 62a_100011218270_200000036426 [0,1,1,0,0,0|0,0,2]=4 9390 B17R0.195 CCC#CCCCCCCSCCCC(=O)OC 62a_200000036426_100011218270 [0,1,1,0,0,0|0,0,2]=4 9391 B17R0.195 CCC#CCCOCCCCCCCC(=O)OC 34a_100000036655_100010004213 [0,1,1,0,0,0|0,0,2]=4 9392 B17R0.195 CCC#CCCOCCCCCCCC(=O)OC 7a_100000036655_100010004213 [0,1,1,0,0,0|0,0,2]=4 9393 B17R0.195 CCC#CCOCCCCCCCCC(=O)OC 34a_100000032950_100010282707 [0,1,1,0,0,0|0,0,2]=4 9394 B17R0.195 CCC#CCOCCCCCCCCC(=O)OC 34a_100000035544_100009813939 [0,1,1,0,0,0|0,0,2]=4 9395 B17R0.195 CCC#CCOCCCCCCCCC(=O)OC 7a_100000035544_100009813939 [0,1,1,0,0,0|0,0,2]=4 9396 B17R0.195 CCC#CCSCCCCCCCCC(=O)OC 62a_100009813939_100010282707 [0,1,1,0,0,0|0,0,2]=4 9397 B17R0.195 CCC#CCSCCCCCCCCC(=O)OC 62a_100010282707_100009813939 [0,1,1,0,0,0|0,0,2]=4 9398 B17R0.195 CCC(=O)CCCCCCCCCCCCCO 1458a_100000210414_100009812470 [0,1,1,0,0,0|1,0,0]=3 9399 B17R0.195 CCC(=O)COCCCCCCCCCCCBr 7a_100009812471_100000747405 [0,1,1,0,0,0|1,0,0]=3 9400 B17R0.195 CCC(=O)COCCCCCCCCCCCO 34a_100000725409_100009812471 [0,1,1,0,0,0|1,0,0]=3 9401 B17R0.195 CCC(=O)CSCCCCCCCCCCCO 62a_100009812471_100000747405 [0,1,1,0,0,0|1,1,0]=4 9402 B17R0.195 CCC(=O)NCCCCCCCCCCCCO 240690a_100000066677_100000210414 [0,1,1,0,0,0|1,0,0]=3 9403 B17R0.195 CCC(=O)NCCNCCCCCCCCCO 34a_100132302217_100009813782 [0,1,1,0,0,0|2,0,0]=4 9404 B17R0.195 CCC(=O)NCCOCCCCCCCCCO 34a_200000158885_100009813782 [0,1,1,0,0,0|2,0,0]=4 9405 B17R0.195 CCC(=O)NCCOCCCCCCCCCO 7a_200000158885_100009813782 [0,1,1,0,0,0|2,0,0]=4 9406 B17R0.195 CCC(=O)OCCOCCCCCCCCCO 7a_200000031056_100009813782 [0,1,1,0,0,0|1,0,0]=3 9407 B17R0.195 CCC(C)OCCCCCCCCCCCCN 34a_100000066677_100011215416 [0,1,1,0,0,0|1,0,1]=4 9408 B17R0.195 CCC(C)OCCCCCCCCCCCCO 7a_100000210228_100009813331 [0,1,1,0,0,0|1,0,1]=4 9409 B17R0.195 CCC/C=C/COCCCCCCCC(=O)OC 34a_100016278788_100010004213 [0,1,1,0,0,0|0,0,2]=4 9410 B17R0.195 CCC/C=C/COCCCCCCCC(=O)OC 7a_100016278788_100010004213 [0,1,1,0,0,0|0,0,2]=4 9411 B17R0.195 CCCC#CCCOCCCCCCC(=O)OC 34a_100000042726_100009815986 [0,1,1,0,0,0|0,0,2]=4 9412 B17R0.195 CCCC#CCCOCCCCCCC(=O)OC 7a_100000042726_100009815986 [0,1,1,0,0,0|0,0,2]=4 9413 B17R0.195 CCCC#CCOCCCCCCCC(=O)OC 34a_100000034806_100010004213 [0,1,1,0,0,0|0,0,2]=4 9414 B17R0.195 CCCC#CCOCCCCCCCC(=O)OC 7a_100000034806_100010004213 [0,1,1,0,0,0|0,0,2]=4 9415 B17R0.195 CCCC/C=C/CCCCOCCCC(=O)OC 34a_200020645093_100000742333 [0,1,1,0,0,0|0,0,2]=4 9416 B17R0.195 CCCC/C=C/CCCCOCCCC(=O)OC 7a_200020645093_100011218270 [0,1,1,0,0,0|0,0,2]=4 9417 B17R0.195 CCCC/C=C/COCCCCCCC(=O)OC 34a_200016272032_100009815986 [0,1,1,0,0,0|0,0,2]=4 9418 B17R0.195 CCCC/C=C/COCCCCCCC(=O)OC 7a_200016272032_100009815986 [0,1,1,0,0,0|0,0,2]=4 9419 B17R0.195 CCCC/C=C\CCOCCCCCC(=O)OC 34a_200016286491_100009816466 [0,1,1,0,0,0|0,0,2]=4 9420 B17R0.195 CCCC/C=C\CCOCCCCCC(=O)OC 7a_200016286491_100009816466 [0,1,1,0,0,0|0,0,2]=4 9421 B17R0.195 CCCCC#CCCCCCCOCC(=O)CC 34a_100000725409_200000043322 [0,1,1,0,0,0|0,0,2]=4 9422 B17R0.195 CCCCC#CCCCCCCSCC(=O)OC 62a_100000747449_200000043322 [0,1,1,0,0,0|0,0,2]=4 9423 B17R0.195 CCCCC#CCCCCCCSCC(=O)OC 62a_200000043322_100000747449 [0,1,1,0,0,0|0,0,2]=4 9424 B17R0.195 CCCCC#CCCCCOCCCC(=O)OC 34a_200000066234_100000742333 [0,1,1,0,0,0|0,0,2]=4 9425 B17R0.195 CCCCC#CCCCCOCCCC(=O)OC 7a_200000066234_100011218270 [0,1,1,0,0,0|0,0,2]=4 9426 B17R0.195 CCCCC#CCCCOCCCCC(=O)OC 34a_100000059025_200000047210 [0,1,1,0,0,0|0,0,2]=4 9427 B17R0.195 CCCCC#CCCCOCCCCC(=O)OC 7a_100000059025_200000047210 [0,1,1,0,0,0|0,0,2]=4 9428 B17R0.195 CCCCC#CCCCSCCCCC(=O)OC 62a_100000204269_200000047210 [0,1,1,0,0,0|0,0,2]=4 9429 B17R0.195 CCCCC#CCCCSCCCCC(=O)OC 62a_200000047210_100000204269 [0,1,1,0,0,0|0,0,2]=4 9430 B17R0.195 CCCCC#CCCOCCCCCC(=O)OC 34a_100000037610_100009816466 [0,1,1,0,0,0|0,0,2]=4 9431 B17R0.195 CCCCC#CCCOCCCCCC(=O)OC 7a_100000037610_100009816466 [0,1,1,0,0,0|0,0,2]=4 9432 B17R0.195 CCCCC#CCOCCCCCCC(=O)OC 34a_200000034558_100009815986 [0,1,1,0,0,0|0,0,2]=4 9433 B17R0.195 CCCCC#CCOCCCCCCC(=O)OC 7a_200000034558_100009815986 [0,1,1,0,0,0|0,0,2]=4 9434 B17R0.195 CCCCC/C=C/COCCCCCC(=O)OC 34a_100016258190_100009816466 [0,1,1,0,0,0|0,0,2]=4 9435 B17R0.195 CCCCC/C=C/COCCCCCC(=O)OC 7a_100016258190_100009816466 [0,1,1,0,0,0|0,0,2]=4 9436 B17R0.195 CCCCC/C=C\CCCOCCCC(=O)OC 34a_100020655193_100000742333 [0,1,1,0,0,0|0,0,2]=4 9437 B17R0.195 CCCCC/C=C\CCCOCCCC(=O)OC 7a_100020655193_100011218270 [0,1,1,0,0,0|0,0,2]=4 9438 B17R0.195 CCCCC/C=C\CCOCCCCC(=O)OC 34a_100016277358_100000204269 [0,1,1,0,0,0|0,0,2]=4 9439 B17R0.195 CCCCC/C=C\CCOCCCCC(=O)OC 7a_100016277358_100000204269 [0,1,1,0,0,0|0,0,2]=4 9440 B17R0.195 CCCCCC#CCCOCCCCC(=O)OC 34a_200000042877_100000204269 [0,1,1,0,0,0|0,0,2]=4 9441 B17R0.195 CCCCCC#CCCOCCCCC(=O)OC 7a_200000042877_100000204269 [0,1,1,0,0,0|0,0,2]=4 9442 B17R0.195 CCCCCC#CCOCCCCCC(=O)OC 34a_100000074720_100009816472 [0,1,1,0,0,0|0,0,2]=4 9443 B17R0.195 CCCCCC#CCOCCCCCC(=O)OC 34a_200000033628_100009816466 [0,1,1,0,0,0|0,0,2]=4 9444 B17R0.195 CCCCCC#CCOCCCCCC(=O)OC 7a_100000074720_100009816472 [0,1,1,0,0,0|0,0,2]=4 9445 B17R0.195 CCCCCC#CCOCCCCCC(=O)OC 7a_200000033628_100009816466 [0,1,1,0,0,0|0,0,2]=4 9446 B17R0.195 CCCCCC#CCSCCCCCC(=O)OC 62a_100009816466_100009816472 [0,1,1,0,0,0|0,0,2]=4 9447 B17R0.195 CCCCCC#CCSCCCCCC(=O)OC 62a_100009816472_100009816466 [0,1,1,0,0,0|0,0,2]=4 9448 B17R0.195 CCCCCC/C=C/COCCCCC(=O)OC 34a_200016276170_100000204269 [0,1,1,0,0,0|0,0,2]=4 9449 B17R0.195 CCCCCC/C=C/COCCCCC(=O)OC 7a_200016276170_100000204269 [0,1,1,0,0,0|0,0,2]=4 9450 B17R0.195 CCCCCCC#CCCOCCCC(=O)OC 34a_200000033163_100000742333 [0,1,1,0,0,0|0,0,2]=4 9451 B17R0.195 CCCCCCC#CCCOCCCC(=O)OC 7a_200000033163_100011218270 [0,1,1,0,0,0|0,0,2]=4 9452 B17R0.195 CCCCCCC#CCOCCCCC(=O)OC 34a_200000037284_100000204269 [0,1,1,0,0,0|0,0,2]=4 9453 B17R0.195 CCCCCCC#CCOCCCCC(=O)OC 7a_200000037284_100000204269 [0,1,1,0,0,0|0,0,2]=4 9454 B17R0.195 CCCCCCCC#CCOCCCC(=O)OC 34a_200000061759_100000742333 [0,1,1,0,0,0|0,0,2]=4 9455 B17R0.195 CCCCCCCC#CCOCCCC(=O)OC 7a_200000061759_100011218270 [0,1,1,0,0,0|0,0,2]=4 9456 B17R0.195 CCCCCCCC/C=C/COCCC(=O)OC 34a_200020667288_100000742370 [0,1,1,0,0,0|0,0,2]=4 9457 B17R0.195 CCCCCCCC/C=C/COCCC(=O)OC 7a_200020667288_100000204255 [0,1,1,0,0,0|0,0,2]=4 9458 B17R0.195 CCCCCCCCC/C=C/COCC(=O)CC 7a_100015232335_100000747405 [0,1,1,0,0,0|0,0,2]=4 9459 B17R0.195 CCCCCCCCC/C=C/COCC(=O)OC 34a_100015232335_100000747449 [0,1,1,0,0,0|0,0,2]=4 9460 B17R0.195 CCCCCCCCC/C=C/COCC(=O)OC 7a_100015232335_100000747449 [0,1,1,0,0,0|0,0,2]=4 9461 B17R0.195 CCCCCCCCCCCC=NNC(=O)CC 4a_100000183195_100011218549 [0,1,1,0,0,0|1,0,1]=4 9462 B17R0.195 CCCCCCCCCCCCCCC(=O)CF 1458a_100000297455_100015361967 [0,1,1,0,0,0|2,0,0]=4 9463 B17R0.195 CCCCCCCCCCCCCCC(=O)CO 1458a_100000210174_100011215471 [0,1,1,0,0,0|2,0,0]=4 9464 B17R0.195 CCCCCCCCCCCCCCC(=O)NC 11a_106832991635_100000297455 [0,1,1,0,0,0|1,0,0]=3 9465 B17R0.195 CCCCCCCCCCCCCCC(=O)NC 1626a_100102657272_100000297455 [0,1,1,0,0,0|1,0,0]=3 9466 B17R0.195 CCCCCCCCCCCCCCC(=O)NC 240690a_100102657272_100000297455 [0,1,1,0,0,0|1,0,0]=3 9467 B17R0.195 CCCCCCCCCCCCCNC(=O)CC 11a_100011215765_100000210414 [0,1,1,0,0,0|1,0,0]=3 9468 B17R0.195 CCCCCCCCCCCCCNC(=O)CC 1626a_100011215765_100000210414 [0,1,1,0,0,0|1,0,0]=3 9469 B17R0.195 CCCCCCCCCCCCCNC(=O)CC 240690a_100011215765_100000210414 [0,1,1,0,0,0|1,0,0]=3 9470 B17R0.195 CCCCCCCCCCCCCNC(=O)CC 527a_100011215765_100000210414 [0,1,1,0,0,0|1,0,0]=3 9471 B17R0.195 CCCCCCCCCCCCCNC(=O)CO 240690a_100011215765_100000210174 [0,1,1,0,0,0|2,0,0]=4 9472 B17R0.195 CCCCCCCCCCCCCNC(=O)CO 527a_100011215765_100000210174 [0,1,1,0,0,0|2,0,0]=4 9473 B17R0.195 CCCCCCCCCCCCCNC(=O)NC 2708a_100011215765_106832991635 [0,1,1,0,0,0|1,0,0]=3 9474 B17R0.195 CCCCCCCCCCCCCNC(=O)NC 2708a_100102657272_100011215765 [0,1,1,0,0,0|1,0,0]=3 9475 B17R0.195 CCCCCCCCCCCCCNC(=O)NC 273464a_100011215765_100102657272 [0,1,1,0,0,0|1,0,0]=3 9476 B17R0.195 CCCCCCCCCCCCCNC(=O)NC 273464a_100102657272_100011215765 [0,1,1,0,0,0|1,0,0]=3 9477 B17R0.195 CCCCCCCCCCCCCNC(=O)NC 512a_100011215765_100102657272 [0,1,1,0,0,0|1,0,0]=3 9478 B17R0.195 CCCCCCCCCCCCCNC(=O)NC 512a_106832991638_100011215765 [0,1,1,0,0,0|1,0,0]=3 9479 B17R0.195 CCCCCCCCCCCCNCC(=O)NC 2230a_100000210451_100000183359 [0,1,1,0,0,0|1,0,0]=3 9480 B17R0.195 CCCCCCCCCCCCNCC(=O)NC 2230a_100000693194_100011215052 [0,1,1,0,0,0|1,0,0]=3 9481 B17R0.195 CCCCCCCCCCCCNCC(=O)NC 270004a_100000693194_100011218549 [0,1,1,0,0,0|1,0,0]=3 9482 B17R0.195 CCCCCCCCCCCCNCC(=O)NC 34a_100000210451_100000183359 [0,1,1,0,0,0|1,0,0]=3 9483 B17R0.195 CCCCCCCCCCCCNCC(=O)OC 2230a_100000210451_100000747449 [0,1,1,0,0,0|0,0,0]=2 9484 B17R0.195 CCCCCCCCCCCCNCC(=O)OC 34a_100000210451_100000747449 [0,1,1,0,0,0|0,0,0]=2 9485 B17R0.195 CCCCCCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100011215052 [0,1,1,0,0,0|1,0,1]=4 9486 B17R0.195 CCCCCCCCCCCCNC[C@@H](C)OC 270004a_100020591295_100011218549 [0,1,1,0,0,0|1,0,1]=4 9487 B17R0.195 CCCCCCCCCCCCOCC(=O)CC 34a_100000725409_100000759014 [0,1,1,0,0,0|0,0,0]=2 9488 B17R0.195 CCCCCCCCCCCCOCC(=O)CC 7a_100000210810_100000747405 [0,1,1,0,0,0|0,0,0]=2 9489 B17R0.195 CCCCCCCCCCCCOCC(=O)NC 34a_100000210810_100000183359 [0,1,1,0,0,0|1,0,0]=3 9490 B17R0.195 CCCCCCCCCCCCOCC(=O)NC 34a_100000750040_100000759014 [0,1,1,0,0,0|1,0,0]=3 9491 B17R0.195 CCCCCCCCCCCCOCC(=O)NC 7a_100000210810_100000183359 [0,1,1,0,0,0|1,0,0]=3 9492 B17R0.195 CCCCCCCCCCCCOCC(=O)OC 34a_100000210810_100000747449 [0,1,1,0,0,0|0,0,0]=2 9493 B17R0.195 CCCCCCCCCCCCOCC(=O)OC 7a_100000210810_100000747449 [0,1,1,0,0,0|0,0,0]=2 9494 B17R0.195 CCCCCCCCCCCCOCC(C)CC 34a_100000210810_100000748023 [0,1,1,0,0,0|1,0,1]=4 9495 B17R0.195 CCCCCCCCCCCCOCC(C)CC 7a_100000210810_100000748023 [0,1,1,0,0,0|1,0,1]=4 9496 B17R0.195 CCCCCCCCCCCCOCC(C)OC 34a_100000690652_100000759014 [0,1,1,0,0,0|1,0,1]=4 9497 B17R0.195 CCCCCCCCCCCCOCC(O)CC 34a_100000210810_100011218378 [0,1,1,0,0,0|0,0,2]=4 9498 B17R0.195 CCCCCCCCCCCCOCC(O)CC 7a_100000210810_100011218378 [0,1,1,0,0,0|0,0,2]=4 9499 B17R0.195 CCCCCCCCCCCCOC[C@@H](C)CC 34a_100000210810_100009816398 [0,1,1,0,0,0|1,0,1]=4 9500 B17R0.195 CCCCCCCCCCCCOC[C@@H](C)CC 7a_100000210810_100009816398 [0,1,1,0,0,0|1,0,1]=4 9501 B17R0.195 CCCCCCCCCCCCOC[C@@H](C)CC 7a_100009816381_100000759014 [0,1,1,0,0,0|1,0,1]=4 9502 B17R0.195 CCCCCCCCCCCCSCC(=O)CC 62a_100000747405_100000759014 [0,1,1,0,0,0|0,1,0]=3 9503 B17R0.195 CCCCCCCCCCCCSCC(=O)NC 62a_100000183359_100000759014 [0,1,1,0,0,0|1,0,0]=3 9504 B17R0.195 CCCCCCCCCCCCSCC(=O)OC 62a_100000747449_100000759014 [0,1,1,0,0,0|0,0,0]=2 9505 B17R0.195 CCCCCCCCCCCNCCC(=O)NC 2230a_100000738227_100011215454 [0,1,1,0,0,0|1,0,0]=3 9506 B17R0.195 CCCCCCCCCCCNCCC(=O)NC 2230a_200011215754_100000737683 [0,1,1,0,0,0|1,0,0]=3 9507 B17R0.195 CCCCCCCCCCCNCCC(=O)NC 34a_100000738227_100011215454 [0,1,1,0,0,0|1,0,0]=3 9508 B17R0.195 CCCCCCCCCCCNCCC(=O)NC 34a_200011215754_100012179268 [0,1,1,0,0,0|1,0,0]=3 9509 B17R0.195 CCCCCCCCCCCNCCC(=O)OC 2230a_200011215754_100000204255 [0,1,1,0,0,0|0,0,0]=2 9510 B17R0.195 CCCCCCCCCCCNCCC(=O)OC 34a_200011215754_100000742370 [0,1,1,0,0,0|0,0,0]=2 9511 B17R0.195 CCCCCCCCCCCOCCC(=O)NC 34a_100000210809_100012179268 [0,1,1,0,0,0|1,0,0]=3 9512 B17R0.195 CCCCCCCCCCCOCCC(=O)NC 34a_100000754576_100011215454 [0,1,1,0,0,0|1,0,0]=3 9513 B17R0.195 CCCCCCCCCCCOCCC(=O)NC 7a_100000210809_100000737683 [0,1,1,0,0,0|1,0,0]=3 9514 B17R0.195 CCCCCCCCCCCOCCC(=O)OC 34a_100000210809_100000742370 [0,1,1,0,0,0|0,0,0]=2 9515 B17R0.195 CCCCCCCCCCCOCCC(=O)OC 7a_100000210809_100000204255 [0,1,1,0,0,0|0,0,0]=2 9516 B17R0.195 CCCCCCCCCCCOCCC(C)OC 7a_100000764861_100011215454 [0,1,1,0,0,0|1,0,1]=4 9517 B17R0.195 CCCCCCCCCCCSCCC(=O)NC 62a_100000737683_100011215454 [0,1,1,0,0,0|1,0,0]=3 9518 B17R0.195 CCCCCCCCCCCSCCC(=O)OC 62a_100000204255_100011215454 [0,1,1,0,0,0|0,0,0]=2 9519 B17R0.195 CCCCCCCCCCNC/C=C/C(=O)OC 2230a_100000684558_100000742655 [0,1,1,0,0,0|0,0,2]=4 9520 B17R0.195 CCCCCCCCCCNC/C=C/C(=O)OC 34a_100000684558_100000742655 [0,1,1,0,0,0|0,0,2]=4 9521 B17R0.195 CCCCCCCCCCNCCCC(=O)NC 2230a_100000684558_100000741757 [0,1,1,0,0,0|1,0,0]=3 9522 B17R0.195 CCCCCCCCCCNCCCC(=O)NC 2230a_100000740002_100000210320 [0,1,1,0,0,0|1,0,0]=3 9523 B17R0.195 CCCCCCCCCCNCCCC(=O)NC 34a_100000684558_100000741757 [0,1,1,0,0,0|1,0,0]=3 9524 B17R0.195 CCCCCCCCCCNCCCC(=O)NC 34a_100000740002_100000210320 [0,1,1,0,0,0|1,0,0]=3 9525 B17R0.195 CCCCCCCCCCNCCCC(=O)OC 2230a_100000684558_100011218270 [0,1,1,0,0,0|0,0,0]=2 9526 B17R0.195 CCCCCCCCCCNCCCC(=O)OC 34a_100000684558_100000742333 [0,1,1,0,0,0|0,0,0]=2 9527 B17R0.195 CCCCCCCCCCNCCNC(=O)CC 34a_100132302217_100000210320 [0,1,1,0,0,0|1,0,0]=3 9528 B17R0.195 CCCCCCCCCCNCCNC(=O)NC 34a_100015205895_100000210320 [0,1,1,0,0,0|2,0,0]=4 9529 B17R0.195 CCCCCCCCCCNCCOC(=O)NC 34a_100000684558_200011997002 [0,1,1,0,0,0|1,0,0]=3 9530 B17R0.195 CCCCCCCCCCOC/C=C/C(=O)OC 34a_100000210711_100000742655 [0,1,1,0,0,0|0,0,2]=4 9531 B17R0.195 CCCCCCCCCCOC/C=C/C(=O)OC 7a_100000210711_100000742655 [0,1,1,0,0,0|0,0,2]=4 9532 B17R0.195 CCCCCCCCCCOCCCC(=O)NC 34a_100000210711_100000741757 [0,1,1,0,0,0|1,0,0]=3 9533 B17R0.195 CCCCCCCCCCOCCCC(=O)NC 7a_100000210711_100000741757 [0,1,1,0,0,0|1,0,0]=3 9534 B17R0.195 CCCCCCCCCCOCCCC(=O)NN 34a_100000211488_100000210320 [0,1,1,0,0,0|2,0,0]=4 9535 B17R0.195 CCCCCCCCCCOCCCC(=O)OC 34a_100000210711_100000742333 [0,1,1,0,0,0|0,0,0]=2 9536 B17R0.195 CCCCCCCCCCOCCCC(=O)OC 7a_100000210711_100011218270 [0,1,1,0,0,0|0,0,0]=2 9537 B17R0.195 CCCCCCCCCCOCCNC(=O)CC 34a_200000158885_100000210320 [0,1,1,0,0,0|1,0,0]=3 9538 B17R0.195 CCCCCCCCCCOCCNC(=O)CC 7a_200000158885_100000210320 [0,1,1,0,0,0|1,0,0]=3 9539 B17R0.195 CCCCCCCCCCOCCNC(=O)OC 34a_100000757965_100000210320 [0,1,1,0,0,0|1,0,0]=3 9540 B17R0.195 CCCCCCCCCCOCCOC(=O)CC 7a_200000031056_100000210320 [0,1,1,0,0,0|0,0,0]=2 9541 B17R0.195 CCCCCCCCCCOCCOC(=O)NC 34a_100000210711_200011997002 [0,1,1,0,0,0|1,0,0]=3 9542 B17R0.195 CCCCCCCCCCOCCOC(=O)NC 7a_100000210711_200011997002 [0,1,1,0,0,0|1,0,0]=3 9543 B17R0.195 CCCCCCCCCCOCCOC(=O)OC 34a_100010262106_100000210320 [0,1,1,0,0,0|1,0,0]=3 9544 B17R0.195 CCCCCCCCCCSC/C=C/C(=O)OC 62a_100000742655_100000210320 [0,1,1,0,0,0|0,0,2]=4 9545 B17R0.195 CCCCCCCCCCSCCCC(=O)NC 62a_100000741757_100000210320 [0,1,1,0,0,0|1,0,0]=3 9546 B17R0.195 CCCCCCCCCCSCCCC(=O)OC 62a_100011218270_100000210320 [0,1,1,0,0,0|0,0,0]=2 9547 B17R0.195 CCCCCCCCCCSCCOC(=O)NC 62a_200011997002_100000210320 [0,1,1,0,0,0|1,0,0]=3 9548 B17R0.195 CCCCCCCCCCSCCOC(C)CC 34a_100011628728_100011215416 [0,1,1,0,0,0|1,0,1]=4 9549 B17R0.195 CCCCCCCCCCSCCOC(C)CC 7a_100011628728_100000758301 [0,1,1,0,0,0|1,0,1]=4 9550 B17R0.195 CCCCCCCCCNCCCCC(=O)OC 2230a_100000212291_100000204269 [0,1,1,0,0,0|0,0,0]=2 9551 B17R0.195 CCCCCCCCCNCCCCC(=O)OC 34a_100000212291_100000204269 [0,1,1,0,0,0|0,0,0]=2 9552 B17R0.195 CCCCCCCCCNCCOCC(=O)OC 2230a_100000212291_100000090808 [0,1,1,0,0,0|1,0,0]=3 9553 B17R0.195 CCCCCCCCCNCCOCC(=O)OC 34a_100000212291_100000090808 [0,1,1,0,0,0|1,0,0]=3 9554 B17R0.195 CCCCCCCCCOCCCCC(=O)OC 34a_100000059025_100011214924 [0,1,1,0,0,0|0,0,0]=2 9555 B17R0.195 CCCCCCCCCOCCCCC(=O)OC 34a_100000210712_100000204269 [0,1,1,0,0,0|0,0,0]=2 9556 B17R0.195 CCCCCCCCCOCCCCC(=O)OC 7a_100000059025_100000210328 [0,1,1,0,0,0|0,0,0]=2 9557 B17R0.195 CCCCCCCCCOCCCCC(=O)OC 7a_100000210712_100000204269 [0,1,1,0,0,0|0,0,0]=2 9558 B17R0.195 CCCCCCCCCOCCOCC(=O)OC 34a_100000210712_100000090808 [0,1,1,0,0,0|1,0,0]=3 9559 B17R0.195 CCCCCCCCCOCCOCC(=O)OC 7a_100000210712_100000090808 [0,1,1,0,0,0|1,0,0]=3 9560 B17R0.195 CCCCCCCCCSCCCCC(=O)OC 62a_100000204269_100000210670 [0,1,1,0,0,0|0,0,0]=2 9561 B17R0.195 CCCCCCCCCSCCOCC(=O)OC 62a_100000090808_100000210670 [0,1,1,0,0,0|1,0,0]=3 9562 B17R0.195 CCCCCCCCNCCCCCC(=O)OC 2230a_100000229939_100009816466 [0,1,1,0,0,0|0,0,0]=2 9563 B17R0.195 CCCCCCCCNCCCCCC(=O)OC 34a_100000229939_100009816466 [0,1,1,0,0,0|0,0,0]=2 9564 B17R0.195 CCCCCCCCOCCCCCC(=O)OC 34a_100000074720_100000210759 [0,1,1,0,0,0|0,0,0]=2 9565 B17R0.195 CCCCCCCCOCCCCCC(=O)OC 34a_100000210232_100009816466 [0,1,1,0,0,0|0,0,0]=2 9566 B17R0.195 CCCCCCCCOCCCCCC(=O)OC 7a_100000074720_100000210759 [0,1,1,0,0,0|0,0,0]=2 9567 B17R0.195 CCCCCCCCOCCCCCC(=O)OC 7a_100000210232_100009816466 [0,1,1,0,0,0|0,0,0]=2 9568 B17R0.195 CCCCCCCCSCCCCCC(=O)OC 62a_100000210759_100009816466 [0,1,1,0,0,0|0,0,0]=2 9569 B17R0.195 CCCCCCCCSCCCCCC(=O)OC 62a_100009816466_100000210317 [0,1,1,0,0,0|0,0,0]=2 9570 B17R0.195 CCCCCCCNCCCCCCC(=O)OC 2230a_100000229938_100009815986 [0,1,1,0,0,0|0,0,0]=2 9571 B17R0.195 CCCCCCCOCCCCCCC(=O)OC 34a_100000210272_100009815986 [0,1,1,0,0,0|0,0,0]=2 9572 B17R0.195 CCCCCCCOCCCCCCC(=O)OC 34a_100009863599_100000210614 [0,1,1,0,0,0|0,0,0]=2 9573 B17R0.195 CCCCCCCOCCCCCCC(=O)OC 7a_100000210272_100009815986 [0,1,1,0,0,0|0,0,0]=2 9574 B17R0.195 CCCCCCCOCCCCCCC(=O)OC 7a_100009863599_100000210614 [0,1,1,0,0,0|0,0,0]=2 9575 B17R0.195 CCCCCCCSCCCCCCC(=O)OC 62a_100000210614_100009815986 [0,1,1,0,0,0|0,0,0]=2 9576 B17R0.195 CCCCCCCSCCCCCCC(=O)OC 62a_100009815986_100000210316 [0,1,1,0,0,0|0,0,0]=2 9577 B17R0.195 CCCCCCNCCCCCCCC(=O)OC 2230a_100000210581_100010004213 [0,1,1,0,0,0|0,0,0]=2 9578 B17R0.195 CCCCCCOCCCCCCCC(=O)OC 34a_100000210259_100010004213 [0,1,1,0,0,0|0,0,0]=2 9579 B17R0.195 CCCCCCOCCCCCCCC(=O)OC 34a_100011022521_100000210314 [0,1,1,0,0,0|0,0,0]=2 9580 B17R0.195 CCCCCCOCCCCCCCC(=O)OC 7a_100000210259_100010004213 [0,1,1,0,0,0|0,0,0]=2 9581 B17R0.195 CCCCCCOCCCCCCCC(=O)OC 7a_100011022521_100000210314 [0,1,1,0,0,0|0,0,0]=2 9582 B17R0.195 CCCCCCOCCOCCCCC(=O)OC 34a_100000691444_100000204269 [0,1,1,0,0,0|1,0,0]=3 9583 B17R0.195 CCCCCCOCCOCCCCC(=O)OC 7a_100000691444_100000204269 [0,1,1,0,0,0|1,0,0]=3 9584 B17R0.195 CCCCCCOCCOCCOCC(=O)CC 7a_100000032842_100000747405 [0,1,1,0,0,0|2,0,0]=4 9585 B17R0.195 CCCCCCOCCOCCOCC(=O)OC 34a_100000032842_100000747449 [0,1,1,0,0,0|2,0,0]=4 9586 B17R0.195 CCCCCCOCCOCCOCC(=O)OC 34a_100000691444_100000090808 [0,1,1,0,0,0|2,0,0]=4 9587 B17R0.195 CCCCCCOCCOCCOCC(=O)OC 34a_100011023656_100000210314 [0,1,1,0,0,0|2,0,0]=4 9588 B17R0.195 CCCCCCOCCOCCOCC(=O)OC 7a_100000032842_100000747449 [0,1,1,0,0,0|2,0,0]=4 9589 B17R0.195 CCCCCCOCCOCCOCC(=O)OC 7a_100000691444_100000090808 [0,1,1,0,0,0|2,0,0]=4 9590 B17R0.195 CCCCCCOCCOCCOCC(=O)OC 7a_100011023656_100000210314 [0,1,1,0,0,0|2,0,0]=4 9591 B17R0.195 CCCCCCSCCCCCCCC(=O)OC 62a_100000210314_100010004213 [0,1,1,0,0,0|0,0,0]=2 9592 B17R0.195 CCCCCCSCCCCCCCC(=O)OC 62a_100010004213_100000210757 [0,1,1,0,0,0|0,0,0]=2 9593 B17R0.195 CCCCCNCCCCCCCCC(=O)OC 2230a_100000209983_100010282707 [0,1,1,0,0,0|0,0,0]=2 9594 B17R0.195 CCCCCNCCOCCCCCC(=O)OC 34a_100000224656_100009816466 [0,1,1,0,0,0|1,0,0]=3 9595 B17R0.195 CCCCCOCCCCCCCCC(=O)OC 34a_100000035544_100000718602 [0,1,1,0,0,0|0,0,0]=2 9596 B17R0.195 CCCCCOCCCCCCCCC(=O)OC 34a_100000210253_100010282707 [0,1,1,0,0,0|0,0,0]=2 9597 B17R0.195 CCCCCOCCCCCCCCC(=O)OC 7a_100000035544_100000210326 [0,1,1,0,0,0|0,0,0]=2 9598 B17R0.195 CCCCCOCCCCCCCCC(=O)OC 7a_100000210253_100010282707 [0,1,1,0,0,0|0,0,0]=2 9599 B17R0.195 CCCCCOCCOCCCCCC(=O)OC 34a_100011215259_100009816466 [0,1,1,0,0,0|1,0,0]=3 9600 B17R0.195 CCCCCOCCOCCCCCC(=O)OC 7a_100011215259_100009816466 [0,1,1,0,0,0|1,0,0]=3 9601 B17R0.195 CCCCCOCCOCCOCCC(=O)OC 34a_100010982084_100000718602 [0,1,1,0,0,0|2,0,0]=4 9602 B17R0.195 CCCCCOCCOCCOCCC(=O)OC 7a_100010982084_100000210326 [0,1,1,0,0,0|2,0,0]=4 9603 B17R0.195 CCCCCSCCCCCCCCC(=O)OC 62a_100000210326_100010282707 [0,1,1,0,0,0|0,0,0]=2 9604 B17R0.195 CCCCCSCCCCCCCCC(=O)OC 62a_100010282707_100000210326 [0,1,1,0,0,0|0,0,0]=2 9605 B17R0.195 CCCCNCCCCCCCCCC(=O)OC 2230a_100000102301_100009813843 [0,1,1,0,0,0|0,0,0]=2 9606 B17R0.195 CCCCNCCCCCCCCCC(=O)OC 7a_106832991798_100009813843 [0,1,1,0,0,0|0,0,0]=2 9607 B17R0.195 CCCCNCCCCOCCCCC(=O)OC 34a_200011216965_100000204269 [0,1,1,0,0,0|1,0,0]=3 9608 B17R0.195 CCCCNCCCCOCCOCC(=O)OC 34a_200011216965_100000090808 [0,1,1,0,0,0|2,0,0]=4 9609 B17R0.195 CCCCOCCCCCCCCCC(=O)OC 34a_100000210227_100009813843 [0,1,1,0,0,0|0,0,0]=2 9610 B17R0.195 CCCCOCCCCCCCCCC(=O)OC 7a_100000210227_100009813843 [0,1,1,0,0,0|0,0,0]=2 9611 B17R0.195 CCCCOCCCCOCCCCC(=O)OC 34a_200000760531_100000204269 [0,1,1,0,0,0|1,0,0]=3 9612 B17R0.195 CCCCOCCCCOCCCCC(=O)OC 7a_200000760531_100000204269 [0,1,1,0,0,0|1,0,0]=3 9613 B17R0.195 CCCCOCCCCOCCOCC(=O)OC 34a_200000760531_100000090808 [0,1,1,0,0,0|2,0,0]=4 9614 B17R0.195 CCCCOCCCCOCCOCC(=O)OC 7a_200000760531_100000090808 [0,1,1,0,0,0|2,0,0]=4 9615 B17R0.195 CCCCOCCCNCCCCCC(=O)OC 2230a_200000211371_100009816466 [0,1,1,0,0,0|1,0,0]=3 9616 B17R0.195 CCCCOCCCNCCCCCC(=O)OC 34a_200000211371_100009816466 [0,1,1,0,0,0|1,0,0]=3 9617 B17R0.195 CCCCOCCCOCCCCCC(=O)OC 34a_200011215613_100009816466 [0,1,1,0,0,0|1,0,0]=3 9618 B17R0.195 CCCCOCCCOCCCCCC(=O)OC 7a_200011215613_100009816466 [0,1,1,0,0,0|1,0,0]=3 9619 B17R0.195 CCCCOCCOCCCCCCC(=O)OC 34a_100000210238_100009815986 [0,1,1,0,0,0|1,0,0]=3 9620 B17R0.195 CCCCOCCOCCCCCCC(=O)OC 34a_100009863599_100000743108 [0,1,1,0,0,0|1,0,0]=3 9621 B17R0.195 CCCCOCCOCCCCCCC(=O)OC 7a_100000210238_100009815986 [0,1,1,0,0,0|1,0,0]=3 9622 B17R0.195 CCCCOCCOCCCCCCC(=O)OC 7a_100009863599_100000743108 [0,1,1,0,0,0|1,0,0]=3 9623 B17R0.195 CCCCOCCOCCOCCCC(=O)OC 34a_100011215186_100000742333 [0,1,1,0,0,0|2,0,0]=4 9624 B17R0.195 CCCCOCCOCCOCCCC(=O)OC 7a_100011215186_100011218270 [0,1,1,0,0,0|2,0,0]=4 9625 B17R0.195 CCCCOCCSCCCCCCC(=O)OC 62a_100000743108_100009815986 [0,1,1,0,0,0|1,0,0]=3 9626 B17R0.195 CCCCOCCSCCCCCCC(=O)OC 62a_100009815986_100000743108 [0,1,1,0,0,0|1,0,0]=3 9627 B17R0.195 CCCCOCOCCCCCCCC(=O)OC 34a_100011022521_100011995733 [0,1,1,0,0,0|1,0,0]=3 9628 B17R0.195 CCCCOCSCCCCCCCC(=O)OC 62a_100010004213_100011995733 [0,1,1,0,0,0|1,0,0]=3 9629 B17R0.195 CCCCOCSCCCCCCCC(=O)OC 62a_100011995733_100010004213 [0,1,1,0,0,0|1,0,0]=3 9630 B17R0.195 CCCCSCCCCCCCCCC(=O)OC 62a_100000210211_100009813843 [0,1,1,0,0,0|0,0,0]=2 9631 B17R0.195 CCCCSCCNCCCCCCC(=O)OC 2230a_100025743550_100009815986 [0,1,1,0,0,0|1,0,0]=3 9632 B17R0.195 CCCCSCCOCCCCCCC(=O)OC 34a_200000230436_100009815986 [0,1,1,0,0,0|1,0,0]=3 9633 B17R0.195 CCCCSCCOCCCCCCC(=O)OC 7a_200000230436_100009815986 [0,1,1,0,0,0|1,0,0]=3 9634 B17R0.195 CCCNN=CCCCCCCCCC(=O)OC 4a_100000740057_200010166605 [0,1,1,0,0,0|1,0,1]=4 9635 B17R0.195 CCCOCCCCCCCCCCC(=O)OC 34a_100000210258_100009812566 [0,1,1,0,0,0|0,0,0]=2 9636 B17R0.195 CCCOCCCCCCCCCCC(=O)OC 34a_100011003013_100000210303 [0,1,1,0,0,0|0,0,0]=2 9637 B17R0.195 CCCOCCCCCCCCCCC(=O)OC 7a_100011003013_100000210303 [0,1,1,0,0,0|0,0,0]=2 9638 B17R0.195 CCCOCCCNCCCCCCC(=O)OC 2230a_100011217757_100009815986 [0,1,1,0,0,0|1,0,0]=3 9639 B17R0.195 CCCOCCCNCCCCCCC(=O)OC 34a_100011217757_100009815986 [0,1,1,0,0,0|1,0,0]=3 9640 B17R0.195 CCCOCCNCCCCCCCC(=O)OC 2230a_100161115042_100010004213 [0,1,1,0,0,0|1,0,0]=3 9641 B17R0.195 CCCOCCNCCCCCCCC(=O)OC 34a_100161115042_100010004213 [0,1,1,0,0,0|1,0,0]=3 9642 B17R0.195 CCCOCCOCCCCCCCC(=O)OC 34a_100000752267_100010004213 [0,1,1,0,0,0|1,0,0]=3 9643 B17R0.195 CCCOCCOCCCCCCCC(=O)OC 34a_100011022521_100011215938 [0,1,1,0,0,0|1,0,0]=3 9644 B17R0.195 CCCOCCOCCCCCCCC(=O)OC 7a_100000752267_100010004213 [0,1,1,0,0,0|1,0,0]=3 9645 B17R0.195 CCCOCCOCCCCCCCC(=O)OC 7a_100011022521_100011215938 [0,1,1,0,0,0|1,0,0]=3 9646 B17R0.195 CCCOCCOCCNCCCCC(=O)OC 2230a_200011904461_100000204269 [0,1,1,0,0,0|2,0,0]=4 9647 B17R0.195 CCCOCCOCCNCCCCC(=O)OC 34a_200011904461_100000204269 [0,1,1,0,0,0|2,0,0]=4 9648 B17R0.195 CCCOCCSCCCCCCCC(=O)OC 62a_100010004213_100011215938 [0,1,1,0,0,0|1,0,0]=3 9649 B17R0.195 CCCOCCSCCCCCCCC(=O)OC 62a_100011215938_100010004213 [0,1,1,0,0,0|1,0,0]=3 9650 B17R0.195 CCCSCCCCCCCCCCC(=O)OC 62a_100000210303_100009812566 [0,1,1,0,0,0|0,0,0]=2 9651 B17R0.195 CCCSCCNCCCCCCCC(=O)OC 2230a_100020603323_100010004213 [0,1,1,0,0,0|1,0,0]=3 9652 B17R0.195 CCCSCCOCCCCCCCC(=O)OC 34a_200000230433_100010004213 [0,1,1,0,0,0|1,0,0]=3 9653 B17R0.195 CCCSCCOCCCCCCCC(=O)OC 7a_200000230433_100010004213 [0,1,1,0,0,0|1,0,0]=3 9654 B17R0.195 CCNCCCCCCCCCCCC(=O)OC 2230a_100015525214_100010983606 [0,1,1,0,0,0|0,0,0]=2 9655 B17R0.195 CCOCCCCCCCCCCCC(=O)OC 34a_100121572206_100010983606 [0,1,1,0,0,0|0,0,0]=2 9656 B17R0.195 CCOCCCCCCCCCOCC(=O)CC 7a_100009875440_100000747405 [0,1,1,0,0,0|1,0,0]=3 9657 B17R0.195 CCOCCCCCCCCCOCC(=O)NC 34a_100009875440_100000183359 [0,1,1,0,0,0|2,0,0]=4 9658 B17R0.195 CCOCCCCCCCCCOCC(=O)NC 7a_100009875440_100000183359 [0,1,1,0,0,0|2,0,0]=4 9659 B17R0.195 CCOCCCCCCCCCOCC(=O)OC 34a_100009875440_100000747449 [0,1,1,0,0,0|1,0,0]=3 9660 B17R0.195 CCOCCCCCCCCCOCC(=O)OC 7a_100009875440_100000747449 [0,1,1,0,0,0|1,0,0]=3 9661 B17R0.195 CCOCCCNCCCCCCCC(=O)OC 2230a_100000210961_100010004213 [0,1,1,0,0,0|1,0,0]=3 9662 B17R0.195 CCOCCCNCCCCCCCC(=O)OC 34a_100000210961_100010004213 [0,1,1,0,0,0|1,0,0]=3 9663 B17R0.195 CCOCCCOCCCCCCCC(=O)OC 34a_100000757476_100010004213 [0,1,1,0,0,0|1,0,0]=3 9664 B17R0.195 CCOCCCOCCCCCCCC(=O)OC 34a_100011022521_100012232248 [0,1,1,0,0,0|1,0,0]=3 9665 B17R0.195 CCOCCCOCCCCCCCC(=O)OC 7a_100000757476_100010004213 [0,1,1,0,0,0|1,0,0]=3 9666 B17R0.195 CCOCCCOCCCCCCCC(=O)OC 7a_100011022521_100012232248 [0,1,1,0,0,0|1,0,0]=3 9667 B17R0.195 CCOCCCSCCCCCCCC(=O)OC 62a_100010004213_100012232248 [0,1,1,0,0,0|1,0,0]=3 9668 B17R0.195 CCOCCCSCCCCCCCC(=O)OC 62a_100012232248_100010004213 [0,1,1,0,0,0|1,0,0]=3 9669 B17R0.195 CCOCCNCCCCCCCCC(=O)OC 2230a_102516460346_100010282707 [0,1,1,0,0,0|1,0,0]=3 9670 B17R0.195 CCOCCNCCCCCCCCC(=O)OC 34a_102516460346_100010282707 [0,1,1,0,0,0|1,0,0]=3 9671 B17R0.195 CCOCCOCCCCCCCCC(=O)OC 34a_100000035544_100000210147 [0,1,1,0,0,0|1,0,0]=3 9672 B17R0.195 CCOCCOCCCCCCCCC(=O)OC 34a_100000210136_100010282707 [0,1,1,0,0,0|1,0,0]=3 9673 B17R0.195 CCOCCOCCCCCCCCC(=O)OC 7a_100000035544_100011215890 [0,1,1,0,0,0|1,0,0]=3 9674 B17R0.195 CCOCCOCCCCCCCCC(=O)OC 7a_100000210136_100010282707 [0,1,1,0,0,0|1,0,0]=3 9675 B17R0.195 CCOCCOCCNCCCCCC(=O)OC 2230a_100102712874_100009816466 [0,1,1,0,0,0|2,0,0]=4 9676 B17R0.195 CCOCCOCCNCCCCCC(=O)OC 34a_100102712874_100009816466 [0,1,1,0,0,0|2,0,0]=4 9677 B17R0.195 CCOCCOCCOCCCCCC(=O)OC 34a_100000074720_100011211534 [0,1,1,0,0,0|2,0,0]=4 9678 B17R0.195 CCOCCOCCOCCCCCC(=O)OC 34a_100000210240_100009816466 [0,1,1,0,0,0|2,0,0]=4 9679 B17R0.195 CCOCCOCCOCCCCCC(=O)OC 7a_100000074720_100011211534 [0,1,1,0,0,0|2,0,0]=4 9680 B17R0.195 CCOCCOCCOCCCCCC(=O)OC 7a_100000210240_100009816466 [0,1,1,0,0,0|2,0,0]=4 9681 B17R0.195 CCOCCOCCSCCCCCC(=O)OC 62a_100009816466_100011211534 [0,1,1,0,0,0|2,0,0]=4 9682 B17R0.195 CCOCCOCCSCCCCCC(=O)OC 62a_100011211534_100009816466 [0,1,1,0,0,0|2,0,0]=4 9683 B17R0.195 CCOCCSCCCCCCCCC(=O)OC 62a_100000210147_100010282707 [0,1,1,0,0,0|1,0,0]=3 9684 B17R0.195 CCOCCSCCCCCCCCC(=O)OC 62a_100010282707_100011215890 [0,1,1,0,0,0|1,0,0]=3 9685 B17R0.195 CCOCSCCCCCCCCCC(=O)OC 62a_100000739092_100009813843 [0,1,1,0,0,0|1,0,0]=3 9686 B17R0.195 CCSCCCCCCCCCCCC(=O)OC 62a_100000210202_100010983606 [0,1,1,0,0,0|0,0,0]=2 9687 B17R0.195 CCSCCCOCCCCCCCC(=O)OC 34a_100011216438_100010004213 [0,1,1,0,0,0|1,0,0]=3 9688 B17R0.195 CCSCCCOCCCCCCCC(=O)OC 7a_100011216438_100010004213 [0,1,1,0,0,0|1,0,0]=3 9689 B17R0.195 CCSCCNCCCCCCCCC(=O)OC 2230a_100000106463_100010282707 [0,1,1,0,0,0|1,0,0]=3 9690 B17R0.195 CCSCCOCCCCCCCCC(=O)OC 34a_100000035544_100000757381 [0,1,1,0,0,0|1,0,0]=3 9691 B17R0.195 CCSCCOCCCCCCCCC(=O)OC 34a_100000212035_100010282707 [0,1,1,0,0,0|1,0,0]=3 9692 B17R0.195 CCSCCOCCCCCCCCC(=O)OC 7a_100000035544_100000757381 [0,1,1,0,0,0|1,0,0]=3 9693 B17R0.195 CCSCCOCCCCCCCCC(=O)OC 7a_100000212035_100010282707 [0,1,1,0,0,0|1,0,0]=3 9694 B17R0.195 CCSCCSCCCCCCCCC(=O)OC 62a_100000757381_100010282707 [0,1,1,0,0,0|1,0,0]=3 9695 B17R0.195 CCSCCSCCCCCCCCC(=O)OC 62a_100010282707_100000757381 [0,1,1,0,0,0|1,0,0]=3 9696 B17R0.195 CNC(=O)CCCCCCCCCCCCCO 240690a_100102657272_100020644313 [0,1,1,0,0,0|1,0,0]=3 9697 B17R0.195 CNC(=O)CCCNCCCCCCCCCO 2230a_100000078944_100000741757 [0,1,1,0,0,0|2,0,0]=4 9698 B17R0.195 CNC(=O)CCCNCCCCCCCCCO 2230a_100000740002_100009813782 [0,1,1,0,0,0|2,0,0]=4 9699 B17R0.195 CNC(=O)CCCNCCCCCCCCCO 34a_100000078944_100000741757 [0,1,1,0,0,0|2,0,0]=4 9700 B17R0.195 CNC(=O)CCCNCCCCCCCCCO 34a_100000740002_100009813782 [0,1,1,0,0,0|2,0,0]=4 9701 B17R0.195 CNC(=O)CCCOCCCCCCCCCBr 34a_100009813782_100000741757 [0,1,1,0,0,0|2,0,0]=4 9702 B17R0.195 CNC(=O)CCCOCCCCCCCCCBr 7a_100009813782_100000741757 [0,1,1,0,0,0|2,0,0]=4 9703 B17R0.195 CNC(=O)CCCOCCCCCCCCCCl 34a_100009868337_100000741757 [0,1,1,0,0,0|2,0,0]=4 9704 B17R0.195 CNC(=O)CCCOCCCCCCCCCCl 7a_100009868337_100000741757 [0,1,1,0,0,0|2,0,0]=4 9705 B17R0.195 CNC(=O)CCCOCCCCCCCCCN 34a_100000078944_100000741757 [0,1,1,0,0,0|2,0,0]=4 9706 B17R0.195 CNC(=O)CCCSCCCCCCCCCO 62a_100000741757_100009813782 [0,1,1,0,0,0|2,0,0]=4 9707 B17R0.195 CNC(=O)CCCSCCCCCCCCCO 62a_100009813782_100000741757 [0,1,1,0,0,0|2,0,0]=4 9708 B17R0.195 CNC(=O)CCNCCCCCCCCCCO 2230a_100000066964_100000737683 [0,1,1,0,0,0|2,0,0]=4 9709 B17R0.195 CNC(=O)CCNCCCCCCCCCCO 2230a_100000738227_100009813290 [0,1,1,0,0,0|2,0,0]=4 9710 B17R0.195 CNC(=O)CCNCCCCCCCCCCO 34a_100000066964_100012179268 [0,1,1,0,0,0|2,0,0]=4 9711 B17R0.195 CNC(=O)CCNCCCCCCCCCCO 34a_100000738227_100009813290 [0,1,1,0,0,0|2,0,0]=4 9712 B17R0.195 CNC(=O)CCOCCCCCCCCCCBr 34a_100009813290_100012179268 [0,1,1,0,0,0|2,0,0]=4 9713 B17R0.195 CNC(=O)CCOCCCCCCCCCCBr 7a_100009813290_100000737683 [0,1,1,0,0,0|2,0,0]=4 9714 B17R0.195 CNC(=O)CCOCCCCCCCCCCCl 34a_200000033068_100012179268 [0,1,1,0,0,0|2,0,0]=4 9715 B17R0.195 CNC(=O)CCOCCCCCCCCCCCl 7a_200000033068_100000737683 [0,1,1,0,0,0|2,0,0]=4 9716 B17R0.195 CNC(=O)CCOCCCCCCCCCCN 34a_100000066964_100012179268 [0,1,1,0,0,0|2,0,0]=4 9717 B17R0.195 CNC(=O)CCOCCCCCCCCCCO 34a_100000754576_100009813290 [0,1,1,0,0,0|2,0,0]=4 9718 B17R0.195 CNC(=O)CCSCCCCCCCCCCO 62a_100000737683_200000033068 [0,1,1,0,0,0|2,0,0]=4 9719 B17R0.195 CNC(=O)CCSCCCCCCCCCCO 62a_100009813290_100000737683 [0,1,1,0,0,0|2,0,0]=4 9720 B17R0.195 CNC(=O)CNCCCCCCCCCCCO 2230a_100000693194_100009812471 [0,1,1,0,0,0|2,0,0]=4 9721 B17R0.195 CNC(=O)COCCCCCCCCCCCBr 34a_100009812471_100000183359 [0,1,1,0,0,0|2,0,0]=4 9722 B17R0.195 CNC(=O)COCCCCCCCCCCCBr 7a_100009812471_100000183359 [0,1,1,0,0,0|2,0,0]=4 9723 B17R0.195 CNC(=O)COCCCCCCCCCCCO 34a_100000750040_100009812471 [0,1,1,0,0,0|2,0,0]=4 9724 B17R0.195 CNC(=O)CSCCCCCCCCCCCO 62a_100009812471_100000183359 [0,1,1,0,0,0|2,0,0]=4 9725 B17R0.195 CNC(=O)NCCCCCCCCCCCCO 2708a_100000066677_106832991635 [0,1,1,0,0,0|2,0,0]=4 9726 B17R0.195 CNC(=O)NCCCCCCCCCCCCO 2708a_100102657272_100000066677 [0,1,1,0,0,0|2,0,0]=4 9727 B17R0.195 CNC(=O)NCCCCCCCCCCCCO 273464a_100000066677_100102657272 [0,1,1,0,0,0|2,0,0]=4 9728 B17R0.195 CNC(=O)NCCCCCCCCCCCCO 273464a_100102657272_100000066677 [0,1,1,0,0,0|2,0,0]=4 9729 B17R0.195 CNC(=O)NCCCCCCCCCCCCO 512a_100000066677_100102657272 [0,1,1,0,0,0|2,0,0]=4 9730 B17R0.195 CNC(=O)NCCCCCCCCCCCCO 512a_106832991638_100000066677 [0,1,1,0,0,0|2,0,0]=4 9731 B17R0.195 CNC(=O)OCCNCCCCCCCCCO 34a_100000078944_200011997002 [0,1,1,0,0,0|2,0,0]=4 9732 B17R0.195 CNC(=O)OCCOCCCCCCCCCBr 34a_100009813782_200011997002 [0,1,1,0,0,0|2,0,0]=4 9733 B17R0.195 CNC(=O)OCCOCCCCCCCCCBr 7a_100009813782_200011997002 [0,1,1,0,0,0|2,0,0]=4 9734 B17R0.195 CNC(=O)OCCOCCCCCCCCCCl 34a_100009868337_200011997002 [0,1,1,0,0,0|2,0,0]=4 9735 B17R0.195 CNC(=O)OCCOCCCCCCCCCCl 7a_100009868337_200011997002 [0,1,1,0,0,0|2,0,0]=4 9736 B17R0.195 CNC(=O)OCCOCCCCCCCCCN 34a_100000078944_200011997002 [0,1,1,0,0,0|2,0,0]=4 9737 B17R0.195 CNC(=O)OCCSCCCCCCCCCO 62a_100009813782_200011997002 [0,1,1,0,0,0|2,0,0]=4 9738 B17R0.195 CNC(=O)OCCSCCCCCCCCCO 62a_200011997002_100009813782 [0,1,1,0,0,0|2,0,0]=4 9739 B17R0.195 CNCCCCCCCCCCCCC(=O)OC 2230a_106832991635_209314222159 [0,1,1,0,0,0|0,0,0]=2 9740 B17R0.195 CNCCCCCCCCCCCCC(=O)OC 34a_100102657272_209314222159 [0,1,1,0,0,0|0,0,0]=2 9741 B17R0.195 CNCCCCCCCCCCCCC(=O)OC 7a_106832991635_209314222159 [0,1,1,0,0,0|0,0,0]=2 9742 B17R0.195 CNCCCCCOCCCCCCC(=O)OC 34a_100000722520_100009815986 [0,1,1,0,0,0|1,0,0]=3 9743 B17R0.195 CNCCCOCCCCCCCCC(=O)OC 34a_100000213112_100010282707 [0,1,1,0,0,0|1,0,0]=3 9744 B17R0.195 CNCCOCCOCCCCCCC(=O)OC 34a_100000228057_100009815986 [0,1,1,0,0,0|2,0,0]=4 9745 B17R0.195 COC(=O)CCCCCCCCCCCCSC 62a_200000210301_209314222159 [0,1,1,0,0,0|0,0,0]=2 9746 B17R0.195 COC(=O)CCCCCCCCCCCCS[13CH3] 62a_200025704644_209314222159 [0,1,1,0,0,0|0,0,0]=2 9747 B17R0.195 COC(=O)CCCCCCCCCCCSCF 62a_100015361967_100010983606 [0,1,1,0,0,0|1,0,0]=3 9748 B17R0.195 COC(=O)CCCCCCCCCCNCCF 34a_100000724931_100009812566 [0,1,1,0,0,0|1,0,0]=3 9749 B17R0.195 COC(=O)CCCCCCCCCCNCCO 2230a_100016997473_100009812566 [0,1,1,0,0,0|1,0,0]=3 9750 B17R0.195 COC(=O)CCCCCCCCCCNCCO 34a_100016990907_100009812566 [0,1,1,0,0,0|1,0,0]=3 9751 B17R0.195 COC(=O)CCCCCCCCCCOCC#N 7a_100011003013_100011215382 [0,1,1,0,0,0|1,0,1]=4 9752 B17R0.195 COC(=O)CCCCCCCCCCOCC=O 34a_100011003013_200009817547 [0,1,1,0,0,0|1,0,1]=4 9753 B17R0.195 COC(=O)CCCCCCCCCCOCC=O 7a_100011003013_200015260668 [0,1,1,0,0,0|1,0,1]=4 9754 B17R0.195 COC(=O)CCCCCCCCCCOCCBr 34a_100000211926_100009812566 [0,1,1,0,0,0|1,0,0]=3 9755 B17R0.195 COC(=O)CCCCCCCCCCOCCF 34a_100011003013_100011217306 [0,1,1,0,0,0|1,0,0]=3 9756 B17R0.195 COC(=O)CCCCCCCCCCOCCF 7a_100011003013_100011217306 [0,1,1,0,0,0|1,0,0]=3 9757 B17R0.195 COC(=O)CCCCCCCCCCOCCN 34a_100000210304_100009812566 [0,1,1,0,0,0|1,0,0]=3 9758 B17R0.195 COC(=O)CCCCCCCCCCOCCO 34a_100011003013_100000211926 [0,1,1,0,0,0|1,0,0]=3 9759 B17R0.195 COC(=O)CCCCCCCCCCOCCO 7a_100011003013_100000211926 [0,1,1,0,0,0|1,0,0]=3 9760 B17R0.195 COC(=O)CCCCCCCCCCOCSC 34a_100011003013_100011218213 [0,1,1,0,0,0|1,0,0]=3 9761 B17R0.195 COC(=O)CCCCCCCCCCSCC#N 62a_100011215382_100009812566 [0,1,1,0,0,0|1,0,1]=4 9762 B17R0.195 COC(=O)CCCCCCCCCCSCC=O 62a_200015260668_100009812566 [0,1,1,0,0,0|1,0,1]=4 9763 B17R0.195 COC(=O)CCCCCCCCCCSCCF 62a_100011217306_100009812566 [0,1,1,0,0,0|1,0,0]=3 9764 B17R0.195 COC(=O)CCCCCCCCCCSCCO 62a_100000211926_100009812566 [0,1,1,0,0,0|1,0,0]=3 9765 B17R0.195 COC(=O)CCCCCCCCCCSCSC 62a_100011218213_100009812566 [0,1,1,0,0,0|1,0,0]=3 9766 B17R0.195 COC(=O)CCCCCCCCCNCCCF 2230a_100015189416_100009813843 [0,1,1,0,0,0|1,0,0]=3 9767 B17R0.195 COC(=O)CCCCCCCCCNCCCF 34a_100015189416_100009813843 [0,1,1,0,0,0|1,0,0]=3 9768 B17R0.195 COC(=O)CCCCCCCCCNCCSC 2230a_100020590264_100009813843 [0,1,1,0,0,0|1,0,0]=3 9769 B17R0.195 COC(=O)CCCCCCCCCOCCCBr 34a_100011217188_100009813843 [0,1,1,0,0,0|1,0,0]=3 9770 B17R0.195 COC(=O)CCCCCCCCCOCCCCl 34a_100000230001_100009813843 [0,1,1,0,0,0|1,0,0]=3 9771 B17R0.195 COC(=O)CCCCCCCCCOCCCF 34a_100000759539_100009813843 [0,1,1,0,0,0|1,0,0]=3 9772 B17R0.195 COC(=O)CCCCCCCCCOCCCN 34a_100000182051_100009813843 [0,1,1,0,0,0|1,0,0]=3 9773 B17R0.195 COC(=O)CCCCCCCCCOCCON 34a_100000700252_100009813843 [0,1,1,0,0,0|2,0,0]=4 9774 B17R0.195 COC(=O)CCCCCCCCCOCCSC 34a_100000230434_100009813843 [0,1,1,0,0,0|1,0,0]=3 9775 B17R0.195 COC(=O)CCCCCCCCCOCCSC 7a_100000230434_100009813843 [0,1,1,0,0,0|1,0,0]=3 9776 B17R0.195 COC(=O)CCCCCCCCCSCCC#N 62a_100011215226_100009813843 [0,1,1,0,0,0|1,0,1]=4 9777 B17R0.195 COC(=O)CCCCCCCCCSCCCF 62a_100011934791_100009813843 [0,1,1,0,0,0|1,0,0]=3 9778 B17R0.195 COC(=O)CCCCCCCCCSCCCO 62a_100011215043_100009813843 [0,1,1,0,0,0|1,0,0]=3 9779 B17R0.195 COC(=O)CCCCCCCCCSCCSC 62a_100000212216_100009813843 [0,1,1,0,0,0|1,0,0]=3 9780 B17R0.195 COC(=O)CCCCCCCCNCCCCO 2230a_100000750430_100010282707 [0,1,1,0,0,0|1,0,0]=3 9781 B17R0.195 COC(=O)CCCCCCCCNCCCCO 34a_100000750430_100010282707 [0,1,1,0,0,0|1,0,0]=3 9782 B17R0.195 COC(=O)CCCCCCCCNCCCSC 2230a_100000749238_100010282707 [0,1,1,0,0,0|1,0,0]=3 9783 B17R0.195 COC(=O)CCCCCCCCOCCCC#N 7a_100000035544_100000687738 [0,1,1,0,0,0|1,0,1]=4 9784 B17R0.195 COC(=O)CCCCCCCCOCCCC=O 7a_100000035544_200011292268 [0,1,1,0,0,0|1,0,1]=4 9785 B17R0.195 COC(=O)CCCCCCCCOCCCCBr 34a_100011216708_100010282707 [0,1,1,0,0,0|1,0,0]=3 9786 B17R0.195 COC(=O)CCCCCCCCOCCCCCl 34a_100000210776_100010282707 [0,1,1,0,0,0|1,0,0]=3 9787 B17R0.195 COC(=O)CCCCCCCCOCCCCCl 7a_100000210776_100010282707 [0,1,1,0,0,0|1,0,0]=3 9788 B17R0.195 COC(=O)CCCCCCCCOCCCCF 34a_100000035544_100000729493 [0,1,1,0,0,0|1,0,0]=3 9789 B17R0.195 COC(=O)CCCCCCCCOCCCCF 34a_100011995726_100010282707 [0,1,1,0,0,0|1,0,0]=3 9790 B17R0.195 COC(=O)CCCCCCCCOCCCCF 7a_100000035544_100000729493 [0,1,1,0,0,0|1,0,0]=3 9791 B17R0.195 COC(=O)CCCCCCCCOCCCCF 7a_100011995726_100010282707 [0,1,1,0,0,0|1,0,0]=3 9792 B17R0.195 COC(=O)CCCCCCCCOCCCCI 34a_200012148704_100010282707 [0,1,1,0,0,0|1,0,0]=3 9793 B17R0.195 COC(=O)CCCCCCCCOCCCCN 34a_100000750430_100010282707 [0,1,1,0,0,0|1,0,0]=3 9794 B17R0.195 COC(=O)CCCCCCCCOCCCCO 34a_100000035544_100011216708 [0,1,1,0,0,0|1,0,0]=3 9795 B17R0.195 COC(=O)CCCCCCCCOCCCCO 7a_100000035544_100000210776 [0,1,1,0,0,0|1,0,0]=3 9796 B17R0.195 COC(=O)CCCCCCCCOCCCSC 34a_100000690336_100010282707 [0,1,1,0,0,0|1,0,0]=3 9797 B17R0.195 COC(=O)CCCCCCCCOCCCSC 7a_100000690336_100010282707 [0,1,1,0,0,0|1,0,0]=3 9798 B17R0.195 COC(=O)CCCCCCCCSCCCC#N 62a_100000687738_100010282707 [0,1,1,0,0,0|1,0,1]=4 9799 B17R0.195 COC(=O)CCCCCCCCSCCCC#N 62a_100010282707_100000687738 [0,1,1,0,0,0|1,0,1]=4 9800 B17R0.195 COC(=O)CCCCCCCCSCCCC=O 62a_100010282707_200011292268 [0,1,1,0,0,0|1,0,1]=4 9801 B17R0.195 COC(=O)CCCCCCCCSCCCC=O 62a_200011292268_100010282707 [0,1,1,0,0,0|1,0,1]=4 9802 B17R0.195 COC(=O)CCCCCCCCSCCCCF 62a_100000729493_100010282707 [0,1,1,0,0,0|1,0,0]=3 9803 B17R0.195 COC(=O)CCCCCCCCSCCCCF 62a_100010282707_100000729493 [0,1,1,0,0,0|1,0,0]=3 9804 B17R0.195 COC(=O)CCCCCCCCSCCCCO 62a_100000210776_100010282707 [0,1,1,0,0,0|1,0,0]=3 9805 B17R0.195 COC(=O)CCCCCCCCSCCCCO 62a_100010282707_100000210776 [0,1,1,0,0,0|1,0,0]=3 9806 B17R0.195 COC(=O)CCCCCCCNCCCCCO 2230a_100000762737_100010004213 [0,1,1,0,0,0|1,0,0]=3 9807 B17R0.195 COC(=O)CCCCCCCNCCCCCO 34a_100000762737_100010004213 [0,1,1,0,0,0|1,0,0]=3 9808 B17R0.195 COC(=O)CCCCCCCNCCOCCO 2230a_100000211614_100010004213 [0,1,1,0,0,0|2,0,0]=4 9809 B17R0.195 COC(=O)CCCCCCCNCCOCCO 34a_100000211614_100010004213 [0,1,1,0,0,0|2,0,0]=4 9810 B17R0.195 COC(=O)CCCCCCCNCCSCCO 2230a_100011219999_100010004213 [0,1,1,0,0,0|2,0,0]=4 9811 B17R0.195 COC(=O)CCCCCCCOCCCCC#N 7a_100011022521_100000211819 [0,1,1,0,0,0|1,0,1]=4 9812 B17R0.195 COC(=O)CCCCCCCOCCCCC=O 7a_100011022521_100000139335 [0,1,1,0,0,0|1,0,1]=4 9813 B17R0.195 COC(=O)CCCCCCCOCCCCCBr 34a_100000746331_100010004213 [0,1,1,0,0,0|1,0,0]=3 9814 B17R0.195 COC(=O)CCCCCCCOCCCCCBr 7a_100000746331_100010004213 [0,1,1,0,0,0|1,0,0]=3 9815 B17R0.195 COC(=O)CCCCCCCOCCCCCCl 34a_100000746330_100010004213 [0,1,1,0,0,0|1,0,0]=3 9816 B17R0.195 COC(=O)CCCCCCCOCCCCCCl 7a_100000746330_100010004213 [0,1,1,0,0,0|1,0,0]=3 9817 B17R0.195 COC(=O)CCCCCCCOCCCCCF 34a_100011022521_100000729378 [0,1,1,0,0,0|1,0,0]=3 9818 B17R0.195 COC(=O)CCCCCCCOCCCCCF 7a_100011022521_100000729378 [0,1,1,0,0,0|1,0,0]=3 9819 B17R0.195 COC(=O)CCCCCCCOCCCCCI 34a_200012148887_100010004213 [0,1,1,0,0,0|1,0,0]=3 9820 B17R0.195 COC(=O)CCCCCCCOCCCCCI 7a_200012148887_100010004213 [0,1,1,0,0,0|1,0,0]=3 9821 B17R0.195 COC(=O)CCCCCCCOCCCCCN 34a_100000762737_100010004213 [0,1,1,0,0,0|1,0,0]=3 9822 B17R0.195 COC(=O)CCCCCCCOCCCCCO 34a_100011022521_100000746330 [0,1,1,0,0,0|1,0,0]=3 9823 B17R0.195 COC(=O)CCCCCCCOCCCCCO 7a_100011022521_100000746330 [0,1,1,0,0,0|1,0,0]=3 9824 B17R0.195 COC(=O)CCCCCCCOCCCCSC 34a_100011217163_100010004213 [0,1,1,0,0,0|1,0,0]=3 9825 B17R0.195 COC(=O)CCCCCCCOCCCCSC 7a_100011217163_100010004213 [0,1,1,0,0,0|1,0,0]=3 9826 B17R0.195 COC(=O)CCCCCCCOCCOCCBr 34a_100000692535_100010004213 [0,1,1,0,0,0|2,0,0]=4 9827 B17R0.195 COC(=O)CCCCCCCOCCOCCBr 7a_100000692535_100010004213 [0,1,1,0,0,0|2,0,0]=4 9828 B17R0.195 COC(=O)CCCCCCCOCCOCCCl 34a_100011215305_100010004213 [0,1,1,0,0,0|2,0,0]=4 9829 B17R0.195 COC(=O)CCCCCCCOCCOCCCl 7a_100011215305_100010004213 [0,1,1,0,0,0|2,0,0]=4 9830 B17R0.195 COC(=O)CCCCCCCOCCOCCF 34a_200015357709_100010004213 [0,1,1,0,0,0|2,0,0]=4 9831 B17R0.195 COC(=O)CCCCCCCOCCOCCF 7a_200015357709_100010004213 [0,1,1,0,0,0|2,0,0]=4 9832 B17R0.195 COC(=O)CCCCCCCOCCOCCI 34a_100012149058_100010004213 [0,1,1,0,0,0|2,0,0]=4 9833 B17R0.195 COC(=O)CCCCCCCOCCOCCI 7a_100012149058_100010004213 [0,1,1,0,0,0|2,0,0]=4 9834 B17R0.195 COC(=O)CCCCCCCOCCOCCN 34a_100000211614_100010004213 [0,1,1,0,0,0|2,0,0]=4 9835 B17R0.195 COC(=O)CCCCCCCOCCOCCO 34a_100011022521_100000692535 [0,1,1,0,0,0|2,0,0]=4 9836 B17R0.195 COC(=O)CCCCCCCOCCOCCO 7a_100011022521_100011215305 [0,1,1,0,0,0|2,0,0]=4 9837 B17R0.195 COC(=O)CCCCCCCSCCCCC#N 62a_100010004213_100000211819 [0,1,1,0,0,0|1,0,1]=4 9838 B17R0.195 COC(=O)CCCCCCCSCCCCC#N 62a_100011219923_100010004213 [0,1,1,0,0,0|1,0,1]=4 9839 B17R0.195 COC(=O)CCCCCCCSCCCCC=O 62a_100000139335_100010004213 [0,1,1,0,0,0|1,0,1]=4 9840 B17R0.195 COC(=O)CCCCCCCSCCCCC=O 62a_100010004213_100000139335 [0,1,1,0,0,0|1,0,1]=4 9841 B17R0.195 COC(=O)CCCCCCCSCCCCCF 62a_100000729378_100010004213 [0,1,1,0,0,0|1,0,0]=3 9842 B17R0.195 COC(=O)CCCCCCCSCCCCCF 62a_100010004213_100000729378 [0,1,1,0,0,0|1,0,0]=3 9843 B17R0.195 COC(=O)CCCCCCCSCCCCCO 62a_100000746330_100010004213 [0,1,1,0,0,0|1,0,0]=3 9844 B17R0.195 COC(=O)CCCCCCCSCCCCCO 62a_100010004213_100000746330 [0,1,1,0,0,0|1,0,0]=3 9845 B17R0.195 COC(=O)CCCCCCCSCCOCCO 62a_100010004213_100011215305 [0,1,1,0,0,0|2,0,0]=4 9846 B17R0.195 COC(=O)CCCCCCCSCCOCCO 62a_100011215305_100010004213 [0,1,1,0,0,0|2,0,0]=4 9847 B17R0.195 COC(=O)CCCCCCNCCCCCCO 2230a_100000686447_100009815986 [0,1,1,0,0,0|1,0,0]=3 9848 B17R0.195 COC(=O)CCCCCCNCCCCCCO 34a_100000686447_100009815986 [0,1,1,0,0,0|1,0,0]=3 9849 B17R0.195 COC(=O)CCCCCCOCCCCCC#N 7a_100009863599_100009813376 [0,1,1,0,0,0|1,0,1]=4 9850 B17R0.195 COC(=O)CCCCCCOCCCCCC=O 7a_100009863599_100000139337 [0,1,1,0,0,0|1,0,1]=4 9851 B17R0.195 COC(=O)CCCCCCOCCCCCCBr 34a_100011215345_100009815986 [0,1,1,0,0,0|1,0,0]=3 9852 B17R0.195 COC(=O)CCCCCCOCCCCCCBr 7a_100011215345_100009815986 [0,1,1,0,0,0|1,0,0]=3 9853 B17R0.195 COC(=O)CCCCCCOCCCCCCCl 34a_100000766143_100009815986 [0,1,1,0,0,0|1,0,0]=3 9854 B17R0.195 COC(=O)CCCCCCOCCCCCCCl 7a_100000766143_100009815986 [0,1,1,0,0,0|1,0,0]=3 9855 B17R0.195 COC(=O)CCCCCCOCCCCCCF 34a_100000732779_100009815986 [0,1,1,0,0,0|1,0,0]=3 9856 B17R0.195 COC(=O)CCCCCCOCCCCCCF 34a_100009863599_100015922095 [0,1,1,0,0,0|1,0,0]=3 9857 B17R0.195 COC(=O)CCCCCCOCCCCCCF 7a_100000732779_100009815986 [0,1,1,0,0,0|1,0,0]=3 9858 B17R0.195 COC(=O)CCCCCCOCCCCCCF 7a_100009863599_100015922095 [0,1,1,0,0,0|1,0,0]=3 9859 B17R0.195 COC(=O)CCCCCCOCCCCCCN 34a_100000686447_100009815986 [0,1,1,0,0,0|1,0,0]=3 9860 B17R0.195 COC(=O)CCCCCCOCCCCCCO 34a_100009863599_100000766143 [0,1,1,0,0,0|1,0,0]=3 9861 B17R0.195 COC(=O)CCCCCCOCCCCCCO 7a_100009863599_100000766143 [0,1,1,0,0,0|1,0,0]=3 9862 B17R0.195 COC(=O)CCCCCCSCCCCCC#N 62a_100009813376_100009815986 [0,1,1,0,0,0|1,0,1]=4 9863 B17R0.195 COC(=O)CCCCCCSCCCCCC#N 62a_100009815986_100009813376 [0,1,1,0,0,0|1,0,1]=4 9864 B17R0.195 COC(=O)CCCCCCSCCCCCC=O 62a_100000139337_100009815986 [0,1,1,0,0,0|1,0,1]=4 9865 B17R0.195 COC(=O)CCCCCCSCCCCCC=O 62a_100009815986_100000139337 [0,1,1,0,0,0|1,0,1]=4 9866 B17R0.195 COC(=O)CCCCCCSCCCCCCF 62a_100009815986_100015922095 [0,1,1,0,0,0|1,0,0]=3 9867 B17R0.195 COC(=O)CCCCCCSCCCCCCF 62a_100015922095_100009815986 [0,1,1,0,0,0|1,0,0]=3 9868 B17R0.195 COC(=O)CCCCCCSCCCCCCO 62a_100000766143_100009815986 [0,1,1,0,0,0|1,0,0]=3 9869 B17R0.195 COC(=O)CCCCCCSCCCCCCO 62a_100009815986_100000766143 [0,1,1,0,0,0|1,0,0]=3 9870 B17R0.195 COC(=O)CCCCCNCCCCCCCO 2230a_100011996573_100009816466 [0,1,1,0,0,0|1,0,0]=3 9871 B17R0.195 COC(=O)CCCCCNCCCCCCCO 34a_100011996573_100009816466 [0,1,1,0,0,0|1,0,0]=3 9872 B17R0.195 COC(=O)CCCCCNCCCOCCCO 2230a_100011310245_100009816466 [0,1,1,0,0,0|2,0,0]=4 9873 B17R0.195 COC(=O)CCCCCNCCCOCCCO 34a_100011310245_100009816466 [0,1,1,0,0,0|2,0,0]=4 9874 B17R0.195 COC(=O)CCCCCOCCCCCCC#N 7a_100000074720_100009813337 [0,1,1,0,0,0|1,0,1]=4 9875 B17R0.195 COC(=O)CCCCCOCCCCCCCBr 34a_100000760002_100009816466 [0,1,1,0,0,0|1,0,0]=3 9876 B17R0.195 COC(=O)CCCCCOCCCCCCCBr 7a_100000760002_100009816466 [0,1,1,0,0,0|1,0,0]=3 9877 B17R0.195 COC(=O)CCCCCOCCCCCCCN 34a_100011996573_100009816466 [0,1,1,0,0,0|1,0,0]=3 9878 B17R0.195 COC(=O)CCCCCOCCCCCCCO 34a_100000074720_100000760002 [0,1,1,0,0,0|1,0,0]=3 9879 B17R0.195 COC(=O)CCCCCOCCCCCCCO 7a_100000074720_100000760002 [0,1,1,0,0,0|1,0,0]=3 9880 B17R0.195 COC(=O)CCCCCOCCCOCCCN 34a_100011310245_100009816466 [0,1,1,0,0,0|2,0,0]=4 9881 B17R0.195 COC(=O)CCCCCSCCCCCCC#N 62a_100009813337_100009816466 [0,1,1,0,0,0|1,0,1]=4 9882 B17R0.195 COC(=O)CCCCCSCCCCCCC#N 62a_100009816466_100009813337 [0,1,1,0,0,0|1,0,1]=4 9883 B17R0.195 COC(=O)CCCCCSCCCCCCCO 62a_100000760002_100009816466 [0,1,1,0,0,0|1,0,0]=3 9884 B17R0.195 COC(=O)CCCCCSCCCCCCCO 62a_100009816466_100000760002 [0,1,1,0,0,0|1,0,0]=3 9885 B17R0.195 COC(=O)CCCCNCCCCCCCCO 2230a_102515433106_100000204269 [0,1,1,0,0,0|1,0,0]=3 9886 B17R0.195 COC(=O)CCCCNCCCCCCCCO 34a_102515433106_100000204269 [0,1,1,0,0,0|1,0,0]=3 9887 B17R0.195 COC(=O)CCCCOCCCCCCCCBr 34a_100009813846_100000204269 [0,1,1,0,0,0|1,0,0]=3 9888 B17R0.195 COC(=O)CCCCOCCCCCCCCBr 7a_100009813846_100000204269 [0,1,1,0,0,0|1,0,0]=3 9889 B17R0.195 COC(=O)CCCCOCCCCCCCCCl 34a_100000033203_100000204269 [0,1,1,0,0,0|1,0,0]=3 9890 B17R0.195 COC(=O)CCCCOCCCCCCCCCl 7a_100000033203_100000204269 [0,1,1,0,0,0|1,0,0]=3 9891 B17R0.195 COC(=O)CCCCOCCCCCCCCN 34a_102515433106_100000204269 [0,1,1,0,0,0|1,0,0]=3 9892 B17R0.195 COC(=O)CCCCOCCCCCCCCO 34a_100000059025_100000033203 [0,1,1,0,0,0|1,0,0]=3 9893 B17R0.195 COC(=O)CCCCOCCCCCCCCO 7a_100000059025_100000033203 [0,1,1,0,0,0|1,0,0]=3 9894 B17R0.195 COC(=O)CCCCOCCCCCNCCN 34a_103619048469_100000204269 [0,1,1,0,0,0|2,0,0]=4 9895 B17R0.195 COC(=O)CCCCSCCCCCCCCO 62a_100000033203_100000204269 [0,1,1,0,0,0|1,0,0]=3 9896 B17R0.195 COC(=O)CCCCSCCCCCCCCO 62a_100000204269_100000033203 [0,1,1,0,0,0|1,0,0]=3 9897 B17R0.195 COC(=O)CCCNCCCCCCCCCO 2230a_100000078944_100011218270 [0,1,1,0,0,0|1,0,0]=3 9898 B17R0.195 COC(=O)CCCNCCCCCCCCCO 34a_100000078944_100000742333 [0,1,1,0,0,0|1,0,0]=3 9899 B17R0.195 COC(=O)CCCOCCCCCCCCCBr 34a_100009813782_100000742333 [0,1,1,0,0,0|1,0,0]=3 9900 B17R0.195 COC(=O)CCCOCCCCCCCCCBr 7a_100009813782_100011218270 [0,1,1,0,0,0|1,0,0]=3 9901 B17R0.195 COC(=O)CCCOCCCCCCCCCCl 34a_100009868337_100000742333 [0,1,1,0,0,0|1,0,0]=3 9902 B17R0.195 COC(=O)CCCOCCCCCCCCCCl 7a_100009868337_100011218270 [0,1,1,0,0,0|1,0,0]=3 9903 B17R0.195 COC(=O)CCCOCCCCCCCCCN 34a_100000078944_100000742333 [0,1,1,0,0,0|1,0,0]=3 9904 B17R0.195 COC(=O)CCCSCCCCCCCCCO 62a_100009813782_100011218270 [0,1,1,0,0,0|1,0,0]=3 9905 B17R0.195 COC(=O)CCCSCCCCCCCCCO 62a_100011218270_100009813782 [0,1,1,0,0,0|1,0,0]=3 9906 B17R0.195 COC(=O)CCNCCCCCCCCCCO 2230a_100000066964_100000204255 [0,1,1,0,0,0|1,0,0]=3 9907 B17R0.195 COC(=O)CCNCCCCCCCCCCO 34a_100000066964_100000742370 [0,1,1,0,0,0|1,0,0]=3 9908 B17R0.195 COC(=O)CCOCCCCCCCCCCBr 34a_100009813290_100000742370 [0,1,1,0,0,0|1,0,0]=3 9909 B17R0.195 COC(=O)CCOCCCCCCCCCCBr 7a_100009813290_100000204255 [0,1,1,0,0,0|1,0,0]=3 9910 B17R0.195 COC(=O)CCOCCCCCCCCCCCl 34a_200000033068_100000742370 [0,1,1,0,0,0|1,0,0]=3 9911 B17R0.195 COC(=O)CCOCCCCCCCCCCCl 7a_200000033068_100000204255 [0,1,1,0,0,0|1,0,0]=3 9912 B17R0.195 COC(=O)CCOCCCCCCCCCCN 34a_100000066964_100000742370 [0,1,1,0,0,0|1,0,0]=3 9913 B17R0.195 COC(=O)CCSCCCCCCCCCCO 62a_100000204255_200000033068 [0,1,1,0,0,0|1,0,0]=3 9914 B17R0.195 COC(=O)CCSCCCCCCCCCCO 62a_100009813290_100000204255 [0,1,1,0,0,0|1,0,0]=3 9915 B17R0.195 COC(=O)COCCCCCCCCCCCBr 34a_100009812471_100000747449 [0,1,1,0,0,0|1,0,0]=3 9916 B17R0.195 COC(=O)COCCCCCCCCCCCBr 7a_100009812471_100000747449 [0,1,1,0,0,0|1,0,0]=3 9917 B17R0.195 COC(=O)COCCNCCCCCCCCO 2230a_102515433106_100000090808 [0,1,1,0,0,0|2,0,0]=4 9918 B17R0.195 COC(=O)COCCNCCCCCCCCO 34a_102515433106_100000090808 [0,1,1,0,0,0|2,0,0]=4 9919 B17R0.195 COC(=O)COCCOCCCCCCCCBr 34a_100009813846_100000090808 [0,1,1,0,0,0|2,0,0]=4 9920 B17R0.195 COC(=O)COCCOCCCCCCCCBr 7a_100009813846_100000090808 [0,1,1,0,0,0|2,0,0]=4 9921 B17R0.195 COC(=O)COCCOCCCCCCCCCl 34a_100000033203_100000090808 [0,1,1,0,0,0|2,0,0]=4 9922 B17R0.195 COC(=O)COCCOCCCCCCCCCl 7a_100000033203_100000090808 [0,1,1,0,0,0|2,0,0]=4 9923 B17R0.195 COC(=O)COCCOCCCCCCCCN 34a_102515433106_100000090808 [0,1,1,0,0,0|2,0,0]=4 9924 B17R0.195 COC(=O)COCCSCCCCCCCCO 62a_100000033203_100000090808 [0,1,1,0,0,0|2,0,0]=4 9925 B17R0.195 COC(=O)COCCSCCCCCCCCO 62a_100000090808_100000033203 [0,1,1,0,0,0|2,0,0]=4 9926 B17R0.195 COC(=O)CSCCCCCCCCCCCO 62a_100009812471_100000747449 [0,1,1,0,0,0|1,0,0]=3 9927 B17R0.195 COC(=O)NCCOCCCCCCCCCO 34a_100000757965_100009813782 [0,1,1,0,0,0|2,0,0]=4 9928 B17R0.195 COC(=O)OCCOCCCCCCCCCO 34a_100010262106_100009813782 [0,1,1,0,0,0|2,0,0]=4 9929 B17R0.195 COC(=O)OCSCCCCCCCCCCO 62a_100009813290_100000139417 [0,1,1,0,0,0|2,0,0]=4 9930 B17R0.195 COCCCCCCCCCCCCC(=O)OC 34a_100138415774_209314222159 [0,1,1,0,0,0|0,0,0]=2 9931 B17R0.195 COCCCCCCOCCCCCC(=O)OC 34a_100000074720_100011998445 [0,1,1,0,0,0|1,0,0]=3 9932 B17R0.195 COCCCCCCOCCCCCC(=O)OC 34a_200012092642_100009816466 [0,1,1,0,0,0|1,0,0]=3 9933 B17R0.195 COCCCCCCOCCCCCC(=O)OC 7a_100000074720_100011998445 [0,1,1,0,0,0|1,0,0]=3 9934 B17R0.195 COCCCCCCOCCCCCC(=O)OC 7a_200012092642_100009816466 [0,1,1,0,0,0|1,0,0]=3 9935 B17R0.195 COCCCCCCSCCCCCC(=O)OC 62a_100009816466_100011998445 [0,1,1,0,0,0|1,0,0]=3 9936 B17R0.195 COCCCCCCSCCCCCC(=O)OC 62a_100011998445_100009816466 [0,1,1,0,0,0|1,0,0]=3 9937 B17R0.195 COCCCCCNCCCCCCC(=O)OC 2230a_100000747528_100009815986 [0,1,1,0,0,0|1,0,0]=3 9938 B17R0.195 COCCCCCNCCCCCCC(=O)OC 34a_100000747528_100009815986 [0,1,1,0,0,0|1,0,0]=3 9939 B17R0.195 COCCCCOCCCCCCCC(=O)OC 34a_100000740925_100010004213 [0,1,1,0,0,0|1,0,0]=3 9940 B17R0.195 COCCCCOCCCCCCCC(=O)OC 34a_100011022521_100000755781 [0,1,1,0,0,0|1,0,0]=3 9941 B17R0.195 COCCCCOCCCCCCCC(=O)OC 7a_100011022521_100000730899 [0,1,1,0,0,0|1,0,0]=3 9942 B17R0.195 COCCCCSCCCCCCCC(=O)OC 62a_100000730899_100010004213 [0,1,1,0,0,0|1,0,0]=3 9943 B17R0.195 COCCCCSCCCCCCCC(=O)OC 62a_100010004213_100000730899 [0,1,1,0,0,0|1,0,0]=3 9944 B17R0.195 COCCCNCCCCCCCCC(=O)OC 34a_100150723488_100010282707 [0,1,1,0,0,0|1,0,0]=3 9945 B17R0.195 COCCCOCCCCCCCCC(=O)OC 34a_100000035544_100000740836 [0,1,1,0,0,0|1,0,0]=3 9946 B17R0.195 COCCCOCCCCCCCCC(=O)OC 34a_100000740835_100010282707 [0,1,1,0,0,0|1,0,0]=3 9947 B17R0.195 COCCCOCCCCCCCCC(=O)OC 7a_100000035544_100000740836 [0,1,1,0,0,0|1,0,0]=3 9948 B17R0.195 COCCCOCCCOCCCCC(=O)OC 34a_200011215475_100000204269 [0,1,1,0,0,0|2,0,0]=4 9949 B17R0.195 COCCCOCCCOCCCCC(=O)OC 7a_200011215475_100000204269 [0,1,1,0,0,0|2,0,0]=4 9950 B17R0.195 COCCCSCCCCCCCCC(=O)OC 62a_100000709357_100010282707 [0,1,1,0,0,0|1,0,0]=3 9951 B17R0.195 COCCCSCCCCCCCCC(=O)OC 62a_100010282707_100000709357 [0,1,1,0,0,0|1,0,0]=3 9952 B17R0.195 COCCNCCCCCCCCCC(=O)OC 2230a_100000209980_100009813843 [0,1,1,0,0,0|1,0,0]=3 9953 B17R0.195 COCCOCCCCCCCCCC(=O)OC 34a_100000210237_100009813843 [0,1,1,0,0,0|1,0,0]=3 9954 B17R0.195 COCCOCCCNCCCCCC(=O)OC 2230a_100000206027_100009816466 [0,1,1,0,0,0|2,0,0]=4 9955 B17R0.195 COCCOCCCNCCCCCC(=O)OC 34a_100000206027_100009816466 [0,1,1,0,0,0|2,0,0]=4 9956 B17R0.195 COCCOCCCOCCCCCC(=O)OC 34a_100000074720_100011216529 [0,1,1,0,0,0|2,0,0]=4 9957 B17R0.195 COCCOCCCOCCCCCC(=O)OC 7a_100000074720_100011216529 [0,1,1,0,0,0|2,0,0]=4 9958 B17R0.195 COCCOCCCSCCCCCC(=O)OC 62a_100009816466_100011216529 [0,1,1,0,0,0|2,0,0]=4 9959 B17R0.195 COCCOCCCSCCCCCC(=O)OC 62a_100011216529_100009816466 [0,1,1,0,0,0|2,0,0]=4 9960 B17R0.195 COCCOCCNCCCCCCC(=O)OC 2230a_100000745349_100009815986 [0,1,1,0,0,0|2,0,0]=4 9961 B17R0.195 COCCOCCNCCCCCCC(=O)OC 34a_100000745349_100009815986 [0,1,1,0,0,0|2,0,0]=4 9962 B17R0.195 COCCOCCOCCCCCCC(=O)OC 34a_100009863599_100000695917 [0,1,1,0,0,0|2,0,0]=4 9963 B17R0.195 COCCOCCOCCCCCCC(=O)OC 34a_100011215163_100009815986 [0,1,1,0,0,0|2,0,0]=4 9964 B17R0.195 COCCOCCOCCCCCCC(=O)OC 7a_100009863599_100000695917 [0,1,1,0,0,0|2,0,0]=4 9965 B17R0.195 COCCOCCOCCCCCCC(=O)OC 7a_100011215163_100009815986 [0,1,1,0,0,0|2,0,0]=4 9966 B17R0.195 COCCOCCSCCCCCCC(=O)OC 62a_100000695917_100009815986 [0,1,1,0,0,0|2,0,0]=4 9967 B17R0.195 COCCOCCSCCCCCCC(=O)OC 62a_100009815986_100000695917 [0,1,1,0,0,0|2,0,0]=4 9968 B17R0.195 COCCOCSCCCCCCCC(=O)OC 62a_100000231047_100010004213 [0,1,1,0,0,0|2,0,0]=4 9969 B17R0.195 COCCOCSCCCCCCCC(=O)OC 62a_100010004213_100000231047 [0,1,1,0,0,0|2,0,0]=4 9970 B17R0.195 COCCSCCCCCCCCCC(=O)OC 62a_100000233755_100009813843 [0,1,1,0,0,0|1,0,0]=3 9971 B17R0.195 COCSCCCCCCCCCCC(=O)OC 62a_100000766300_100009812566 [0,1,1,0,0,0|1,0,0]=3 9972 B17R0.195 O=C(CO)CCCCCCCCCCCCCO 1458a_100000210174_100009812470 [0,1,1,0,0,0|2,0,0]=4 9973 B17R0.195 O=C(CO)NCCCCCCCCCCCCO 240690a_100000066677_100000210174 [0,1,1,0,0,0|2,0,0]=4 9974 B17R0.3217 C#CC(CC)OCCCCCCCCCCCC 34a_100000758843_100000759014 [0,1,1,0,0,0|1,0,1]=4 9975 B17R0.3217 C#CC(CC)OCCCCCCCCCCCC 7a_100000758843_100000759014 [0,1,1,0,0,0|1,0,1]=4 9976 B17R0.3217 C=CC(CC)OCCCCCCCCCCCC 34a_100000766422_100000759014 [0,1,1,0,0,0|1,0,1]=4 9977 B17R0.3217 C=CC(CC)OCCCCCCCCCCCC 7a_100000766422_100000759014 [0,1,1,0,0,0|1,0,1]=4 9978 B17R0.5801 CCCCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000210211 [0,1,1,0,0,0|0,0,1]=3 9979 B17R0.5801 CCCCC(=O)CCCCCCCCC(=O)OC 1458a_100000210183_100010282707 [0,1,1,0,0,0|0,0,1]=3 9980 B17R0.5801 CCCCC(=O)NCCCCCCCC(=O)OC 188690a_100000687944_100000210183 [0,1,1,0,0,0|1,0,1]=4 9981 B17R0.5801 CCCCC(C)CCCCOCCCC(=O)NC 34a_200011021034_100000741757 [0,1,1,0,0,0|2,0,0]=4 9982 B17R0.5801 CCCCC(C)CCCCOCCCC(=O)NC 7a_200011021034_100000741757 [0,1,1,0,0,0|2,0,0]=4 9983 B17R0.5801 CCCCC(C)CCCCOCCCC(=O)OC 34a_200011021034_100000742333 [0,1,1,0,0,0|1,0,0]=3 9984 B17R0.5801 CCCCC(C)CCCCOCCCC(=O)OC 7a_200011021034_100011218270 [0,1,1,0,0,0|1,0,0]=3 9985 B17R0.5801 CCCCC(C)CCCCOCCOC(=O)NC 34a_200011021034_200011997002 [0,1,1,0,0,0|2,0,0]=4 9986 B17R0.5801 CCCCC(C)CCCCOCCOC(=O)NC 7a_200011021034_200011997002 [0,1,1,0,0,0|2,0,0]=4 9987 B17R0.5801 CCCCC(C)COCCCCCCC(=O)OC 34a_100011995851_100009815986 [0,1,1,0,0,0|1,0,0]=3 9988 B17R0.5801 CCCCC(C)COCCCCCCC(=O)OC 7a_100011995851_100009815986 [0,1,1,0,0,0|1,0,0]=3 9989 B17R0.5801 CCCCC(C)NCCCCCCCC(=O)OC 2230a_100000126638_100010004213 [0,1,1,0,0,0|1,0,0]=3 9990 B17R0.5801 CCCCC(C)OCCCCCCCC(=O)OC 34a_100000687866_100010004213 [0,1,1,0,0,0|1,0,0]=3 9991 B17R0.5801 CCCCC(C)OCCCCCCCC(=O)OC 34a_100011022521_200011215066 [0,1,1,0,0,0|1,0,0]=3 9992 B17R0.5801 CCCCC(C)OCCCCCCCC(=O)OC 7a_100000687866_100010004213 [0,1,1,0,0,0|1,0,0]=3 9993 B17R0.5801 CCCCC(C)OCCCCCCCC(=O)OC 7a_100011022521_200011215066 [0,1,1,0,0,0|1,0,0]=3 9994 B17R0.5801 CCCCC(C)SCCCCCCCC(=O)OC 62a_100010004213_200011215066 [0,1,1,0,0,0|1,0,0]=3 9995 B17R0.5801 CCCCC(C)SCCCCCCCC(=O)OC 62a_200011215066_100010004213 [0,1,1,0,0,0|1,0,0]=3 9996 B17R0.5801 CCCCN(C)CCCCCCCCC(=O)OC 2230a_100000207549_100010282707 [0,1,1,0,0,0|1,0,0]=3 9997 B17R0.5801 CCCCN(C)CCCCCCCCC(=O)OC 269982a_100000207549_100010282707 [0,1,1,0,0,0|1,0,0]=3 9998 B17R0.5801 CCCC[C@H](N)COCCCCCCC(=O)OC 34a_100011934283_100009815986 [0,1,1,0,0,0|1,0,0]=3 9999 B17R0.5801 CCCNC(=O)CCCCCCCCC(=O)OC 11a_100020643023_100000036616 [0,1,1,0,0,0|1,0,1]=4 10000 B17R0.5801 CCCNC(=O)CCCCCCCCC(=O)OC 1626a_100020643023_100000036616 [0,1,1,0,0,0|1,0,1]=4 10001 B17R0.5801 CCCNC(=O)CCCCCCCCC(=O)OC 240690a_100020643023_100000036616 [0,1,1,0,0,0|1,0,1]=4 10002 B17R0.5801 CCCOC(C)CNCCCCCCC(=O)OC 2230a_100015185124_100009815986 [0,1,1,0,0,0|2,0,0]=4 10003 B17R0.5801 CCCOC(C)CNCCCCCCC(=O)OC 34a_100015185124_100009815986 [0,1,1,0,0,0|2,0,0]=4 10004 B17R0.5801 CCOCC(=O)CCCCCCCCC(=O)OC 1458a_100000211967_100010282707 [0,1,1,0,0,0|1,0,1]=4 10005 B17R0.5801 CCOCC(C)OCCCCCCCC(=O)OC 34a_100000718985_100010004213 [0,1,1,0,0,0|2,0,0]=4 10006 B17R0.5801 CCOCC(C)OCCCCCCCC(=O)OC 7a_100000718985_100010004213 [0,1,1,0,0,0|2,0,0]=4 10007 B17R0.5801 CCOCC(O)CNCCCCCCC(=O)OC 2230a_102515437182_100009815986 [0,1,1,0,0,0|2,0,0]=4 10008 B17R0.5801 CCOCC(O)CNCCCCCCC(=O)OC 34a_102515437182_100009815986 [0,1,1,0,0,0|2,0,0]=4 10009 B17R0.5801 CCSCC(=O)CCCCCCCCC(=O)OC 1458a_100000230394_100010282707 [0,1,1,0,0,0|1,0,1]=4 10010 B17R0.5801 COC(=O)CCCCCCCCC(=O)CCCF 1458a_100000036616_100011934791 [0,1,1,0,0,0|1,0,1]=4 10011 B17R0.5801 COC(=O)CCCCCCCCC(=O)CCCO 1458a_100000036616_100011215043 [0,1,1,0,0,0|1,0,1]=4 10012 B17R0.5801 COC(=O)CCCCCCCCC(=O)CCSC 1458a_100000036616_100000751147 [0,1,1,0,0,0|1,0,1]=4 10013 B17R0.5801 COC(=O)CCCCCCCCC(=O)CCSC 1458a_100000174002_100010282707 [0,1,1,0,0,0|1,0,1]=4 10014 B17R0.5801 COC(=O)CCCCCCCCN(C)CCCO 2230a_100000213112_100010282707 [0,1,1,0,0,0|2,0,0]=4 10015 B17R0.5801 COC(=O)CCCCCCCCN(C)CCCO 269982a_100000213112_100010282707 [0,1,1,0,0,0|2,0,0]=4 10016 B17R0.5801 COC(=O)CCCCCCCCN(C)CCSC 2230a_100000686725_100010282707 [0,1,1,0,0,0|2,0,0]=4 10017 B17R0.5801 COC(=O)CCCCCCCCN(C)CCSC 269982a_100000686725_100010282707 [0,1,1,0,0,0|2,0,0]=4 10018 B17R0.5801 COC(=O)CCCCCCCOC(C)CCCCl 34a_200000718107_100010004213 [0,1,1,0,0,0|2,0,0]=4 10019 B17R0.5801 COC(=O)CCCCCCCOC(C)CCCCl 7a_200000718107_100010004213 [0,1,1,0,0,0|2,0,0]=4 10020 B17R0.5801 COC(=O)CCCCCCNC[C@H](C)CCCO 2230a_100160569302_100009815986 [0,1,1,0,0,0|2,0,0]=4 10021 B17R0.5801 COC(=O)CCCCCCNC[C@H](C)CCCO 34a_100160569302_100009815986 [0,1,1,0,0,0|2,0,0]=4 10022 B17R0.5801 COC(=O)CCCCCCOC[C@@H](N)CCSC 34a_100011827619_100009815986 [0,1,1,0,0,0|2,0,0]=4 10023 B17R0.5801 COCCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000233755 [0,1,1,0,0,0|1,0,1]=4 10024 B17R0.5801 COCCC(=O)CCCCCCCCC(=O)OC 1458a_100000749529_100010282707 [0,1,1,0,0,0|1,0,1]=4 10025 B17R0.5801 COCCN(C)CCCCCCCCC(=O)OC 2230a_100000743101_100010282707 [0,1,1,0,0,0|2,0,0]=4 10026 B17R0.5801 COCCN(C)CCCCCCCCC(=O)OC 269982a_100000743101_100010282707 [0,1,1,0,0,0|2,0,0]=4 10027 B17R0.8798 CCCCCCCCCC(=O)CCCC(=O)NC 1458a_100000210558_100000741757 [0,1,1,0,0,0|1,0,1]=4 10028 B17R0.8798 CCCCCCCCCC(=O)CCCC(=O)OC 1458a_100000210558_100011218270 [0,1,1,0,0,0|0,0,1]=3 10029 B17R0.8798 CCCCCCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100000210670 [0,1,1,0,0,0|0,0,1]=3 10030 B17R0.8798 CCCCCCCCCC(=O)CCOC(=O)NC 1458a_100000210558_200011997002 [0,1,1,0,0,0|1,0,1]=4 10031 B17R0.8798 CCCCCCCCCC(=O)CSCC(=O)OC 1458a_100000191316_100000210670 [0,1,1,0,0,0|1,0,1]=4 10032 B17R0.8798 CCCCCCCCCC(=O)NCCC(=O)OC 188690a_100000683876_100000210558 [0,1,1,0,0,0|1,0,1]=4 10033 B17R0.8798 CCCCCCCCCC(C)CNCC(=O)NC 270004a_100000693194_200011218516 [0,1,1,0,0,0|2,0,0]=4 10034 B17R0.8798 CCCCCCCCCC(C)NCCC(=O)NC 270004a_100000738227_100011215753 [0,1,1,0,0,0|2,0,0]=4 10035 B17R0.8798 CCCCCCCCCC(C)OCCC(=O)NC 34a_100011218016_100012179268 [0,1,1,0,0,0|2,0,0]=4 10036 B17R0.8798 CCCCCCCCCC(C)OCCC(=O)NC 7a_100011218016_100000737683 [0,1,1,0,0,0|2,0,0]=4 10037 B17R0.8798 CCCCCCCCCC(C)OCCC(=O)OC 34a_100011218016_100000742370 [0,1,1,0,0,0|1,0,0]=3 10038 B17R0.8798 CCCCCCCCCC(C)OCCC(=O)OC 7a_100011218016_100000204255 [0,1,1,0,0,0|1,0,0]=3 10039 B17R0.8798 CCCCCCCCCN(C)CCCC(=O)NC 2230a_100000232482_100000741757 [0,1,1,0,0,0|2,0,0]=4 10040 B17R0.8798 CCCCCCCCCN(C)CCCC(=O)NC 269982a_100000232482_100000741757 [0,1,1,0,0,0|2,0,0]=4 10041 B17R0.8798 CCCCCCCCCN(C)CCCC(=O)OC 2230a_100000232482_100011218270 [0,1,1,0,0,0|1,0,0]=3 10042 B17R0.8798 CCCCCCCCCN(C)CCCC(=O)OC 269982a_100000232482_100011218270 [0,1,1,0,0,0|1,0,0]=3 10043 B17R0.8798 CCCCCCCCCN(C)CCCC(=O)OC 269982a_100000739225_100000210670 [0,1,1,0,0,0|1,0,0]=3 10044 B17R0.8798 CCCCCCCCCN(C)CCOC(=O)NC 269982a_100000232482_200011997002 [0,1,1,0,0,0|2,0,0]=4 10045 B17R0.8798 CCCCCCCCNC(=O)CCCC(=O)OC 11a_100000229939_100000239890 [0,1,1,0,0,0|1,0,1]=4 10046 B17R0.8798 CCCCCCCCNC(=O)CCCC(=O)OC 1626a_100000229939_100000239890 [0,1,1,0,0,0|1,0,1]=4 10047 B17R0.8798 CCCCCCCCNC(=O)CCCC(=O)OC 240690a_100000229939_100000239890 [0,1,1,0,0,0|1,0,1]=4 10048 B17R0.8798 CCCCCCCCNC(=O)CCCC(=O)OC 527a_100000229939_100000239890 [0,1,1,0,0,0|1,0,1]=4 10049 B17R0.8798 COC(=O)CCCC(=O)CCCCCCCCO 1458a_100000239890_100000033203 [0,1,1,0,0,0|1,0,1]=4 10050 B17R0.8798 COC(=O)CCCN(C)CCCCCCCCO 269982a_100000739225_100000033203 [0,1,1,0,0,0|2,0,0]=4 10051 B17R0.11645 CCC(=O)CCCCCCCCCCC(=O)OC 1458a_100000210414_100009812566 [0,1,1,0,0,0|0,0,1]=3 10052 B17R0.11645 CCC(=O)CCCCCCCCCCC(=O)OC 1458a_100016987261_100000210202 [0,1,1,0,0,0|0,0,1]=3 10053 B17R0.11645 CCC(=O)COCCCCCCCCC(=O)OC 34a_100000725409_100010282707 [0,1,1,0,0,0|1,0,1]=4 10054 B17R0.11645 CCC(=O)COCCCCCCCCC(=O)OC 7a_100000035544_100000747405 [0,1,1,0,0,0|1,0,1]=4 10055 B17R0.11645 CCC(=O)CSCCCCCCCCC(=O)OC 62a_100000747405_100010282707 [0,1,1,0,0,0|1,0,1]=4 10056 B17R0.11645 CCC(=O)CSCCCCCCCCC(=O)OC 62a_100010282707_100000747405 [0,1,1,0,0,0|1,0,1]=4 10057 B17R0.11645 CCC(C)CCCCCOCCCCC(=O)OC 7a_200000035636_100000204269 [0,1,1,0,0,0|1,0,0]=3 10058 B17R0.11645 CCC(C)CCCCCOCCOCC(=O)OC 7a_200000035636_100000090808 [0,1,1,0,0,0|2,0,0]=4 10059 B17R0.11645 CCC(C)CCCOCCCCCCC(=O)OC 7a_100011216074_100009815986 [0,1,1,0,0,0|1,0,0]=3 10060 B17R0.11645 CCC(C)CCNCCCCCCCC(=O)OC 2230a_100020591266_100010004213 [0,1,1,0,0,0|1,0,0]=3 10061 B17R0.11645 CCC(C)CCOCCCCCCCC(=O)OC 7a_100011215188_100010004213 [0,1,1,0,0,0|1,0,0]=3 10062 B17R0.11645 CCC(C)CNCCCCCCCCC(=O)OC 2230a_100020588543_100010282707 [0,1,1,0,0,0|1,0,0]=3 10063 B17R0.11645 CCC(C)COCCCCCCCCC(=O)OC 34a_100000035544_100000748023 [0,1,1,0,0,0|1,0,0]=3 10064 B17R0.11645 CCC(C)COCCCCCCCCC(=O)OC 7a_100000035544_100000748023 [0,1,1,0,0,0|1,0,0]=3 10065 B17R0.11645 CCC(C)CSCCCCCCCCC(=O)OC 62a_100000748023_100010282707 [0,1,1,0,0,0|1,0,0]=3 10066 B17R0.11645 CCC(C)CSCCCCCCCCC(=O)OC 62a_100010282707_100000748023 [0,1,1,0,0,0|1,0,0]=3 10067 B17R0.11645 CCC(C)NCCCCCCCCCC(=O)OC 2230a_100000209981_100009813843 [0,1,1,0,0,0|1,0,0]=3 10068 B17R0.11645 CCC(C)OCCCCCCCCCC(=O)OC 7a_100000210228_100009813843 [0,1,1,0,0,0|1,0,0]=3 10069 B17R0.11645 CCC(C)SCCCCCCCCCC(=O)OC 62a_100000758301_100009813843 [0,1,1,0,0,0|1,0,0]=3 10070 B17R0.11645 CCC(O)CNCCCCCCCCC(=O)OC 2230a_100011218483_100010282707 [0,1,1,0,0,0|1,0,0]=3 10071 B17R0.11645 CCC(O)COCCCCCCCCC(=O)OC 34a_100000035544_100011218378 [0,1,1,0,0,0|1,0,0]=3 10072 B17R0.11645 CCC(O)COCCCCCCCCC(=O)OC 7a_100000035544_100011218378 [0,1,1,0,0,0|1,0,0]=3 10073 B17R0.11645 CCC(O)CSCCCCCCCCC(=O)OC 62a_100010282707_100011218378 [0,1,1,0,0,0|1,0,0]=3 10074 B17R0.11645 CCC(O)CSCCCCCCCCC(=O)OC 62a_100011218378_100010282707 [0,1,1,0,0,0|1,0,0]=3 10075 B17R0.11645 CCN(C)CCCCCCCCCCC(=O)OC 2230a_100000225621_100009812566 [0,1,1,0,0,0|1,0,0]=3 10076 B17R0.11645 CCN(C)CCCCCCCCCCC(=O)OC 269982a_100000225621_100009812566 [0,1,1,0,0,0|1,0,0]=3 10077 B17R0.11645 CCN(C)CCCOCCCCCCC(=O)OC 7a_100009863599_100015186262 [0,1,1,0,0,0|2,0,0]=4 10078 B17R0.11645 CCN(C)CCCSCCCCCCC(=O)OC 62a_100009815986_100015186262 [0,1,1,0,0,0|2,0,0]=4 10079 B17R0.11645 CC[C@H](C)COCCCCCCCCC(=O)OC 34a_100000035544_100009816398 [0,1,1,0,0,0|1,0,0]=3 10080 B17R0.11645 CC[C@H](C)COCCCCCCCCC(=O)OC 7a_100000035544_100009816398 [0,1,1,0,0,0|1,0,0]=3 10081 B17R0.11645 CC[C@H](C)COCCCCCCCCC(=O)OC 7a_100009816381_100010282707 [0,1,1,0,0,0|1,0,0]=3 10082 B17R0.11645 CC[C@H](C)CSCCCCCCCCC(=O)OC 62a_100009816398_100010282707 [0,1,1,0,0,0|1,0,0]=3 10083 B17R0.11645 CC[C@H](C)CSCCCCCCCCC(=O)OC 62a_100010282707_100009816398 [0,1,1,0,0,0|1,0,0]=3 10084 B17R0.11645 CNC(=O)CCCCCCCCCCC(=O)OC 11a_106832991635_100016987261 [0,1,1,0,0,0|1,0,1]=4 10085 B17R0.11645 CNC(=O)CCCCCCCCCCC(=O)OC 1626a_100102657272_100016987261 [0,1,1,0,0,0|1,0,1]=4 10086 B17R0.11645 CNC(=O)CCCCCCCCCCC(=O)OC 240690a_100102657272_100016987261 [0,1,1,0,0,0|1,0,1]=4 10087 B17R0.11645 COC(=O)CCCCCCCCCCC(=O)CF 1458a_100016987261_100015361967 [0,1,1,0,0,0|1,0,1]=4 10088 B17R0.11645 COC(=O)CCCCCCCCCCC(=O)CO 1458a_100000210174_100009812566 [0,1,1,0,0,0|1,0,1]=4 10089 B17R0.11645 COC(=O)CCCCCCCCCN[C@H](C)CO 2230a_100000737577_100009813843 [0,1,1,0,0,0|2,0,0]=4 10090 B17R0.11645 COC(=O)CCCCCCCCCOC(C)CF 34a_100016041109_100009813843 [0,1,1,0,0,0|2,0,0]=4 10091 B17R0.11645 COC(=O)CCCCCCCCCOC(C)CF 7a_100016041109_100009813843 [0,1,1,0,0,0|2,0,0]=4 10092 B17R0.11645 COC(=O)CCCCCCCCCOC(C)CN 34a_100000210904_100009813843 [0,1,1,0,0,0|2,0,0]=4 10093 B17R0.11645 COC(=O)CCCCCCCCCSC(C)CO 62a_100012180447_100009813843 [0,1,1,0,0,0|2,0,0]=4 10094 B17R0.11645 COC(=O)CCCCCCCCCSC(C)OC 62a_100009879195_100009813843 [0,1,1,0,0,0|2,0,0]=4 10095 B17R0.11645 COC(=O)CCCCCCCCCS[C@H](C)CO 62a_100016084084_100009813843 [0,1,1,0,0,0|2,0,0]=4 10096 B17R0.11645 COC(=O)CCCCCCCCNCC(C)CO 34a_100000744482_100010282707 [0,1,1,0,0,0|2,0,0]=4 10097 B17R0.11645 COC(=O)CCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100010282707 [0,1,1,0,0,0|2,0,0]=4 10098 B17R0.11645 COC(=O)CCCCCCCCNC[C@@H](F)CO 34a_100015665980_100010282707 [0,1,1,0,0,0|2,0,0]=4 10099 B17R0.11645 COC(=O)CCCCCCCCNC[C@H](O)CO 2230a_100020644852_100010282707 [0,1,1,0,0,0|2,0,0]=4 10100 B17R0.11645 COC(=O)CCCCCCCCOCC(C)CN 34a_100000744482_100010282707 [0,1,1,0,0,0|2,0,0]=4 10101 B17R0.11645 COC(=O)CCCCCCCCOCC(C)OC 34a_100000690652_100010282707 [0,1,1,0,0,0|2,0,0]=4 10102 B17R0.11645 COC(=O)CCCCCCCCOCC(Cl)CCl 34a_100000033668_100010282707 [0,1,1,0,0,0|2,0,0]=4 10103 B17R0.11645 COC(=O)CCCCCCCCOCC(O)CO 34a_100000035544_100011219619 [0,1,1,0,0,0|2,0,0]=4 10104 B17R0.11645 COC(=O)CCCCCCCCOCC(O)CO 7a_100000035544_100011219619 [0,1,1,0,0,0|2,0,0]=4 10105 B17R0.11645 COC(=O)CCCCCCCCOC[C@@H](C)CO 34a_100000035544_100000059175 [0,1,1,0,0,0|2,0,0]=4 10106 B17R0.11645 COC(=O)CCCCCCCCOC[C@@H](C)CO 7a_100000035544_100000059175 [0,1,1,0,0,0|2,0,0]=4 10107 B17R0.11645 COC(=O)CCCCCCCCOC[C@@H](O)CF 34a_100000035544_100015614560 [0,1,1,0,0,0|2,0,0]=4 10108 B17R0.11645 COC(=O)CCCCCCCCOC[C@@H](O)CF 7a_100000035544_100015614560 [0,1,1,0,0,0|2,0,0]=4 10109 B17R0.11645 COC(=O)CCCCCCCCOC[C@@H](O)CO 34a_100000035544_100009815848 [0,1,1,0,0,0|2,0,0]=4 10110 B17R0.11645 COC(=O)CCCCCCCCOC[C@@H](O)CO 7a_100000035544_100009815848 [0,1,1,0,0,0|2,0,0]=4 10111 B17R0.11645 COC(=O)CCCCCCCCOC[C@H](F)CN 34a_100015665980_100010282707 [0,1,1,0,0,0|2,0,0]=4 10112 B17R0.11645 COC(=O)CCCCCCCCSCC(O)CO 62a_100010282707_100011219619 [0,1,1,0,0,0|2,0,0]=4 10113 B17R0.11645 COC(=O)CCCCCCCCSCC(O)CO 62a_100011219619_100010282707 [0,1,1,0,0,0|2,0,0]=4 10114 B17R0.11645 COC(=O)CCCCCCCCSC[C@@H](C)CO 62a_100000059175_100010282707 [0,1,1,0,0,0|2,0,0]=4 10115 B17R0.11645 COC(=O)CCCCCCCCSC[C@@H](C)CO 62a_100010282707_100000059175 [0,1,1,0,0,0|2,0,0]=4 10116 B17R0.11645 COC(=O)CCCCCCCCSC[C@@H](O)CF 62a_100010282707_100015614560 [0,1,1,0,0,0|2,0,0]=4 10117 B17R0.11645 COC(=O)CCCCCCCCSC[C@@H](O)CF 62a_100015614560_100010282707 [0,1,1,0,0,0|2,0,0]=4 10118 B17R0.11645 COC(=O)CCCCCCCCSC[C@@H](O)CO 62a_100009815848_100010282707 [0,1,1,0,0,0|2,0,0]=4 10119 B17R0.11645 COC(=O)CCCCCCCCSC[C@@H](O)CO 62a_100010282707_100009815848 [0,1,1,0,0,0|2,0,0]=4 10120 B17R0.11645 COC(=O)CCCCCCCNCCC(C)CO 2230a_106354213184_100010004213 [0,1,1,0,0,0|2,0,0]=4 10121 B17R0.11645 COC(=O)CCCCCCCNCCC(C)CO 34a_106354213184_100010004213 [0,1,1,0,0,0|2,0,0]=4 10122 B17R0.11645 COC(=O)CCCCCCCOCCC(C)OC 7a_100000764861_100010004213 [0,1,1,0,0,0|2,0,0]=4 10123 B17R0.11645 COC(=O)CCCCCCOCCC[C@@H](C)CN 34a_100160569302_100009815986 [0,1,1,0,0,0|2,0,0]=4 10124 B17R0.13601 CCCCCCCCCCCC(=O)CC(=O)CC 1458a_100000210736_100000747405 [0,1,1,0,0,0|1,0,1]=4 10125 B17R0.13601 CCCCCCCCCCCC(=O)CC(=O)NC 1458a_100000210736_100000183359 [0,1,1,0,0,0|1,0,1]=4 10126 B17R0.13601 CCCCCCCCCCCC(=O)CC(=O)OC 1458a_100000210736_100000747449 [0,1,1,0,0,0|0,0,1]=3 10127 B17R0.13601 CCCCCCCCCCCC(=O)CC(=O)OC 1458a_100000211351_100011215454 [0,1,1,0,0,0|0,0,1]=3 10128 B17R0.13601 CCCCCCCCCCCC(O)CC(=O)NC 1626a_100102657272_100000082106 [0,1,1,0,0,0|1,0,0]=3 10129 B17R0.13601 CCCCCCCCCCCC(O)CC(=O)NC 240690a_100102657272_100000082106 [0,1,1,0,0,0|1,0,0]=3 10130 B17R0.13601 CCCCCCCCCCCN(C)CC(=O)NC 2230a_100000189611_100011215454 [0,1,1,0,0,0|2,0,0]=4 10131 B17R0.13601 CCCCCCCCCCCN(C)CC(=O)OC 2230a_100000198492_100011215454 [0,1,1,0,0,0|1,0,0]=3 10132 B17R0.13601 CCCCCCCCCCNC(=O)CC(=O)OC 240690a_100000684558_100000211351 [0,1,1,0,0,0|1,0,1]=4 10133 B17R0.13601 CCCCCCCCCCNC(C)CC(=O)OC 2230a_100000684558_100009817358 [0,1,1,0,0,0|1,0,0]=3 10134 B17R0.13601 CCCCCCCCCCNC(C)CC(=O)OC 34a_100000684558_100009817358 [0,1,1,0,0,0|1,0,0]=3 10135 B17R0.13601 CCCCCCCCCCOC(C)CC(=O)OC 34a_100000210711_100009817358 [0,1,1,0,0,0|1,0,0]=3 10136 B17R0.13601 CCCCCCCCCCOC(C)CC(=O)OC 7a_100000210711_100009817358 [0,1,1,0,0,0|1,0,0]=3 10137 B17R0.13601 CCCCCCCCCCSC(C)CC(=O)OC 62a_100009817358_100000210320 [0,1,1,0,0,0|1,0,0]=3 10138 B17R0.13601 CCCCCCCCCNC[C@H](O)CC(=O)OC 34a_100000212291_100000754131 [0,1,1,0,0,0|1,0,0]=3 10139 B17R0.13601 CCCCCCCCCOC[C@H](O)CC(=O)OC 34a_100000210712_100000754131 [0,1,1,0,0,0|1,0,0]=3 10140 B17R0.13601 CCCCCCCCCOC[C@H](O)CC(=O)OC 7a_100000210712_100000754131 [0,1,1,0,0,0|1,0,0]=3 10141 B17R0.13601 CCCCCCCCCSCC(=O)CC(=O)OC 62a_100000210525_100000210670 [0,1,1,0,0,0|1,0,1]=4 10142 B17R0.13601 CCCCCCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100000210670 [0,1,1,0,0,0|1,0,0]=3 10143 B17R0.13601 CCCCCCOCCOC[C@H](O)CC(=O)OC 34a_100000691444_100000754131 [0,1,1,0,0,0|2,0,0]=4 10144 B17R0.13601 CCCCCCOCCOC[C@H](O)CC(=O)OC 7a_100000691444_100000754131 [0,1,1,0,0,0|2,0,0]=4 10145 B17R0.13601 CCCCNCCCCOC[C@H](O)CC(=O)OC 34a_200011216965_100000754131 [0,1,1,0,0,0|2,0,0]=4 10146 B17R0.13601 CCCCOCCCCOC[C@H](O)CC(=O)OC 34a_200000760531_100000754131 [0,1,1,0,0,0|2,0,0]=4 10147 B17R0.13601 CCCCOCCCCOC[C@H](O)CC(=O)OC 7a_200000760531_100000754131 [0,1,1,0,0,0|2,0,0]=4 10148 B17R0.13601 COC(=O)CC(=O)CCCCCCCCCCO 1458a_100000211351_100009813290 [0,1,1,0,0,0|1,0,1]=4 10149 B17R0.13601 COC(=O)CC(C)NCCCCCCCCCO 2230a_100000078944_100009817358 [0,1,1,0,0,0|2,0,0]=4 10150 B17R0.13601 COC(=O)CC(C)NCCCCCCCCCO 34a_100000078944_100009817358 [0,1,1,0,0,0|2,0,0]=4 10151 B17R0.13601 COC(=O)CC(C)OCCCCCCCCCBr 34a_100009813782_100009817358 [0,1,1,0,0,0|2,0,0]=4 10152 B17R0.13601 COC(=O)CC(C)OCCCCCCCCCBr 7a_100009813782_100009817358 [0,1,1,0,0,0|2,0,0]=4 10153 B17R0.13601 COC(=O)CC(C)OCCCCCCCCCCl 34a_100009868337_100009817358 [0,1,1,0,0,0|2,0,0]=4 10154 B17R0.13601 COC(=O)CC(C)OCCCCCCCCCCl 7a_100009868337_100009817358 [0,1,1,0,0,0|2,0,0]=4 10155 B17R0.13601 COC(=O)CC(C)OCCCCCCCCCN 34a_100000078944_100009817358 [0,1,1,0,0,0|2,0,0]=4 10156 B17R0.13601 COC(=O)CC(C)SCCCCCCCCCO 62a_100009813782_100009817358 [0,1,1,0,0,0|2,0,0]=4 10157 B17R0.13601 COC(=O)CC(C)SCCCCCCCCCO 62a_100009817358_100009813782 [0,1,1,0,0,0|2,0,0]=4 10158 B17R0.13601 COC(=O)CN(C)CCCCCCCCCCO 2230a_100000198492_100009813290 [0,1,1,0,0,0|2,0,0]=4 10159 B17R0.13601 COC(=O)C[C@@H](O)CNCCCCCCCCO 34a_102515433106_100000754131 [0,1,1,0,0,0|2,0,0]=4 10160 B17R0.13601 COC(=O)C[C@@H](O)COCCCCCCCCBr 34a_100009813846_100000754131 [0,1,1,0,0,0|2,0,0]=4 10161 B17R0.13601 COC(=O)C[C@@H](O)COCCCCCCCCBr 7a_100009813846_100000754131 [0,1,1,0,0,0|2,0,0]=4 10162 B17R0.13601 COC(=O)C[C@@H](O)COCCCCCCCCCl 34a_100000033203_100000754131 [0,1,1,0,0,0|2,0,0]=4 10163 B17R0.13601 COC(=O)C[C@@H](O)COCCCCCCCCCl 7a_100000033203_100000754131 [0,1,1,0,0,0|2,0,0]=4 10164 B17R0.13601 COC(=O)C[C@@H](O)COCCCCCCCCN 34a_102515433106_100000754131 [0,1,1,0,0,0|2,0,0]=4 10165 B17R0.13601 COC(=O)C[C@@H](O)CSCCCCCCCCO 62a_100000033203_100000754131 [0,1,1,0,0,0|2,0,0]=4 10166 B17R0.13601 COC(=O)C[C@@H](O)CSCCCCCCCCO 62a_100000754131_100000033203 [0,1,1,0,0,0|2,0,0]=4 10167 B17R0.14245 C=C(C)C(=O)CCCCCCCCCCCCC 1458a_100000185857_100000210684 [0,1,1,0,0,0|1,0,0]=3 10168 B17R0.14245 C=C(C)C(=O)CCCCCCCCCCCCO 1458a_100000185857_100009813331 [0,1,1,0,0,0|2,0,0]=4 10169 B17R0.14245 C=C(C)C(=O)NCCCCCCCCCCCC 11a_100000210451_100000185857 [0,1,1,0,0,0|1,0,1]=4 10170 B17R0.14245 C=C(C)C(=O)NCCCCCCCCCCCC 1626a_100000210451_100000185857 [0,1,1,0,0,0|1,0,1]=4 10171 B17R0.14245 C=C(C)C(=O)OCCCCCCNCCCCC 2230a_100000209983_200010402237 [0,1,1,0,0,0|1,0,1]=4 10172 B17R0.14245 C=C(C)C(=O)OCCCCCCOCCCCC 34a_100000210253_200010402237 [0,1,1,0,0,0|1,0,1]=4 10173 B17R0.14245 C=C(C)C(=O)OCCCCCCOCCCCC 7a_100000210253_200010402237 [0,1,1,0,0,0|1,0,1]=4 10174 B17R0.14245 C=C(C)C(=O)OCCCCCCSCCCCC 62a_100000210326_200010402237 [0,1,1,0,0,0|1,0,1]=4 10175 B17R0.14245 C=C(C)C(=O)OCCCCCCSCCCCC 62a_200010402237_100000210326 [0,1,1,0,0,0|1,0,1]=4 10176 B17R0.14245 C=C(C)C(=O)OCCCCOCCCCCCC 7a_100000065474_100000210614 [0,1,1,0,0,0|1,0,1]=4 10177 B17R0.14245 C=C(C)C(=O)OCCCOCCCCCCCC 7a_100000032641_100000210759 [0,1,1,0,0,0|1,0,1]=4 10178 B17R0.14245 C=C(C)C(=O)OCCNCCCCCCCCC 2230a_100000212291_100009816335 [0,1,1,0,0,0|1,0,1]=4 10179 B17R0.14245 C=C(C)C(=O)OCCNCCCCCCCCC 34a_100000212291_100009816335 [0,1,1,0,0,0|1,0,1]=4 10180 B17R0.14245 C=C(C)C(=O)OCCOCCCCCCCCC 34a_100000210712_100009816335 [0,1,1,0,0,0|1,0,1]=4 10181 B17R0.14245 C=C(C)C(=O)OCCOCCCCCCCCC 7a_100000210712_100009816335 [0,1,1,0,0,0|1,0,1]=4 10182 B17R0.14245 C=C(C)C(=O)OCCSCCCCCCCCC 62a_100009816335_100000210670 [0,1,1,0,0,0|1,0,1]=4 10183 B17R0.14245 CC(C)C(=O)CCCCCCCCCCCCO 1458a_100000210198_100009813331 [0,1,1,0,0,0|2,0,0]=4 10184 B17R0.14245 CC(C)C(=O)OCSCCCCCCCCCO 62a_100000139345_100009813782 [0,1,1,0,0,0|2,0,0]=4 10185 B17R0.14245 CC(C)C(=O)OCSCCCCCCCCCO 62a_100009813782_100000139345 [0,1,1,0,0,0|2,0,0]=4 10186 B17R0.14245 CC(F)C(=O)CCCCCCCCCCCCO 1458a_100000062450_100009813331 [0,1,1,0,0,0|2,0,0]=4 10187 B17R0.14245 CCCCCCCCCCCCCC(=O)C(C)C 1458a_100000210198_100000210684 [0,1,1,0,0,0|1,0,0]=3 10188 B17R0.14245 CCCCCCCCCCCCCC(=O)C(C)C 1458a_100000756256_100000210206 [0,1,1,0,0,0|1,0,0]=3 10189 B17R0.14245 CCCCCCCCCCCCCC(=O)C(C)F 1458a_100000062450_100000210684 [0,1,1,0,0,0|1,0,0]=3 10190 B17R0.14245 CCCCCCCCCCCCCC(=O)C(O)O 1458a_100000233687_100000210684 [0,1,1,0,0,0|2,0,0]=4 10191 B17R0.14245 CCCCCCCCCCCCCC(=O)N(C)C 11a_100102631434_100000756256 [0,1,1,0,0,0|1,0,0]=3 10192 B17R0.14245 CCCCCCCCCCCCCC(=O)N(C)C 1626a_100102631434_100000756256 [0,1,1,0,0,0|1,0,0]=3 10193 B17R0.14245 CCCCCCCCCCCCCC(=O)N(C)C 240690a_100102631434_100000756256 [0,1,1,0,0,0|1,0,0]=3 10194 B17R0.14245 CCCCCCCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100000210684 [0,1,1,0,0,0|1,0,0]=3 10195 B17R0.14245 CCCCCCCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100000210684 [0,1,1,0,0,0|1,0,0]=3 10196 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)C 11a_100000210451_100000210198 [0,1,1,0,0,0|1,0,0]=3 10197 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)C 1626a_100000210451_100000210198 [0,1,1,0,0,0|1,0,0]=3 10198 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)C 240690a_100000210451_100000210198 [0,1,1,0,0,0|1,0,0]=3 10199 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)C 527a_100000210451_100000210198 [0,1,1,0,0,0|1,0,0]=3 10200 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)F 11a_100000210451_100000062450 [0,1,1,0,0,0|1,0,0]=3 10201 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)F 1626a_100000210451_100000062450 [0,1,1,0,0,0|1,0,0]=3 10202 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)F 240690a_100000210451_100000062450 [0,1,1,0,0,0|1,0,0]=3 10203 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)F 527a_100000210451_100000062450 [0,1,1,0,0,0|1,0,0]=3 10204 B17R0.14245 CCCCCCCCCCCCNC(=O)C(F)F 11a_100000210451_100000210393 [0,1,1,0,0,0|2,0,0]=4 10205 B17R0.14245 CCCCCCCCCCCCNC(=O)C(F)F 1626a_100000210451_100000210393 [0,1,1,0,0,0|2,0,0]=4 10206 B17R0.14245 CCCCCCCCCCCCNC(=O)C(F)F 240690a_100000210451_100000210393 [0,1,1,0,0,0|2,0,0]=4 10207 B17R0.14245 CCCCCCCCCCCCNC(=O)C(F)F 527a_100000210451_100000210393 [0,1,1,0,0,0|2,0,0]=4 10208 B17R0.14245 CCCCCCCCCCCCNC(=O)C(O)O 240690a_100000210451_100000233687 [0,1,1,0,0,0|2,0,0]=4 10209 B17R0.14245 CCCCCCCCCCCCNC(=O)N(C)C 2708a_100000210451_100102631434 [0,1,1,0,0,0|2,0,0]=4 10210 B17R0.14245 CCCCCCCCCCCCNC(=O)[C@@H](C)O 240690a_100000210451_100000717761 [0,1,1,0,0,0|1,0,0]=3 10211 B17R0.14245 CCCCCCCCCCCCNC(=O)[C@H](C)O 1626a_100000210451_217856618621 [0,1,1,0,0,0|1,0,0]=3 10212 B17R0.14245 CCCCCCCCCCCCNC(=O)[C@H](C)O 240690a_100000210451_217856618621 [0,1,1,0,0,0|1,0,0]=3 10213 B17R0.14245 CCCCCCCCCCCCOC(C)C(C)C 7a_100000748068_100000759014 [0,1,1,0,0,0|1,0,1]=4 10214 B17R0.14245 CCCCCCCCCCCNCC(=O)C(=O)C 34a_200011215754_100011261029 [0,1,1,0,0,0|2,0,0]=4 10215 B17R0.14245 CCCCCCCCCCCNCC(=O)C(C)C 2230a_200011215754_100000753385 [0,1,1,0,0,0|2,0,0]=4 10216 B17R0.14245 CCCCCCCCCCCNCC(=O)C(C)C 34a_200011215754_100000753385 [0,1,1,0,0,0|2,0,0]=4 10217 B17R0.14245 CCCCCCCCCCCNCC(=O)N(C)C 2230a_100015183351_100011215454 [0,1,1,0,0,0|2,0,0]=4 10218 B17R0.14245 CCCCCCCCCCCNCC(=O)N(C)C 2230a_200011215754_100000185267 [0,1,1,0,0,0|2,0,0]=4 10219 B17R0.14245 CCCCCCCCCCCNCC(=O)N(C)C 34a_200011215754_100000692301 [0,1,1,0,0,0|2,0,0]=4 10220 B17R0.14245 CCCCCCCCCCCOCC(=O)C(=O)C 34a_100000210809_100011261029 [0,1,1,0,0,0|2,0,0]=4 10221 B17R0.14245 CCCCCCCCCCCOCC(=O)C(C)C 34a_100000210809_100000753385 [0,1,1,0,0,0|2,0,0]=4 10222 B17R0.14245 CCCCCCCCCCCOCC(=O)C(C)C 7a_100000210809_100000753385 [0,1,1,0,0,0|2,0,0]=4 10223 B17R0.14245 CCCCCCCCCCCOCC(=O)N(C)C 34a_100000210809_100000692301 [0,1,1,0,0,0|2,0,0]=4 10224 B17R0.14245 CCCCCCCCCCCOCC(=O)N(C)C 7a_100000210809_100000692301 [0,1,1,0,0,0|2,0,0]=4 10225 B17R0.14245 CCCCCCCCCCCSCC(=O)C(=O)C 62a_100011261029_100011215454 [0,1,1,0,0,0|2,0,0]=4 10226 B17R0.14245 CCCCCCCCCCCSCC(=O)C(C)C 62a_100000753385_100011215454 [0,1,1,0,0,0|2,0,0]=4 10227 B17R0.14245 CCCCCCCCCCCSCC(=O)N(C)C 62a_100000692301_100011215454 [0,1,1,0,0,0|2,0,0]=4 10228 B17R0.14245 CCCCCCCCCCNCCC(=O)N(C)C 2230a_100000684558_100000737620 [0,1,1,0,0,0|2,0,0]=4 10229 B17R0.14245 CCCCCCCCCCNCCC(=O)N(C)C 2230a_100000738053_100000210320 [0,1,1,0,0,0|2,0,0]=4 10230 B17R0.14245 CCCCCCCCCCOCCC(=O)N(C)C 34a_200000747469_100000210320 [0,1,1,0,0,0|2,0,0]=4 10231 B17R0.14245 CCCCCCCCCCOCCC(=O)N(C)C 7a_100000210711_100000737620 [0,1,1,0,0,0|2,0,0]=4 10232 B17R0.14245 CCCCCCCCCCSCCC(=O)N(C)C 62a_100000737620_100000210320 [0,1,1,0,0,0|2,0,0]=4 10233 B17R0.14245 CCCCCCCCCCSCOC(=O)C(C)C 62a_100000139345_100000210320 [0,1,1,0,0,0|1,0,0]=3 10234 B17R0.14245 CCCCCCCCCNCCCC(=O)N(C)C 2230a_100000212291_100000737642 [0,1,1,0,0,0|2,0,0]=4 10235 B17R0.14245 CCCCCCCCCNCCCC(=O)N(C)C 2230a_200000744827_100011214924 [0,1,1,0,0,0|2,0,0]=4 10236 B17R0.14245 CCCCCCCCCNCCNC(=O)C(C)C 2230a_100000752568_100011214924 [0,1,1,0,0,0|2,0,0]=4 10237 B17R0.14245 CCCCCCCCCNCCNC(=O)C(C)C 34a_100000752568_100011214924 [0,1,1,0,0,0|2,0,0]=4 10238 B17R0.14245 CCCCCCCCCOCCCC(=O)N(C)C 7a_100000210712_100000737642 [0,1,1,0,0,0|2,0,0]=4 10239 B17R0.14245 CCCCCCCCCSCCCC(=O)N(C)C 62a_100000737642_100000210670 [0,1,1,0,0,0|2,0,0]=4 10240 B17R0.14245 CCCCCCCCNCCCCC(=O)N(C)C 34a_100000229939_100000752486 [0,1,1,0,0,0|2,0,0]=4 10241 B17R0.14245 CCCCCCCCOCCCCC(=O)N(C)C 34a_100000210232_100000752486 [0,1,1,0,0,0|2,0,0]=4 10242 B17R0.14245 CCCCCCCCOCCCCC(=O)N(C)C 7a_100000210232_100000752486 [0,1,1,0,0,0|2,0,0]=4 10243 B17R0.14245 CCCCCCCCSCCCCC(=O)N(C)C 62a_100000210759_100000752486 [0,1,1,0,0,0|2,0,0]=4 10244 B17R0.14245 CCCCCCCCSCCCCC(=O)N(C)C 62a_100000752486_100000210317 [0,1,1,0,0,0|2,0,0]=4 10245 B17R0.14245 CN(C)C(=O)CCCCCCCCCCCCO 240690a_100102631434_100102582631 [0,1,1,0,0,0|2,0,0]=4 10246 B17R0.14245 C[C@@H](O)C(=O)CCCCCCCCCCCCO 1458a_100000717761_100009813331 [0,1,1,0,0,0|2,0,0]=4 10247 B17R0.14245 C[C@H](O)C(=O)CCCCCCCCCCCCO 1458a_217856618621_100009813331 [0,1,1,0,0,0|2,0,0]=4 10248 B17R0.14363 C=C(C)CCOCCCCCCCCC(=O)OC 34a_100000035544_100000730704 [0,1,1,0,0,0|1,0,1]=4 10249 B17R0.14363 C=C(C)CCOCCCCCCCCC(=O)OC 34a_100000764851_100010282707 [0,1,1,0,0,0|1,0,1]=4 10250 B17R0.14363 C=C(C)CCOCCCCCCCCC(=O)OC 7a_100000035544_100000730704 [0,1,1,0,0,0|1,0,1]=4 10251 B17R0.14363 C=C(C)CCSCCCCCCCCC(=O)OC 62a_100000730704_100010282707 [0,1,1,0,0,0|1,0,1]=4 10252 B17R0.14363 C=C(C)CCSCCCCCCCCC(=O)OC 62a_100010282707_100000730704 [0,1,1,0,0,0|1,0,1]=4 10253 B17R0.14363 C=C(C)COCCCCCCCCCC(=O)OC 34a_100000210245_100009813843 [0,1,1,0,0,0|1,0,1]=4 10254 B17R0.14363 C=C(C)CSCCCCCCCCCC(=O)OC 62a_100000748629_100009813843 [0,1,1,0,0,0|1,0,1]=4 10255 B17R0.14363 CNC(=O)CCCOCCCCCCCC(C)C 34a_200000210741_100000741757 [0,1,1,0,0,0|2,0,0]=4 10256 B17R0.14363 CNC(=O)CCCOCCCCCCCC(C)C 7a_200000210741_100000741757 [0,1,1,0,0,0|2,0,0]=4 10257 B17R0.14363 CNC(=O)OCCOCCCCCCCC(C)C 34a_200000210741_200011997002 [0,1,1,0,0,0|2,0,0]=4 10258 B17R0.14363 CNC(=O)OCCOCCCCCCCC(C)C 7a_200000210741_200011997002 [0,1,1,0,0,0|2,0,0]=4 10259 B17R0.14363 COC(=O)CCCCCCCCCCCC(=O)C 1458a_100000070787_100010983606 [0,1,1,0,0,0|0,0,1]=3 10260 B17R0.14363 COC(=O)CCCCCCCCCCCN(C)C 2230a_100102631434_100010983606 [0,1,1,0,0,0|1,0,0]=3 10261 B17R0.14363 COC(=O)CCCCCCCCCCCN(C)C 269982a_100102631434_100010983606 [0,1,1,0,0,0|1,0,0]=3 10262 B17R0.14363 COC(=O)CCCCCCCCCCNC(=O)C 188690a_202495363284_100015343762 [0,1,1,0,0,0|1,0,1]=4 10263 B17R0.14363 COC(=O)CCCCCCCCCCNC(C)C 2230a_100138425928_100009812566 [0,1,1,0,0,0|1,0,0]=3 10264 B17R0.14363 COC(=O)CCCCCCCCCCNC(C)C 34a_100138425928_100009812566 [0,1,1,0,0,0|1,0,0]=3 10265 B17R0.14363 COC(=O)CCCCCCCCCCOC(C)C 34a_100000212225_100009812566 [0,1,1,0,0,0|1,0,0]=3 10266 B17R0.14363 COC(=O)CCCCCCCCCCOC(C)C 34a_100011003013_100000210206 [0,1,1,0,0,0|1,0,0]=3 10267 B17R0.14363 COC(=O)CCCCCCCCCCOC(C)C 7a_100011003013_100000210206 [0,1,1,0,0,0|1,0,0]=3 10268 B17R0.14363 COC(=O)CCCCCCCCCCSC(C)C 62a_100000210206_100009812566 [0,1,1,0,0,0|1,0,0]=3 10269 B17R0.14363 COC(=O)CCCCCCCCCNCC(C)C 2230a_100000210953_100009813843 [0,1,1,0,0,0|1,0,0]=3 10270 B17R0.14363 COC(=O)CCCCCCCCCNCC(C)C 34a_100000210953_100009813843 [0,1,1,0,0,0|1,0,0]=3 10271 B17R0.14363 COC(=O)CCCCCCCCCNCC(C)O 2230a_100000210904_100009813843 [0,1,1,0,0,0|1,0,0]=3 10272 B17R0.14363 COC(=O)CCCCCCCCCNCC(C)O 34a_100000210904_100009813843 [0,1,1,0,0,0|1,0,0]=3 10273 B17R0.14363 COC(=O)CCCCCCCCCNCC(F)F 34a_100000765723_100009813843 [0,1,1,0,0,0|2,0,0]=4 10274 B17R0.14363 COC(=O)CCCCCCCCCOCC(=O)C 34a_100000211253_100009813843 [0,1,1,0,0,0|1,0,1]=4 10275 B17R0.14363 COC(=O)CCCCCCCCCOCC(C)Br 34a_100012180447_100009813843 [0,1,1,0,0,0|1,0,0]=3 10276 B17R0.14363 COC(=O)CCCCCCCCCOCC(C)C 34a_100000210257_100009813843 [0,1,1,0,0,0|1,0,0]=3 10277 B17R0.14363 COC(=O)CCCCCCCCCOCC(C)F 34a_100015925927_100009813843 [0,1,1,0,0,0|1,0,0]=3 10278 B17R0.14363 COC(=O)CCCCCCCCCOCC(F)F 34a_100000743014_100009813843 [0,1,1,0,0,0|2,0,0]=4 10279 B17R0.14363 COC(=O)CCCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100009813843 [0,1,1,0,0,0|1,0,0]=3 10280 B17R0.14363 COC(=O)CCCCCCCCCOC[C@@H](C)N 34a_100000737577_100009813843 [0,1,1,0,0,0|1,0,0]=3 10281 B17R0.14363 COC(=O)CCCCCCCCCSCC(C)C 62a_100000210624_100009813843 [0,1,1,0,0,0|1,0,0]=3 10282 B17R0.14363 COC(=O)CCCCCCCCCSCC(C)O 62a_100011218427_100009813843 [0,1,1,0,0,0|1,0,0]=3 10283 B17R0.14363 COC(=O)CCCCCCCCCSCC(F)F 62a_100011934356_100009813843 [0,1,1,0,0,0|2,0,0]=4 10284 B17R0.14363 COC(=O)CCCCCCCCCSC[C@@H](C)O 62a_100009817552_100009813843 [0,1,1,0,0,0|1,0,0]=3 10285 B17R0.14363 COC(=O)CCCCCCCCNCCC(C)O 2230a_200000755665_100010282707 [0,1,1,0,0,0|1,0,0]=3 10286 B17R0.14363 COC(=O)CCCCCCCCOCCC(=O)C 34a_100000759926_100010282707 [0,1,1,0,0,0|1,0,1]=4 10287 B17R0.14363 COC(=O)CCCCCCCCOCCC(=O)C 7a_100000035544_100000053229 [0,1,1,0,0,0|1,0,1]=4 10288 B17R0.14363 COC(=O)CCCCCCCCOCCC(=O)C 7a_100000759926_100010282707 [0,1,1,0,0,0|1,0,1]=4 10289 B17R0.14363 COC(=O)CCCCCCCCOCCC(C)Br 34a_100009893172_100010282707 [0,1,1,0,0,0|1,0,0]=3 10290 B17R0.14363 COC(=O)CCCCCCCCOCCC(C)C 34a_100000035544_100000210312 [0,1,1,0,0,0|1,0,0]=3 10291 B17R0.14363 COC(=O)CCCCCCCCOCCC(C)C 34a_100000210254_100010282707 [0,1,1,0,0,0|1,0,0]=3 10292 B17R0.14363 COC(=O)CCCCCCCCOCCC(C)C 7a_100000035544_100000210626 [0,1,1,0,0,0|1,0,0]=3 10293 B17R0.14363 COC(=O)CCCCCCCCOCCC(C)C 7a_100000210254_100010282707 [0,1,1,0,0,0|1,0,0]=3 10294 B17R0.14363 COC(=O)CCCCCCCCOCCC(C)O 34a_100000035544_100012276601 [0,1,1,0,0,0|1,0,0]=3 10295 B17R0.14363 COC(=O)CCCCCCCCOCCC(C)O 7a_100000035544_100012276601 [0,1,1,0,0,0|1,0,0]=3 10296 B17R0.14363 COC(=O)CCCCCCCCOCCC(F)F 34a_100103093639_100010282707 [0,1,1,0,0,0|2,0,0]=4 10297 B17R0.14363 COC(=O)CCCCCCCCOCCN(C)C 7a_100000035544_100000755713 [0,1,1,0,0,0|2,0,0]=4 10298 B17R0.14363 COC(=O)CCCCCCCCOCC[C@@H](C)N 34a_100000706166_100010282707 [0,1,1,0,0,0|1,0,0]=3 10299 B17R0.14363 COC(=O)CCCCCCCCOCOC(C)C 34a_100000035544_100000709892 [0,1,1,0,0,0|2,0,0]=4 10300 B17R0.14363 COC(=O)CCCCCCCCSCCC(=O)C 62a_100000053229_100010282707 [0,1,1,0,0,0|1,0,1]=4 10301 B17R0.14363 COC(=O)CCCCCCCCSCCC(=O)C 62a_100010282707_100000053229 [0,1,1,0,0,0|1,0,1]=4 10302 B17R0.14363 COC(=O)CCCCCCCCSCCC(C)C 62a_100000210312_100010282707 [0,1,1,0,0,0|1,0,0]=3 10303 B17R0.14363 COC(=O)CCCCCCCCSCCC(C)C 62a_100010282707_100000210312 [0,1,1,0,0,0|1,0,0]=3 10304 B17R0.14363 COC(=O)CCCCCCCCSCCC(C)O 62a_100010282707_100012276601 [0,1,1,0,0,0|1,0,0]=3 10305 B17R0.14363 COC(=O)CCCCCCCCSCCC(C)O 62a_100012276601_100010282707 [0,1,1,0,0,0|1,0,0]=3 10306 B17R0.14363 COC(=O)CCCCCCCCSCCN(C)C 62a_100010282707_100000755713 [0,1,1,0,0,0|2,0,0]=4 10307 B17R0.14363 COC(=O)CCCCCCCCSCOC(C)C 62a_100000709892_100010282707 [0,1,1,0,0,0|2,0,0]=4 10308 B17R0.14363 COC(=O)CCCCCCCCSCOC(C)C 62a_100010282707_100000709892 [0,1,1,0,0,0|2,0,0]=4 10309 B17R0.14363 COC(=O)CCCCCCCNCCCC(C)C 2230a_200000737386_100010004213 [0,1,1,0,0,0|1,0,0]=3 10310 B17R0.14363 COC(=O)CCCCCCCNCCCC(C)C 34a_200000737386_100010004213 [0,1,1,0,0,0|1,0,0]=3 10311 B17R0.14363 COC(=O)CCCCCCCNCCCS(=O)C 2230a_200000753449_100010004213 [0,1,1,0,0,0|2,0,0]=4 10312 B17R0.14363 COC(=O)CCCCCCCNCCOC(C)C 2230a_100000701111_100010004213 [0,1,1,0,0,0|2,0,0]=4 10313 B17R0.14363 COC(=O)CCCCCCCNCCOC(C)C 34a_100000701111_100010004213 [0,1,1,0,0,0|2,0,0]=4 10314 B17R0.14363 COC(=O)CCCCCCCNCCSC(C)C 2230a_100000731138_100010004213 [0,1,1,0,0,0|2,0,0]=4 10315 B17R0.14363 COC(=O)CCCCCCCNCCSC(C)C 34a_100000731138_100010004213 [0,1,1,0,0,0|2,0,0]=4 10316 B17R0.14363 COC(=O)CCCCCCCOCCCC(=O)C 34a_100000759063_100010004213 [0,1,1,0,0,0|1,0,1]=4 10317 B17R0.14363 COC(=O)CCCCCCCOCCCC(=O)C 34a_100011022521_100000685027 [0,1,1,0,0,0|1,0,1]=4 10318 B17R0.14363 COC(=O)CCCCCCCOCCCC(=O)C 7a_100000759063_100010004213 [0,1,1,0,0,0|1,0,1]=4 10319 B17R0.14363 COC(=O)CCCCCCCOCCCC(=O)C 7a_100011022521_100011215641 [0,1,1,0,0,0|1,0,1]=4 10320 B17R0.14363 COC(=O)CCCCCCCOCCCC(C)C 34a_100000210774_100010004213 [0,1,1,0,0,0|1,0,0]=3 10321 B17R0.14363 COC(=O)CCCCCCCOCCCC(C)C 34a_100011022521_100011214892 [0,1,1,0,0,0|1,0,0]=3 10322 B17R0.14363 COC(=O)CCCCCCCOCCCC(C)C 7a_100000210774_100010004213 [0,1,1,0,0,0|1,0,0]=3 10323 B17R0.14363 COC(=O)CCCCCCCOCCCC(C)C 7a_100011022521_100011214892 [0,1,1,0,0,0|1,0,0]=3 10324 B17R0.14363 COC(=O)CCCCCCCOCCCC(C)O 34a_100011022521_200000718107 [0,1,1,0,0,0|1,0,0]=3 10325 B17R0.14363 COC(=O)CCCCCCCOCCCC(C)O 7a_100011022521_200000718107 [0,1,1,0,0,0|1,0,0]=3 10326 B17R0.14363 COC(=O)CCCCCCCOCCCN(C)C 7a_100011022521_100000757444 [0,1,1,0,0,0|2,0,0]=4 10327 B17R0.14363 COC(=O)CCCCCCCOCCNC(C)C 34a_100000224655_100010004213 [0,1,1,0,0,0|2,0,0]=4 10328 B17R0.14363 COC(=O)CCCCCCCOCCOC(C)C 34a_100000211219_100010004213 [0,1,1,0,0,0|2,0,0]=4 10329 B17R0.14363 COC(=O)CCCCCCCOCCOC(C)C 34a_100011022521_100000211751 [0,1,1,0,0,0|2,0,0]=4 10330 B17R0.14363 COC(=O)CCCCCCCOCCOC(C)C 7a_100000211219_100010004213 [0,1,1,0,0,0|2,0,0]=4 10331 B17R0.14363 COC(=O)CCCCCCCOCCOC(C)C 7a_100011022521_100000211751 [0,1,1,0,0,0|2,0,0]=4 10332 B17R0.14363 COC(=O)CCCCCCCOCCSC(C)C 34a_100011022521_100000730970 [0,1,1,0,0,0|2,0,0]=4 10333 B17R0.14363 COC(=O)CCCCCCCOCCSC(C)C 34a_200011212901_100010004213 [0,1,1,0,0,0|2,0,0]=4 10334 B17R0.14363 COC(=O)CCCCCCCOCCSC(C)C 7a_100011022521_100000730970 [0,1,1,0,0,0|2,0,0]=4 10335 B17R0.14363 COC(=O)CCCCCCCOCCSC(C)C 7a_200011212901_100010004213 [0,1,1,0,0,0|2,0,0]=4 10336 B17R0.14363 COC(=O)CCCCCCCSCCCC(=O)C 62a_100010004213_100011215641 [0,1,1,0,0,0|1,0,1]=4 10337 B17R0.14363 COC(=O)CCCCCCCSCCCC(=O)C 62a_100011215641_100010004213 [0,1,1,0,0,0|1,0,1]=4 10338 B17R0.14363 COC(=O)CCCCCCCSCCCC(C)C 62a_100010004213_100011214892 [0,1,1,0,0,0|1,0,0]=3 10339 B17R0.14363 COC(=O)CCCCCCCSCCCC(C)C 62a_100011214892_100010004213 [0,1,1,0,0,0|1,0,0]=3 10340 B17R0.14363 COC(=O)CCCCCCCSCCCC(C)O 62a_100010004213_200000718107 [0,1,1,0,0,0|1,0,0]=3 10341 B17R0.14363 COC(=O)CCCCCCCSCCCC(C)O 62a_200000718107_100010004213 [0,1,1,0,0,0|1,0,0]=3 10342 B17R0.14363 COC(=O)CCCCCCCSCCCN(C)C 62a_100010004213_100000757444 [0,1,1,0,0,0|2,0,0]=4 10343 B17R0.14363 COC(=O)CCCCCCCSCCOC(C)C 62a_100000211751_100010004213 [0,1,1,0,0,0|2,0,0]=4 10344 B17R0.14363 COC(=O)CCCCCCCSCCOC(C)C 62a_100010004213_100000211751 [0,1,1,0,0,0|2,0,0]=4 10345 B17R0.14363 COC(=O)CCCCCCCSCCSC(C)C 62a_100000730970_100010004213 [0,1,1,0,0,0|2,0,0]=4 10346 B17R0.14363 COC(=O)CCCCCCCSCCSC(C)C 62a_100010004213_100000730970 [0,1,1,0,0,0|2,0,0]=4 10347 B17R0.14363 COC(=O)CCCCCCNCCCOC(C)C 2230a_100000737246_100009815986 [0,1,1,0,0,0|2,0,0]=4 10348 B17R0.14363 COC(=O)CCCCCCNCCCOC(C)C 34a_100000737246_100009815986 [0,1,1,0,0,0|2,0,0]=4 10349 B17R0.14363 COC(=O)CCCCCCOCCCCC(=O)C 34a_100009863599_100009817362 [0,1,1,0,0,0|1,0,1]=4 10350 B17R0.14363 COC(=O)CCCCCCOCCCCC(=O)C 7a_100009863599_100000735457 [0,1,1,0,0,0|1,0,1]=4 10351 B17R0.14363 COC(=O)CCCCCCOCCCCC(C)C 34a_100009863599_100011216152 [0,1,1,0,0,0|1,0,0]=3 10352 B17R0.14363 COC(=O)CCCCCCOCCCCC(C)C 34a_100011214890_100009815986 [0,1,1,0,0,0|1,0,0]=3 10353 B17R0.14363 COC(=O)CCCCCCOCCCCC(C)C 7a_100009863599_100011216152 [0,1,1,0,0,0|1,0,0]=3 10354 B17R0.14363 COC(=O)CCCCCCOCCCCC(C)C 7a_100011214890_100009815986 [0,1,1,0,0,0|1,0,0]=3 10355 B17R0.14363 COC(=O)CCCCCCOCCCNC(C)C 34a_100000182298_100009815986 [0,1,1,0,0,0|2,0,0]=4 10356 B17R0.14363 COC(=O)CCCCCCOCCNCC(C)C 34a_100015185251_100009815986 [0,1,1,0,0,0|2,0,0]=4 10357 B17R0.14363 COC(=O)CCCCCCOCCOCC(C)C 34a_100000703358_100009815986 [0,1,1,0,0,0|2,0,0]=4 10358 B17R0.14363 COC(=O)CCCCCCOCCOCC(C)C 7a_100000703358_100009815986 [0,1,1,0,0,0|2,0,0]=4 10359 B17R0.14363 COC(=O)CCCCCCOCCSCC(C)C 34a_200000230437_100009815986 [0,1,1,0,0,0|2,0,0]=4 10360 B17R0.14363 COC(=O)CCCCCCOCCSCC(C)C 7a_200000230437_100009815986 [0,1,1,0,0,0|2,0,0]=4 10361 B17R0.14363 COC(=O)CCCCCCSCCCCC(=O)C 62a_100000735457_100009815986 [0,1,1,0,0,0|1,0,1]=4 10362 B17R0.14363 COC(=O)CCCCCCSCCCCC(=O)C 62a_100009815986_100000735457 [0,1,1,0,0,0|1,0,1]=4 10363 B17R0.14363 COC(=O)CCCCCCSCCCCC(C)C 62a_100009815986_100011216152 [0,1,1,0,0,0|1,0,0]=3 10364 B17R0.14363 COC(=O)CCCCCCSCCCCC(C)C 62a_100011216152_100009815986 [0,1,1,0,0,0|1,0,0]=3 10365 B17R0.14363 COC(=O)CCCCCCSCCCCN(C)C 62a_100009815986_100000690147 [0,1,1,0,0,0|2,0,0]=4 10366 B17R0.14363 COC(=O)CCCCCNCCCCCC(C)C 2230a_100011290863_100009816466 [0,1,1,0,0,0|1,0,0]=3 10367 B17R0.14363 COC(=O)CCCCCNCCCCCC(C)C 34a_100011290863_100009816466 [0,1,1,0,0,0|1,0,0]=3 10368 B17R0.14363 COC(=O)CCCCCNCCCOCC(C)C 2230a_100000205972_100009816466 [0,1,1,0,0,0|2,0,0]=4 10369 B17R0.14363 COC(=O)CCCCCNCCCOCC(C)C 34a_100000205972_100009816466 [0,1,1,0,0,0|2,0,0]=4 10370 B17R0.14363 COC(=O)CCCCCOCCCCCC(C)C 34a_100000074720_100000210682 [0,1,1,0,0,0|1,0,0]=3 10371 B17R0.14363 COC(=O)CCCCCOCCCCCC(C)C 34a_100011995859_100009816466 [0,1,1,0,0,0|1,0,0]=3 10372 B17R0.14363 COC(=O)CCCCCOCCCCCC(C)C 7a_100000074720_100000210682 [0,1,1,0,0,0|1,0,0]=3 10373 B17R0.14363 COC(=O)CCCCCOCCCCCC(C)C 7a_100011995859_100009816466 [0,1,1,0,0,0|1,0,0]=3 10374 B17R0.14363 COC(=O)CCCCCOCCCCNC(C)C 34a_100011521146_100009816466 [0,1,1,0,0,0|2,0,0]=4 10375 B17R0.14363 COC(=O)CCCCCSCCCCCC(C)C 62a_100000210682_100009816466 [0,1,1,0,0,0|1,0,0]=3 10376 B17R0.14363 COC(=O)CCCCCSCCCCCC(C)C 62a_100009816466_100000210682 [0,1,1,0,0,0|1,0,0]=3 10377 B17R0.14363 COC(=O)CCCCNCCCCCCC(C)C 2230a_100000211014_100000204269 [0,1,1,0,0,0|1,0,0]=3 10378 B17R0.14363 COC(=O)CCCCNCCCCCCC(C)C 34a_100000211014_100000204269 [0,1,1,0,0,0|1,0,0]=3 10379 B17R0.14363 COC(=O)CCCCOCCCCCNC(C)C 34a_100011629493_100000204269 [0,1,1,0,0,0|2,0,0]=4 10380 B17R0.14363 COC(=O)CCCOCCCCCCCC(C)C 34a_200000210741_100000742333 [0,1,1,0,0,0|1,0,0]=3 10381 B17R0.14363 COC(=O)CCCOCCCCCCCC(C)C 7a_200000210741_100011218270 [0,1,1,0,0,0|1,0,0]=3 10382 B17R0.14363 COC(=O)COCCNCCCCCCC(C)C 2230a_100000211014_100000090808 [0,1,1,0,0,0|2,0,0]=4 10383 B17R0.14363 COC(=O)COCCNCCCCCCC(C)C 34a_100000211014_100000090808 [0,1,1,0,0,0|2,0,0]=4 10384 B17R0.14367 CCCCCCCCCCCCNS(=O)(=O)CC 270084a_100000210451_100000211323 [0,1,1,0,0,0|2,0,0]=4 10385 B17R0.14367 CCCCCCCCCCCCNS(=O)(=O)CC 274078a_100000210451_100000211323 [0,1,1,0,0,0|2,0,0]=4 10386 B17R0.14367 CCCCCCCCCCCCNS(=O)(=O)CC 40a_100000210451_100000053943 [0,1,1,0,0,0|2,0,0]=4 10387 B17R0.43 C#CCCCCCCCCCCOCOC(=O)C 34a_100000054667_100009813279 [0,1,1,0,0,0|0,0,2]=4 10388 B17R0.43 C#CCCCCCCCCCOCCOC(=O)C 34a_100000034437_100009814007 [0,1,1,0,0,0|0,0,2]=4 10389 B17R0.43 C#CCCCCCCCCCOCCOC(=O)C 7a_100000034437_100009814007 [0,1,1,0,0,0|0,0,2]=4 10390 B17R0.43 C#CCCCCCCCCOCCCOC(=O)C 34a_100000065265_100000042594 [0,1,1,0,0,0|0,0,2]=4 10391 B17R0.43 C#CCCCCCCCCOCCCOC(=O)C 7a_100000065265_100000042594 [0,1,1,0,0,0|0,0,2]=4 10392 B17R0.43 C#CCCCCCCCOCCCCOC(=O)C 34a_100000054614_100000033659 [0,1,1,0,0,0|0,0,2]=4 10393 B17R0.43 C#CCCCCCCCOCCCCOC(=O)C 34a_100000073216_100153394163 [0,1,1,0,0,0|0,0,2]=4 10394 B17R0.43 C#CCCCCCCCOCCCCOC(=O)C 7a_100000054614_100000033659 [0,1,1,0,0,0|0,0,2]=4 10395 B17R0.43 C#CCCCCCCCOCCCCOC(=O)C 7a_100000073216_100153394163 [0,1,1,0,0,0|0,0,2]=4 10396 B17R0.43 C#CCCCCCCCSCCCCOC(=O)C 62a_100000033659_100153394163 [0,1,1,0,0,0|0,0,2]=4 10397 B17R0.43 C#CCCCCCCCSCCCCOC(=O)C 62a_100153394163_100000033659 [0,1,1,0,0,0|0,0,2]=4 10398 B17R0.43 C#CCCCCCCOCCCCCOC(=O)C 34a_100011217361_100000033007 [0,1,1,0,0,0|0,0,2]=4 10399 B17R0.43 C#CCCCCCCOCCCCCOC(=O)C 7a_100011217361_100000033007 [0,1,1,0,0,0|0,0,2]=4 10400 B17R0.43 C#CCCCCCCSCCCCCOC(=O)C 62a_100000033007_100012276617 [0,1,1,0,0,0|0,0,2]=4 10401 B17R0.43 C#CCCCCCCSCCCCCOC(=O)C 62a_100012276617_100000033007 [0,1,1,0,0,0|0,0,2]=4 10402 B17R0.43 C=C(C)CCNCCCCCCCCCCCC 2230a_100000210451_100000730704 [0,1,1,0,0,0|2,0,0]=4 10403 B17R0.43 C=C(C)CCNCCCCCCCCCCCC 34a_100000210451_100000730704 [0,1,1,0,0,0|2,0,0]=4 10404 B17R0.43 C=C(C)CCOCCCCCCCCCCCC 34a_100000210810_100000730704 [0,1,1,0,0,0|2,0,0]=4 10405 B17R0.43 C=C(C)CCOCCCCCCCCCCCC 34a_100000764851_100000759014 [0,1,1,0,0,0|2,0,0]=4 10406 B17R0.43 C=C(C)CCOCCCCCCCCCCCC 7a_100000210810_100000730704 [0,1,1,0,0,0|2,0,0]=4 10407 B17R0.43 C=C(C)CNCCCCCCCCCCCCC 2230a_100011215765_100000748629 [0,1,1,0,0,0|2,0,0]=4 10408 B17R0.43 C=C(C)CNCCCCCCCCCCCCC 34a_100011215765_100000748629 [0,1,1,0,0,0|2,0,0]=4 10409 B17R0.43 C=C(C)COCCCCCCCCCCCCBr 34a_100009813331_100000748629 [0,1,1,0,0,0|2,0,0]=4 10410 B17R0.43 C=C(C)COCCCCCCCCCCCCBr 7a_100009813331_100000748629 [0,1,1,0,0,0|2,0,0]=4 10411 B17R0.43 C=C(C)COCCCCCCCCCCCCC 34a_100000185773_100000748629 [0,1,1,0,0,0|1,0,0]=3 10412 B17R0.43 C=C(C)COCCCCCCCCCCCCC 34a_100000210245_100000210684 [0,1,1,0,0,0|1,0,0]=3 10413 B17R0.43 C=C(C)COCCCCCCCCCCCCC 7a_100000185773_100000748629 [0,1,1,0,0,0|1,0,0]=3 10414 B17R0.43 C=C(C)COCCCCCCCCCCCCN 34a_100000066677_100000748629 [0,1,1,0,0,0|2,0,0]=4 10415 B17R0.43 C=C(C)COCCCCCCCCCCCCO 34a_100000210245_100009813331 [0,1,1,0,0,0|2,0,0]=4 10416 B17R0.43 C=C(C)COCCSCCCCCCCCCC 34a_100011628728_100000748629 [0,1,1,0,0,0|2,0,0]=4 10417 B17R0.43 C=C(C)COCCSCCCCCCCCCC 7a_100011628728_100000748629 [0,1,1,0,0,0|2,0,0]=4 10418 B17R0.43 C=C(F)CNCCCCCCCCCCCCC 2230a_100011215765_100009893438 [0,1,1,0,0,0|2,0,0]=4 10419 B17R0.43 C=C(F)CNCCCCCCCCCCCCC 34a_100011215765_100009893438 [0,1,1,0,0,0|2,0,0]=4 10420 B17R0.43 C=C(F)COCCCCCCCCCCCCC 34a_100000185773_100009893438 [0,1,1,0,0,0|1,0,1]=4 10421 B17R0.43 C=C(F)COCCCCCCCCCCCCC 34a_200010262243_100000210684 [0,1,1,0,0,0|1,0,1]=4 10422 B17R0.43 C=C(F)COCCCCCCCCCCCCC 7a_100000185773_100000042424 [0,1,1,0,0,0|1,0,1]=4 10423 B17R0.43 C=CCCCCCCCCCCCCCC(=O)C 1458a_100000070787_102495333938 [0,1,1,0,0,0|1,0,1]=4 10424 B17R0.43 C=CCCCCCCCCCCCNCC(=O)O 269956a_100016091260_102130925996 [0,1,1,0,0,0|0,0,2]=4 10425 B17R0.43 C=CCCCCCCCCCCCOCC(=O)C 34a_100000211253_102130925996 [0,1,1,0,0,0|0,0,2]=4 10426 B17R0.43 C=CCCCCCCCCCCSCOC(=O)C 62a_100000076356_100011093070 [0,1,1,0,0,0|0,0,2]=4 10427 B17R0.43 C=CCCCCCCCCCCSCOC(=O)C 62a_100011093070_100000076356 [0,1,1,0,0,0|0,0,2]=4 10428 B17R0.43 C=CCCCCCCCCCNCCOC(=O)C 34a_100000081888_100009814007 [0,1,1,0,0,0|0,0,2]=4 10429 B17R0.43 C=CCCCCCCCCCOCCOC(=O)C 34a_100000038209_100009814007 [0,1,1,0,0,0|0,0,2]=4 10430 B17R0.43 C=CCCCCCCCCCOCCOC(=O)C 7a_100000038209_100009814007 [0,1,1,0,0,0|0,0,2]=4 10431 B17R0.43 C=CCCCCCCCCCSCCOC(=O)C 62a_100009814007_100009814027 [0,1,1,0,0,0|0,0,2]=4 10432 B17R0.43 C=CCCCCCCCCCSCCOC(=O)C 62a_100009814027_100009814007 [0,1,1,0,0,0|0,0,2]=4 10433 B17R0.43 C=CCCCCCCCCOCCCOC(=O)C 34a_100011215194_100000042594 [0,1,1,0,0,0|0,0,2]=4 10434 B17R0.43 C=CCCCCCCCCOCCCOC(=O)C 7a_100011215194_100000042594 [0,1,1,0,0,0|0,0,2]=4 10435 B17R0.43 C=CCCCCCCCCSCCCOC(=O)C 62a_100000042594_100011933949 [0,1,1,0,0,0|0,0,2]=4 10436 B17R0.43 C=CCCCCCCCCSCCCOC(=O)C 62a_100011933949_100000042594 [0,1,1,0,0,0|0,0,2]=4 10437 B17R0.43 C=CCCCCCCCOCCCCOC(=O)C 34a_100000073216_100012355270 [0,1,1,0,0,0|0,0,2]=4 10438 B17R0.43 C=CCCCCCCCOCCCCOC(=O)C 34a_100000730831_100000033659 [0,1,1,0,0,0|0,0,2]=4 10439 B17R0.43 C=CCCCCCCCOCCCCOC(=O)C 7a_100000073216_100012355270 [0,1,1,0,0,0|0,0,2]=4 10440 B17R0.43 C=CCCCCCCCOCCCCOC(=O)C 7a_100000730831_100000033659 [0,1,1,0,0,0|0,0,2]=4 10441 B17R0.43 C=CCCCCCCCSCCCCOC(=O)C 62a_100000033659_100012355270 [0,1,1,0,0,0|0,0,2]=4 10442 B17R0.43 C=CCCCCCCCSCCCCOC(=O)C 62a_100012355270_100000033659 [0,1,1,0,0,0|0,0,2]=4 10443 B17R0.43 C=CCCCCCCOCCCCCOC(=O)C 34a_200011216477_100000033007 [0,1,1,0,0,0|0,0,2]=4 10444 B17R0.43 C=CCCCCCCOCCCCCOC(=O)C 7a_200011216477_100000033007 [0,1,1,0,0,0|0,0,2]=4 10445 B17R0.43 C=CCCCCCCSCCCCCOC(=O)C 62a_100000033007_100011215473 [0,1,1,0,0,0|0,0,2]=4 10446 B17R0.43 C=CCCCCCCSCCCCCOC(=O)C 62a_100011215473_100000033007 [0,1,1,0,0,0|0,0,2]=4 10447 B17R0.43 CC(=O)CCCCCCCCCCCCCCO 1458a_100000070787_100009828009 [0,1,1,0,0,0|1,0,0]=3 10448 B17R0.43 CC(=O)CCCCNCCCCCCCCCO 34a_100000078944_100009817362 [0,1,1,0,0,0|2,0,0]=4 10449 B17R0.43 CC(=O)CCCCOCCCCCCCCCBr 34a_100009813782_100009817362 [0,1,1,0,0,0|2,0,0]=4 10450 B17R0.43 CC(=O)CCCCOCCCCCCCCCBr 7a_100009813782_100000735457 [0,1,1,0,0,0|2,0,0]=4 10451 B17R0.43 CC(=O)CCCCOCCCCCCCCCCl 34a_100009868337_100009817362 [0,1,1,0,0,0|2,0,0]=4 10452 B17R0.43 CC(=O)CCCCOCCCCCCCCCCl 7a_100009868337_100000735457 [0,1,1,0,0,0|2,0,0]=4 10453 B17R0.43 CC(=O)CCCCOCCCCCCCCCN 34a_100000078944_100009817362 [0,1,1,0,0,0|2,0,0]=4 10454 B17R0.43 CC(=O)CCCCSCCCCCCCCCO 62a_100000735457_100009813782 [0,1,1,0,0,0|2,0,0]=4 10455 B17R0.43 CC(=O)CCCCSCCCCCCCCCO 62a_100009813782_100000735457 [0,1,1,0,0,0|2,0,0]=4 10456 B17R0.43 CC(=O)CCCNCCCCCCCCCCO 34a_100000066964_100000685027 [0,1,1,0,0,0|2,0,0]=4 10457 B17R0.43 CC(=O)CCCOCCCCCCCCCCBr 34a_100009813290_100000685027 [0,1,1,0,0,0|2,0,0]=4 10458 B17R0.43 CC(=O)CCCOCCCCCCCCCCBr 7a_100009813290_100011215641 [0,1,1,0,0,0|2,0,0]=4 10459 B17R0.43 CC(=O)CCCOCCCCCCCCCCCl 34a_200000033068_100000685027 [0,1,1,0,0,0|2,0,0]=4 10460 B17R0.43 CC(=O)CCCOCCCCCCCCCCCl 7a_200000033068_100011215641 [0,1,1,0,0,0|2,0,0]=4 10461 B17R0.43 CC(=O)CCCOCCCCCCCCCCN 34a_100000066964_100000685027 [0,1,1,0,0,0|2,0,0]=4 10462 B17R0.43 CC(=O)CCCOCCCCCCCCCCO 34a_100000759063_100009813290 [0,1,1,0,0,0|2,0,0]=4 10463 B17R0.43 CC(=O)CCCOCCCCCCCCCCO 7a_100000759063_100009813290 [0,1,1,0,0,0|2,0,0]=4 10464 B17R0.43 CC(=O)CCCSCCCCCCCCCCO 62a_100009813290_100011215641 [0,1,1,0,0,0|2,0,0]=4 10465 B17R0.43 CC(=O)CCCSCCCCCCCCCCO 62a_100011215641_200000033068 [0,1,1,0,0,0|2,0,0]=4 10466 B17R0.43 CC(=O)CCOCCCCCCCCCCCBr 7a_100009812471_100000053229 [0,1,1,0,0,0|2,0,0]=4 10467 B17R0.43 CC(=O)CCOCCCCCCCCCCCO 34a_100000759926_100009812471 [0,1,1,0,0,0|2,0,0]=4 10468 B17R0.43 CC(=O)CCOCCCCCCCCCCCO 7a_100000759926_100009812471 [0,1,1,0,0,0|2,0,0]=4 10469 B17R0.43 CC(=O)CCSCCCCCCCCCCCO 62a_100009812471_100000053229 [0,1,1,0,0,0|2,0,0]=4 10470 B17R0.43 CC(=O)COCCCCCCCCCCCCO 34a_100000211253_100009813331 [0,1,1,0,0,0|1,0,0]=3 10471 B17R0.43 CC(=O)COCCCCCCOCCCCCO 34a_100000211253_200132310570 [0,1,1,0,0,0|2,0,0]=4 10472 B17R0.43 CC(=O)NCCCCCCNCCCCCCF 2230a_200011996284_100015922095 [0,1,1,0,0,0|2,0,0]=4 10473 B17R0.43 CC(=O)NCCCCCCNCCCCCCF 34a_200011996284_100015922095 [0,1,1,0,0,0|2,0,0]=4 10474 B17R0.43 CC(=O)NCCCCCCNCCCCCCO 2230a_200011996284_100000766143 [0,1,1,0,0,0|2,0,0]=4 10475 B17R0.43 CC(=O)NCCCCCCNCCCCCCO 34a_200011996284_100000766143 [0,1,1,0,0,0|2,0,0]=4 10476 B17R0.43 CC(=O)NCCCCCNCCCCCCCO 2230a_200012022750_100000760002 [0,1,1,0,0,0|2,0,0]=4 10477 B17R0.43 CC(=O)NCCCCCNCCCCCCCO 34a_200012022750_100000760002 [0,1,1,0,0,0|2,0,0]=4 10478 B17R0.43 CC(=O)NCCCCNCCCCCCCCO 2230a_200011368371_100000033203 [0,1,1,0,0,0|2,0,0]=4 10479 B17R0.43 CC(=O)NCCCCNCCCCCCCCO 34a_200011368371_100000033203 [0,1,1,0,0,0|2,0,0]=4 10480 B17R0.43 CC(=O)NCCCNCCCCCCCCCO 34a_100000736810_100009813782 [0,1,1,0,0,0|2,0,0]=4 10481 B17R0.43 CC(=O)NCCCOCCCCCCCCCO 34a_100000752032_100009813782 [0,1,1,0,0,0|2,0,0]=4 10482 B17R0.43 CC(=O)NCCNCCCCCCCCCCO 2230a_100000066964_100000189650 [0,1,1,0,0,0|2,0,0]=4 10483 B17R0.43 CC(=O)NCCNCCCCCCCCCCO 2230a_100000209853_100009813290 [0,1,1,0,0,0|2,0,0]=4 10484 B17R0.43 CC(=O)NCCOCCCCCCCCCCBr 7a_100009813290_100000189650 [0,1,1,0,0,0|2,0,0]=4 10485 B17R0.43 CC(=O)NCCOCCCCCCCCCCCl 7a_200000033068_100000189650 [0,1,1,0,0,0|2,0,0]=4 10486 B17R0.43 CC(=O)NCCOCCCCCCCCCCO 34a_100000158858_100009813290 [0,1,1,0,0,0|2,0,0]=4 10487 B17R0.43 CC(=O)NCCSCCCCCCCCCCO 62a_100000189650_200000033068 [0,1,1,0,0,0|2,0,0]=4 10488 B17R0.43 CC(=O)NCCSCCCCCCCCCCO 62a_100009813290_100000189650 [0,1,1,0,0,0|2,0,0]=4 10489 B17R0.43 CC(=O)OCCCCCNCCCCCCCO 2230a_100011996573_100009813381 [0,1,1,0,0,0|1,0,0]=3 10490 B17R0.43 CC(=O)OCCCCCNCCCCCCCO 34a_100011996573_100000033007 [0,1,1,0,0,0|1,0,0]=3 10491 B17R0.43 CC(=O)OCCCCCNCCCOCCCO 2230a_100011310245_100009813381 [0,1,1,0,0,0|2,0,0]=4 10492 B17R0.43 CC(=O)OCCCCCNCCCOCCCO 34a_100011310245_100000033007 [0,1,1,0,0,0|2,0,0]=4 10493 B17R0.43 CC(=O)OCCCCCOCCCCCCCBr 34a_100000760002_100000033007 [0,1,1,0,0,0|1,0,0]=3 10494 B17R0.43 CC(=O)OCCCCCOCCCCCCCBr 7a_100000760002_100000033007 [0,1,1,0,0,0|1,0,0]=3 10495 B17R0.43 CC(=O)OCCCCCOCCCCCCCN 34a_100011996573_100000033007 [0,1,1,0,0,0|1,0,0]=3 10496 B17R0.43 CC(=O)OCCCCCOCCCOCCCN 34a_100011310245_100000033007 [0,1,1,0,0,0|2,0,0]=4 10497 B17R0.43 CC(=O)OCCCCCSCCCCCCC#N 62a_100000033007_100009813337 [0,1,1,0,0,0|1,0,1]=4 10498 B17R0.43 CC(=O)OCCCCCSCCCCCCC#N 62a_100009813337_100000033007 [0,1,1,0,0,0|1,0,1]=4 10499 B17R0.43 CC(=O)OCCCCCSCCCCCCCO 62a_100000033007_100000760002 [0,1,1,0,0,0|1,0,0]=3 10500 B17R0.43 CC(=O)OCCCCCSCCCCCCCO 62a_100000760002_100000033007 [0,1,1,0,0,0|1,0,0]=3 10501 B17R0.43 CC(=O)OCCCCNCCCCCCCCO 34a_102515433106_100000033659 [0,1,1,0,0,0|1,0,0]=3 10502 B17R0.43 CC(=O)OCCCCOCCCCCCCCBr 34a_100009813846_100000033659 [0,1,1,0,0,0|1,0,0]=3 10503 B17R0.43 CC(=O)OCCCCOCCCCCCCCBr 7a_100009813846_100000033659 [0,1,1,0,0,0|1,0,0]=3 10504 B17R0.43 CC(=O)OCCCCOCCCCCCCCCl 34a_100000033203_100000033659 [0,1,1,0,0,0|1,0,0]=3 10505 B17R0.43 CC(=O)OCCCCOCCCCCCCCCl 7a_100000033203_100000033659 [0,1,1,0,0,0|1,0,0]=3 10506 B17R0.43 CC(=O)OCCCCOCCCCCCCCN 34a_102515433106_100000033659 [0,1,1,0,0,0|1,0,0]=3 10507 B17R0.43 CC(=O)OCCCCOCCCCCCCCO 34a_100000073216_100000033203 [0,1,1,0,0,0|1,0,0]=3 10508 B17R0.43 CC(=O)OCCCCOCCCCCCCCO 7a_100000073216_100000033203 [0,1,1,0,0,0|1,0,0]=3 10509 B17R0.43 CC(=O)OCCCCOCCCCCNCCN 34a_103619048469_100000033659 [0,1,1,0,0,0|2,0,0]=4 10510 B17R0.43 CC(=O)OCCCCSCCCCCCCCO 62a_100000033203_100000033659 [0,1,1,0,0,0|1,0,0]=3 10511 B17R0.43 CC(=O)OCCCCSCCCCCCCCO 62a_100000033659_100000033203 [0,1,1,0,0,0|1,0,0]=3 10512 B17R0.43 CC(=O)OCCCNCCCCCCCCCO 34a_100000078944_100000042594 [0,1,1,0,0,0|1,0,0]=3 10513 B17R0.43 CC(=O)OCCCOCCCCCCCCCBr 34a_100009813782_100000042594 [0,1,1,0,0,0|1,0,0]=3 10514 B17R0.43 CC(=O)OCCCOCCCCCCCCCBr 7a_100009813782_100000042594 [0,1,1,0,0,0|1,0,0]=3 10515 B17R0.43 CC(=O)OCCCOCCCCCCCCCCl 34a_100009868337_100000042594 [0,1,1,0,0,0|1,0,0]=3 10516 B17R0.43 CC(=O)OCCCOCCCCCCCCCCl 7a_100009868337_100000042594 [0,1,1,0,0,0|1,0,0]=3 10517 B17R0.43 CC(=O)OCCCOCCCCCCCCCN 34a_100000078944_100000042594 [0,1,1,0,0,0|1,0,0]=3 10518 B17R0.43 CC(=O)OCCCSCCCCCCCCCO 62a_100000042594_100009813782 [0,1,1,0,0,0|1,0,0]=3 10519 B17R0.43 CC(=O)OCCCSCCCCCCCCCO 62a_100009813782_100000042594 [0,1,1,0,0,0|1,0,0]=3 10520 B17R0.43 CC(=O)OCCNCCCCCCCCCCO 34a_100000066964_100009814007 [0,1,1,0,0,0|1,0,0]=3 10521 B17R0.43 CC(=O)OCCOCCCCCCCCCCBr 34a_100009813290_100009814007 [0,1,1,0,0,0|1,0,0]=3 10522 B17R0.43 CC(=O)OCCOCCCCCCCCCCBr 7a_100009813290_100009814007 [0,1,1,0,0,0|1,0,0]=3 10523 B17R0.43 CC(=O)OCCOCCCCCCCCCCCl 34a_200000033068_100009814007 [0,1,1,0,0,0|1,0,0]=3 10524 B17R0.43 CC(=O)OCCOCCCCCCCCCCCl 7a_200000033068_100009814007 [0,1,1,0,0,0|1,0,0]=3 10525 B17R0.43 CC(=O)OCCOCCCCCCCCCCN 34a_100000066964_100009814007 [0,1,1,0,0,0|1,0,0]=3 10526 B17R0.43 CC(=O)OCCOCCNCCCCCCCO 2230a_100011996573_200000083610 [0,1,1,0,0,0|2,0,0]=4 10527 B17R0.43 CC(=O)OCCOCCNCCCCCCCO 34a_100011996573_200000083610 [0,1,1,0,0,0|2,0,0]=4 10528 B17R0.43 CC(=O)OCCOCCOCCCCCCCBr 34a_100000760002_200000083610 [0,1,1,0,0,0|2,0,0]=4 10529 B17R0.43 CC(=O)OCCOCCOCCCCCCCBr 7a_100000760002_200000083610 [0,1,1,0,0,0|2,0,0]=4 10530 B17R0.43 CC(=O)OCCOCCOCCCCCCCN 34a_100011996573_200000083610 [0,1,1,0,0,0|2,0,0]=4 10531 B17R0.43 CC(=O)OCCOCCSCCCCCCCO 62a_100000760002_200000083610 [0,1,1,0,0,0|2,0,0]=4 10532 B17R0.43 CC(=O)OCCOCCSCCCCCCCO 62a_200000083610_100000760002 [0,1,1,0,0,0|2,0,0]=4 10533 B17R0.43 CC(=O)OCCOCNCCCCCCCCO 34a_102515433106_100000076355 [0,1,1,0,0,0|2,0,0]=4 10534 B17R0.43 CC(=O)OCCOCOCCCCCCCCBr 34a_100009813846_100000076355 [0,1,1,0,0,0|2,0,0]=4 10535 B17R0.43 CC(=O)OCCOCOCCCCCCCCCl 34a_100000033203_100000076355 [0,1,1,0,0,0|2,0,0]=4 10536 B17R0.43 CC(=O)OCCOCOCCCCCCCCN 34a_102515433106_100000076355 [0,1,1,0,0,0|2,0,0]=4 10537 B17R0.43 CC(=O)OCCOCSCCCCCCCCO 62a_100000033203_100000076355 [0,1,1,0,0,0|2,0,0]=4 10538 B17R0.43 CC(=O)OCCOCSCCCCCCCCO 62a_100000076355_100000033203 [0,1,1,0,0,0|2,0,0]=4 10539 B17R0.43 CC(=O)OCCSCCCCCCCCCCO 62a_100009813290_100009814007 [0,1,1,0,0,0|1,0,0]=3 10540 B17R0.43 CC(=O)OCCSCCCCCCCCCCO 62a_100009814007_200000033068 [0,1,1,0,0,0|1,0,0]=3 10541 B17R0.43 CC(=O)OCOCCCCCCCCCCCBr 34a_100009812471_100009813279 [0,1,1,0,0,0|1,0,0]=3 10542 B17R0.43 CC(=O)OCSCCCCCCCCCCCO 62a_100009812471_100000076356 [0,1,1,0,0,0|1,0,0]=3 10543 B17R0.43 CC(=O)SCCCCCCCCCCCSCF 62a_100010140907_100015361967 [0,1,1,0,0,0|1,1,0]=4 10544 B17R0.43 CC(=O)SCCCCCCCCCCCSCF 62a_100015361967_100010140907 [0,1,1,0,0,0|1,1,0]=4 10545 B17R0.43 CC(=O)SCCCCNCCCCCCCCO 2230a_102515433106_200010402107 [0,1,1,0,0,0|1,1,0]=4 10546 B17R0.43 CC(=O)SCCCCNCCCCCCCCO 34a_102515433106_200010402107 [0,1,1,0,0,0|1,1,0]=4 10547 B17R0.43 CC(=O)SCCCCOCCCCCCCCBr 34a_100009813846_200010402107 [0,1,1,0,0,0|1,1,0]=4 10548 B17R0.43 CC(=O)SCCCCOCCCCCCCCBr 7a_100009813846_200010402107 [0,1,1,0,0,0|1,1,0]=4 10549 B17R0.43 CC(=O)SCCCCOCCCCCCCCCl 34a_100000033203_200010402107 [0,1,1,0,0,0|1,1,0]=4 10550 B17R0.43 CC(=O)SCCCCOCCCCCCCCCl 7a_100000033203_200010402107 [0,1,1,0,0,0|1,1,0]=4 10551 B17R0.43 CC(=O)SCCCCOCCCCCCCCN 34a_102515433106_200010402107 [0,1,1,0,0,0|1,1,0]=4 10552 B17R0.43 CC(=O)SCCCCSCCCCCCCCO 62a_100000033203_200010402107 [0,1,1,0,0,0|1,1,0]=4 10553 B17R0.43 CC(=O)SCCCCSCCCCCCCCO 62a_200010402107_100000033203 [0,1,1,0,0,0|1,1,0]=4 10554 B17R0.43 CC(=O)SCCCNCCCCCCCCCO 2230a_100000078944_100000038929 [0,1,1,0,0,0|1,1,0]=4 10555 B17R0.43 CC(=O)SCCCNCCCCCCCCCO 34a_100000078944_100000038929 [0,1,1,0,0,0|1,1,0]=4 10556 B17R0.43 CC(=O)SCCCOCCCCCCCCCBr 34a_100009813782_100000038929 [0,1,1,0,0,0|1,1,0]=4 10557 B17R0.43 CC(=O)SCCCOCCCCCCCCCBr 7a_100009813782_100000038929 [0,1,1,0,0,0|1,1,0]=4 10558 B17R0.43 CC(=O)SCCCOCCCCCCCCCCl 34a_100009868337_100000038929 [0,1,1,0,0,0|1,1,0]=4 10559 B17R0.43 CC(=O)SCCCOCCCCCCCCCCl 7a_100009868337_100000038929 [0,1,1,0,0,0|1,1,0]=4 10560 B17R0.43 CC(=O)SCCCOCCCCCCCCCN 34a_100000078944_100000038929 [0,1,1,0,0,0|1,1,0]=4 10561 B17R0.43 CC(=O)SCCCSCCCCCCCCCO 62a_100000038929_100009813782 [0,1,1,0,0,0|1,1,0]=4 10562 B17R0.43 CC(=O)SCCCSCCCCCCCCCO 62a_100009813782_100000038929 [0,1,1,0,0,0|1,1,0]=4 10563 B17R0.43 CC(=S)OCCCNCCCCCCCCCO 2230a_100000078944_200135323944 [0,1,1,0,0,0|1,1,0]=4 10564 B17R0.43 CC(=S)OCCCNCCCCCCCCCO 34a_100000078944_200135323944 [0,1,1,0,0,0|1,1,0]=4 10565 B17R0.43 CC(=S)OCCCOCCCCCCCCCBr 34a_100009813782_200135323944 [0,1,1,0,0,0|1,1,0]=4 10566 B17R0.43 CC(=S)OCCCOCCCCCCCCCBr 7a_100009813782_200135323944 [0,1,1,0,0,0|1,1,0]=4 10567 B17R0.43 CC(=S)OCCCOCCCCCCCCCCl 34a_100009868337_200135323944 [0,1,1,0,0,0|1,1,0]=4 10568 B17R0.43 CC(=S)OCCCOCCCCCCCCCCl 7a_100009868337_200135323944 [0,1,1,0,0,0|1,1,0]=4 10569 B17R0.43 CC(=S)OCCCOCCCCCCCCCN 34a_100000078944_200135323944 [0,1,1,0,0,0|1,1,0]=4 10570 B17R0.43 CC(=S)OCCCSCCCCCCCCCO 62a_100009813782_200135323944 [0,1,1,0,0,0|1,1,0]=4 10571 B17R0.43 CC(=S)OCCCSCCCCCCCCCO 62a_200135323944_100009813782 [0,1,1,0,0,0|1,1,0]=4 10572 B17R0.43 CC(C)OCCCCCCCCCCCCCO 34a_100000212225_100009812470 [0,1,1,0,0,0|1,0,1]=4 10573 B17R0.43 CC/C=C\CCCCCOCCCCOC(=O)C 34a_100016268722_100000033659 [0,1,1,0,0,0|0,0,2]=4 10574 B17R0.43 CC/C=C\CCCCCOCCCCOC(=O)C 7a_100016268722_100000033659 [0,1,1,0,0,0|0,0,2]=4 10575 B17R0.43 CC/C=C\CCCCOCCCCCOC(=O)C 34a_100016287862_100000033007 [0,1,1,0,0,0|0,0,2]=4 10576 B17R0.43 CC/C=C\CCCCOCCCCCOC(=O)C 7a_100016287862_100000033007 [0,1,1,0,0,0|0,0,2]=4 10577 B17R0.43 CCC#CCCCCCCCCOCOC(=O)C 34a_200000031908_100009813279 [0,1,1,0,0,0|0,0,2]=4 10578 B17R0.43 CCC#CCCCCCCSCCCOC(=O)C 62a_100000042594_200000036426 [0,1,1,0,0,0|0,0,2]=4 10579 B17R0.43 CCC#CCCCCCCSCCCOC(=O)C 62a_200000036426_100000042594 [0,1,1,0,0,0|0,0,2]=4 10580 B17R0.43 CCCC/C=C/CCCCOCCCOC(=O)C 34a_200020645093_100000042594 [0,1,1,0,0,0|0,0,2]=4 10581 B17R0.43 CCCC/C=C/CCCCOCCCOC(=O)C 7a_200020645093_100000042594 [0,1,1,0,0,0|0,0,2]=4 10582 B17R0.43 CCCC/C=C\CCOCCCCCOC(=O)C 34a_200016286491_100000033007 [0,1,1,0,0,0|0,0,2]=4 10583 B17R0.43 CCCC/C=C\CCOCCCCCOC(=O)C 7a_200016286491_100000033007 [0,1,1,0,0,0|0,0,2]=4 10584 B17R0.43 CCCCC#CCCCCCCSCOC(=O)C 62a_100000076356_200000043322 [0,1,1,0,0,0|0,0,2]=4 10585 B17R0.43 CCCCC#CCCCCCCSCOC(=O)C 62a_200000043322_100000076356 [0,1,1,0,0,0|0,0,2]=4 10586 B17R0.43 CCCCC#CCCCCOCCCOC(=O)C 34a_200000066234_100000042594 [0,1,1,0,0,0|0,0,2]=4 10587 B17R0.43 CCCCC#CCCCCOCCCOC(=O)C 7a_200000066234_100000042594 [0,1,1,0,0,0|0,0,2]=4 10588 B17R0.43 CCCCC#CCCCOCCCCOC(=O)C 34a_100000073216_200000047210 [0,1,1,0,0,0|0,0,2]=4 10589 B17R0.43 CCCCC#CCCCOCCCCOC(=O)C 7a_100000073216_200000047210 [0,1,1,0,0,0|0,0,2]=4 10590 B17R0.43 CCCCC#CCCCSCCCCOC(=O)C 62a_100000033659_200000047210 [0,1,1,0,0,0|0,0,2]=4 10591 B17R0.43 CCCCC#CCCCSCCCCOC(=O)C 62a_200000047210_100000033659 [0,1,1,0,0,0|0,0,2]=4 10592 B17R0.43 CCCCC#CCCOCCCCCOC(=O)C 34a_100000037610_100000033007 [0,1,1,0,0,0|0,0,2]=4 10593 B17R0.43 CCCCC#CCCOCCCCCOC(=O)C 7a_100000037610_100000033007 [0,1,1,0,0,0|0,0,2]=4 10594 B17R0.43 CCCCC/C=C/COCCCCCOC(=O)C 34a_100016258190_100000033007 [0,1,1,0,0,0|0,0,2]=4 10595 B17R0.43 CCCCC/C=C/COCCCCCOC(=O)C 7a_100016258190_100000033007 [0,1,1,0,0,0|0,0,2]=4 10596 B17R0.43 CCCCC/C=C\CCCOCCCOC(=O)C 34a_100020655193_100000042594 [0,1,1,0,0,0|0,0,2]=4 10597 B17R0.43 CCCCC/C=C\CCCOCCCOC(=O)C 7a_100020655193_100000042594 [0,1,1,0,0,0|0,0,2]=4 10598 B17R0.43 CCCCC/C=C\CCOCCCCOC(=O)C 34a_100016277358_100000033659 [0,1,1,0,0,0|0,0,2]=4 10599 B17R0.43 CCCCC/C=C\CCOCCCCOC(=O)C 7a_100016277358_100000033659 [0,1,1,0,0,0|0,0,2]=4 10600 B17R0.43 CCCCCC#CCCOCCCCOC(=O)C 34a_200000042877_100000033659 [0,1,1,0,0,0|0,0,2]=4 10601 B17R0.43 CCCCCC#CCCOCCCCOC(=O)C 7a_200000042877_100000033659 [0,1,1,0,0,0|0,0,2]=4 10602 B17R0.43 CCCCCC#CCOCCCCCOC(=O)C 34a_200000033628_100000033007 [0,1,1,0,0,0|0,0,2]=4 10603 B17R0.43 CCCCCC#CCOCCCCCOC(=O)C 7a_200000033628_100000033007 [0,1,1,0,0,0|0,0,2]=4 10604 B17R0.43 CCCCCC#CCSCCCCCOC(=O)C 62a_100000033007_100009816472 [0,1,1,0,0,0|0,0,2]=4 10605 B17R0.43 CCCCCC#CCSCCCCCOC(=O)C 62a_100009816472_100000033007 [0,1,1,0,0,0|0,0,2]=4 10606 B17R0.43 CCCCCC/C=C/COCCCCOC(=O)C 34a_200016276170_100000033659 [0,1,1,0,0,0|0,0,2]=4 10607 B17R0.43 CCCCCC/C=C/COCCCCOC(=O)C 7a_200016276170_100000033659 [0,1,1,0,0,0|0,0,2]=4 10608 B17R0.43 CCCCCC/C=C\CCCCCCCC(=O)C 1458a_100020587579_200000210301 [0,1,1,0,0,0|1,0,1]=4 10609 B17R0.43 CCCCCC/C=C\CCCCCCCC(=O)[13CH3] 1458a_100020587579_200025704644 [0,1,1,0,0,0|1,0,1]=4 10610 B17R0.43 CCCCCCC#CCCOCCCOC(=O)C 34a_200000033163_100000042594 [0,1,1,0,0,0|0,0,2]=4 10611 B17R0.43 CCCCCCC#CCCOCCCOC(=O)C 7a_200000033163_100000042594 [0,1,1,0,0,0|0,0,2]=4 10612 B17R0.43 CCCCCCC#CCOCCCCOC(=O)C 34a_200000037284_100000033659 [0,1,1,0,0,0|0,0,2]=4 10613 B17R0.43 CCCCCCC#CCOCCCCOC(=O)C 7a_200000037284_100000033659 [0,1,1,0,0,0|0,0,2]=4 10614 B17R0.43 CCCCCCCC#CCOCCCOC(=O)C 34a_200000061759_100000042594 [0,1,1,0,0,0|0,0,2]=4 10615 B17R0.43 CCCCCCCC#CCOCCCOC(=O)C 7a_200000061759_100000042594 [0,1,1,0,0,0|0,0,2]=4 10616 B17R0.43 CCCCCCCC/C=C/COCCOC(=O)C 34a_200020667288_100009814007 [0,1,1,0,0,0|0,0,2]=4 10617 B17R0.43 CCCCCCCC/C=C/COCCOC(=O)C 7a_200020667288_100009814007 [0,1,1,0,0,0|0,0,2]=4 10618 B17R0.43 CCCCCCCCC/C=C/COCOC(=O)C 34a_100015232335_100009813279 [0,1,1,0,0,0|0,0,2]=4 10619 B17R0.43 CCCCCCCCCCCCC=NNC(=O)C 4a_100000189765_200011215488 [0,1,1,0,0,0|1,0,1]=4 10620 B17R0.43 CCCCCCCCCCCCCCNC(=O)C 11a_100011217771_100015343762 [0,1,1,0,0,0|1,0,0]=3 10621 B17R0.43 CCCCCCCCCCCCCCNC(=O)C 1626a_100011217771_100015343762 [0,1,1,0,0,0|1,0,0]=3 10622 B17R0.43 CCCCCCCCCCCCCCNC(=O)C 240690a_100011217771_100015343762 [0,1,1,0,0,0|1,0,0]=3 10623 B17R0.43 CCCCCCCCCCCCCCNC(=O)C 527a_100011217771_100103153847 [0,1,1,0,0,0|1,0,0]=3 10624 B17R0.43 CCCCCCCCCCCCCNCC(=O)N 2230a_100000711301_100000210684 [0,1,1,0,0,0|1,0,0]=3 10625 B17R0.43 CCCCCCCCCCCCCNCC(=O)N 2230a_100011215765_100000747473 [0,1,1,0,0,0|1,0,0]=3 10626 B17R0.43 CCCCCCCCCCCCCNCC(=O)N 34a_100011215765_100000187820 [0,1,1,0,0,0|1,0,0]=3 10627 B17R0.43 CCCCCCCCCCCCCNCC(=O)O 269956a_100016091260_100000210684 [0,1,1,0,0,0|0,0,0]=2 10628 B17R0.43 CCCCCCCCCCCCCNCC(=O)[O-] 34a_100011215765_100020667443 [0,1,1,0,0,0|0,0,1]=3 10629 B17R0.43 CCCCCCCCCCCCCNCC(C)O 2230a_100000210904_100000210684 [0,1,1,0,0,0|1,0,1]=4 10630 B17R0.43 CCCCCCCCCCCCCNCC(C)O 2230a_100011215765_100011218427 [0,1,1,0,0,0|1,0,1]=4 10631 B17R0.43 CCCCCCCCCCCCCNCC(C)O 270004a_100000210904_200011215488 [0,1,1,0,0,0|1,0,1]=4 10632 B17R0.43 CCCCCCCCCCCCCNCC(C)O 34a_100000210904_100000210684 [0,1,1,0,0,0|1,0,1]=4 10633 B17R0.43 CCCCCCCCCCCCCNCC(C)O 34a_100011215765_100011218427 [0,1,1,0,0,0|1,0,1]=4 10634 B17R0.43 CCCCCCCCCCCCCNC[C@@H](C)O 2230a_100011215765_100009817552 [0,1,1,0,0,0|1,0,1]=4 10635 B17R0.43 CCCCCCCCCCCCCNC[C@@H](C)O 34a_100011215765_100009817552 [0,1,1,0,0,0|1,0,1]=4 10636 B17R0.43 CCCCCCCCCCCCCNC[N+](=O)[O-] 34a_100011215765_100000761209 [0,1,1,0,0,0|1,0,1]=4 10637 B17R0.43 CCCCCCCCCCCCCOCC(=O)C 34a_100000211253_100000210684 [0,1,1,0,0,0|0,0,0]=2 10638 B17R0.43 CCCCCCCCCCCCCOCC(=O)N 34a_100000185773_100000187820 [0,1,1,0,0,0|1,0,0]=3 10639 B17R0.43 CCCCCCCCCCCCCOCC(=O)N 7a_100000185773_100000187820 [0,1,1,0,0,0|1,0,0]=3 10640 B17R0.43 CCCCCCCCCCCCCOCC(=O)[O-] 34a_100000185773_100020667443 [0,1,1,0,0,0|0,0,1]=3 10641 B17R0.43 CCCCCCCCCCCCCOCC(C)C 34a_100000185773_100000210624 [0,1,1,0,0,0|1,0,1]=4 10642 B17R0.43 CCCCCCCCCCCCCOCC(C)C 34a_100000210257_100000210684 [0,1,1,0,0,0|1,0,1]=4 10643 B17R0.43 CCCCCCCCCCCCCOCC(C)C 7a_100000185773_100000210760 [0,1,1,0,0,0|1,0,1]=4 10644 B17R0.43 CCCCCCCCCCCCCOCC(C)F 34a_100015925927_100000210684 [0,1,1,0,0,0|1,0,1]=4 10645 B17R0.43 CCCCCCCCCCCCCOCC(C)O 34a_100000185773_100011218427 [0,1,1,0,0,0|0,0,2]=4 10646 B17R0.43 CCCCCCCCCCCCCOCC(C)O 7a_100000185773_100011218427 [0,1,1,0,0,0|0,0,2]=4 10647 B17R0.43 CCCCCCCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100000210684 [0,1,1,0,0,0|1,0,1]=4 10648 B17R0.43 CCCCCCCCCCCCCOC[C@@H](C)N 34a_100000737577_100000210684 [0,1,1,0,0,0|1,0,1]=4 10649 B17R0.43 CCCCCCCCCCCCCOC[C@@H](C)O 34a_100000185773_100009817552 [0,1,1,0,0,0|0,0,2]=4 10650 B17R0.43 CCCCCCCCCCCCCOC[C@@H](C)O 7a_100000185773_100009817552 [0,1,1,0,0,0|0,0,2]=4 10651 B17R0.43 CCCCCCCCCCCCCOC[N+](=O)[O-] 34a_100000185773_100000761209 [0,1,1,0,0,0|1,0,1]=4 10652 B17R0.43 CCCCCCCCCCCCCSCC(=O)N 62a_100000747473_100011934334 [0,1,1,0,0,0|1,0,0]=3 10653 B17R0.43 CCCCCCCCCCCCCSCC(=O)[O-] 62a_100020667443_100011934334 [0,1,1,0,0,0|0,0,1]=3 10654 B17R0.43 CCCCCCCCCCCCCSCC(C)O 62a_100011218427_100011934334 [0,1,1,0,0,0|1,0,1]=4 10655 B17R0.43 CCCCCCCCCCCCCSC[C@@H](C)O 62a_100009817552_100011934334 [0,1,1,0,0,0|1,0,1]=4 10656 B17R0.43 CCCCCCCCCCCCNCC=C(C)C 2230a_100000210451_100000761012 [0,1,1,0,0,0|2,0,0]=4 10657 B17R0.43 CCCCCCCCCCCCNCC=C(C)C 270004a_100000718196_100011218549 [0,1,1,0,0,0|2,0,0]=4 10658 B17R0.43 CCCCCCCCCCCCNCC=C(C)C 34a_100000210451_100000761012 [0,1,1,0,0,0|2,0,0]=4 10659 B17R0.43 CCCCCCCCCCCCNCC=C(C)C 34a_100000718196_100000759014 [0,1,1,0,0,0|2,0,0]=4 10660 B17R0.43 CCCCCCCCCCCCNCCC(=O)N 2230a_100000210451_100000744528 [0,1,1,0,0,0|1,0,0]=3 10661 B17R0.43 CCCCCCCCCCCCNCCC(=O)N 34a_100000210451_100000731001 [0,1,1,0,0,0|1,0,0]=3 10662 B17R0.43 CCCCCCCCCCCCNCCC(C)O 2230a_100000210451_100012276601 [0,1,1,0,0,0|1,0,1]=4 10663 B17R0.43 CCCCCCCCCCCCNCCC(C)O 2230a_200000755665_100011215052 [0,1,1,0,0,0|1,0,1]=4 10664 B17R0.43 CCCCCCCCCCCCNCCC(C)O 270004a_200000755665_100011218549 [0,1,1,0,0,0|1,0,1]=4 10665 B17R0.43 CCCCCCCCCCCCNCCC(C)O 34a_100000210451_100012276601 [0,1,1,0,0,0|1,0,1]=4 10666 B17R0.43 CCCCCCCCCCCCNCOC(=O)C 34a_100000210451_100009813279 [0,1,1,0,0,0|0,0,0]=2 10667 B17R0.43 CCCCCCCCCCCCNCOC(C)C 2230a_100000210451_100000709892 [0,1,1,0,0,0|1,0,1]=4 10668 B17R0.43 CCCCCCCCCCCCNCOC(C)C 34a_100000210451_100000709892 [0,1,1,0,0,0|1,0,1]=4 10669 B17R0.43 CCCCCCCCCCCCNOCC(=O)O 269956a_100000106656_100000759014 [0,1,1,0,0,0|1,0,0]=3 10670 B17R0.43 CCCCCCCCCCCCOCC=C(C)C 34a_100000210810_100000761012 [0,1,1,0,0,0|2,0,0]=4 10671 B17R0.43 CCCCCCCCCCCCOCC=C(C)C 34a_100000753907_100000759014 [0,1,1,0,0,0|2,0,0]=4 10672 B17R0.43 CCCCCCCCCCCCOCC=C(C)C 7a_100000210810_100000761012 [0,1,1,0,0,0|2,0,0]=4 10673 B17R0.43 CCCCCCCCCCCCOCCC(=O)C 34a_100000759926_100000759014 [0,1,1,0,0,0|1,0,0]=3 10674 B17R0.43 CCCCCCCCCCCCOCCC(=O)C 7a_100000210810_100000053229 [0,1,1,0,0,0|1,0,0]=3 10675 B17R0.43 CCCCCCCCCCCCOCCC(=O)C 7a_100000759926_100000759014 [0,1,1,0,0,0|1,0,0]=3 10676 B17R0.43 CCCCCCCCCCCCOCCC(=O)N 34a_100000210810_100000731001 [0,1,1,0,0,0|1,0,0]=3 10677 B17R0.43 CCCCCCCCCCCCOCCC(=O)N 34a_100000757172_100000759014 [0,1,1,0,0,0|1,0,0]=3 10678 B17R0.43 CCCCCCCCCCCCOCCC(=O)N 7a_100000210810_100000744528 [0,1,1,0,0,0|1,0,0]=3 10679 B17R0.43 CCCCCCCCCCCCOCCC(=O)N 7a_100000757172_100000759014 [0,1,1,0,0,0|1,0,0]=3 10680 B17R0.43 CCCCCCCCCCCCOCCC(C)O 34a_100000210810_100012276601 [0,1,1,0,0,0|1,0,1]=4 10681 B17R0.43 CCCCCCCCCCCCOCCC(C)O 7a_100000210810_100012276601 [0,1,1,0,0,0|1,0,1]=4 10682 B17R0.43 CCCCCCCCCCCCOCOC(=O)C 34a_100000210810_100009813279 [0,1,1,0,0,0|0,0,0]=2 10683 B17R0.43 CCCCCCCCCCCCOCOC(C)C 34a_100000210810_100000709892 [0,1,1,0,0,0|1,0,1]=4 10684 B17R0.43 CCCCCCCCCCCCSCCC(=O)C 1458a_100008107568_200000210301 [0,1,1,0,0,0|1,0,0]=3 10685 B17R0.43 CCCCCCCCCCCCSCCC(=O)C 62a_100000053229_100000759014 [0,1,1,0,0,0|1,0,0]=3 10686 B17R0.43 CCCCCCCCCCCCSCCC(=O)N 62a_100000744528_100000759014 [0,1,1,0,0,0|1,0,0]=3 10687 B17R0.43 CCCCCCCCCCCCSCCC(=O)[13CH3] 1458a_100008107568_200025704644 [0,1,1,0,0,0|1,0,0]=3 10688 B17R0.43 CCCCCCCCCCCCSCCC(C)O 62a_100012276601_100000759014 [0,1,1,0,0,0|1,0,1]=4 10689 B17R0.43 CCCCCCCCCCCCSCOC(=O)C 62a_100000076356_100000759014 [0,1,1,0,0,0|0,0,0]=2 10690 B17R0.43 CCCCCCCCCCCNCCC=C(C)C 2230a_200011215754_100011217483 [0,1,1,0,0,0|2,0,0]=4 10691 B17R0.43 CCCCCCCCCCCNCCC=C(C)C 34a_200011215754_100011217483 [0,1,1,0,0,0|2,0,0]=4 10692 B17R0.43 CCCCCCCCCCCNCCCC(=O)C 34a_200011215754_100000685027 [0,1,1,0,0,0|1,0,0]=3 10693 B17R0.43 CCCCCCCCCCCNCCCC(=O)N 34a_100000739312_100011215454 [0,1,1,0,0,0|1,0,0]=3 10694 B17R0.43 CCCCCCCCCCCNCCCC(=O)N 34a_200011215754_100102525003 [0,1,1,0,0,0|1,0,0]=3 10695 B17R0.43 CCCCCCCCCCCNCCCC(C)O 2230a_200011215754_200000718107 [0,1,1,0,0,0|1,0,1]=4 10696 B17R0.43 CCCCCCCCCCCNCCCC(C)O 34a_200011215754_200000718107 [0,1,1,0,0,0|1,0,1]=4 10697 B17R0.43 CCCCCCCCCCCNCCCS(=O)C 2230a_200000753449_100011215454 [0,1,1,0,0,0|2,0,0]=4 10698 B17R0.43 CCCCCCCCCCCNCCNC(=O)C 2230a_100000209853_100011215454 [0,1,1,0,0,0|1,0,0]=3 10699 B17R0.43 CCCCCCCCCCCNCCNC(=O)C 2230a_200011215754_100000189650 [0,1,1,0,0,0|1,0,0]=3 10700 B17R0.43 CCCCCCCCCCCNCCNC(=O)N 2230a_200011215754_200000034859 [0,1,1,0,0,0|2,0,0]=4 10701 B17R0.43 CCCCCCCCCCCNCCNC(=O)N 34a_100020590234_100011215454 [0,1,1,0,0,0|2,0,0]=4 10702 B17R0.43 CCCCCCCCCCCNCCOC(=O)C 34a_200011215754_100009814007 [0,1,1,0,0,0|0,0,0]=2 10703 B17R0.43 CCCCCCCCCCCNCCOC(=O)N 34a_200011215754_200011214921 [0,1,1,0,0,0|1,0,0]=3 10704 B17R0.43 CCCCCCCCCCCNCCOC(C)C 2230a_100000701111_100011215454 [0,1,1,0,0,0|1,0,1]=4 10705 B17R0.43 CCCCCCCCCCCNCCOC(C)C 2230a_200011215754_100000211751 [0,1,1,0,0,0|1,0,1]=4 10706 B17R0.43 CCCCCCCCCCCNCCOC(C)C 34a_100000701111_100011215454 [0,1,1,0,0,0|1,0,1]=4 10707 B17R0.43 CCCCCCCCCCCNCCOC(C)C 34a_200011215754_100000211751 [0,1,1,0,0,0|1,0,1]=4 10708 B17R0.43 CCCCCCCCCCCOCCC=C(C)C 34a_100000210809_100011217483 [0,1,1,0,0,0|2,0,0]=4 10709 B17R0.43 CCCCCCCCCCCOCCC=C(C)C 7a_100000210809_100011217483 [0,1,1,0,0,0|2,0,0]=4 10710 B17R0.43 CCCCCCCCCCCOCCCC(=O)C 34a_100000210809_100000685027 [0,1,1,0,0,0|1,0,0]=3 10711 B17R0.43 CCCCCCCCCCCOCCCC(=O)C 34a_100000759063_100011215454 [0,1,1,0,0,0|1,0,0]=3 10712 B17R0.43 CCCCCCCCCCCOCCCC(=O)C 7a_100000210809_100011215641 [0,1,1,0,0,0|1,0,0]=3 10713 B17R0.43 CCCCCCCCCCCOCCCC(=O)C 7a_100000759063_100011215454 [0,1,1,0,0,0|1,0,0]=3 10714 B17R0.43 CCCCCCCCCCCOCCCC(=O)N 34a_100000210809_100102525003 [0,1,1,0,0,0|1,0,0]=3 10715 B17R0.43 CCCCCCCCCCCOCCCC(=O)N 7a_100000210809_100102525003 [0,1,1,0,0,0|1,0,0]=3 10716 B17R0.43 CCCCCCCCCCCOCCCC(C)O 34a_100000210809_200000718107 [0,1,1,0,0,0|1,0,1]=4 10717 B17R0.43 CCCCCCCCCCCOCCCC(C)O 7a_100000210809_200000718107 [0,1,1,0,0,0|1,0,1]=4 10718 B17R0.43 CCCCCCCCCCCOCCC[N+](=O)[O-] 34a_200000037920_100011215454 [0,1,1,0,0,0|1,0,1]=4 10719 B17R0.43 CCCCCCCCCCCOCCNC(=O)C 34a_100000158858_100011215454 [0,1,1,0,0,0|1,0,0]=3 10720 B17R0.43 CCCCCCCCCCCOCCNC(=O)C 7a_100000210809_100000189650 [0,1,1,0,0,0|1,0,0]=3 10721 B17R0.43 CCCCCCCCCCCOCCNC(=O)N 34a_100000181757_100011215454 [0,1,1,0,0,0|2,0,0]=4 10722 B17R0.43 CCCCCCCCCCCOCCNC(=O)N 7a_100000210809_200000034859 [0,1,1,0,0,0|2,0,0]=4 10723 B17R0.43 CCCCCCCCCCCOCCOC(=O)C 34a_100000210809_100009814007 [0,1,1,0,0,0|0,0,0]=2 10724 B17R0.43 CCCCCCCCCCCOCCOC(=O)C 7a_100000210809_100009814007 [0,1,1,0,0,0|0,0,0]=2 10725 B17R0.43 CCCCCCCCCCCOCCOC(=O)N 34a_100000210809_200011214921 [0,1,1,0,0,0|1,0,0]=3 10726 B17R0.43 CCCCCCCCCCCOCCOC(=O)N 7a_100000210809_200011214921 [0,1,1,0,0,0|1,0,0]=3 10727 B17R0.43 CCCCCCCCCCCOCCOC(=O)N 7a_100000766696_100011215454 [0,1,1,0,0,0|1,0,0]=3 10728 B17R0.43 CCCCCCCCCCCOCCOC(C)C 34a_100000210809_100000211751 [0,1,1,0,0,0|1,0,1]=4 10729 B17R0.43 CCCCCCCCCCCOCCOC(C)C 34a_100000211219_100011215454 [0,1,1,0,0,0|1,0,1]=4 10730 B17R0.43 CCCCCCCCCCCOCCOC(C)C 34a_100010166600_100000210206 [0,1,1,0,0,0|1,0,1]=4 10731 B17R0.43 CCCCCCCCCCCOCCOC(C)C 7a_100000210809_100000211751 [0,1,1,0,0,0|1,0,1]=4 10732 B17R0.43 CCCCCCCCCCCOCCOC(C)C 7a_100000211219_100011215454 [0,1,1,0,0,0|1,0,1]=4 10733 B17R0.43 CCCCCCCCCCCOCCOC(C)C 7a_100010166600_100000210206 [0,1,1,0,0,0|1,0,1]=4 10734 B17R0.43 CCCCCCCCCCCSCCCC(=O)C 62a_100011215641_100011215454 [0,1,1,0,0,0|1,0,0]=3 10735 B17R0.43 CCCCCCCCCCCSCCCC(=O)N 62a_100102525003_100011215454 [0,1,1,0,0,0|1,0,0]=3 10736 B17R0.43 CCCCCCCCCCCSCCCC(C)O 62a_200000718107_100011215454 [0,1,1,0,0,0|1,0,1]=4 10737 B17R0.43 CCCCCCCCCCCSCCNC(=O)C 62a_100000189650_100011215454 [0,1,1,0,0,0|1,0,0]=3 10738 B17R0.43 CCCCCCCCCCCSCCNC(=O)N 62a_200000034859_100011215454 [0,1,1,0,0,0|2,0,0]=4 10739 B17R0.43 CCCCCCCCCCCSCCOC(=O)C 62a_100009814007_100011215454 [0,1,1,0,0,0|0,0,0]=2 10740 B17R0.43 CCCCCCCCCCCSCCOC(=O)N 62a_200011214921_100011215454 [0,1,1,0,0,0|1,0,0]=3 10741 B17R0.43 CCCCCCCCCCCSCCOC(C)C 62a_100000211751_100011215454 [0,1,1,0,0,0|1,0,1]=4 10742 B17R0.43 CCCCCCCCCCNCCCCB(O)O 2230a_100000684558_200009817182 [0,1,1,0,0,0|1,0,1]=4 10743 B17R0.43 CCCCCCCCCCNCCCCB(O)O 34a_100000684558_200009817182 [0,1,1,0,0,0|1,0,1]=4 10744 B17R0.43 CCCCCCCCCCNCCCCC(=O)C 34a_100000684558_100009817362 [0,1,1,0,0,0|1,0,0]=3 10745 B17R0.43 CCCCCCCCCCNCCCCC(=O)N 34a_100000696515_100000210320 [0,1,1,0,0,0|1,0,0]=3 10746 B17R0.43 CCCCCCCCCCNCCCNC(=O)C 34a_100000736810_100000210320 [0,1,1,0,0,0|1,0,0]=3 10747 B17R0.43 CCCCCCCCCCNCCCOC(=O)C 34a_100000684558_100000042594 [0,1,1,0,0,0|0,0,0]=2 10748 B17R0.43 CCCCCCCCCCNCCCOC(=S)C 2230a_100000684558_200135323944 [0,1,1,0,0,0|0,1,0]=3 10749 B17R0.43 CCCCCCCCCCNCCCOC(=S)C 34a_100000684558_200135323944 [0,1,1,0,0,0|0,1,0]=3 10750 B17R0.43 CCCCCCCCCCNCCCOC(C)C 2230a_100000737246_100000210320 [0,1,1,0,0,0|1,0,1]=4 10751 B17R0.43 CCCCCCCCCCNCCCOC(C)C 34a_100000737246_100000210320 [0,1,1,0,0,0|1,0,1]=4 10752 B17R0.43 CCCCCCCCCCNCCCSC(=O)C 2230a_100000684558_100000038929 [0,1,1,0,0,0|0,1,0]=3 10753 B17R0.43 CCCCCCCCCCNCCCSC(=O)C 34a_100000684558_100000038929 [0,1,1,0,0,0|0,1,0]=3 10754 B17R0.43 CCCCCCCCCCNCCOCC(=O)N 2230a_100000684558_100000076697 [0,1,1,0,0,0|2,0,0]=4 10755 B17R0.43 CCCCCCCCCCNCCOCC(=O)N 34a_100000684558_100000076697 [0,1,1,0,0,0|2,0,0]=4 10756 B17R0.43 CCCCCCCCCCNCCOCC(=O)O 269956a_100000700818_100000210320 [0,1,1,0,0,0|1,0,0]=3 10757 B17R0.43 CCCCCCCCCCOCCCCB(O)O 34a_100000210711_200009817182 [0,1,1,0,0,0|1,0,1]=4 10758 B17R0.43 CCCCCCCCCCOCCCCB(O)O 7a_100000210711_200009817182 [0,1,1,0,0,0|1,0,1]=4 10759 B17R0.43 CCCCCCCCCCOCCCCC(=O)C 34a_100000210711_100009817362 [0,1,1,0,0,0|1,0,0]=3 10760 B17R0.43 CCCCCCCCCCOCCCCC(=O)C 7a_100000210711_100000735457 [0,1,1,0,0,0|1,0,0]=3 10761 B17R0.43 CCCCCCCCCCOCCCCC(=O)N 34a_100012022536_100000210320 [0,1,1,0,0,0|1,0,0]=3 10762 B17R0.43 CCCCCCCCCCOCCCCC(=O)N 7a_100012022536_100000210320 [0,1,1,0,0,0|1,0,0]=3 10763 B17R0.43 CCCCCCCCCCOCCCC[N+](=O)[O-] 34a_200015379883_100000210320 [0,1,1,0,0,0|1,0,1]=4 10764 B17R0.43 CCCCCCCCCCOCCCC[N+](=O)[O-] 7a_200015379883_100000210320 [0,1,1,0,0,0|1,0,1]=4 10765 B17R0.43 CCCCCCCCCCOCCCNC(=O)C 34a_100000752032_100000210320 [0,1,1,0,0,0|1,0,0]=3 10766 B17R0.43 CCCCCCCCCCOCCCOC(=O)C 34a_100000210711_100000042594 [0,1,1,0,0,0|0,0,0]=2 10767 B17R0.43 CCCCCCCCCCOCCCOC(=O)C 7a_100000210711_100000042594 [0,1,1,0,0,0|0,0,0]=2 10768 B17R0.43 CCCCCCCCCCOCCCOC(=S)C 34a_100000210711_200135323944 [0,1,1,0,0,0|0,1,0]=3 10769 B17R0.43 CCCCCCCCCCOCCCOC(=S)C 7a_100000210711_200135323944 [0,1,1,0,0,0|0,1,0]=3 10770 B17R0.43 CCCCCCCCCCOCCCSC(=O)C 34a_100000210711_100000038929 [0,1,1,0,0,0|0,1,0]=3 10771 B17R0.43 CCCCCCCCCCOCCCSC(=O)C 7a_100000210711_100000038929 [0,1,1,0,0,0|0,1,0]=3 10772 B17R0.43 CCCCCCCCCCOCCOCC(=O)N 34a_100000210711_100000076697 [0,1,1,0,0,0|2,0,0]=4 10773 B17R0.43 CCCCCCCCCCOCCOCC(=O)N 7a_100000210711_100000076697 [0,1,1,0,0,0|2,0,0]=4 10774 B17R0.43 CCCCCCCCCCSCCCCB(O)O 62a_200009817182_100000210320 [0,1,1,0,0,0|1,0,1]=4 10775 B17R0.43 CCCCCCCCCCSCCCCC(=O)C 62a_100000735457_100000210320 [0,1,1,0,0,0|1,0,0]=3 10776 B17R0.43 CCCCCCCCCCSCCCOC(=O)C 62a_100000042594_100000210320 [0,1,1,0,0,0|0,0,0]=2 10777 B17R0.43 CCCCCCCCCCSCCCOC(=S)C 62a_200135323944_100000210320 [0,1,1,0,0,0|0,1,0]=3 10778 B17R0.43 CCCCCCCCCCSCCCSC(=O)C 62a_100000038929_100000210320 [0,1,1,0,0,0|0,1,0]=3 10779 B17R0.43 CCCCCCCCCCSCCOCC(=O)N 34a_100011628728_100000187820 [0,1,1,0,0,0|2,0,0]=4 10780 B17R0.43 CCCCCCCCCCSCCOCC(=O)N 62a_100000076697_100000210320 [0,1,1,0,0,0|2,0,0]=4 10781 B17R0.43 CCCCCCCCCCSCCOCC(=O)N 7a_100011628728_100000187820 [0,1,1,0,0,0|2,0,0]=4 10782 B17R0.43 CCCCCCCCCCSCCOCC(=O)[O-] 34a_100011628728_100020667443 [0,1,1,0,0,0|1,0,1]=4 10783 B17R0.43 CCCCCCCCCNCCCCCB(O)O 2230a_100000212291_200009817188 [0,1,1,0,0,0|1,0,1]=4 10784 B17R0.43 CCCCCCCCCNCCCCCB(O)O 34a_100000212291_200009817188 [0,1,1,0,0,0|1,0,1]=4 10785 B17R0.43 CCCCCCCCCNCCCCCC(=O)N 2230a_100000212291_100009817443 [0,1,1,0,0,0|1,0,0]=3 10786 B17R0.43 CCCCCCCCCNCCCCCC(=O)N 34a_100000212291_100009817443 [0,1,1,0,0,0|1,0,0]=3 10787 B17R0.43 CCCCCCCCCNCCCCNC(=O)C 2230a_200011368371_100011214924 [0,1,1,0,0,0|1,0,0]=3 10788 B17R0.43 CCCCCCCCCNCCCCNC(=O)C 34a_200011368371_100011214924 [0,1,1,0,0,0|1,0,0]=3 10789 B17R0.43 CCCCCCCCCNCCCCOC(=O)C 34a_100000212291_100000033659 [0,1,1,0,0,0|0,0,0]=2 10790 B17R0.43 CCCCCCCCCNCCCCO[N+](=O)[O-] 34a_100000212291_100015694321 [0,1,1,0,0,0|2,0,0]=4 10791 B17R0.43 CCCCCCCCCNCCCCSC(=O)C 2230a_100000212291_200010402107 [0,1,1,0,0,0|0,1,0]=3 10792 B17R0.43 CCCCCCCCCNCCCCSC(=O)C 34a_100000212291_200010402107 [0,1,1,0,0,0|0,1,0]=3 10793 B17R0.43 CCCCCCCCCNCOCCOC(=O)C 34a_100000212291_100000076355 [0,1,1,0,0,0|1,0,0]=3 10794 B17R0.43 CCCCCCCCCOCCCCCB(O)O 34a_100000210712_200009817188 [0,1,1,0,0,0|1,0,1]=4 10795 B17R0.43 CCCCCCCCCOCCCCCB(O)O 7a_100000210712_200009817188 [0,1,1,0,0,0|1,0,1]=4 10796 B17R0.43 CCCCCCCCCOCCCCCC(=O)N 34a_100000123541_100011214924 [0,1,1,0,0,0|1,0,0]=3 10797 B17R0.43 CCCCCCCCCOCCCCCC(=O)N 34a_100000210712_100009817443 [0,1,1,0,0,0|1,0,0]=3 10798 B17R0.43 CCCCCCCCCOCCCCCC(=O)N 7a_100000123541_100000210328 [0,1,1,0,0,0|1,0,0]=3 10799 B17R0.43 CCCCCCCCCOCCCCCC(=O)N 7a_100000210712_100009817443 [0,1,1,0,0,0|1,0,0]=3 10800 B17R0.43 CCCCCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210328 [0,1,1,0,0,0|0,0,1]=3 10801 B17R0.43 CCCCCCCCCOCCCCOC(=O)C 34a_100000073216_100011214924 [0,1,1,0,0,0|0,0,0]=2 10802 B17R0.43 CCCCCCCCCOCCCCOC(=O)C 34a_100000210712_100000033659 [0,1,1,0,0,0|0,0,0]=2 10803 B17R0.43 CCCCCCCCCOCCCCOC(=O)C 7a_100000073216_100000210328 [0,1,1,0,0,0|0,0,0]=2 10804 B17R0.43 CCCCCCCCCOCCCCOC(=O)C 7a_100000210712_100000033659 [0,1,1,0,0,0|0,0,0]=2 10805 B17R0.43 CCCCCCCCCOCCCCO[N+](=O)[O-] 34a_100000210712_100015694321 [0,1,1,0,0,0|2,0,0]=4 10806 B17R0.43 CCCCCCCCCOCCCCO[N+](=O)[O-] 7a_100000210712_100015694321 [0,1,1,0,0,0|2,0,0]=4 10807 B17R0.43 CCCCCCCCCOCCCCSC(=O)C 34a_100000210712_200010402107 [0,1,1,0,0,0|0,1,0]=3 10808 B17R0.43 CCCCCCCCCOCCCCSC(=O)C 7a_100000210712_200010402107 [0,1,1,0,0,0|0,1,0]=3 10809 B17R0.43 CCCCCCCCCOCOCCOC(=O)C 34a_100000210712_100000076355 [0,1,1,0,0,0|1,0,0]=3 10810 B17R0.43 CCCCCCCCCSCCCCCB(O)O 62a_200009817188_100000210670 [0,1,1,0,0,0|1,0,1]=4 10811 B17R0.43 CCCCCCCCCSCCCCCC(=O)N 62a_100009817443_100000210670 [0,1,1,0,0,0|1,0,0]=3 10812 B17R0.43 CCCCCCCCCSCCCCOC(=O)C 62a_100000033659_100000210670 [0,1,1,0,0,0|0,0,0]=2 10813 B17R0.43 CCCCCCCCCSCCCCSC(=O)C 62a_200010402107_100000210670 [0,1,1,0,0,0|0,1,0]=3 10814 B17R0.43 CCCCCCCCCSCOCCOC(=O)C 62a_100000076355_100000210670 [0,1,1,0,0,0|1,0,0]=3 10815 B17R0.43 CCCCCCCCNCCCCCCB(O)O 2230a_100000229939_100009817187 [0,1,1,0,0,0|1,0,1]=4 10816 B17R0.43 CCCCCCCCNCCCCCCB(O)O 34a_100000229939_100009817187 [0,1,1,0,0,0|1,0,1]=4 10817 B17R0.43 CCCCCCCCNCCCCCNC(=O)C 2230a_200012022750_100000210759 [0,1,1,0,0,0|1,0,0]=3 10818 B17R0.43 CCCCCCCCNCCCCCNC(=O)C 34a_200012022750_100000210759 [0,1,1,0,0,0|1,0,0]=3 10819 B17R0.43 CCCCCCCCNCCCCCOC(=O)C 2230a_100000229939_100009813381 [0,1,1,0,0,0|0,0,0]=2 10820 B17R0.43 CCCCCCCCNCCCCCOC(=O)C 34a_100000229939_100000033007 [0,1,1,0,0,0|0,0,0]=2 10821 B17R0.43 CCCCCCCCNCCOCCOC(=O)C 2230a_100000229939_200000083610 [0,1,1,0,0,0|1,0,0]=3 10822 B17R0.43 CCCCCCCCNCCOCCOC(=O)C 34a_100000229939_200000083610 [0,1,1,0,0,0|1,0,0]=3 10823 B17R0.43 CCCCCCCCOCCCCCCB(O)O 34a_100000210232_100009817187 [0,1,1,0,0,0|1,0,1]=4 10824 B17R0.43 CCCCCCCCOCCCCCCB(O)O 7a_100000210232_100009817187 [0,1,1,0,0,0|1,0,1]=4 10825 B17R0.43 CCCCCCCCOCCCCCOC(=O)C 34a_100000210232_100000033007 [0,1,1,0,0,0|0,0,0]=2 10826 B17R0.43 CCCCCCCCOCCCCCOC(=O)C 7a_100000210232_100000033007 [0,1,1,0,0,0|0,0,0]=2 10827 B17R0.43 CCCCCCCCOCCOCCOC(=O)C 34a_100000210232_200000083610 [0,1,1,0,0,0|1,0,0]=3 10828 B17R0.43 CCCCCCCCOCCOCCOC(=O)C 7a_100000210232_200000083610 [0,1,1,0,0,0|1,0,0]=3 10829 B17R0.43 CCCCCCCCSCCCCCCB(O)O 62a_100000210759_100009817187 [0,1,1,0,0,0|1,0,1]=4 10830 B17R0.43 CCCCCCCCSCCCCCCB(O)O 62a_100009817187_100000210317 [0,1,1,0,0,0|1,0,1]=4 10831 B17R0.43 CCCCCCCCSCCCCCOC(=O)C 62a_100000033007_100000210317 [0,1,1,0,0,0|0,0,0]=2 10832 B17R0.43 CCCCCCCCSCCCCCOC(=O)C 62a_100000210759_100000033007 [0,1,1,0,0,0|0,0,0]=2 10833 B17R0.43 CCCCCCCCSCCOCCOC(=O)C 62a_100000210759_200000083610 [0,1,1,0,0,0|1,0,0]=3 10834 B17R0.43 CCCCCCCCSCCOCCOC(=O)C 62a_200000083610_100000210317 [0,1,1,0,0,0|1,0,0]=3 10835 B17R0.43 CCCCCCCNCCCCCCNC(=O)C 2230a_200011996284_100000210681 [0,1,1,0,0,0|1,0,0]=3 10836 B17R0.43 CCCCCCCNCCCCCCNC(=O)C 34a_200011996284_100000210614 [0,1,1,0,0,0|1,0,0]=3 10837 B17R0.43 CCCCCCCNCCOCCOCC(=O)O 269956a_100009854275_100000210614 [0,1,1,0,0,0|2,0,0]=4 10838 B17R0.43 CCCCCCOCCOCCCCCC(=O)N 34a_100000691444_100009817443 [0,1,1,0,0,0|2,0,0]=4 10839 B17R0.43 CCCCCCOCCOCCCCCC(=O)N 7a_100000691444_100009817443 [0,1,1,0,0,0|2,0,0]=4 10840 B17R0.43 CCCCCCOCCOCCCCOC(=O)C 34a_100000691444_100000033659 [0,1,1,0,0,0|1,0,0]=3 10841 B17R0.43 CCCCCCOCCOCCCCOC(=O)C 7a_100000691444_100000033659 [0,1,1,0,0,0|1,0,0]=3 10842 B17R0.43 CCCCCCOCCOCCCCSC(=O)C 34a_100000691444_200010402107 [0,1,1,0,0,0|1,1,0]=4 10843 B17R0.43 CCCCCCOCCOCCCCSC(=O)C 7a_100000691444_200010402107 [0,1,1,0,0,0|1,1,0]=4 10844 B17R0.43 CCCCCCOCCOCCOCOC(=O)C 34a_100000032842_100009813279 [0,1,1,0,0,0|2,0,0]=4 10845 B17R0.43 CCCCCCOCCOCOCCOC(=O)C 34a_100000691444_100000076355 [0,1,1,0,0,0|2,0,0]=4 10846 B17R0.43 CCCCCNCCOCCCCCOC(=O)C 34a_100000224656_100000033007 [0,1,1,0,0,0|1,0,0]=3 10847 B17R0.43 CCCCCNCCOCCOCCOC(=O)C 34a_100000224656_200000083610 [0,1,1,0,0,0|2,0,0]=4 10848 B17R0.43 CCCCCOCCOCCCCCOC(=O)C 34a_100011215259_100000033007 [0,1,1,0,0,0|1,0,0]=3 10849 B17R0.43 CCCCCOCCOCCCCCOC(=O)C 7a_100011215259_100000033007 [0,1,1,0,0,0|1,0,0]=3 10850 B17R0.43 CCCCCOCCOCCOCCOC(=O)C 34a_100011215259_200000083610 [0,1,1,0,0,0|2,0,0]=4 10851 B17R0.43 CCCCCOCCOCCOCCOC(=O)C 7a_100011215259_200000083610 [0,1,1,0,0,0|2,0,0]=4 10852 B17R0.43 CCCCNCCCCCCCCCCC(=O)N 2230a_100000102301_200010167045 [0,1,1,0,0,0|1,0,0]=3 10853 B17R0.43 CCCCNCCCCCCCCCCC(=O)N 7a_106832991798_200010167045 [0,1,1,0,0,0|1,0,0]=3 10854 B17R0.43 CCCCNCCCCOCCCCCC(=O)N 34a_200011216965_100009817443 [0,1,1,0,0,0|2,0,0]=4 10855 B17R0.43 CCCCNCCCCOCCCCOC(=O)C 34a_200011216965_100000033659 [0,1,1,0,0,0|1,0,0]=3 10856 B17R0.43 CCCCNCCCCOCCCCSC(=O)C 34a_200011216965_200010402107 [0,1,1,0,0,0|1,1,0]=4 10857 B17R0.43 CCCCNCCCCOCOCCOC(=O)C 34a_200011216965_100000076355 [0,1,1,0,0,0|2,0,0]=4 10858 B17R0.43 CCCCOCCCCCCCCCCC(=O)N 34a_100000210227_200010167045 [0,1,1,0,0,0|1,0,0]=3 10859 B17R0.43 CCCCOCCCCCCCCCCC(=O)N 7a_100000210227_200010167045 [0,1,1,0,0,0|1,0,0]=3 10860 B17R0.43 CCCCOCCCCOCCCCCC(=O)N 34a_200000760531_100009817443 [0,1,1,0,0,0|2,0,0]=4 10861 B17R0.43 CCCCOCCCCOCCCCCC(=O)N 7a_200000760531_100009817443 [0,1,1,0,0,0|2,0,0]=4 10862 B17R0.43 CCCCOCCCCOCCCCOC(=O)C 34a_200000760531_100000033659 [0,1,1,0,0,0|1,0,0]=3 10863 B17R0.43 CCCCOCCCCOCCCCOC(=O)C 7a_200000760531_100000033659 [0,1,1,0,0,0|1,0,0]=3 10864 B17R0.43 CCCCOCCCCOCCCCSC(=O)C 34a_200000760531_200010402107 [0,1,1,0,0,0|1,1,0]=4 10865 B17R0.43 CCCCOCCCCOCCCCSC(=O)C 7a_200000760531_200010402107 [0,1,1,0,0,0|1,1,0]=4 10866 B17R0.43 CCCCOCCCCOCOCCOC(=O)C 34a_200000760531_100000076355 [0,1,1,0,0,0|2,0,0]=4 10867 B17R0.43 CCCCOCCCNCCCCCOC(=O)C 2230a_200000211371_100009813381 [0,1,1,0,0,0|1,0,0]=3 10868 B17R0.43 CCCCOCCCNCCCCCOC(=O)C 34a_200000211371_100000033007 [0,1,1,0,0,0|1,0,0]=3 10869 B17R0.43 CCCCOCCCNCCOCCOC(=O)C 2230a_200000211371_200000083610 [0,1,1,0,0,0|2,0,0]=4 10870 B17R0.43 CCCCOCCCNCCOCCOC(=O)C 34a_200000211371_200000083610 [0,1,1,0,0,0|2,0,0]=4 10871 B17R0.43 CCCCOCCCOCCCCCOC(=O)C 34a_200011215613_100000033007 [0,1,1,0,0,0|1,0,0]=3 10872 B17R0.43 CCCCOCCCOCCCCCOC(=O)C 7a_200011215613_100000033007 [0,1,1,0,0,0|1,0,0]=3 10873 B17R0.43 CCCCOCCCOCCOCCOC(=O)C 34a_200011215613_200000083610 [0,1,1,0,0,0|2,0,0]=4 10874 B17R0.43 CCCCOCCCOCCOCCOC(=O)C 7a_200011215613_200000083610 [0,1,1,0,0,0|2,0,0]=4 10875 B17R0.43 CCCCOCCNCCCCCCNC(=O)C 2230a_200011996284_100000743108 [0,1,1,0,0,0|2,0,0]=4 10876 B17R0.43 CCCCOCCNCCCCCCNC(=O)C 34a_200011996284_100000743108 [0,1,1,0,0,0|2,0,0]=4 10877 B17R0.43 CCCCOCCOCCOCCCOC(=O)C 34a_100011215186_100000042594 [0,1,1,0,0,0|2,0,0]=4 10878 B17R0.43 CCCCOCCOCCOCCCOC(=O)C 7a_100011215186_100000042594 [0,1,1,0,0,0|2,0,0]=4 10879 B17R0.43 CCCCSCCCCCCCCCCC(=O)N 62a_100000210211_200010167045 [0,1,1,0,0,0|1,0,0]=3 10880 B17R0.43 CCCCSCCCCCCCCCCC(=O)N 62a_200010167045_100000210210 [0,1,1,0,0,0|1,0,0]=3 10881 B17R0.43 CCCOCCOCCNCCCCOC(=O)C 34a_200011904461_100000033659 [0,1,1,0,0,0|2,0,0]=4 10882 B17R0.43 CCNCCCCCCCCCCCSC(=O)C 2230a_100015525214_100010140907 [0,1,1,0,0,0|0,1,0]=3 10883 B17R0.43 CCOCCCCCCCCCCCSC(=O)C 34a_100121572206_100010140907 [0,1,1,0,0,0|0,1,0]=3 10884 B17R0.43 CCOCCCCCCCCCOCCC(=O)C 7a_100009875440_100000053229 [0,1,1,0,0,0|2,0,0]=4 10885 B17R0.43 CCOCCCCCCCCCOCCC(=O)N 34a_100009875440_100000731001 [0,1,1,0,0,0|2,0,0]=4 10886 B17R0.43 CCOCCCCCCCCCOCCC(=O)N 7a_100009875440_100000744528 [0,1,1,0,0,0|2,0,0]=4 10887 B17R0.43 CCOCCCCCCCCCOCOC(=O)C 34a_100009875440_100009813279 [0,1,1,0,0,0|1,0,0]=3 10888 B17R0.43 CCOCCOCCNCCCCCOC(=O)C 2230a_100102712874_100009813381 [0,1,1,0,0,0|2,0,0]=4 10889 B17R0.43 CCOCCOCCNCCCCCOC(=O)C 34a_100102712874_100000033007 [0,1,1,0,0,0|2,0,0]=4 10890 B17R0.43 CCOCCOCCOCCCCCOC(=O)C 34a_100000210240_100000033007 [0,1,1,0,0,0|2,0,0]=4 10891 B17R0.43 CCOCCOCCOCCCCCOC(=O)C 7a_100000210240_100000033007 [0,1,1,0,0,0|2,0,0]=4 10892 B17R0.43 CCOCCOCCSCCCCCOC(=O)C 62a_100000033007_100011211534 [0,1,1,0,0,0|2,0,0]=4 10893 B17R0.43 CCOCCOCCSCCCCCOC(=O)C 62a_100011211534_100000033007 [0,1,1,0,0,0|2,0,0]=4 10894 B17R0.43 CCOCSCCCCCCCCCCC(=O)N 62a_100000739092_200010167045 [0,1,1,0,0,0|2,0,0]=4 10895 B17R0.43 CCOCSCCCCCCCCCCC(=O)N 62a_200010167045_100000739092 [0,1,1,0,0,0|2,0,0]=4 10896 B17R0.43 CCSCCCCCCCCCCCSC(=O)C 62a_100000210202_100010140907 [0,1,1,0,0,0|0,1,0]=3 10897 B17R0.43 CCSCCCCCCCCCCCSC(=O)C 62a_100010140907_100000210202 [0,1,1,0,0,0|0,1,0]=3 10898 B17R0.43 COCCCCCCNCCCCCNC(=O)C 2230a_200012022750_100011998445 [0,1,1,0,0,0|2,0,0]=4 10899 B17R0.43 COCCCCCCNCCCCCNC(=O)C 34a_200012022750_100011998445 [0,1,1,0,0,0|2,0,0]=4 10900 B17R0.43 COCCCCCCOCCCCCOC(=O)C 34a_200012092642_100000033007 [0,1,1,0,0,0|1,0,0]=3 10901 B17R0.43 COCCCCCCOCCCCCOC(=O)C 7a_200012092642_100000033007 [0,1,1,0,0,0|1,0,0]=3 10902 B17R0.43 COCCCCCCOCCOCCOC(=O)C 34a_200012092642_200000083610 [0,1,1,0,0,0|2,0,0]=4 10903 B17R0.43 COCCCCCCOCCOCCOC(=O)C 7a_200012092642_200000083610 [0,1,1,0,0,0|2,0,0]=4 10904 B17R0.43 COCCCCCCSCCCCCOC(=O)C 62a_100000033007_100011998445 [0,1,1,0,0,0|1,0,0]=3 10905 B17R0.43 COCCCCCCSCCCCCOC(=O)C 62a_100011998445_100000033007 [0,1,1,0,0,0|1,0,0]=3 10906 B17R0.43 COCCCCCCSCCOCCOC(=O)C 62a_100011998445_200000083610 [0,1,1,0,0,0|2,0,0]=4 10907 B17R0.43 COCCCCCCSCCOCCOC(=O)C 62a_200000083610_100011998445 [0,1,1,0,0,0|2,0,0]=4 10908 B17R0.43 COCCCOCCCOCCCCOC(=O)C 34a_200011215475_100000033659 [0,1,1,0,0,0|2,0,0]=4 10909 B17R0.43 COCCCOCCCOCCCCOC(=O)C 7a_200011215475_100000033659 [0,1,1,0,0,0|2,0,0]=4 10910 B17R0.43 COCCNCCCCCCCCCCC(=O)N 2230a_100000209980_200010167045 [0,1,1,0,0,0|2,0,0]=4 10911 B17R0.43 COCCOCCCCCCCCCCC(=O)N 34a_100000210237_200010167045 [0,1,1,0,0,0|2,0,0]=4 10912 B17R0.43 COCCOCCCNCCCCCOC(=O)C 2230a_100000206027_100009813381 [0,1,1,0,0,0|2,0,0]=4 10913 B17R0.43 COCCOCCCNCCCCCOC(=O)C 34a_100000206027_100000033007 [0,1,1,0,0,0|2,0,0]=4 10914 B17R0.43 COCCOCCCSCCCCCOC(=O)C 62a_100000033007_100011216529 [0,1,1,0,0,0|2,0,0]=4 10915 B17R0.43 COCCOCCCSCCCCCOC(=O)C 62a_100011216529_100000033007 [0,1,1,0,0,0|2,0,0]=4 10916 B17R0.43 COCCSCCCCCCCCCCC(=O)N 62a_100000233755_200010167045 [0,1,1,0,0,0|2,0,0]=4 10917 B17R0.43 COCCSCCCCCCCCCCC(=O)N 62a_200010167045_100000233755 [0,1,1,0,0,0|2,0,0]=4 10918 B17R0.43 CSCCNCCCCCCCCCCC(=O)N 2230a_100020590264_200010167045 [0,1,1,0,0,0|2,0,0]=4 10919 B17R0.43 CSCCOCCCCCCCCCCC(=O)N 34a_100000230434_200010167045 [0,1,1,0,0,0|2,0,0]=4 10920 B17R0.43 CSCCOCCCCCCCCCCC(=O)N 7a_100000230434_200010167045 [0,1,1,0,0,0|2,0,0]=4 10921 B17R0.43 CSCCSCCCCCCCCCCC(=O)N 62a_100000212216_200010167045 [0,1,1,0,0,0|2,0,0]=4 10922 B17R0.43 CSCCSCCCCCCCCCCC(=O)N 62a_200010167045_100000751147 [0,1,1,0,0,0|2,0,0]=4 10923 B17R0.43 NC(=O)CCCCCCCCCCNCCCF 2230a_100015189416_200010167045 [0,1,1,0,0,0|2,0,0]=4 10924 B17R0.43 NC(=O)CCCCCCCCCCNCCCF 34a_100015189416_200010167045 [0,1,1,0,0,0|2,0,0]=4 10925 B17R0.43 NC(=O)CCCCCCCCCCOCCCBr 34a_100011217188_200010167045 [0,1,1,0,0,0|2,0,0]=4 10926 B17R0.43 NC(=O)CCCCCCCCCCOCCCCl 34a_100000230001_200010167045 [0,1,1,0,0,0|2,0,0]=4 10927 B17R0.43 NC(=O)CCCCCCCCCCOCCCF 34a_100000759539_200010167045 [0,1,1,0,0,0|2,0,0]=4 10928 B17R0.43 NC(=O)CCCCCCCCCCSCCCF 62a_100011934791_200010167045 [0,1,1,0,0,0|2,0,0]=4 10929 B17R0.43 NC(=O)CCCCCCCCCCSCCCF 62a_200010167045_100011934791 [0,1,1,0,0,0|2,0,0]=4 10930 B17R0.43 NC(=O)CCCCCCCCCCSCCCO 62a_100011215043_200010167045 [0,1,1,0,0,0|2,0,0]=4 10931 B17R0.43 NC(=O)CCCCCCCCCCSCCCO 62a_200010167045_100011215043 [0,1,1,0,0,0|2,0,0]=4 10932 B17R0.43 NC(=O)CCCCCNCCCCCCCCO 2230a_102515433106_100009817443 [0,1,1,0,0,0|2,0,0]=4 10933 B17R0.43 NC(=O)CCCCCNCCCCCCCCO 34a_102515433106_100009817443 [0,1,1,0,0,0|2,0,0]=4 10934 B17R0.43 NC(=O)CCCCCOCCCCCCCCBr 34a_100009813846_100009817443 [0,1,1,0,0,0|2,0,0]=4 10935 B17R0.43 NC(=O)CCCCCOCCCCCCCCBr 7a_100009813846_100009817443 [0,1,1,0,0,0|2,0,0]=4 10936 B17R0.43 NC(=O)CCCCCOCCCCCCCCCl 34a_100000033203_100009817443 [0,1,1,0,0,0|2,0,0]=4 10937 B17R0.43 NC(=O)CCCCCOCCCCCCCCCl 7a_100000033203_100009817443 [0,1,1,0,0,0|2,0,0]=4 10938 B17R0.43 NC(=O)CCCCCOCCCCCCCCO 34a_100000123541_100000033203 [0,1,1,0,0,0|2,0,0]=4 10939 B17R0.43 NC(=O)CCCCCOCCCCCCCCO 7a_100000123541_100000033203 [0,1,1,0,0,0|2,0,0]=4 10940 B17R0.43 NC(=O)CCCCCSCCCCCCCCO 62a_100000033203_100009817443 [0,1,1,0,0,0|2,0,0]=4 10941 B17R0.43 NC(=O)CCCCCSCCCCCCCCO 62a_100009817443_100000033203 [0,1,1,0,0,0|2,0,0]=4 10942 B17R0.43 NC(=O)CCCCNCCCCCCCCCO 34a_100000696515_100009813782 [0,1,1,0,0,0|2,0,0]=4 10943 B17R0.43 NC(=O)CCCCOCCCCCCCCCO 34a_100012022536_100009813782 [0,1,1,0,0,0|2,0,0]=4 10944 B17R0.43 NC(=O)CCCCOCCCCCCCCCO 7a_100012022536_100009813782 [0,1,1,0,0,0|2,0,0]=4 10945 B17R0.43 NC(=O)CCCNCCCCCCCCCCO 34a_100000066964_100102525003 [0,1,1,0,0,0|2,0,0]=4 10946 B17R0.43 NC(=O)CCCNCCCCCCCCCCO 34a_100000739312_100009813290 [0,1,1,0,0,0|2,0,0]=4 10947 B17R0.43 NC(=O)CCCOCCCCCCCCCCBr 34a_100009813290_100102525003 [0,1,1,0,0,0|2,0,0]=4 10948 B17R0.43 NC(=O)CCCOCCCCCCCCCCBr 7a_100009813290_100102525003 [0,1,1,0,0,0|2,0,0]=4 10949 B17R0.43 NC(=O)CCCOCCCCCCCCCCCl 34a_200000033068_100102525003 [0,1,1,0,0,0|2,0,0]=4 10950 B17R0.43 NC(=O)CCCOCCCCCCCCCCCl 7a_200000033068_100102525003 [0,1,1,0,0,0|2,0,0]=4 10951 B17R0.43 NC(=O)CCCSCCCCCCCCCCO 62a_100009813290_100102525003 [0,1,1,0,0,0|2,0,0]=4 10952 B17R0.43 NC(=O)CCCSCCCCCCCCCCO 62a_100102525003_200000033068 [0,1,1,0,0,0|2,0,0]=4 10953 B17R0.43 NC(=O)CCOCCCCCCCCCCCBr 34a_100009812471_100000731001 [0,1,1,0,0,0|2,0,0]=4 10954 B17R0.43 NC(=O)CCOCCCCCCCCCCCBr 7a_100009812471_100000744528 [0,1,1,0,0,0|2,0,0]=4 10955 B17R0.43 NC(=O)CCOCCCCCCCCCCCO 34a_100000757172_100009812471 [0,1,1,0,0,0|2,0,0]=4 10956 B17R0.43 NC(=O)CCOCCCCCCCCCCCO 7a_100000757172_100009812471 [0,1,1,0,0,0|2,0,0]=4 10957 B17R0.43 NC(=O)CCSCCCCCCCCCCCO 62a_100009812471_100000744528 [0,1,1,0,0,0|2,0,0]=4 10958 B17R0.43 NC(=O)CNCCCCCCCCCCCCO 2230a_100000066677_100000747473 [0,1,1,0,0,0|2,0,0]=4 10959 B17R0.43 NC(=O)CNCCCCCCCCCCCCO 2230a_100000711301_100009813331 [0,1,1,0,0,0|2,0,0]=4 10960 B17R0.43 NC(=O)CNCCCCCCCCCCCCO 34a_100000066677_100000187820 [0,1,1,0,0,0|2,0,0]=4 10961 B17R0.43 NC(=O)COCCCCCCCCCCCCBr 34a_100009813331_100000187820 [0,1,1,0,0,0|2,0,0]=4 10962 B17R0.43 NC(=O)COCCCCCCCCCCCCBr 7a_100009813331_100000187820 [0,1,1,0,0,0|2,0,0]=4 10963 B17R0.43 NC(=O)CSCCCCCCCCCCCCO 62a_100009813331_100000747473 [0,1,1,0,0,0|2,0,0]=4 10964 B17R0.43 NC(=O)OCCNCCCCCCCCCCO 34a_100000066964_200011214921 [0,1,1,0,0,0|2,0,0]=4 10965 B17R0.43 NC(=O)OCCOCCCCCCCCCCBr 34a_100009813290_200011214921 [0,1,1,0,0,0|2,0,0]=4 10966 B17R0.43 NC(=O)OCCOCCCCCCCCCCBr 7a_100009813290_200011214921 [0,1,1,0,0,0|2,0,0]=4 10967 B17R0.43 NC(=O)OCCOCCCCCCCCCCCl 34a_200000033068_200011214921 [0,1,1,0,0,0|2,0,0]=4 10968 B17R0.43 NC(=O)OCCOCCCCCCCCCCCl 7a_200000033068_200011214921 [0,1,1,0,0,0|2,0,0]=4 10969 B17R0.43 NC(=O)OCCOCCCCCCCCCCO 7a_100000766696_100009813290 [0,1,1,0,0,0|2,0,0]=4 10970 B17R0.43 NC(=O)OCCSCCCCCCCCCCO 62a_100009813290_200011214921 [0,1,1,0,0,0|2,0,0]=4 10971 B17R0.43 NC(=O)OCCSCCCCCCCCCCO 62a_200011214921_200000033068 [0,1,1,0,0,0|2,0,0]=4 10972 B17R0.43 NCCCCCCCCCCCCOCC(=O)N 34a_100000066677_100000187820 [0,1,1,0,0,0|2,0,0]=4 10973 B17R0.43 NCCCCCCCCCCCCOCC(=O)[O-] 34a_100000066677_100020667443 [0,1,1,0,0,0|1,0,1]=4 10974 B17R0.43 NCCCCCCCCCCOCCCC(=O)N 34a_100000066964_100102525003 [0,1,1,0,0,0|2,0,0]=4 10975 B17R0.43 NCCCCCCCCCCOCCOC(=O)N 34a_100000066964_200011214921 [0,1,1,0,0,0|2,0,0]=4 10976 B17R0.43 NCCCCCCCCOCCCCCC(=O)N 34a_102515433106_100009817443 [0,1,1,0,0,0|2,0,0]=4 10977 B17R0.43 NCCCOCCCCCCCCCCC(=O)N 34a_100000182051_200010167045 [0,1,1,0,0,0|2,0,0]=4 10978 B17R0.43 O=C(O)CNCCCCCCCCCCCCO 269956a_100016091260_100009813331 [0,1,1,0,0,0|1,0,0]=3 10979 B17R0.43 O=C(O)CNCCCCCCOCCCCCO 269956a_100016091260_200132310570 [0,1,1,0,0,0|2,0,0]=4 10980 B17R0.43 O=C(O)COCCNCCCCCCCCCO 269956a_100000700818_100009813782 [0,1,1,0,0,0|2,0,0]=4 10981 B17R0.43 O=C(O)CONCCCCCCCCCCCO 269956a_100000106656_100009812471 [0,1,1,0,0,0|2,0,0]=4 10982 B17R0.43 O=C([O-])CCCCCOCCCCCCCCO 7a_100102619762_100000033203 [0,1,1,0,0,0|1,0,1]=4 10983 B17R0.43 O=C([O-])CNCCCCCCCCCCCCO 34a_100000066677_100020667443 [0,1,1,0,0,0|1,0,1]=4 10984 B17R0.43 O=C([O-])COCCCCCCCCCCCCBr 34a_100009813331_100020667443 [0,1,1,0,0,0|1,0,1]=4 10985 B17R0.43 O=C([O-])CSCCCCCCCCCCCCO 62a_100009813331_100020667443 [0,1,1,0,0,0|1,0,1]=4 10986 B17R0.139 CCCCCCC(C)CCOCCCCC(=O)C 34a_200011024964_100009817362 [0,1,1,0,0,0|2,0,0]=4 10987 B17R0.139 CCCCCCC(C)CCOCCCCC(=O)C 7a_200011024964_100000735457 [0,1,1,0,0,0|2,0,0]=4 10988 B17R0.139 CCCCCCC(C)CCOCCCOC(=O)C 34a_200011024964_100000042594 [0,1,1,0,0,0|1,0,0]=3 10989 B17R0.139 CCCCCCC(C)CCOCCCOC(=O)C 7a_200011024964_100000042594 [0,1,1,0,0,0|1,0,0]=3 10990 B17R0.139 CCCCCCC(C)CCOCCCOC(=S)C 34a_200011024964_200135323944 [0,1,1,0,0,0|1,1,0]=4 10991 B17R0.139 CCCCCCC(C)CCOCCCOC(=S)C 7a_200011024964_200135323944 [0,1,1,0,0,0|1,1,0]=4 10992 B17R0.139 CCCCCCC(C)CCOCCCSC(=O)C 34a_200011024964_100000038929 [0,1,1,0,0,0|1,1,0]=4 10993 B17R0.139 CCCCCCC(C)CCOCCCSC(=O)C 7a_200011024964_100000038929 [0,1,1,0,0,0|1,1,0]=4 10994 B17R0.139 CCCCCCC(C)NCCCCCNC(=O)C 2230a_200012022750_100011215978 [0,1,1,0,0,0|2,0,0]=4 10995 B17R0.139 CCCCCCC(C)NCCCCCNC(=O)C 270004a_200012022750_100000210826 [0,1,1,0,0,0|2,0,0]=4 10996 B17R0.139 CCCCCCC(C)NCCCCCNC(=O)C 34a_200012022750_100011215978 [0,1,1,0,0,0|2,0,0]=4 10997 B17R0.139 CCCCCCC(C)NCCCCCOC(=O)C 2230a_100000210919_100009813381 [0,1,1,0,0,0|1,0,0]=3 10998 B17R0.139 CCCCCCC(C)NCCCCCOC(=O)C 34a_100000210919_100000033007 [0,1,1,0,0,0|1,0,0]=3 10999 B17R0.139 CCCCCCC(C)NCCOCCOC(=O)C 2230a_100000210919_200000083610 [0,1,1,0,0,0|2,0,0]=4 11000 B17R0.139 CCCCCCC(C)NCCOCCOC(=O)C 34a_100000210919_200000083610 [0,1,1,0,0,0|2,0,0]=4 11001 B17R0.139 CCCCCCC(C)OCCCCCOC(=O)C 34a_100000210265_100000033007 [0,1,1,0,0,0|1,0,0]=3 11002 B17R0.139 CCCCCCC(C)OCCCCCOC(=O)C 7a_100000210265_100000033007 [0,1,1,0,0,0|1,0,0]=3 11003 B17R0.139 CCCCCCC(C)OCCOCCOC(=O)C 34a_100000210265_200000083610 [0,1,1,0,0,0|2,0,0]=4 11004 B17R0.139 CCCCCCC(C)OCCOCCOC(=O)C 7a_100000210265_200000083610 [0,1,1,0,0,0|2,0,0]=4 11005 B17R0.139 CCCCCCC(C)SCCCCCOC(=O)C 62a_100000033007_100011215978 [0,1,1,0,0,0|1,0,0]=3 11006 B17R0.139 CCCCCCC(C)SCCCCCOC(=O)C 62a_100011215978_100000033007 [0,1,1,0,0,0|1,0,0]=3 11007 B17R0.139 CCCCCCC(C)SCCOCCOC(=O)C 62a_100011215978_200000083610 [0,1,1,0,0,0|2,0,0]=4 11008 B17R0.139 CCCCCCC(C)SCCOCCOC(=O)C 62a_200000083610_100011215978 [0,1,1,0,0,0|2,0,0]=4 11009 B17R0.139 CCCCOCC(C)OCCCCCOC(=O)C 34a_100011217071_100000033007 [0,1,1,0,0,0|2,0,0]=4 11010 B17R0.139 CCCCOCC(C)OCCCCCOC(=O)C 7a_100011217071_100000033007 [0,1,1,0,0,0|2,0,0]=4 11011 B17R0.170 CCCCC(C)CCCCOCCCCC(=O)C 34a_200011021034_100009817362 [0,1,1,0,0,0|2,0,0]=4 11012 B17R0.170 CCCCC(C)CCCCOCCCCC(=O)C 7a_200011021034_100000735457 [0,1,1,0,0,0|2,0,0]=4 11013 B17R0.170 CCCCC(C)CCCCOCCCOC(=O)C 34a_200011021034_100000042594 [0,1,1,0,0,0|1,0,0]=3 11014 B17R0.170 CCCCC(C)CCCCOCCCOC(=O)C 7a_200011021034_100000042594 [0,1,1,0,0,0|1,0,0]=3 11015 B17R0.170 CCCCC(C)CCCCOCCCOC(=S)C 34a_200011021034_200135323944 [0,1,1,0,0,0|1,1,0]=4 11016 B17R0.170 CCCCC(C)CCCCOCCCOC(=S)C 7a_200011021034_200135323944 [0,1,1,0,0,0|1,1,0]=4 11017 B17R0.170 CCCCC(C)CCCCOCCCSC(=O)C 34a_200011021034_100000038929 [0,1,1,0,0,0|1,1,0]=4 11018 B17R0.170 CCCCC(C)CCCCOCCCSC(=O)C 7a_200011021034_100000038929 [0,1,1,0,0,0|1,1,0]=4 11019 B17R0.192 CC(=O)OCC(=O)CCCCCCCCCCO 1458a_100000183556_100009813290 [0,1,1,0,0,0|1,0,1]=4 11020 B17R0.192 CC(=O)OCC(C)NCCCCCCCCCO 270004a_100000078944_100000000629 [0,1,1,0,0,0|2,0,0]=4 11021 B17R0.192 CC(=O)OCC(O)CNCCCCCCCCO 34a_102515433106_200000139349 [0,1,1,0,0,0|2,0,0]=4 11022 B17R0.192 CC(=O)OCC(O)COCCCCCCCCBr 34a_100009813846_200000139349 [0,1,1,0,0,0|2,0,0]=4 11023 B17R0.192 CC(=O)OCC(O)COCCCCCCCCBr 7a_100009813846_200000139349 [0,1,1,0,0,0|2,0,0]=4 11024 B17R0.192 CC(=O)OCC(O)COCCCCCCCCCl 34a_100000033203_200000139349 [0,1,1,0,0,0|2,0,0]=4 11025 B17R0.192 CC(=O)OCC(O)COCCCCCCCCCl 7a_100000033203_200000139349 [0,1,1,0,0,0|2,0,0]=4 11026 B17R0.192 CC(=O)OCC(O)COCCCCCCCCN 34a_102515433106_200000139349 [0,1,1,0,0,0|2,0,0]=4 11027 B17R0.192 CC(=O)OCC(O)CSCCCCCCCCO 62a_100000033203_200000139349 [0,1,1,0,0,0|2,0,0]=4 11028 B17R0.192 CC(=O)OCC(O)CSCCCCCCCCO 62a_200000139349_100000033203 [0,1,1,0,0,0|2,0,0]=4 11029 B17R0.192 CCCCCCCCCCCC(=O)CCC(=O)N 1458a_100011215257_100011215454 [0,1,1,0,0,0|1,0,1]=4 11030 B17R0.192 CCCCCCCCCCCC(=O)CNC(=O)C 1458a_100000194580_100011215454 [0,1,1,0,0,0|1,0,1]=4 11031 B17R0.192 CCCCCCCCCCCC(=O)COC(=O)C 1458a_100000183556_100011215454 [0,1,1,0,0,0|0,0,1]=3 11032 B17R0.192 CCCCCCCCCCCC(=O)CSC(=O)C 1458a_100000049016_100011215454 [0,1,1,0,0,0|0,1,1]=4 11033 B17R0.192 CCCCCCCCCCCC(C)OCC(=O)N 34a_100011217895_100000187820 [0,1,1,0,0,0|2,0,0]=4 11034 B17R0.192 CCCCCCCCCCCC(C)OCC(=O)N 7a_100011217895_100000187820 [0,1,1,0,0,0|2,0,0]=4 11035 B17R0.192 CCCCCCCCCCCC(C)OCC(=O)[O-] 34a_100011217895_100020667443 [0,1,1,0,0,0|1,0,1]=4 11036 B17R0.192 CCCCCCCCCCCN(C)CCC(=O)N 2230a_100000730477_100011215454 [0,1,1,0,0,0|2,0,0]=4 11037 B17R0.192 CCCCCCCCCCNC(=O)COC(=O)C 1626a_100000684558_100000183556 [0,1,1,0,0,0|1,0,1]=4 11038 B17R0.192 CCCCCCCCCCNC(=O)COC(=O)C 240690a_100000684558_100000183556 [0,1,1,0,0,0|1,0,1]=4 11039 B17R0.192 CCCCCCCCCCNC(=O)COC(=O)C 527a_100000684558_100000183556 [0,1,1,0,0,0|1,0,1]=4 11040 B17R0.192 CCCCCCCCCCNC(C)COC(=O)C 270004a_100000684558_100000000629 [0,1,1,0,0,0|1,0,0]=3 11041 B17R0.192 CCCCCCCCCNCC(=O)COC(=O)C 34a_100000212291_100000036994 [0,1,1,0,0,0|1,0,1]=4 11042 B17R0.192 CCCCCCCCCNCC(C)CSC(=O)C 2230a_100000212291_200000116872 [0,1,1,0,0,0|1,1,0]=4 11043 B17R0.192 CCCCCCCCCNCC(C)CSC(=O)C 34a_100000212291_200000116872 [0,1,1,0,0,0|1,1,0]=4 11044 B17R0.192 CCCCCCCCCNCC(O)COC(=O)C 34a_100000212291_200000139349 [0,1,1,0,0,0|1,0,0]=3 11045 B17R0.192 CCCCCCCCCOCC(=O)COC(=O)C 34a_100000210712_100000036994 [0,1,1,0,0,0|1,0,1]=4 11046 B17R0.192 CCCCCCCCCOCC(C)CSC(=O)C 34a_100000210712_200000116872 [0,1,1,0,0,0|1,1,0]=4 11047 B17R0.192 CCCCCCCCCOCC(C)CSC(=O)C 7a_100000210712_200000116872 [0,1,1,0,0,0|1,1,0]=4 11048 B17R0.192 CCCCCCCCCOCC(O)COC(=O)C 34a_100000210712_200000139349 [0,1,1,0,0,0|1,0,0]=3 11049 B17R0.192 CCCCCCCCCOCC(O)COC(=O)C 7a_100000210712_200000139349 [0,1,1,0,0,0|1,0,0]=3 11050 B17R0.192 CCCCCCCCCSCC(=O)COC(=O)C 62a_100000036994_100000210670 [0,1,1,0,0,0|1,0,1]=4 11051 B17R0.192 CCCCCCCCCSCC(C)CSC(=O)C 62a_200000116872_100000210670 [0,1,1,0,0,0|1,1,0]=4 11052 B17R0.192 CCCCCCCCCSCC(O)COC(=O)C 62a_200000139349_100000210670 [0,1,1,0,0,0|1,0,0]=3 11053 B17R0.192 CCCCCCOCCOCC(O)COC(=O)C 34a_100000691444_200000139349 [0,1,1,0,0,0|2,0,0]=4 11054 B17R0.192 CCCCCCOCCOCC(O)COC(=O)C 7a_100000691444_200000139349 [0,1,1,0,0,0|2,0,0]=4 11055 B17R0.192 CCCCNCCCCOCC(O)COC(=O)C 34a_200011216965_200000139349 [0,1,1,0,0,0|2,0,0]=4 11056 B17R0.192 CCCCOCCCCOCC(O)COC(=O)C 34a_200000760531_200000139349 [0,1,1,0,0,0|2,0,0]=4 11057 B17R0.192 CCCCOCCCCOCC(O)COC(=O)C 7a_200000760531_200000139349 [0,1,1,0,0,0|2,0,0]=4 11058 B17R0.197 CCCCCCCCCCCCCNS(=O)(=O)C 40a_100011215765_100000738038 [0,1,1,0,0,0|2,0,0]=4 11059 B17R0.197 CCCCCCCCCCNCCOS(=O)(=O)C 2230a_100000684558_200000036756 [0,1,1,0,0,0|2,0,0]=4 11060 B17R0.197 CCCCCCCCCCNCCOS(=O)(=O)C 34a_100000684558_200000036756 [0,1,1,0,0,0|2,0,0]=4 11061 B17R0.197 CCCCCCCCCCOCCOS(=O)(=O)C 34a_100000210711_200000036756 [0,1,1,0,0,0|2,0,0]=4 11062 B17R0.197 CCCCCCCCCCOCCOS(=O)(=O)C 7a_100000210711_200000036756 [0,1,1,0,0,0|2,0,0]=4 11063 B17R0.197 CCCCCCCCCCSCCOS(=O)(=O)C 62a_200000036756_100000210320 [0,1,1,0,0,0|2,0,0]=4 11064 B17R0.1713 CC(=O)CCCCCCCCCCCSC(=O)C 1458a_100000070787_100010140907 [0,1,1,0,0,0|0,1,1]=4 11065 B17R0.1713 CC(=O)CCCCOCCCCCCCC(C)C 34a_200000210741_100009817362 [0,1,1,0,0,0|2,0,0]=4 11066 B17R0.1713 CC(=O)CCCCOCCCCCCCC(C)C 7a_200000210741_100000735457 [0,1,1,0,0,0|2,0,0]=4 11067 B17R0.1713 CC(=O)NCCCCCCNCCCCC(C)C 2230a_200011996284_100011216152 [0,1,1,0,0,0|2,0,0]=4 11068 B17R0.1713 CC(=O)NCCCCCCNCCCCC(C)C 34a_200011996284_100011216152 [0,1,1,0,0,0|2,0,0]=4 11069 B17R0.1713 CC(=O)NCCCCCNCCCCCC(C)C 2230a_200012022750_100000210682 [0,1,1,0,0,0|2,0,0]=4 11070 B17R0.1713 CC(=O)NCCCCCNCCCCCC(C)C 34a_200012022750_100000210682 [0,1,1,0,0,0|2,0,0]=4 11071 B17R0.1713 CC(=O)OCCCCCNCCCCCC(C)C 2230a_100011290863_100009813381 [0,1,1,0,0,0|1,0,0]=3 11072 B17R0.1713 CC(=O)OCCCCCNCCCCCC(C)C 34a_100011290863_100000033007 [0,1,1,0,0,0|1,0,0]=3 11073 B17R0.1713 CC(=O)OCCCCCNCCCOCC(C)C 2230a_100000205972_100009813381 [0,1,1,0,0,0|2,0,0]=4 11074 B17R0.1713 CC(=O)OCCCCCNCCCOCC(C)C 34a_100000205972_100000033007 [0,1,1,0,0,0|2,0,0]=4 11075 B17R0.1713 CC(=O)OCCCCCOCCCCCC(C)C 34a_100011995859_100000033007 [0,1,1,0,0,0|1,0,0]=3 11076 B17R0.1713 CC(=O)OCCCCCOCCCCCC(C)C 7a_100011995859_100000033007 [0,1,1,0,0,0|1,0,0]=3 11077 B17R0.1713 CC(=O)OCCCCCOCCCCNC(C)C 34a_100011521146_100000033007 [0,1,1,0,0,0|2,0,0]=4 11078 B17R0.1713 CC(=O)OCCCCCSCCCCCC(C)C 62a_100000033007_100000210682 [0,1,1,0,0,0|1,0,0]=3 11079 B17R0.1713 CC(=O)OCCCCCSCCCCCC(C)C 62a_100000210682_100000033007 [0,1,1,0,0,0|1,0,0]=3 11080 B17R0.1713 CC(=O)OCCCCNCCCCCCC(C)C 34a_100000211014_100000033659 [0,1,1,0,0,0|1,0,0]=3 11081 B17R0.1713 CC(=O)OCCCCOCCCCCNC(C)C 34a_100011629493_100000033659 [0,1,1,0,0,0|2,0,0]=4 11082 B17R0.1713 CC(=O)OCCCOCCCCCCCC(C)C 34a_200000210741_100000042594 [0,1,1,0,0,0|1,0,0]=3 11083 B17R0.1713 CC(=O)OCCCOCCCCCCCC(C)C 7a_200000210741_100000042594 [0,1,1,0,0,0|1,0,0]=3 11084 B17R0.1713 CC(=O)OCCOCCNCCCCCC(C)C 2230a_100011290863_200000083610 [0,1,1,0,0,0|2,0,0]=4 11085 B17R0.1713 CC(=O)OCCOCCNCCCCCC(C)C 34a_100011290863_200000083610 [0,1,1,0,0,0|2,0,0]=4 11086 B17R0.1713 CC(=O)OCCOCCOCCCCCC(C)C 34a_100011995859_200000083610 [0,1,1,0,0,0|2,0,0]=4 11087 B17R0.1713 CC(=O)OCCOCCOCCCCCC(C)C 7a_100011995859_200000083610 [0,1,1,0,0,0|2,0,0]=4 11088 B17R0.1713 CC(=O)OCCOCCSCCCCCC(C)C 62a_100000210682_200000083610 [0,1,1,0,0,0|2,0,0]=4 11089 B17R0.1713 CC(=O)OCCOCCSCCCCCC(C)C 62a_200000083610_100000210682 [0,1,1,0,0,0|2,0,0]=4 11090 B17R0.1713 CC(=O)OCCOCNCCCCCCC(C)C 34a_100000211014_100000076355 [0,1,1,0,0,0|2,0,0]=4 11091 B17R0.1713 CC(=O)SCCCCCCCCCCCN(C)C 2230a_100102631434_100010140907 [0,1,1,0,0,0|1,1,0]=4 11092 B17R0.1713 CC(=O)SCCCCCCCCCCCN(C)C 269982a_100102631434_100010140907 [0,1,1,0,0,0|1,1,0]=4 11093 B17R0.1713 CC(=O)SCCCCNCCCCCCC(C)C 2230a_100000211014_200010402107 [0,1,1,0,0,0|1,1,0]=4 11094 B17R0.1713 CC(=O)SCCCCNCCCCCCC(C)C 34a_100000211014_200010402107 [0,1,1,0,0,0|1,1,0]=4 11095 B17R0.1713 CC(=O)SCCCOCCCCCCCC(C)C 34a_200000210741_100000038929 [0,1,1,0,0,0|1,1,0]=4 11096 B17R0.1713 CC(=O)SCCCOCCCCCCCC(C)C 7a_200000210741_100000038929 [0,1,1,0,0,0|1,1,0]=4 11097 B17R0.1713 CC(=S)OCCCOCCCCCCCC(C)C 34a_200000210741_200135323944 [0,1,1,0,0,0|1,1,0]=4 11098 B17R0.1713 CC(=S)OCCCOCCCCCCCC(C)C 7a_200000210741_200135323944 [0,1,1,0,0,0|1,1,0]=4 11099 B17R0.1713 CC(Br)COCCCCCCCCCCC(=O)N 34a_100012180447_200010167045 [0,1,1,0,0,0|2,0,0]=4 11100 B17R0.1713 CC(C)CCCCCCNCCCCCC(=O)N 2230a_100000211014_100009817443 [0,1,1,0,0,0|2,0,0]=4 11101 B17R0.1713 CC(C)CCCCCCNCCCCCC(=O)N 34a_100000211014_100009817443 [0,1,1,0,0,0|2,0,0]=4 11102 B17R0.1713 CC(C)CNCCCCCCCCCCC(=O)N 2230a_100000210953_200010167045 [0,1,1,0,0,0|2,0,0]=4 11103 B17R0.1713 CC(C)CNCCCCCCCCCCC(=O)N 34a_100000210953_200010167045 [0,1,1,0,0,0|2,0,0]=4 11104 B17R0.1713 CC(C)COCCCCCCCCCCC(=O)N 34a_100000210257_200010167045 [0,1,1,0,0,0|2,0,0]=4 11105 B17R0.1713 CC(C)CSCCCCCCCCCCC(=O)N 62a_100000210624_200010167045 [0,1,1,0,0,0|2,0,0]=4 11106 B17R0.1713 CC(C)CSCCCCCCCCCCC(=O)N 62a_200010167045_100000210760 [0,1,1,0,0,0|2,0,0]=4 11107 B17R0.1713 CC(F)COCCCCCCCCCCC(=O)N 34a_100015925927_200010167045 [0,1,1,0,0,0|2,0,0]=4 11108 B17R0.1713 CC(O)CNCCCCCCCCCCC(=O)N 2230a_100000210904_200010167045 [0,1,1,0,0,0|2,0,0]=4 11109 B17R0.1713 CC(O)CNCCCCCCCCCCC(=O)N 34a_100000210904_200010167045 [0,1,1,0,0,0|2,0,0]=4 11110 B17R0.1713 CC(O)CSCCCCCCCCCCC(=O)N 62a_100011218427_200010167045 [0,1,1,0,0,0|2,0,0]=4 11111 B17R0.1713 CC(O)CSCCCCCCCCCCC(=O)N 62a_200010167045_100011218427 [0,1,1,0,0,0|2,0,0]=4 11112 B17R0.1713 C[C@@H](Cl)COCCCCCCCCCCC(=O)N 34a_100016084084_200010167045 [0,1,1,0,0,0|2,0,0]=4 11113 B17R0.1713 C[C@@H](N)COCCCCCCCCCCC(=O)N 34a_100000737577_200010167045 [0,1,1,0,0,0|2,0,0]=4 11114 B17R0.1713 C[C@@H](O)CSCCCCCCCCCCC(=O)N 62a_100009817552_200010167045 [0,1,1,0,0,0|2,0,0]=4 11115 B17R0.1713 C[C@@H](O)CSCCCCCCCCCCC(=O)N 62a_200010167045_100009817552 [0,1,1,0,0,0|2,0,0]=4 11116 B17R0.8801 CCCCCCCCCC(=O)CCCCC(=O)C 1458a_100000210558_100000735457 [0,1,1,0,0,0|1,0,1]=4 11117 B17R0.8801 CCCCCCCCCC(=O)CCCNC(=O)C 1458a_100000194741_100000210670 [0,1,1,0,0,0|1,0,1]=4 11118 B17R0.8801 CCCCCCCCCC(=O)CCCOC(=O)C 1458a_100000210558_100000042594 [0,1,1,0,0,0|0,0,1]=3 11119 B17R0.8801 CCCCCCCCCC(=O)CCCOC(=S)C 1458a_100000210558_200135323944 [0,1,1,0,0,0|0,1,1]=4 11120 B17R0.8801 CCCCCCCCCC(=O)CCCSC(=O)C 1458a_100000210558_100000038929 [0,1,1,0,0,0|0,1,1]=4 11121 B17R0.8801 CCCCCCCCCC(=O)NCCOC(=O)C 11a_100000724843_100000210558 [0,1,1,0,0,0|1,0,1]=4 11122 B17R0.8801 CCCCCCCCCC(=O)NCCOC(=O)C 240690a_100000724843_100000210558 [0,1,1,0,0,0|1,0,1]=4 11123 B17R0.8801 CCCCCCCCCC(=O)NCCOC(=O)C 527a_100000724843_100000210558 [0,1,1,0,0,0|1,0,1]=4 11124 B17R0.8801 CCCCCCCCCC(C)OCCCC(=O)C 34a_100011218016_100000685027 [0,1,1,0,0,0|2,0,0]=4 11125 B17R0.8801 CCCCCCCCCC(C)OCCCC(=O)C 7a_100011218016_100011215641 [0,1,1,0,0,0|2,0,0]=4 11126 B17R0.8801 CCCCCCCCCC(C)OCCCC(=O)N 34a_100011218016_100102525003 [0,1,1,0,0,0|2,0,0]=4 11127 B17R0.8801 CCCCCCCCCC(C)OCCCC(=O)N 7a_100011218016_100102525003 [0,1,1,0,0,0|2,0,0]=4 11128 B17R0.8801 CCCCCCCCCC(C)OCCNC(=O)C 7a_100011218016_100000189650 [0,1,1,0,0,0|2,0,0]=4 11129 B17R0.8801 CCCCCCCCCC(C)OCCOC(=O)C 34a_100011218016_100009814007 [0,1,1,0,0,0|1,0,0]=3 11130 B17R0.8801 CCCCCCCCCC(C)OCCOC(=O)C 7a_100011218016_100009814007 [0,1,1,0,0,0|1,0,0]=3 11131 B17R0.8801 CCCCCCCCCC(C)OCCOC(=O)N 34a_100011218016_200011214921 [0,1,1,0,0,0|2,0,0]=4 11132 B17R0.8801 CCCCCCCCCC(C)OCCOC(=O)N 7a_100011218016_200011214921 [0,1,1,0,0,0|2,0,0]=4 11133 B17R0.8801 CCCCCCCCCN(C)CCCCC(=O)C 269982a_100000232482_100000735457 [0,1,1,0,0,0|2,0,0]=4 11134 B17R0.8801 CCCCCCCCCN(C)CCCOC(=O)C 269982a_100000232482_100000042594 [0,1,1,0,0,0|1,0,0]=3 11135 B17R0.8801 CCCCCCCCCN(C)CCCOC(=S)C 2230a_100000232482_200135323944 [0,1,1,0,0,0|1,1,0]=4 11136 B17R0.8801 CCCCCCCCCN(C)CCCOC(=S)C 269982a_100000232482_200135323944 [0,1,1,0,0,0|1,1,0]=4 11137 B17R0.8801 CCCCCCCCCN(C)CCCSC(=O)C 2230a_100000232482_100000038929 [0,1,1,0,0,0|1,1,0]=4 11138 B17R0.8801 CCCCCCCCCN(C)CCCSC(=O)C 269982a_100000232482_100000038929 [0,1,1,0,0,0|1,1,0]=4 11139 B17R0.117 C#CCCCCCCCCCCOCCCC=O 7a_100000054667_200011292268 [0,1,1,0,0,0|1,0,1]=4 11140 B17R0.117 C#CCCCCCCCCCCOCCCCO 34a_100000054667_100011216708 [0,1,1,0,0,0|1,0,1]=4 11141 B17R0.117 C#CCCCCCCCCCCOCCCCO 7a_100000054667_100000210776 [0,1,1,0,0,0|1,0,1]=4 11142 B17R0.117 C#CCCCCCCCCCOCCCCC=O 7a_100000034437_100000139335 [0,1,1,0,0,0|1,0,1]=4 11143 B17R0.117 C#CCCCCCCCCCOCCCCCO 34a_100000034437_100000746330 [0,1,1,0,0,0|1,0,1]=4 11144 B17R0.117 C#CCCCCCCCCCOCCCCCO 7a_100000034437_100000746330 [0,1,1,0,0,0|1,0,1]=4 11145 B17R0.117 C#CCCCCCCCCOCCCCCC=O 7a_100000065265_100000139337 [0,1,1,0,0,0|1,0,1]=4 11146 B17R0.117 C#CCCCCCCCCOCCCCCCO 34a_100000065265_100000766143 [0,1,1,0,0,0|1,0,1]=4 11147 B17R0.117 C#CCCCCCCCCOCCCCCCO 7a_100000065265_100000766143 [0,1,1,0,0,0|1,0,1]=4 11148 B17R0.117 C#CCCCCCCCNCCCCCCCO 2230a_100011996573_100153394163 [0,1,1,0,0,0|1,0,1]=4 11149 B17R0.117 C#CCCCCCCCNCCCCCCCO 34a_100011996573_100153394163 [0,1,1,0,0,0|1,0,1]=4 11150 B17R0.117 C#CCCCCCCCOCCCCCCCO 34a_100000054614_100000760002 [0,1,1,0,0,0|1,0,1]=4 11151 B17R0.117 C#CCCCCCCCOCCCCCCCO 7a_100000054614_100000760002 [0,1,1,0,0,0|1,0,1]=4 11152 B17R0.117 C#CCCCCCCCSCCCCCCCO 62a_100000760002_100153394163 [0,1,1,0,0,0|1,0,1]=4 11153 B17R0.117 C#CCCCCCCCSCCCCCCCO 62a_100153394163_100000760002 [0,1,1,0,0,0|1,0,1]=4 11154 B17R0.117 C#CCCCCCCNCCCCCCCCO 2230a_102515433106_100012276617 [0,1,1,0,0,0|1,0,1]=4 11155 B17R0.117 C#CCCCCCCNCCCCCCCCO 34a_102515433106_100012276617 [0,1,1,0,0,0|1,0,1]=4 11156 B17R0.117 C#CCCCCCCOCCCCCCCCO 34a_100011217361_100000033203 [0,1,1,0,0,0|1,0,1]=4 11157 B17R0.117 C#CCCCCCCOCCCCCCCCO 7a_100011217361_100000033203 [0,1,1,0,0,0|1,0,1]=4 11158 B17R0.117 C#CCCCCCCSCCCCCCCCO 62a_100000033203_100012276617 [0,1,1,0,0,0|1,0,1]=4 11159 B17R0.117 C#CCCCCCCSCCCCCCCCO 62a_100012276617_100000033203 [0,1,1,0,0,0|1,0,1]=4 11160 B17R0.117 C#CCCCCCNCCCCCCCCCO 2230a_100000078944_100012094781 [0,1,1,0,0,0|1,0,1]=4 11161 B17R0.117 C#CCCCCCNCCCCCCCCCO 34a_100000078944_100012094781 [0,1,1,0,0,0|1,0,1]=4 11162 B17R0.117 C#CCCCCCOCCCCCCCCCO 34a_100000766912_100009813782 [0,1,1,0,0,0|1,0,1]=4 11163 B17R0.117 C#CCCCCCOCCCCCCCCCO 7a_100000766912_100009813782 [0,1,1,0,0,0|1,0,1]=4 11164 B17R0.117 C#CCCCCCSCCCCCCCCCO 62a_100009813782_100012094781 [0,1,1,0,0,0|1,0,1]=4 11165 B17R0.117 C#CCCCCCSCCCCCCCCCO 62a_100012094781_100009813782 [0,1,1,0,0,0|1,0,1]=4 11166 B17R0.117 C#CCCCCNCCCCCCCCCCO 2230a_100000066964_100010269958 [0,1,1,0,0,0|1,0,1]=4 11167 B17R0.117 C#CCCCCNCCCCCCCCCCO 2230a_100000706060_100009813290 [0,1,1,0,0,0|1,0,1]=4 11168 B17R0.117 C#CCCCCNCCCCCCCCCCO 34a_100000066964_100010269958 [0,1,1,0,0,0|1,0,1]=4 11169 B17R0.117 C#CCCCCNCCCCCCCCCCO 34a_100000706060_100009813290 [0,1,1,0,0,0|1,0,1]=4 11170 B17R0.117 C#CCCCCOCCCCCCCCCCO 34a_100000766709_100009813290 [0,1,1,0,0,0|1,0,1]=4 11171 B17R0.117 C#CCCCCOCCCCCCCCCCO 7a_100000766709_100009813290 [0,1,1,0,0,0|1,0,1]=4 11172 B17R0.117 C#CCCCCSCCCCCCCCCCO 62a_100009813290_100010269958 [0,1,1,0,0,0|1,0,1]=4 11173 B17R0.117 C#CCCCCSCCCCCCCCCCO 62a_100010269958_200000033068 [0,1,1,0,0,0|1,0,1]=4 11174 B17R0.117 C#CCCCNCCCCCCCCCCCO 34a_100000718082_100009812471 [0,1,1,0,0,0|1,0,1]=4 11175 B17R0.117 C#CCCCOCCCCCCCCCCCO 34a_100000215630_100009812471 [0,1,1,0,0,0|1,0,1]=4 11176 B17R0.117 C#CCCCOCCCCCCCCCCCO 7a_100000215630_100009812471 [0,1,1,0,0,0|1,0,1]=4 11177 B17R0.117 C#CCCCSCCCCCCCCCCCO 62a_100009812471_100011215417 [0,1,1,0,0,0|1,0,1]=4 11178 B17R0.117 C#CCCNCCCCCCCCCCCCO 2230a_100000066677_100000688953 [0,1,1,0,0,0|1,0,1]=4 11179 B17R0.117 C#CCCNCCCCCCCCCCCCO 34a_100000066677_100000688953 [0,1,1,0,0,0|1,0,1]=4 11180 B17R0.117 C#CCCNCCCCCCCCCCCCO 34a_100000755551_100009813331 [0,1,1,0,0,0|1,0,1]=4 11181 B17R0.117 C#CCCOCCCCCCCCCCCCO 34a_100011215631_100009813331 [0,1,1,0,0,0|1,0,1]=4 11182 B17R0.117 C#CCCSCCCCCCCCCCCCO 62a_100009813331_100000688953 [0,1,1,0,0,0|1,0,1]=4 11183 B17R0.117 C#CCNCCCCCCCCCCCCCO 34a_100000212058_100009812470 [0,1,1,0,0,0|1,0,1]=4 11184 B17R0.117 C#CCOCCCCCCCCCCCCCC 34a_100000210247_100011215471 [0,1,1,0,0,0|1,0,1]=4 11185 B17R0.117 C#CCOCCCCCCCCCCCCCC 34a_100000210739_100000184674 [0,1,1,0,0,0|1,0,1]=4 11186 B17R0.117 C#CCOCCCCCCCCCCCCCC 7a_100000210739_100000038162 [0,1,1,0,0,0|1,0,1]=4 11187 B17R0.117 C#CCOCCCCCCCCCCCCCO 34a_100000210247_100009812470 [0,1,1,0,0,0|1,0,1]=4 11188 B17R0.117 C/C=C/CCOCCCCCCCCCCCC 34a_100016278192_100000759014 [0,1,1,0,0,0|2,0,0]=4 11189 B17R0.117 C/C=C/CCOCCCCCCCCCCCO 34a_100016278192_100009812471 [0,1,1,0,0,0|1,0,1]=4 11190 B17R0.117 C/C=C/CNCCCCCCCCCCCCC 34a_100011215765_100102629194 [0,1,1,0,0,0|2,0,0]=4 11191 B17R0.117 C/C=C/CNCCCCCCCCCCCCO 34a_100000066677_100102629194 [0,1,1,0,0,0|1,0,1]=4 11192 B17R0.117 C/C=C/COCCCCCCCCCCCCC 34a_100000185773_100102629194 [0,1,1,0,0,0|2,0,0]=4 11193 B17R0.117 C/C=C/COCCCCCCCCCCCCC 34a_100016270725_100000210684 [0,1,1,0,0,0|2,0,0]=4 11194 B17R0.117 C/C=C/COCCCCCCCCCCCCC 7a_100000185773_100102629194 [0,1,1,0,0,0|2,0,0]=4 11195 B17R0.117 C/C=C/COCCCCCCCCCCCCO 34a_100016270725_100009813331 [0,1,1,0,0,0|1,0,1]=4 11196 B17R0.117 C/C=C/CSCCCCCCCCCCCCO 62a_100009813331_100102629194 [0,1,1,0,0,0|1,0,1]=4 11197 B17R0.117 CC/C=C/CCCCCCCCCCOCC=O 34a_200025759790_200009817547 [0,1,1,0,0,0|0,0,2]=4 11198 B17R0.117 CC/C=C/CCCCCCCCCCOCC=O 7a_200025759790_200015260668 [0,1,1,0,0,0|0,0,2]=4 11199 B17R0.117 CC=CCCCOCCCCCCCCCCC 34a_100020645299_100011215454 [0,1,1,0,0,0|2,0,0]=4 11200 B17R0.117 CC=CCCCOCCCCCCCCCCO 34a_100020645299_100009813290 [0,1,1,0,0,0|1,0,1]=4 11201 B17R0.117 CC=CCNCCCCCCCCCCCCC 2230a_100011215765_100000070051 [0,1,1,0,0,0|2,0,0]=4 11202 B17R0.117 CC=CCNCCCCCCCCCCCCC 34a_100011215765_100000070051 [0,1,1,0,0,0|2,0,0]=4 11203 B17R0.117 CC=CCNCCCCCCCCCCCCO 2230a_100000066677_100000070051 [0,1,1,0,0,0|1,0,1]=4 11204 B17R0.117 CC=CCNCCCCCCCCCCCCO 34a_100000066677_100000070051 [0,1,1,0,0,0|1,0,1]=4 11205 B17R0.117 CC=CCOCCCCCCCCCCCCC 34a_100000185773_100000070051 [0,1,1,0,0,0|2,0,0]=4 11206 B17R0.117 CC=CCOCCCCCCCCCCCCC 7a_100000185773_100000070051 [0,1,1,0,0,0|2,0,0]=4 11207 B17R0.117 CC=CCSCCCCCCCCCCCCO 62a_100009813331_100000070051 [0,1,1,0,0,0|1,0,1]=4 11208 B17R0.117 CCCC/C=C\CCCCCCCCOCC=O 34a_100020587526_200009817547 [0,1,1,0,0,0|0,0,2]=4 11209 B17R0.117 CCCC/C=C\CCCCCCCCOCC=O 7a_100020587526_200015260668 [0,1,1,0,0,0|0,0,2]=4 11210 B17R0.117 CCCCCCCCCCCCCCOCC#N 7a_100000210739_100011215382 [0,1,1,0,0,0|1,0,1]=4 11211 B17R0.117 N#CCCCCCCNCCCCCCCCO 2230a_102515433106_100009813337 [0,1,1,0,0,0|1,0,1]=4 11212 B17R0.117 N#CCCCCCCSCCCCCCCCO 62a_100000033203_100009813337 [0,1,1,0,0,0|1,0,1]=4 11213 B17R0.117 N#CCCCCCCSCCCCCCCCO 62a_100009813337_100000033203 [0,1,1,0,0,0|1,0,1]=4 11214 B17R0.117 N#CCCCCCNCCCCCCCCCO 2230a_100000078944_100009813376 [0,1,1,0,0,0|1,0,1]=4 11215 B17R0.117 N#CCCCCCSCCCCCCCCCO 62a_100009813376_100009813782 [0,1,1,0,0,0|1,0,1]=4 11216 B17R0.117 N#CCCCCCSCCCCCCCCCO 62a_100009813782_100009813376 [0,1,1,0,0,0|1,0,1]=4 11217 B17R0.117 N#CCCCCNCCCCCCCCCCO 2230a_100000066964_100000211819 [0,1,1,0,0,0|1,0,1]=4 11218 B17R0.117 N#CCCCCSCCCCCCCCCCO 62a_100009813290_100000211819 [0,1,1,0,0,0|1,0,1]=4 11219 B17R0.117 N#CCCCCSCCCCCCCCCCO 62a_100011219923_200000033068 [0,1,1,0,0,0|1,0,1]=4 11220 B17R0.117 N#CCCCSCCCCCCCCCCCO 62a_100009812471_100000687738 [0,1,1,0,0,0|1,0,1]=4 11221 B17R0.117 N#CCCNCCCCCCCCCCCCO 2230a_100000066677_100011215226 [0,1,1,0,0,0|1,0,1]=4 11222 B17R0.117 N#CCCSCCCCCCCCCCCCO 62a_100009813331_100011215226 [0,1,1,0,0,0|1,0,1]=4 11223 B17R0.117 N#CCSCCCCCCCCCCCCCO 62a_100009812470_100011215382 [0,1,1,0,0,0|1,0,1]=4 11224 B17R0.6422 CCCCCCCCCCNS(=O)(=O)CCCC 270084a_100000684558_100000212082 [0,1,1,0,0,0|2,0,0]=4 11225 B17R0.6422 CCCCCCCCCCNS(=O)(=O)CCCC 274078a_100000684558_100000212082 [0,1,1,0,0,0|2,0,0]=4 11226 B17R0.6422 CCCCCCCCCCNS(=O)(=O)CCCC 40a_100000684558_100000054263 [0,1,1,0,0,0|2,0,0]=4 11227 B17R0.8052 CCCCC(C)CCCCOCC(=O)NCCC 34a_200011021034_100000183358 [0,1,1,0,0,0|2,0,0]=4 11228 B17R0.8052 CCCCC(C)CCCCOCC(=O)NCCC 7a_200011021034_100000183358 [0,1,1,0,0,0|2,0,0]=4 11229 B17R0.8052 CCCCC(C)CCCCOCC(=O)OCCC 34a_200011021034_200011215008 [0,1,1,0,0,0|1,0,0]=3 11230 B17R0.8052 CCCCC(C)CCCCOCC(=O)OCCC 7a_200011021034_200011215008 [0,1,1,0,0,0|1,0,0]=3 11231 B17R0.8625 CCCCCCC(C)CCOCC(=O)NCCC 34a_200011024964_100000183358 [0,1,1,0,0,0|2,0,0]=4 11232 B17R0.8625 CCCCCCC(C)CCOCC(=O)NCCC 7a_200011024964_100000183358 [0,1,1,0,0,0|2,0,0]=4 11233 B17R0.8625 CCCCCCC(C)CCOCC(=O)OCCC 34a_200011024964_200011215008 [0,1,1,0,0,0|1,0,0]=3 11234 B17R0.8625 CCCCCCC(C)CCOCC(=O)OCCC 7a_200011024964_200011215008 [0,1,1,0,0,0|1,0,0]=3 11235 B17R0.8625 CCCCCCC(C)NCCCC(=O)NCCC 2230a_100000210919_100011194427 [0,1,1,0,0,0|2,0,0]=4 11236 B17R0.8625 CCCCCCC(C)OCCCC(=O)NCCC 7a_100000210265_100011194427 [0,1,1,0,0,0|2,0,0]=4 11237 B17R0.8625 CCCCCCC(C)SCCCC(=O)NCCC 62a_100011194427_100011215978 [0,1,1,0,0,0|2,0,0]=4 11238 B17R0.8625 CCCCCCC(C)SCCCC(=O)NCCC 62a_100011215978_100011194427 [0,1,1,0,0,0|2,0,0]=4 11239 B17R0.13599 C#CC(CCCC)OCCCCCCCCCC 34a_200011217967_100000210320 [0,1,1,0,0,0|1,0,1]=4 11240 B17R0.13599 C#CC(CCCC)OCCCCCCCCCC 7a_200011217967_100000210320 [0,1,1,0,0,0|1,0,1]=4 11241 B17R0.13599 C=CC(CCCC)OCCCCCCCCCC 34a_200011215037_100000210320 [0,1,1,0,0,0|1,0,1]=4 11242 B17R0.13599 C=CC(CCCC)OCCCCCCCCCC 7a_200011215037_100000210320 [0,1,1,0,0,0|1,0,1]=4 11243 B17R0.14268 CCCCCCCCCC(=O)CC(=O)NCCC 1458a_100000210558_100000183358 [0,1,1,0,0,0|1,0,1]=4 11244 B17R0.14268 CCCCCCCCCC(=O)CC(=O)OCCC 1458a_100000210558_200011215008 [0,1,1,0,0,0|0,0,1]=3 11245 B17R0.14268 CCCCCCCCCC(O)CC(=O)NCCC 1626a_100020643023_200012339438 [0,1,1,0,0,0|1,0,0]=3 11246 B17R0.14268 CCCCCCCCCC(O)CC(=O)NCCC 240690a_100020643023_200012339438 [0,1,1,0,0,0|1,0,0]=3 11247 B17R0.14268 CCCCCCCCCC(O)CC(=O)NCCF 1626a_100000724931_200012339438 [0,1,1,0,0,0|2,0,0]=4 11248 B17R0.14268 CCCCCCCCCC(O)CC(=O)NCCF 240690a_100000724931_200012339438 [0,1,1,0,0,0|2,0,0]=4 11249 B17R0.14268 CCCCCCCCCC(O)CC(=O)NCCO 240690a_100000210304_200012339438 [0,1,1,0,0,0|2,0,0]=4 11250 B17R0.14268 CCCCCCCCCC(O)CC(=O)NNCC 22a_100000756455_200012339438 [0,1,1,0,0,0|2,0,0]=4 11251 B17R0.14268 CCCCCCCCCN(C)CC(=O)NCCC 2230a_100000232482_100000183358 [0,1,1,0,0,0|2,0,0]=4 11252 B17R0.14268 CCCCCCCCCN(C)CC(=O)NCCC 2230a_100000684209_100011214924 [0,1,1,0,0,0|2,0,0]=4 11253 B17R0.14268 CCCCCCCCCN(C)CC(=O)NCCC 269982a_100000232482_100000183358 [0,1,1,0,0,0|2,0,0]=4 11254 B17R0.14268 CCCCCCCCCN(C)CC(=O)NCCC 269982a_100000684209_100000210670 [0,1,1,0,0,0|2,0,0]=4 11255 B17R0.14268 CCCCCCCCCN(C)CC(=O)OCCC 2230a_100000232482_200011215008 [0,1,1,0,0,0|1,0,0]=3 11256 B17R0.14268 CCCCCCCCCN(C)CC(=O)OCCC 269982a_100000232482_200011215008 [0,1,1,0,0,0|1,0,0]=3 11257 B17R0.950 CCCCCCC(=O)CCC(=O)OCCCCO 1458a_200009914559_100000210757 [0,1,1,0,0,0|1,0,1]=4 11258 B17R0.950 CCCCCCC(C)NCC(=O)NCCCCC 2230a_100000210919_100000230301 [0,1,1,0,0,0|2,0,0]=4 11259 B17R0.950 CCCCCCC(C)NCC(=O)NCCCCC 34a_100000210919_100000230301 [0,1,1,0,0,0|2,0,0]=4 11260 B17R0.950 CCCCCCC(C)NCC(=O)OCCOCC 2230a_100000210919_200000101388 [0,1,1,0,0,0|2,0,0]=4 11261 B17R0.950 CCCCCCC(C)NCC(=O)OCCOCC 34a_100000210919_200000101388 [0,1,1,0,0,0|2,0,0]=4 11262 B17R0.950 CCCCCCC(C)OCC(=O)NCCCCC 34a_100000210265_100000230301 [0,1,1,0,0,0|2,0,0]=4 11263 B17R0.950 CCCCCCC(C)OCC(=O)NCCCCC 7a_100000210265_100000230301 [0,1,1,0,0,0|2,0,0]=4 11264 B17R0.950 CCCCCCC(C)OCC(=O)OCCOCC 34a_100000210265_200000101388 [0,1,1,0,0,0|2,0,0]=4 11265 B17R0.950 CCCCCCC(C)OCC(=O)OCCOCC 7a_100000210265_200000101388 [0,1,1,0,0,0|2,0,0]=4 11266 B17R0.950 CCCCCCC(C)SCC(=O)NCCCCC 62a_100000230301_100011215978 [0,1,1,0,0,0|2,0,0]=4 11267 B17R0.950 CCCCCCC(C)SCC(=O)NCCCCC 62a_100011215978_100000230301 [0,1,1,0,0,0|2,0,0]=4 11268 B17R0.950 CCCCCCC(C)SCC(=O)OCCOCC 62a_100011215978_200000101388 [0,1,1,0,0,0|2,0,0]=4 11269 B17R0.950 CCCCCCC(C)SCC(=O)OCCOCC 62a_200000101388_100011215978 [0,1,1,0,0,0|2,0,0]=4 11270 B17R0.8664 CCCCCCCCNS(=O)(=O)CCCCCC 270084a_100000229939_100011361803 [0,1,1,0,0,0|2,0,0]=4 11271 B17R0.8664 CCCCCCCCNS(=O)(=O)CCCCCC 274078a_100000229939_100011361803 [0,1,1,0,0,0|2,0,0]=4 11272 B17R0.12196 C=CC(CCCCCC)OCCCCCCCC 34a_200011215977_100000210759 [0,1,1,0,0,0|1,0,1]=4 11273 B17R0.12196 C=CC(CCCCCC)OCCCCCCCC 7a_200011215977_100000210759 [0,1,1,0,0,0|1,0,1]=4 11274 B17R1.27002 CNC1CCCCCCCCCCCCCC1 270004a_106832991635_100000040017 [0,1,0,0,1,0|1,0,1]=4 11275 B17R1.27002 COC1CCCCCCCCCCCCCC1 34a_200000037640_200000210301 [0,1,0,0,1,0|0,0,2]=4 11276 B17R1.27002 COC1CCCCCCCCCCCCCC1 7a_200000037640_200000210301 [0,1,0,0,1,0|0,0,2]=4 11277 B17R1.27002 [13CH3]OC1CCCCCCCCCCCCCC1 34a_200000037640_200025704644 [0,1,0,0,1,0|0,0,2]=4 11278 B17R1.27002 [13CH3]OC1CCCCCCCCCCCCCC1 7a_200000037640_200025704644 [0,1,0,0,1,0|0,0,2]=4 11279 B17R1.346 CCCC(=O)OCOC1CCCCC1CCC 34a_100011217265_100000034017 [0,0,1,1,0,0|1,0,0]=3 11280 B17R1.346 CCCC1CCCCC1NCCC(=O)NCC 269862a_100025743525_100011218038 [0,0,1,1,0,0|2,0,0]=4 11281 B17R1.346 CCCC1CCCCC1NCCC(=O)NCC 270004a_100025743525_100011218038 [0,0,1,1,0,0|2,0,0]=4 11282 B17R1.346 CCCC1CCCCC1OCCC(=O)NCC 7a_100011217265_100000737597 [0,0,1,1,0,0|2,0,0]=4 11283 B17R1.346 CCCC1CCCCC1OCCC(=O)OCC 34a_100011217265_100000765890 [0,0,1,1,0,0|1,0,0]=3 11284 B17R1.346 CCCC1CCCCC1OCCC(=O)OCC 7a_100011217265_100011206558 [0,0,1,1,0,0|1,0,0]=3 11285 B17R1.346 CCCC1CCCCN1CCCC(=O)OCC 2230a_100000701414_100009991533 [0,0,1,1,0,0|1,0,0]=3 11286 B17R1.346 CCCC1CCCCN1CCCC(=O)OCC 269982a_100000701414_100009991533 [0,0,1,1,0,0|1,0,0]=3 11287 B17R1.346 CCCC1CCCCN1CCCC(=O)OCC 34a_100000701414_100009991533 [0,0,1,1,0,0|1,0,0]=3 11288 B17R1.346 CCCC1CCCCN1CCNC(=O)OCC 269982a_100000701414_200011445536 [0,0,1,1,0,0|2,0,0]=4 11289 B17R1.346 CCCC1COCCN1CCCC(=O)OCC 2230a_102495339903_100009991533 [0,0,1,1,0,0|2,0,0]=4 11290 B17R1.346 CCCC1COCCN1CCCC(=O)OCC 269982a_102495339903_100009991533 [0,0,1,1,0,0|2,0,0]=4 11291 B17R1.346 CCCC1COCCN1CCCC(=O)OCC 34a_102495339903_100009991533 [0,0,1,1,0,0|2,0,0]=4 11292 B17R1.346 CCOC(=O)CCCN1CCCCC1CCO 2230a_100000211664_100009991533 [0,0,1,1,0,0|2,0,0]=4 11293 B17R1.346 CCOC(=O)CCCN1CCCCC1CCO 269982a_100000211664_100009991533 [0,0,1,1,0,0|2,0,0]=4 11294 B17R1.346 CCOC(=O)CCCN1CCCCC1CCO 34a_100000211664_100009991533 [0,0,1,1,0,0|2,0,0]=4 11295 B17R1.346 CCOC(=O)CCCN1CCCCC1COC 2230a_100015184032_100009991533 [0,0,1,1,0,0|2,0,0]=4 11296 B17R1.346 CCOC(=O)CCCN1CCCCC1COC 269982a_100015184032_100009991533 [0,0,1,1,0,0|2,0,0]=4 11297 B17R1.346 CCOC(=O)CCCN1CCCCC1COC 34a_100015184032_100009991533 [0,0,1,1,0,0|2,0,0]=4 11298 B17R1.359 CCCC(=O)OCOCC1CCCN1CCC 34a_200000694710_100000034017 [0,0,1,1,0,0|2,0,0]=4 11299 B17R1.359 CCCN1CCCC1COCCC(=O)OCC 34a_200000694710_100000765890 [0,0,1,1,0,0|2,0,0]=4 11300 B17R1.359 CCCN1CCCC1COCCC(=O)OCC 7a_200000694710_100011206558 [0,0,1,1,0,0|2,0,0]=4 11301 B17R1.359 CCOC(=O)CCCCN1CCC[C@H]1COC 2230a_100020646714_100000750268 [0,0,1,1,0,0|2,0,0]=4 11302 B17R1.359 CCOC(=O)CCCCN1CCC[C@H]1COC 269982a_100020646714_100000750268 [0,0,1,1,0,0|2,0,0]=4 11303 B17R1.359 CCOC(=O)CCCCN1CCC[C@H]1COC 34a_100020646714_100000750268 [0,0,1,1,0,0|2,0,0]=4 11304 B17R1.716 CCCCCCCCCCN1CCNC(=O)C1 2230a_100000184651_100000210320 [0,0,1,1,0,0|2,0,0]=4 11305 B17R1.716 CCCCCCCCCCN1CCOC(=O)C1 2230a_100000131268_100000210320 [0,0,1,1,0,0|1,0,0]=3 11306 B17R1.716 CCCCCCCCCNC1CCNC(=O)C1 2230a_100016994916_100011214924 [0,0,1,1,0,0|2,0,0]=4 11307 B17R1.716 CCCCCCCCCNC1CCNC(=O)C1 34a_100016994916_100011214924 [0,0,1,1,0,0|2,0,0]=4 11308 B17R1.716 CCCCCCCCCOC1CCCC(=O)C1 34a_100012613340_100011214924 [0,0,1,1,0,0|2,0,0]=4 11309 B17R1.716 CCCCCCCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100011214924 [0,0,1,1,0,0|2,0,0]=4 11310 B17R1.716 CCCCCCCCOCC1CCCC(=O)N1 34a_200000102386_100000210759 [0,0,1,1,0,0|2,0,0]=4 11311 B17R1.716 CCCCCCCCOCC1CCNC(=O)C1 34a_100009886756_100000210759 [0,0,1,1,0,0|2,0,0]=4 11312 B17R1.716 O=C1CN(CCO1)CCCCCCCCCO 2230a_100000131268_100009813782 [0,0,1,1,0,0|2,0,0]=4 11313 B17R1.915 CCCC(=O)OCNCCCOC1CCCC1 34a_100000747560_100000034017 [0,0,1,1,0,0|2,0,0]=4 11314 B17R1.915 CCOC(=O)CCCCCCCN1CCCC1 2230a_100000188435_100009991516 [0,0,1,1,0,0|1,0,0]=3 11315 B17R1.915 CCOC(=O)CCCCCCCN1CCCC1 269982a_100000188435_100009991516 [0,0,1,1,0,0|1,0,0]=3 11316 B17R1.915 CCOC(=O)CCCCCCCN1CCSC1 2230a_100011215254_100009991516 [0,0,1,1,0,0|2,0,0]=4 11317 B17R1.915 CCOC(=O)CCCCCCCN1CCSC1 269982a_100011215254_100009991516 [0,0,1,1,0,0|2,0,0]=4 11318 B17R1.915 CCOC(=O)CCCCCCNC1CCCC1 2230a_100000211070_100009814379 [0,0,1,1,0,0|1,0,0]=3 11319 B17R1.915 CCOC(=O)CCCCCCNC1CCCC1 34a_100000211070_100009814379 [0,0,1,1,0,0|1,0,0]=3 11320 B17R1.915 CCOC(=O)CCCCCCN[C@@H]1CCOC1 2230a_200015188469_100009814379 [0,0,1,1,0,0|2,0,0]=4 11321 B17R1.915 CCOC(=O)CCCCCCN[C@H]1CCOC1 2230a_100015188467_100009814379 [0,0,1,1,0,0|2,0,0]=4 11322 B17R1.915 CCOC(=O)CCCCCCN[C@H]1CCOC1 34a_100015188467_100009814379 [0,0,1,1,0,0|2,0,0]=4 11323 B17R1.915 CCOC(=O)CCCCCCOC1CCCC1 34a_100000210269_100009814379 [0,0,1,1,0,0|1,0,0]=3 11324 B17R1.915 CCOC(=O)CCCCCCOC1CCCC1 7a_100000210269_100009814379 [0,0,1,1,0,0|1,0,0]=3 11325 B17R1.915 CCOC(=O)CCCCCCOC1CCCO1 34a_100000085407_100009814379 [0,0,1,1,0,0|2,0,0]=4 11326 B17R1.915 CCOC(=O)CCCCCCOC1CCSC1 7a_100011232664_100009814379 [0,0,1,1,0,0|2,0,0]=4 11327 B17R1.915 CCOC(=O)CCCCCCO[C@H]1CCOC1 34a_100000717292_100009814379 [0,0,1,1,0,0|2,0,0]=4 11328 B17R1.915 CCOC(=O)CCCCCCSC1CCCC1 62a_100011217020_100009814379 [0,0,1,1,0,0|1,0,0]=3 11329 B17R1.915 CCOC(=O)CCCCCNCC1CCCC1 2230a_100000737975_100000755133 [0,0,1,1,0,0|1,0,0]=3 11330 B17R1.915 CCOC(=O)CCCCCNCC1CCCC1 34a_100000737975_100000755133 [0,0,1,1,0,0|1,0,0]=3 11331 B17R1.915 CCOC(=O)CCCCCNCC1CCOC1 2230a_100000737293_100000755133 [0,0,1,1,0,0|2,0,0]=4 11332 B17R1.915 CCOC(=O)CCCCCNCC1CCOC1 34a_100000737293_100000755133 [0,0,1,1,0,0|2,0,0]=4 11333 B17R1.915 CCOC(=O)CCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000755133 [0,0,1,1,0,0|2,0,0]=4 11334 B17R1.915 CCOC(=O)CCCCCNC[C@@H]1CCCO1 34a_100020590478_100000755133 [0,0,1,1,0,0|2,0,0]=4 11335 B17R1.915 CCOC(=O)CCCCCOCC1CCCC1 34a_100000742336_100000755133 [0,0,1,1,0,0|1,0,0]=3 11336 B17R1.915 CCOC(=O)CCCCCOCC1CCCC1 7a_100000742336_100000755133 [0,0,1,1,0,0|1,0,0]=3 11337 B17R1.915 CCOC(=O)CCCCCOCC1CCCC1 7a_100011214988_100000740388 [0,0,1,1,0,0|1,0,0]=3 11338 B17R1.915 CCOC(=O)CCCCCOCC1CCCO1 34a_100000210270_100000755133 [0,0,1,1,0,0|2,0,0]=4 11339 B17R1.915 CCOC(=O)CCCCCOCC1CCCO1 7a_100000210270_100000755133 [0,0,1,1,0,0|2,0,0]=4 11340 B17R1.915 CCOC(=O)CCCCCOCC1CCCO1 7a_100011214988_100000203698 [0,0,1,1,0,0|2,0,0]=4 11341 B17R1.915 CCOC(=O)CCCCCOCC1CCNC1 34a_100000748654_100000755133 [0,0,1,1,0,0|2,0,0]=4 11342 B17R1.915 CCOC(=O)CCCCCOCC1CCOC1 34a_100000740260_100000755133 [0,0,1,1,0,0|2,0,0]=4 11343 B17R1.915 CCOC(=O)CCCCCOCC1CCOC1 7a_100011214988_100000702531 [0,0,1,1,0,0|2,0,0]=4 11344 B17R1.915 CCOC(=O)CCCCCOC[C@H]1CCCN1 34a_100000745186_100000755133 [0,0,1,1,0,0|2,0,0]=4 11345 B17R1.915 CCOC(=O)CCCCCSCC1CCCC1 62a_100000740388_100000755133 [0,0,1,1,0,0|1,0,0]=3 11346 B17R1.915 CCOC(=O)CCCCCSCC1CCCC1 62a_100000755133_100000740388 [0,0,1,1,0,0|1,0,0]=3 11347 B17R1.915 CCOC(=O)CCCCCSCC1CCCO1 62a_100000203698_100000755133 [0,0,1,1,0,0|2,0,0]=4 11348 B17R1.915 CCOC(=O)CCCCCSCC1CCCO1 62a_100000755133_100000203698 [0,0,1,1,0,0|2,0,0]=4 11349 B17R1.915 CCOC(=O)CCCCCSCC1CCOC1 62a_100000702531_100000755133 [0,0,1,1,0,0|2,0,0]=4 11350 B17R1.915 CCOC(=O)CCCCCSCC1CCOC1 62a_100000755133_100000702531 [0,0,1,1,0,0|2,0,0]=4 11351 B17R1.915 CCOC(=O)CCCCNCCC1CCCC1 2230a_100000739158_100000750268 [0,0,1,1,0,0|1,0,0]=3 11352 B17R1.915 CCOC(=O)CCCCNCCC1CCCC1 34a_100000739158_100000750268 [0,0,1,1,0,0|1,0,0]=3 11353 B17R1.915 CCOC(=O)CCCCOCCC1CCCC1 34a_100000749090_100000750268 [0,0,1,1,0,0|1,0,0]=3 11354 B17R1.915 CCOC(=O)CCCCOCCC1CCCC1 7a_100000749090_100000750268 [0,0,1,1,0,0|1,0,0]=3 11355 B17R1.915 CCOC(=O)CCCCOCCC1CCNC1 34a_100016987287_100000750268 [0,0,1,1,0,0|2,0,0]=4 11356 B17R1.915 CCOC(=O)CCCCOCCC1CCOC1 34a_100011879284_100000750268 [0,0,1,1,0,0|2,0,0]=4 11357 B17R1.915 CCOC(=O)CCCCSCCC1CCCC1 62a_100000750268_100000760354 [0,0,1,1,0,0|1,0,0]=3 11358 B17R1.915 CCOC(=O)CCCCSCCC1CCCC1 62a_100000760354_100000750268 [0,0,1,1,0,0|1,0,0]=3 11359 B17R1.915 CCOC(=O)CCCCSCCN1CCCC1 62a_100000700749_100000750268 [0,0,1,1,0,0|2,0,0]=4 11360 B17R1.915 CCOC(=O)CCCCSCCN1CCCC1 62a_100000750268_100000004467 [0,0,1,1,0,0|2,0,0]=4 11361 B17R1.915 CCOC(=O)CCCNCCCC1CCCC1 2230a_100000736752_100009991533 [0,0,1,1,0,0|1,0,0]=3 11362 B17R1.915 CCOC(=O)CCCNCCCC1CCCC1 34a_100000736752_100009991533 [0,0,1,1,0,0|1,0,0]=3 11363 B17R1.915 CCOC(=O)CCCNCCOC1CCCC1 34a_100000741755_100009991533 [0,0,1,1,0,0|2,0,0]=4 11364 B17R1.915 CCOC(=O)CCCOCCCC1CCCC1 34a_100011215328_100009991533 [0,0,1,1,0,0|1,0,0]=3 11365 B17R1.915 CCOC(=O)CCCOCCCC1CCCC1 7a_100011215328_100011215271 [0,0,1,1,0,0|1,0,0]=3 11366 B17R1.915 CCOC(=O)CCCOCCCC1CCCC1 7a_100012001163_100011713738 [0,0,1,1,0,0|1,0,0]=3 11367 B17R1.915 CCOC(=O)CCCOCCCN1CCCC1 7a_100012001163_100011445909 [0,0,1,1,0,0|2,0,0]=4 11368 B17R1.915 CCOC(=O)CCCOCCNC1CCCC1 34a_200000200444_100009991533 [0,0,1,1,0,0|2,0,0]=4 11369 B17R1.915 CCOC(=O)CCCOCCOC1CCCC1 34a_100000738311_100009991533 [0,0,1,1,0,0|2,0,0]=4 11370 B17R1.915 CCOC(=O)CCCOCCOC1CCCC1 7a_100000738311_100011215271 [0,0,1,1,0,0|2,0,0]=4 11371 B17R1.915 CCOC(=O)CCCSCCCC1CCCC1 62a_100009991533_100011713738 [0,0,1,1,0,0|1,0,0]=3 11372 B17R1.915 CCOC(=O)CCCSCCCC1CCCC1 62a_100011713738_100009991533 [0,0,1,1,0,0|1,0,0]=3 11373 B17R1.915 CCOC(=O)CCCSCCCN1CCCC1 62a_100009991533_100011445909 [0,0,1,1,0,0|2,0,0]=4 11374 B17R1.915 CCOC(=O)CCCSCCCN1CCCC1 62a_100016991639_100009991533 [0,0,1,1,0,0|2,0,0]=4 11375 B17R1.915 CCOC(=O)CCNCCCOC1CCCC1 34a_100000747560_100000765890 [0,0,1,1,0,0|2,0,0]=4 11376 B17R1.915 CCOC(=O)COCCCNCC1CCCC1 2230a_100000737975_100009893628 [0,0,1,1,0,0|2,0,0]=4 11377 B17R1.915 CCOC(=O)COCCCNCC1CCCC1 34a_100000737975_100009893628 [0,0,1,1,0,0|2,0,0]=4 11378 B17R1.915 CCOC(=O)COCCCOCC1CCCC1 34a_100000742336_100009893628 [0,0,1,1,0,0|2,0,0]=4 11379 B17R1.915 CCOC(=O)COCCCOCC1CCCC1 7a_100000742336_100009893628 [0,0,1,1,0,0|2,0,0]=4 11380 B17R1.915 CCOC(=O)COCCCSCC1CCCC1 62a_100000740388_100009893628 [0,0,1,1,0,0|2,0,0]=4 11381 B17R1.915 CCOC(=O)COCCCSCC1CCCC1 62a_100009893628_100000740388 [0,0,1,1,0,0|2,0,0]=4 11382 B17R1.915 CCOC(=O)COCCNCCC1CCCC1 2230a_100000739158_100000088970 [0,0,1,1,0,0|2,0,0]=4 11383 B17R1.915 CCOC(=O)COCCNCCC1CCCC1 34a_100000739158_100000088970 [0,0,1,1,0,0|2,0,0]=4 11384 B17R1.915 CCOC(=O)COCCOCCC1CCCC1 34a_100000749090_100000088970 [0,0,1,1,0,0|2,0,0]=4 11385 B17R1.915 CCOC(=O)COCCOCCC1CCCC1 7a_100000749090_100000088970 [0,0,1,1,0,0|2,0,0]=4 11386 B17R1.915 CCOC(=O)COCCSCCC1CCCC1 62a_100000088970_100000760354 [0,0,1,1,0,0|2,0,0]=4 11387 B17R1.915 CCOC(=O)COCCSCCC1CCCC1 62a_100000760354_100000088970 [0,0,1,1,0,0|2,0,0]=4 11388 B17R1.915 CCOC(=O)CSCCOCCC1CCCC1 7a_200000230590_100000760354 [0,0,1,1,0,0|2,0,0]=4 11389 B17R1.915 CCOC(=O)NCCOCCCC1CCCC1 34a_100000158857_100011713738 [0,0,1,1,0,0|2,0,0]=4 11390 B17R1.915 CCOC(=O)NCCOCCCC1CCCC1 7a_100011215328_200011445536 [0,0,1,1,0,0|2,0,0]=4 11391 B17R1.915 CCOC(=O)NCCSCCCC1CCCC1 62a_100011713738_200011445536 [0,0,1,1,0,0|2,0,0]=4 11392 B17R1.957 CCCC(=O)OCNCCN1CCCCC1C 2230a_100000739827_100000034017 [0,0,1,1,0,0|2,0,0]=4 11393 B17R1.957 CCCC(=O)OCNCCN1CCCCC1C 34a_100000739827_100000034017 [0,0,1,1,0,0|2,0,0]=4 11394 B17R1.957 CCCC(=O)OCOCCN1CCCCC1C 34a_100011305533_100000034017 [0,0,1,1,0,0|2,0,0]=4 11395 B17R1.957 CCCC(=O)OCSCCC1CCCCN1C 62a_100000211948_100000034017 [0,0,1,1,0,0|2,0,0]=4 11396 B17R1.957 CCOC(=O)CCCCCN1CCCCC1C 2230a_100000211376_100000755133 [0,0,1,1,0,0|1,0,0]=3 11397 B17R1.957 CCOC(=O)CCCCCN1CCCCC1C 269982a_100000211376_100000755133 [0,0,1,1,0,0|1,0,0]=3 11398 B17R1.957 CCOC(=O)CCCCCN1CCCCC1C 34a_100000211376_100000755133 [0,0,1,1,0,0|1,0,0]=3 11399 B17R1.957 CCOC(=O)CCCCCN1CCOC[C@@H]1C 2230a_100009815349_100000755133 [0,0,1,1,0,0|2,0,0]=4 11400 B17R1.957 CCOC(=O)CCCCCN1CCOC[C@@H]1C 269982a_100009815349_100000755133 [0,0,1,1,0,0|2,0,0]=4 11401 B17R1.957 CCOC(=O)CCCCCN1CCOC[C@@H]1C 34a_100009815349_100000755133 [0,0,1,1,0,0|2,0,0]=4 11402 B17R1.957 CCOC(=O)CCCCNC1CCCCC1C 2230a_100000211402_100000750268 [0,0,1,1,0,0|1,0,0]=3 11403 B17R1.957 CCOC(=O)CCCCNC1CCCCC1C 34a_100000211402_100000750268 [0,0,1,1,0,0|1,0,0]=3 11404 B17R1.957 CCOC(=O)CCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000750268 [0,0,1,1,0,0|2,0,0]=4 11405 B17R1.957 CCOC(=O)CCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000750268 [0,0,1,1,0,0|2,0,0]=4 11406 B17R1.957 CCOC(=O)CCCCOC1CCCCC1C 34a_100000211207_100000750268 [0,0,1,1,0,0|1,0,0]=3 11407 B17R1.957 CCOC(=O)CCCCOC1CCCCC1C 7a_100000211207_100000750268 [0,0,1,1,0,0|1,0,0]=3 11408 B17R1.957 CCOC(=O)CCCCOC1CCCCC1Cl 34a_100000038908_100000750268 [0,0,1,1,0,0|2,0,0]=4 11409 B17R1.957 CCOC(=O)CCCCOC1CCCCC1Cl 7a_100000038908_100000750268 [0,0,1,1,0,0|2,0,0]=4 11410 B17R1.957 CCOC(=O)CCCCOC1CCNCC1C 34a_100011998114_100000750268 [0,0,1,1,0,0|2,0,0]=4 11411 B17R1.957 CCOC(=O)CCCCOC1CNCCC1C 34a_100000696640_100000750268 [0,0,1,1,0,0|2,0,0]=4 11412 B17R1.957 CCOC(=O)CCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000750268 [0,0,1,1,0,0|2,0,0]=4 11413 B17R1.957 CCOC(=O)CCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000750268 [0,0,1,1,0,0|2,0,0]=4 11414 B17R1.957 CCOC(=O)CCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000750268 [0,0,1,1,0,0|2,0,0]=4 11415 B17R1.957 CCOC(=O)CCCCSC1CCCCC1F 62a_100000750268_100015423560 [0,0,1,1,0,0|2,0,0]=4 11416 B17R1.957 CCOC(=O)CCCCSC1CCCCC1F 62a_100015423560_100000750268 [0,0,1,1,0,0|2,0,0]=4 11417 B17R1.957 CCOC(=O)CCCCSC1CCCCC1O 62a_100000038908_100000750268 [0,0,1,1,0,0|2,0,0]=4 11418 B17R1.957 CCOC(=O)CCCCSC1CCCCC1O 62a_100000750268_100000038908 [0,0,1,1,0,0|2,0,0]=4 11419 B17R1.957 CCOC(=O)CCCNCC1CCCCC1O 34a_100011216029_100009991533 [0,0,1,1,0,0|2,0,0]=4 11420 B17R1.957 CCOC(=O)CCCNCC1CCCCN1C 34a_100011228421_100009991533 [0,0,1,1,0,0|2,0,0]=4 11421 B17R1.957 CCOC(=O)CCCOCC1CCCCN1C 34a_100000225079_100009991533 [0,0,1,1,0,0|2,0,0]=4 11422 B17R1.957 CCOC(=O)CCCOCC1CCCCN1C 7a_100012001163_100015185383 [0,0,1,1,0,0|2,0,0]=4 11423 B17R1.957 CCOC(=O)CCCSCC1CCCCN1C 62a_100009991533_100015185383 [0,0,1,1,0,0|2,0,0]=4 11424 B17R1.957 CCOC(=O)CCCSCC1CCCCN1C 62a_100015185383_100009991533 [0,0,1,1,0,0|2,0,0]=4 11425 B17R1.957 CCOC(=O)CCNCCN1CCCCC1C 2230a_100000739827_100011206558 [0,0,1,1,0,0|2,0,0]=4 11426 B17R1.957 CCOC(=O)CCNCCN1CCCCC1C 34a_100000739827_100000765890 [0,0,1,1,0,0|2,0,0]=4 11427 B17R1.957 CCOC(=O)CCOCCN1CCCCC1C 34a_100011305533_100000765890 [0,0,1,1,0,0|2,0,0]=4 11428 B17R1.957 CCOC(=O)CCSCCC1CCCCN1C 62a_100000211948_100000765890 [0,0,1,1,0,0|2,0,0]=4 11429 B17R1.957 CCOC(=O)CCSCCC1CCCCN1C 62a_100000765890_100000211948 [0,0,1,1,0,0|2,0,0]=4 11430 B17R1.957 CCOC(=O)CNCCCN1CCCCC1C 34a_100000212276_100000188475 [0,0,1,1,0,0|2,0,0]=4 11431 B17R1.957 CCOC(=O)COCCCN1CCCCC1C 2230a_100000211376_100009893628 [0,0,1,1,0,0|2,0,0]=4 11432 B17R1.957 CCOC(=O)COCCCN1CCCCC1C 269982a_100000211376_100009893628 [0,0,1,1,0,0|2,0,0]=4 11433 B17R1.957 CCOC(=O)COCCCN1CCCCC1C 34a_100000211376_100009893628 [0,0,1,1,0,0|2,0,0]=4 11434 B17R1.957 CCOC(=O)COCCCN1CCCCC1C 34a_100000213889_100000188475 [0,0,1,1,0,0|2,0,0]=4 11435 B17R1.957 CCOC(=O)COCCCN1CCCCC1C 7a_100000213889_100000188475 [0,0,1,1,0,0|2,0,0]=4 11436 B17R1.957 CCOC(=O)COCCNC1CCCCC1C 2230a_100000211402_100000088970 [0,0,1,1,0,0|2,0,0]=4 11437 B17R1.957 CCOC(=O)COCCNC1CCCCC1C 34a_100000211402_100000088970 [0,0,1,1,0,0|2,0,0]=4 11438 B17R1.957 CCOC(=O)COCCOC1CCCCC1C 34a_100000211207_100000088970 [0,0,1,1,0,0|2,0,0]=4 11439 B17R1.957 CCOC(=O)COCCOC1CCCCC1C 7a_100000211207_100000088970 [0,0,1,1,0,0|2,0,0]=4 11440 B17R1.958 CCOC(=O)CCCCCN1CCCC1CC 2230a_100000754278_100000755133 [0,0,1,1,0,0|1,0,0]=3 11441 B17R1.958 CCOC(=O)CCCCCN1CCCC1CC 269982a_100000754278_100000755133 [0,0,1,1,0,0|1,0,0]=3 11442 B17R1.958 CCOC(=O)CCCCCN1CCCC1CC 34a_100000754278_100000755133 [0,0,1,1,0,0|1,0,0]=3 11443 B17R1.958 CCOC(=O)CCCCCN1CCC[C@@H]1CO 2230a_100000745186_100000755133 [0,0,1,1,0,0|2,0,0]=4 11444 B17R1.958 CCOC(=O)CCCCCN1CCC[C@@H]1CO 269982a_100000745186_100000755133 [0,0,1,1,0,0|2,0,0]=4 11445 B17R1.958 CCOC(=O)CCCCCN1CCC[C@@H]1CO 34a_100000745186_100000755133 [0,0,1,1,0,0|2,0,0]=4 11446 B17R1.958 CCOC(=O)CCCNCC1CCCN1CC 2230a_100000211693_100009991533 [0,0,1,1,0,0|2,0,0]=4 11447 B17R1.958 CCOC(=O)CCCOC[C@H]1CCCN1CC 34a_100011739246_100009991533 [0,0,1,1,0,0|2,0,0]=4 11448 B17R1.958 CCOC(=O)CCCOC[C@H]1CCCN1CC 7a_100011739246_100011215271 [0,0,1,1,0,0|2,0,0]=4 11449 B17R1.958 CCOC(=O)COCCCN1CCCC1CC 2230a_100000754278_100009893628 [0,0,1,1,0,0|2,0,0]=4 11450 B17R1.958 CCOC(=O)COCCCN1CCCC1CC 269982a_100000754278_100009893628 [0,0,1,1,0,0|2,0,0]=4 11451 B17R1.958 CCOC(=O)COCCCN1CCCC1CC 34a_100000754278_100009893628 [0,0,1,1,0,0|2,0,0]=4 11452 B17R1.995 CCCC(=O)COCCCCC1CCCCC1 7a_100011215267_100000747444 [0,0,1,1,0,0|2,0,0]=4 11453 B17R1.995 CCCC(=O)NCCCCCN1CCCCC1 240690a_100000754421_100000211992 [0,0,1,1,0,0|2,0,0]=4 11454 B17R1.995 CCCC(=O)NCCCCCN1CCCCC1 527a_100000754421_100000211992 [0,0,1,1,0,0|2,0,0]=4 11455 B17R1.995 CCCC(=O)OCNCCCC1CCCCC1 2230a_100011211642_100000034017 [0,0,1,1,0,0|1,0,0]=3 11456 B17R1.995 CCCC(=O)OCNCCCC1CCCCC1 34a_100011211642_100000034017 [0,0,1,1,0,0|1,0,0]=3 11457 B17R1.995 CCCC(=O)OCNCCOC1CCCCC1 34a_100015206981_100000034017 [0,0,1,1,0,0|2,0,0]=4 11458 B17R1.995 CCCC(=O)OCOCCCC1CCCCC1 34a_100000198086_100000034017 [0,0,1,1,0,0|1,0,0]=3 11459 B17R1.995 CCCC(=O)OCOCCCC1CCCCN1 34a_100011934581_100000034017 [0,0,1,1,0,0|2,0,0]=4 11460 B17R1.995 CCCC(=O)OCOCCCC1CCCNC1 34a_100150707839_100000034017 [0,0,1,1,0,0|2,0,0]=4 11461 B17R1.995 CCCC(=O)OCOCCCC1CCNCC1 34a_100016988962_100000034017 [0,0,1,1,0,0|2,0,0]=4 11462 B17R1.995 CCCC(=O)OCOCCCN1CCCCC1 34a_100000212458_100000034017 [0,0,1,1,0,0|2,0,0]=4 11463 B17R1.995 CCCC(=O)OCOCCNC1CCCCC1 34a_100000200466_100000034017 [0,0,1,1,0,0|2,0,0]=4 11464 B17R1.995 CCCC(=O)OCOCCOC1CCCCC1 34a_100011249652_100000034017 [0,0,1,1,0,0|2,0,0]=4 11465 B17R1.995 CCCC(=O)OCSCCCC1CCCCC1 62a_100011713725_100000034017 [0,0,1,1,0,0|1,0,0]=3 11466 B17R1.995 CCCC(=O)OCSCCCN1CCCCC1 62a_100132302099_100000034017 [0,0,1,1,0,0|2,0,0]=4 11467 B17R1.995 CCCC(=O)OCSCCOC1CCCCC1 62a_100011211530_100000034017 [0,0,1,1,0,0|2,0,0]=4 11468 B17R1.995 CCNC(=O)CCNCCCC1CCCCC1 2230a_100011211642_100000737597 [0,0,1,1,0,0|2,0,0]=4 11469 B17R1.995 CCNC(=O)CCNCCCC1CCCCC1 34a_100025743525_100011713725 [0,0,1,1,0,0|2,0,0]=4 11470 B17R1.995 CCNC(=O)CCOCCCC1CCCCC1 7a_100000198086_100000737597 [0,0,1,1,0,0|2,0,0]=4 11471 B17R1.995 CCNC(=O)CCSCCCC1CCCCC1 62a_100000737597_100011713725 [0,0,1,1,0,0|2,0,0]=4 11472 B17R1.995 CCNC(=O)CCSCCCC1CCCCC1 62a_100011713725_100000737597 [0,0,1,1,0,0|2,0,0]=4 11473 B17R1.995 CCNC(=O)COCCCCC1CCCCC1 34a_100011215267_100000183381 [0,0,1,1,0,0|2,0,0]=4 11474 B17R1.995 CCNC(=O)COCCCCC1CCCCC1 7a_100011215267_100000183381 [0,0,1,1,0,0|2,0,0]=4 11475 B17R1.995 CCOC(=O)CCCCCCN1CCCOC1 2230a_100000131196_100009814379 [0,0,1,1,0,0|2,0,0]=4 11476 B17R1.995 CCOC(=O)CCCCCCN1CCCOC1 269982a_100000131196_100009814379 [0,0,1,1,0,0|2,0,0]=4 11477 B17R1.995 CCOC(=O)CCCCCCN1CCCOC1 34a_100000131196_100009814379 [0,0,1,1,0,0|2,0,0]=4 11478 B17R1.995 CCOC(=O)CCCCCCN1CCOCC1 2230a_100015191051_100009814379 [0,0,1,1,0,0|2,0,0]=4 11479 B17R1.995 CCOC(=O)CCCCCCN1CCOCC1 269982a_100015191051_100009814379 [0,0,1,1,0,0|2,0,0]=4 11480 B17R1.995 CCOC(=O)CCCCCCN1CCOCC1 34a_100015191051_100009814379 [0,0,1,1,0,0|2,0,0]=4 11481 B17R1.995 CCOC(=O)CCCCCCN1CCSCC1 2230a_100000737611_100009814379 [0,0,1,1,0,0|2,0,0]=4 11482 B17R1.995 CCOC(=O)CCCCCCN1CCSCC1 269982a_100000737611_100009814379 [0,0,1,1,0,0|2,0,0]=4 11483 B17R1.995 CCOC(=O)CCCCCNC1CCCCC1 2230a_100000182618_100000755133 [0,0,1,1,0,0|1,0,0]=3 11484 B17R1.995 CCOC(=O)CCCCCNC1CCCCC1 34a_100000182618_100000755133 [0,0,1,1,0,0|1,0,0]=3 11485 B17R1.995 CCOC(=O)CCCCCNC1CCCOC1 2230a_100000719290_100000755133 [0,0,1,1,0,0|2,0,0]=4 11486 B17R1.995 CCOC(=O)CCCCCNC1CCCOC1 34a_100000719290_100000755133 [0,0,1,1,0,0|2,0,0]=4 11487 B17R1.995 CCOC(=O)CCCCCNC1CCOCC1 2230a_100000741149_100000755133 [0,0,1,1,0,0|2,0,0]=4 11488 B17R1.995 CCOC(=O)CCCCCNC1CCOCC1 34a_100000741149_100000755133 [0,0,1,1,0,0|2,0,0]=4 11489 B17R1.995 CCOC(=O)CCCCCNC1CCSCC1 2230a_100000748639_100000755133 [0,0,1,1,0,0|2,0,0]=4 11490 B17R1.995 CCOC(=O)CCCCCNC1CCSCC1 34a_100000748639_100000755133 [0,0,1,1,0,0|2,0,0]=4 11491 B17R1.995 CCOC(=O)CCCCCOC1CCCCC1 34a_100000210231_100000755133 [0,0,1,1,0,0|1,0,0]=3 11492 B17R1.995 CCOC(=O)CCCCCOC1CCCCC1 7a_100000210231_100000755133 [0,0,1,1,0,0|1,0,0]=3 11493 B17R1.995 CCOC(=O)CCCCCOC1CCCCC1 7a_100011214988_100000210327 [0,0,1,1,0,0|1,0,0]=3 11494 B17R1.995 CCOC(=O)CCCCCOC1CCCCO1 34a_100000033831_100000755133 [0,0,1,1,0,0|2,0,0]=4 11495 B17R1.995 CCOC(=O)CCCCCOC1CCCOC1 34a_100000754041_100000755133 [0,0,1,1,0,0|2,0,0]=4 11496 B17R1.995 CCOC(=O)CCCCCOC1CCCOC1 7a_100011214988_100000693364 [0,0,1,1,0,0|2,0,0]=4 11497 B17R1.995 CCOC(=O)CCCCCOC1CCCSC1 7a_100015962668_100000755133 [0,0,1,1,0,0|2,0,0]=4 11498 B17R1.995 CCOC(=O)CCCCCOC1CCOCC1 34a_100000744328_100000755133 [0,0,1,1,0,0|2,0,0]=4 11499 B17R1.995 CCOC(=O)CCCCCOC1CCOCC1 7a_100011214988_100000686592 [0,0,1,1,0,0|2,0,0]=4 11500 B17R1.995 CCOC(=O)CCCCCOC1CCSCC1 34a_100000731022_100000755133 [0,0,1,1,0,0|2,0,0]=4 11501 B17R1.995 CCOC(=O)CCCCCOC1CCSCC1 7a_100000731022_100000755133 [0,0,1,1,0,0|2,0,0]=4 11502 B17R1.995 CCOC(=O)CCCCCOC1CCSCC1 7a_100011214988_100011500858 [0,0,1,1,0,0|2,0,0]=4 11503 B17R1.995 CCOC(=O)CCCCCSC1CCCCC1 62a_100000210327_100000755133 [0,0,1,1,0,0|1,0,0]=3 11504 B17R1.995 CCOC(=O)CCCCCSC1CCCCC1 62a_100000755133_100000210327 [0,0,1,1,0,0|1,0,0]=3 11505 B17R1.995 CCOC(=O)CCCCCSC1CCCOC1 62a_100000755133_100000693364 [0,0,1,1,0,0|2,0,0]=4 11506 B17R1.995 CCOC(=O)CCCCCSC1CCOCC1 62a_100000755133_100011324220 [0,0,1,1,0,0|2,0,0]=4 11507 B17R1.995 CCOC(=O)CCCCCSC1CCSCC1 62a_100000755133_100000069128 [0,0,1,1,0,0|2,0,0]=4 11508 B17R1.995 CCOC(=O)CCCCNCC1CCCCC1 2230a_100000210473_100000750268 [0,0,1,1,0,0|1,0,0]=3 11509 B17R1.995 CCOC(=O)CCCCNCC1CCCCC1 34a_100000210473_100000750268 [0,0,1,1,0,0|1,0,0]=3 11510 B17R1.995 CCOC(=O)CCCCNCC1CCCCO1 2230a_100000174945_100000750268 [0,0,1,1,0,0|2,0,0]=4 11511 B17R1.995 CCOC(=O)CCCCNCC1CCCCO1 34a_100000174945_100000750268 [0,0,1,1,0,0|2,0,0]=4 11512 B17R1.995 CCOC(=O)CCCCNCC1CCCOC1 2230a_100000720124_100000750268 [0,0,1,1,0,0|2,0,0]=4 11513 B17R1.995 CCOC(=O)CCCCNCC1CCCOC1 34a_100000720124_100000750268 [0,0,1,1,0,0|2,0,0]=4 11514 B17R1.995 CCOC(=O)CCCCNCC1CCOCC1 2230a_100000746373_100000750268 [0,0,1,1,0,0|2,0,0]=4 11515 B17R1.995 CCOC(=O)CCCCNCC1CCOCC1 34a_100000746373_100000750268 [0,0,1,1,0,0|2,0,0]=4 11516 B17R1.995 CCOC(=O)CCCCNCC1CCSCC1 2230a_100015188806_100000750268 [0,0,1,1,0,0|2,0,0]=4 11517 B17R1.995 CCOC(=O)CCCCNCC1CCSCC1 34a_100015188806_100000750268 [0,0,1,1,0,0|2,0,0]=4 11518 B17R1.995 CCOC(=O)CCCCOCC1CCCCC1 34a_100000212181_100000750268 [0,0,1,1,0,0|1,0,0]=3 11519 B17R1.995 CCOC(=O)CCCCOCC1CCCCC1 7a_100000212181_100000750268 [0,0,1,1,0,0|1,0,0]=3 11520 B17R1.995 CCOC(=O)CCCCOCC1CCCCN1 34a_100000210821_100000750268 [0,0,1,1,0,0|2,0,0]=4 11521 B17R1.995 CCOC(=O)CCCCOCC1CCCCO1 34a_100000211370_100000750268 [0,0,1,1,0,0|2,0,0]=4 11522 B17R1.995 CCOC(=O)CCCCOCC1CCCCO1 7a_100000211370_100000750268 [0,0,1,1,0,0|2,0,0]=4 11523 B17R1.995 CCOC(=O)CCCCOCC1CCCNC1 34a_100000211344_100000750268 [0,0,1,1,0,0|2,0,0]=4 11524 B17R1.995 CCOC(=O)CCCCOCC1CCCOC1 34a_100000741520_100000750268 [0,0,1,1,0,0|2,0,0]=4 11525 B17R1.995 CCOC(=O)CCCCOCC1CCNCC1 34a_100000738675_100000750268 [0,0,1,1,0,0|2,0,0]=4 11526 B17R1.995 CCOC(=O)CCCCOCC1CCOCC1 34a_100000749013_100000750268 [0,0,1,1,0,0|2,0,0]=4 11527 B17R1.995 CCOC(=O)CCCCOCC1CCSCC1 34a_100000070558_100000750268 [0,0,1,1,0,0|2,0,0]=4 11528 B17R1.995 CCOC(=O)CCCCOCC1CCSCC1 7a_100000070558_100000750268 [0,0,1,1,0,0|2,0,0]=4 11529 B17R1.995 CCOC(=O)CCCCSCC1CCCCC1 62a_100000211423_100000750268 [0,0,1,1,0,0|1,0,0]=3 11530 B17R1.995 CCOC(=O)CCCCSCC1CCCCC1 62a_100000750268_100000211423 [0,0,1,1,0,0|1,0,0]=3 11531 B17R1.995 CCOC(=O)CCCCSCC1CCCCO1 62a_100000211543_100000750268 [0,0,1,1,0,0|2,0,0]=4 11532 B17R1.995 CCOC(=O)CCCCSCC1CCCCO1 62a_100000750268_100000211543 [0,0,1,1,0,0|2,0,0]=4 11533 B17R1.995 CCOC(=O)CCCCSCC1CCCOC1 62a_100000741521_100000750268 [0,0,1,1,0,0|2,0,0]=4 11534 B17R1.995 CCOC(=O)CCCCSCC1CCCOC1 62a_100000750268_100000741521 [0,0,1,1,0,0|2,0,0]=4 11535 B17R1.995 CCOC(=O)CCCCSCC1CCOCC1 62a_100000750268_100000749018 [0,0,1,1,0,0|2,0,0]=4 11536 B17R1.995 CCOC(=O)CCCCSCC1CCOCC1 62a_100000754603_100000750268 [0,0,1,1,0,0|2,0,0]=4 11537 B17R1.995 CCOC(=O)CCCNCCC1CCCCC1 2230a_100000738074_100009991533 [0,0,1,1,0,0|1,0,0]=3 11538 B17R1.995 CCOC(=O)CCCNCCC1CCCCC1 34a_100000738074_100009991533 [0,0,1,1,0,0|1,0,0]=3 11539 B17R1.995 CCOC(=O)CCCNCCC1CCCCO1 2230a_100015183643_100009991533 [0,0,1,1,0,0|2,0,0]=4 11540 B17R1.995 CCOC(=O)CCCNCCC1CCCCO1 34a_100015183643_100009991533 [0,0,1,1,0,0|2,0,0]=4 11541 B17R1.995 CCOC(=O)CCCNCCC1CCOCC1 2230a_100000755988_100009991533 [0,0,1,1,0,0|2,0,0]=4 11542 B17R1.995 CCOC(=O)CCCNCCC1CCOCC1 34a_100000755988_100009991533 [0,0,1,1,0,0|2,0,0]=4 11543 B17R1.995 CCOC(=O)CCCOCCC1CCCCC1 34a_100011217863_100009991533 [0,0,1,1,0,0|1,0,0]=3 11544 B17R1.995 CCOC(=O)CCCOCCC1CCCCC1 7a_100011217863_100011215271 [0,0,1,1,0,0|1,0,0]=3 11545 B17R1.995 CCOC(=O)CCCOCCC1CCCCC1 7a_100012001163_100011273959 [0,0,1,1,0,0|1,0,0]=3 11546 B17R1.995 CCOC(=O)CCCOCCC1CCCCN1 34a_100000211664_100009991533 [0,0,1,1,0,0|2,0,0]=4 11547 B17R1.995 CCOC(=O)CCCOCCC1CCCNC1 34a_100000752241_100009991533 [0,0,1,1,0,0|2,0,0]=4 11548 B17R1.995 CCOC(=O)CCCOCCC1CCNCC1 34a_100015190746_100009991533 [0,0,1,1,0,0|2,0,0]=4 11549 B17R1.995 CCOC(=O)CCCOCCC1CCOCC1 34a_100011933979_100009991533 [0,0,1,1,0,0|2,0,0]=4 11550 B17R1.995 CCOC(=O)CCCOCCC1CCOCC1 7a_100011933979_100011215271 [0,0,1,1,0,0|2,0,0]=4 11551 B17R1.995 CCOC(=O)CCCOCCC1CCOCC1 7a_100012001163_100011934994 [0,0,1,1,0,0|2,0,0]=4 11552 B17R1.995 CCOC(=O)CCCOCCN1CCCCC1 7a_100012001163_100000739454 [0,0,1,1,0,0|2,0,0]=4 11553 B17R1.995 CCOC(=O)CCCOCOC1CCCCC1 7a_100012001163_100011935260 [0,0,1,1,0,0|2,0,0]=4 11554 B17R1.995 CCOC(=O)CCCSCCC1CCCCC1 62a_100009991533_100012355289 [0,0,1,1,0,0|1,0,0]=3 11555 B17R1.995 CCOC(=O)CCCSCCC1CCCCC1 62a_100012355289_100009991533 [0,0,1,1,0,0|1,0,0]=3 11556 B17R1.995 CCOC(=O)CCCSCCC1CCOCC1 62a_100009991533_100011934994 [0,0,1,1,0,0|2,0,0]=4 11557 B17R1.995 CCOC(=O)CCCSCCC1CCOCC1 62a_100011934994_100009991533 [0,0,1,1,0,0|2,0,0]=4 11558 B17R1.995 CCOC(=O)CCCSCCN1CCCCC1 62a_100000739454_100009991533 [0,0,1,1,0,0|2,0,0]=4 11559 B17R1.995 CCOC(=O)CCCSCCN1CCCCC1 62a_100009991533_100000739454 [0,0,1,1,0,0|2,0,0]=4 11560 B17R1.995 CCOC(=O)CCCSCOC1CCCCC1 62a_100009991533_100011935260 [0,0,1,1,0,0|2,0,0]=4 11561 B17R1.995 CCOC(=O)CCCSCOC1CCCCC1 62a_100011935260_100009991533 [0,0,1,1,0,0|2,0,0]=4 11562 B17R1.995 CCOC(=O)CCNCCCC1CCCCC1 2230a_100011211642_100011206558 [0,0,1,1,0,0|1,0,0]=3 11563 B17R1.995 CCOC(=O)CCNCCCC1CCCCC1 34a_100011211642_100000765890 [0,0,1,1,0,0|1,0,0]=3 11564 B17R1.995 CCOC(=O)CCNCCOC1CCCCC1 34a_100015206981_100000765890 [0,0,1,1,0,0|2,0,0]=4 11565 B17R1.995 CCOC(=O)CCOCCCC1CCCCC1 34a_100000198086_100000765890 [0,0,1,1,0,0|1,0,0]=3 11566 B17R1.995 CCOC(=O)CCOCCCC1CCCCC1 7a_100000198086_100011206558 [0,0,1,1,0,0|1,0,0]=3 11567 B17R1.995 CCOC(=O)CCOCCCC1CCCCN1 34a_100011934581_100000765890 [0,0,1,1,0,0|2,0,0]=4 11568 B17R1.995 CCOC(=O)CCOCCCC1CCCNC1 34a_100150707839_100000765890 [0,0,1,1,0,0|2,0,0]=4 11569 B17R1.995 CCOC(=O)CCOCCCC1CCNCC1 34a_100016988962_100000765890 [0,0,1,1,0,0|2,0,0]=4 11570 B17R1.995 CCOC(=O)CCOCCCN1CCCCC1 34a_100000212458_100000765890 [0,0,1,1,0,0|2,0,0]=4 11571 B17R1.995 CCOC(=O)CCOCCNC1CCCCC1 34a_100000200466_100000765890 [0,0,1,1,0,0|2,0,0]=4 11572 B17R1.995 CCOC(=O)CCOCCOC1CCCCC1 34a_100011249652_100000765890 [0,0,1,1,0,0|2,0,0]=4 11573 B17R1.995 CCOC(=O)CCOCCOC1CCCCC1 7a_100011249652_100011206558 [0,0,1,1,0,0|2,0,0]=4 11574 B17R1.995 CCOC(=O)CCSCCCC1CCCCC1 62a_100000765890_100011713725 [0,0,1,1,0,0|1,0,0]=3 11575 B17R1.995 CCOC(=O)CCSCCCC1CCCCC1 62a_100011713725_100000765890 [0,0,1,1,0,0|1,0,0]=3 11576 B17R1.995 CCOC(=O)CCSCCCN1CCCCC1 62a_100000765890_100000007876 [0,0,1,1,0,0|2,0,0]=4 11577 B17R1.995 CCOC(=O)CCSCCCN1CCCCC1 62a_100132302099_100000765890 [0,0,1,1,0,0|2,0,0]=4 11578 B17R1.995 CCOC(=O)CCSCCOC1CCCCC1 62a_100000765890_100011211530 [0,0,1,1,0,0|2,0,0]=4 11579 B17R1.995 CCOC(=O)CCSCCOC1CCCCC1 62a_100011211530_100000765890 [0,0,1,1,0,0|2,0,0]=4 11580 B17R1.995 CCOC(=O)CNCCCOC1CCCCC1 34a_100000205933_100000188475 [0,0,1,1,0,0|2,0,0]=4 11581 B17R1.995 CCOC(=O)COCCCCC1CCCCC1 34a_100011215267_100000188475 [0,0,1,1,0,0|1,0,0]=3 11582 B17R1.995 CCOC(=O)COCCCCC1CCCCC1 7a_100011215267_100000188475 [0,0,1,1,0,0|1,0,0]=3 11583 B17R1.995 CCOC(=O)COCCCCC1CCNCC1 34a_100016989291_100000188475 [0,0,1,1,0,0|2,0,0]=4 11584 B17R1.995 CCOC(=O)COCCCNC1CCCCC1 2230a_100000182618_100009893628 [0,0,1,1,0,0|2,0,0]=4 11585 B17R1.995 CCOC(=O)COCCCNC1CCCCC1 34a_100000182618_100009893628 [0,0,1,1,0,0|2,0,0]=4 11586 B17R1.995 CCOC(=O)COCCCOC1CCCCC1 34a_100000210231_100009893628 [0,0,1,1,0,0|2,0,0]=4 11587 B17R1.995 CCOC(=O)COCCCOC1CCCCC1 7a_100000210231_100009893628 [0,0,1,1,0,0|2,0,0]=4 11588 B17R1.995 CCOC(=O)COCCCSC1CCCCC1 62a_100000210327_100009893628 [0,0,1,1,0,0|2,0,0]=4 11589 B17R1.995 CCOC(=O)COCCCSC1CCCCC1 62a_100009893628_100000210327 [0,0,1,1,0,0|2,0,0]=4 11590 B17R1.995 CCOC(=O)COCCNCC1CCCCC1 2230a_100000210473_100000088970 [0,0,1,1,0,0|2,0,0]=4 11591 B17R1.995 CCOC(=O)COCCNCC1CCCCC1 34a_100000210473_100000088970 [0,0,1,1,0,0|2,0,0]=4 11592 B17R1.995 CCOC(=O)COCCOCC1CCCCC1 34a_100000212181_100000088970 [0,0,1,1,0,0|2,0,0]=4 11593 B17R1.995 CCOC(=O)COCCOCC1CCCCC1 7a_100000212181_100000088970 [0,0,1,1,0,0|2,0,0]=4 11594 B17R1.995 CCOC(=O)COCCSCC1CCCCC1 62a_100000088970_100000211423 [0,0,1,1,0,0|2,0,0]=4 11595 B17R1.995 CCOC(=O)COCCSCC1CCCCC1 62a_100000211423_100000088970 [0,0,1,1,0,0|2,0,0]=4 11596 B17R1.995 CCOC(=O)CSCCOCC1CCCCC1 7a_200000230590_100000211423 [0,0,1,1,0,0|2,0,0]=4 11597 B17R1.995 CCOC(=O)NCCOCCC1CCCCC1 34a_100000158857_100011209188 [0,0,1,1,0,0|2,0,0]=4 11598 B17R1.995 CCOC(=O)NCCOCCC1CCCCC1 7a_100011217863_200011445536 [0,0,1,1,0,0|2,0,0]=4 11599 B17R1.995 CCOC(=O)NCCSCCC1CCCCC1 62a_100012355289_200011445536 [0,0,1,1,0,0|2,0,0]=4 11600 B17R1.995 CCOC(=O)OCSCCCC1CCCCC1 62a_100011713725_100000075025 [0,0,1,1,0,0|2,0,0]=4 11601 B17R1.1293 CCCC(=O)OCN1CCCCC1CCCO 2230a_100011934581_100000034017 [0,0,1,1,0,0|2,0,0]=4 11602 B17R1.1293 CCCC(=O)OCN1CCCCC1CCCO 269982a_100011934581_100000034017 [0,0,1,1,0,0|2,0,0]=4 11603 B17R1.1293 CCCC(=O)OCN1CCCCC1CCCO 34a_100011934581_100000034017 [0,0,1,1,0,0|2,0,0]=4 11604 B17R1.1293 CCCC(=O)OCN1CCCCC1CCOC 2230a_100015186528_100000034017 [0,0,1,1,0,0|2,0,0]=4 11605 B17R1.1293 CCCC(=O)OCN1CCCCC1CCOC 269982a_100015186528_100000034017 [0,0,1,1,0,0|2,0,0]=4 11606 B17R1.1293 CCCC(=O)OCN1CCCCC1CCOC 34a_100015186528_100000034017 [0,0,1,1,0,0|2,0,0]=4 11607 B17R1.1293 CCOC(=O)CCN1CCCCC1CCCO 2230a_100011934581_100011206558 [0,0,1,1,0,0|2,0,0]=4 11608 B17R1.1293 CCOC(=O)CCN1CCCCC1CCCO 269982a_100011934581_100011206558 [0,0,1,1,0,0|2,0,0]=4 11609 B17R1.1293 CCOC(=O)CCN1CCCCC1CCCO 34a_100011934581_100000765890 [0,0,1,1,0,0|2,0,0]=4 11610 B17R1.1293 CCOC(=O)CCN1CCCCC1CCOC 2230a_100015186528_100011206558 [0,0,1,1,0,0|2,0,0]=4 11611 B17R1.1293 CCOC(=O)CCN1CCCCC1CCOC 269982a_100015186528_100011206558 [0,0,1,1,0,0|2,0,0]=4 11612 B17R1.1293 CCOC(=O)CCN1CCCCC1CCOC 34a_100015186528_100000765890 [0,0,1,1,0,0|2,0,0]=4 11613 B17R1.1425 CCCCCCCCCCCOC1CCCC1 34a_100000210269_100011215454 [0,0,1,1,0,0|1,0,1]=4 11614 B17R1.1425 CCCCCCCCCCCOC1CCCC1 34a_100000210809_100000179811 [0,0,1,1,0,0|1,0,1]=4 11615 B17R1.1425 CCCCCCCCCCCOC1CCCC1 7a_100000210269_100011215454 [0,0,1,1,0,0|1,0,1]=4 11616 B17R1.1425 CCCCCCCCCCCOC1CCCC1 7a_100000210809_100000179811 [0,0,1,1,0,0|1,0,1]=4 11617 B17R1.1425 CCCCCCCCCCCOC1CCCO1 34a_100000085407_100011215454 [0,0,1,1,0,0|0,0,2]=4 11618 B17R1.1502 CCCCCC1CCCC1NCC(=O)NCC 270004a_100016988866_200000198059 [0,0,1,1,0,0|2,0,0]=4 11619 B17R1.1661 CCCC(=O)NCCCN1CCCCC1CC 11a_100011191702_100000211992 [0,0,1,1,0,0|2,0,0]=4 11620 B17R1.1661 CCCC(=O)NCCCN1CCCCC1CC 1626a_100011191702_100000211992 [0,0,1,1,0,0|2,0,0]=4 11621 B17R1.1661 CCCC(=O)NCCCN1CCCCC1CC 240690a_100011191702_100000211992 [0,0,1,1,0,0|2,0,0]=4 11622 B17R1.1661 CCCC(=O)NCCCN1CCCCC1CC 527a_100011191702_100000211992 [0,0,1,1,0,0|2,0,0]=4 11623 B17R1.1661 CCCC(=O)OCNCC1CCCCN1CC 2230a_100000754393_100000034017 [0,0,1,1,0,0|2,0,0]=4 11624 B17R1.1661 CCCC(=O)OCNCC1CCCCN1CC 34a_100000754393_100000034017 [0,0,1,1,0,0|2,0,0]=4 11625 B17R1.1661 CCCC(=O)OCOCC1CCCCN1CC 34a_100000225091_100000034017 [0,0,1,1,0,0|2,0,0]=4 11626 B17R1.1661 CCOC(=O)CCCCN1CCCCC1CC 2230a_100000210034_100000750268 [0,0,1,1,0,0|1,0,0]=3 11627 B17R1.1661 CCOC(=O)CCCCN1CCCCC1CC 269982a_100000210034_100000750268 [0,0,1,1,0,0|1,0,0]=3 11628 B17R1.1661 CCOC(=O)CCCCN1CCCCC1CC 34a_100000210034_100000750268 [0,0,1,1,0,0|1,0,0]=3 11629 B17R1.1661 CCOC(=O)CCCCN1CCCCC1CO 2230a_100000210821_100000750268 [0,0,1,1,0,0|2,0,0]=4 11630 B17R1.1661 CCOC(=O)CCCCN1CCCCC1CO 269982a_100000210821_100000750268 [0,0,1,1,0,0|2,0,0]=4 11631 B17R1.1661 CCOC(=O)CCCCN1CCCCC1CO 34a_100000210821_100000750268 [0,0,1,1,0,0|2,0,0]=4 11632 B17R1.1661 CCOC(=O)CCCCN1CCOC[C@@H]1CC 2230a_100016988097_100000750268 [0,0,1,1,0,0|2,0,0]=4 11633 B17R1.1661 CCOC(=O)CCCCN1CCOC[C@@H]1CC 269982a_100016988097_100000750268 [0,0,1,1,0,0|2,0,0]=4 11634 B17R1.1661 CCOC(=O)CCCCN1CCOC[C@@H]1CC 34a_100016988097_100000750268 [0,0,1,1,0,0|2,0,0]=4 11635 B17R1.1661 CCOC(=O)CCCNC1CCCCC1OC 34a_100011208099_100009991533 [0,0,1,1,0,0|2,0,0]=4 11636 B17R1.1661 CCOC(=O)CCCOC1CCCCC1CC 34a_100000210738_100009991533 [0,0,1,1,0,0|1,0,0]=3 11637 B17R1.1661 CCOC(=O)CCCOC1CCCCC1CC 7a_100000210738_100011215271 [0,0,1,1,0,0|1,0,0]=3 11638 B17R1.1661 CCOC(=O)CCCOC1CCCCC1CN 34a_100011216029_100009991533 [0,0,1,1,0,0|2,0,0]=4 11639 B17R1.1661 CCOC(=O)CCCO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100009991533 [0,0,1,1,0,0|2,0,0]=4 11640 B17R1.1661 CCOC(=O)CCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100009991533 [0,0,1,1,0,0|2,0,0]=4 11641 B17R1.1661 CCOC(=O)CCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100011215271 [0,0,1,1,0,0|2,0,0]=4 11642 B17R1.1661 CCOC(=O)CCNCC1CCCCN1CC 2230a_100000754393_100011206558 [0,0,1,1,0,0|2,0,0]=4 11643 B17R1.1661 CCOC(=O)CCNCC1CCCCN1CC 34a_100000754393_100000765890 [0,0,1,1,0,0|2,0,0]=4 11644 B17R1.1661 CCOC(=O)CCOCC1CCCCN1CC 34a_100000225091_100000765890 [0,0,1,1,0,0|2,0,0]=4 11645 B17R1.1661 CCOC(=O)CCOCC1CCCCN1CC 7a_100000225091_100011206558 [0,0,1,1,0,0|2,0,0]=4 11646 B17R1.1661 CCOC(=O)CNCCN1CCCCC1CC 2230a_100000755458_100000188475 [0,0,1,1,0,0|2,0,0]=4 11647 B17R1.1661 CCOC(=O)CNCCN1CCCCC1CC 34a_100000755458_100000188475 [0,0,1,1,0,0|2,0,0]=4 11648 B17R1.1661 CCOC(=O)COCCN1CCCCC1CC 2230a_100000210034_100000088970 [0,0,1,1,0,0|2,0,0]=4 11649 B17R1.1661 CCOC(=O)COCCN1CCCCC1CC 269982a_100000210034_100000088970 [0,0,1,1,0,0|2,0,0]=4 11650 B17R1.1661 CCOC(=O)COCCN1CCCCC1CC 34a_100000210034_100000088970 [0,0,1,1,0,0|2,0,0]=4 11651 B17R1.1661 CCOC(=O)NCCOC1CCCCC1CC 7a_100000210738_200011445536 [0,0,1,1,0,0|2,0,0]=4 11652 B17R1.5241 CCCCCCCCCCNC1CCCC1=O 2230a_100000684558_100000211823 [0,0,1,1,0,0|2,0,0]=4 11653 B17R1.5241 CCCCCCCCCCNC1CCCC1=O 34a_100000684558_100000709159 [0,0,1,1,0,0|2,0,0]=4 11654 B17R1.5241 CCCCCCCCCCNC1CCNC1=O 2230a_100016995588_100000210320 [0,0,1,1,0,0|2,0,0]=4 11655 B17R1.5241 CCCCCCCCCCNC1CCNC1=O 34a_100016995588_100000210320 [0,0,1,1,0,0|2,0,0]=4 11656 B17R1.5241 CCCCCCCCCCNC1CCOC1=O 2230a_100000684558_100000211211 [0,0,1,1,0,0|1,0,0]=3 11657 B17R1.5241 CCCCCCCCCCNC1CCOC1=O 34a_100000684558_100000211211 [0,0,1,1,0,0|1,0,0]=3 11658 B17R1.5241 CCCCCCCCCCOC1CCCC1=O 34a_100000210711_100000709159 [0,0,1,1,0,0|2,0,0]=4 11659 B17R1.5241 CCCCCCCCCCOC1CCCC1=O 34a_200000719330_100000210320 [0,0,1,1,0,0|2,0,0]=4 11660 B17R1.5241 CCCCCCCCCCOC1CCCC1=O 7a_100000210711_100000211823 [0,0,1,1,0,0|2,0,0]=4 11661 B17R1.5241 CCCCCCCCCCOC1CCOC1=O 34a_100000210711_100000211211 [0,0,1,1,0,0|1,0,0]=3 11662 B17R1.5241 CCCCCCCCCCOC1CCOC1=O 7a_100000210711_100000211211 [0,0,1,1,0,0|1,0,0]=3 11663 B17R1.5241 CCCCCCCCCCO[C@H]1CCNC1=O 34a_100000688343_100000210320 [0,0,1,1,0,0|2,0,0]=4 11664 B17R1.5241 CCCCCCCCCCSC1CCCC1=O 62a_100000211823_100000210320 [0,0,1,1,0,0|2,0,0]=4 11665 B17R1.5241 CCCCCCCCCCSC1CCOC1=O 62a_100000211211_100000210320 [0,0,1,1,0,0|1,0,0]=3 11666 B17R1.5241 CCCCCCCCCOCC1CCNC1=O 34a_100000133458_100011214924 [0,0,1,1,0,0|2,0,0]=4 11667 B17R1.5241 CCCCCCCCCSCN1CCCC1=O 62a_100000026320_100000210670 [0,0,1,1,0,0|2,0,0]=4 11668 B17R1.5241 CCCCCCCCNCCN1CCCC1=O 2230a_100000229939_100000739059 [0,0,1,1,0,0|2,0,0]=4 11669 B17R1.5241 CCCCCCCCNCCN1CCCC1=O 2230a_100011200922_100000210759 [0,0,1,1,0,0|2,0,0]=4 11670 B17R1.5241 CCCCCCCCNCCN1CCCC1=O 34a_100000229939_100000739059 [0,0,1,1,0,0|2,0,0]=4 11671 B17R1.5241 CCCCCCCCOCCN1CCCC1=O 34a_100000210232_100000739059 [0,0,1,1,0,0|2,0,0]=4 11672 B17R1.5241 CCCCCCCCOCCN1CCCC1=O 34a_100000211209_100000210759 [0,0,1,1,0,0|2,0,0]=4 11673 B17R1.5241 CCCCCCCCOCCN1CCCC1=O 7a_100000210232_100000739059 [0,0,1,1,0,0|2,0,0]=4 11674 B17R1.5241 CCCCCCCCOCCN1CCCC1=O 7a_100000211209_100000210759 [0,0,1,1,0,0|2,0,0]=4 11675 B17R1.5241 CCCCCCCCSCCN1CCCC1=O 62a_100000210759_100000739059 [0,0,1,1,0,0|2,0,0]=4 11676 B17R1.5241 CCCCCCCCSCCN1CCCC1=O 62a_100000739059_100000210317 [0,0,1,1,0,0|2,0,0]=4 11677 B17R1.5241 CCCCCCCNCCCN1CCCC1=O 2230a_100000210347_100000210681 [0,0,1,1,0,0|2,0,0]=4 11678 B17R1.5241 CCCCCCCNCCCN1CCCC1=O 34a_100000210347_100000210614 [0,0,1,1,0,0|2,0,0]=4 11679 B17R1.5241 CCCCCCCOCCCN1CCCC1=O 34a_100011216539_100000210614 [0,0,1,1,0,0|2,0,0]=4 11680 B17R1.5241 CCCCCCCOCCCN1CCCC1=O 7a_100011216539_100000210614 [0,0,1,1,0,0|2,0,0]=4 11681 B17R1.5241 NCCCCCCCCCOC1CCOC1=O 34a_100000078944_100000211211 [0,0,1,1,0,0|2,0,0]=4 11682 B17R1.5241 O=C1OCCC1NCCCCCCCCCO 2230a_100000078944_100000211211 [0,0,1,1,0,0|2,0,0]=4 11683 B17R1.5241 O=C1OCCC1NCCCCCCCCCO 34a_100000078944_100000211211 [0,0,1,1,0,0|2,0,0]=4 11684 B17R1.5241 O=C1OCCC1OCCCCCCCCCBr 34a_100009813782_100000211211 [0,0,1,1,0,0|2,0,0]=4 11685 B17R1.5241 O=C1OCCC1OCCCCCCCCCBr 7a_100009813782_100000211211 [0,0,1,1,0,0|2,0,0]=4 11686 B17R1.5241 O=C1OCCC1OCCCCCCCCCCl 34a_100009868337_100000211211 [0,0,1,1,0,0|2,0,0]=4 11687 B17R1.5241 O=C1OCCC1OCCCCCCCCCCl 7a_100009868337_100000211211 [0,0,1,1,0,0|2,0,0]=4 11688 B17R1.5241 O=C1OCCC1SCCCCCCCCCO 62a_100000211211_100009813782 [0,0,1,1,0,0|2,0,0]=4 11689 B17R1.5241 O=C1OCCC1SCCCCCCCCCO 62a_100009813782_100000211211 [0,0,1,1,0,0|2,0,0]=4 11690 B17R1.5255 CCCCC1CCCC1NCCC(=O)NCC 269862a_100025743525_100000750825 [0,0,1,1,0,0|2,0,0]=4 11691 B17R1.5255 CCCCC1CCCC1NCCC(=O)NCC 270004a_100025743525_100000750825 [0,0,1,1,0,0|2,0,0]=4 11692 B17R1.6374 CCCCCN1CCCCC1CC(=O)OCC 2230a_100116209990_100000210326 [0,0,1,1,0,0|1,0,0]=3 11693 B17R1.6374 CCCCCN1CCCCC1CC(=O)OCC 269982a_100116209990_100000210215 [0,0,1,1,0,0|1,0,0]=3 11694 B17R1.6374 CCOC(=O)CC1CCCCN1CCCCF 2230a_100116209990_100000729493 [0,0,1,1,0,0|2,0,0]=4 11695 B17R1.6374 CCOC(=O)CC1CCCCN1CCCCF 269982a_100116209990_100000729493 [0,0,1,1,0,0|2,0,0]=4 11696 B17R1.6374 CCOC(=O)CC1CCCCN1CCCCO 2230a_100116209990_100000210776 [0,0,1,1,0,0|2,0,0]=4 11697 B17R1.6374 CCOC(=O)CC1CCCCN1CCCCO 269982a_100116209990_100000210776 [0,0,1,1,0,0|2,0,0]=4 11698 B17R1.6374 CCOC(=O)CC1CCCCN1CCCOC 2230a_100116209990_100000740836 [0,0,1,1,0,0|2,0,0]=4 11699 B17R1.6374 CCOC(=O)CC1CCCCN1CCCOC 269982a_100116209990_100000740836 [0,0,1,1,0,0|2,0,0]=4 11700 B17R1.6374 CCOC(=O)CC1CCCCN1CCSCC 2230a_100116209990_100000757381 [0,0,1,1,0,0|2,0,0]=4 11701 B17R1.6374 CCOC(=O)CC1CCCCN1CCSCC 269982a_100116209990_100000757381 [0,0,1,1,0,0|2,0,0]=4 11702 B17R1.6374 CCOC(=O)CN1CCCCC1CCCOC 2230a_100011804088_100000188475 [0,0,1,1,0,0|2,0,0]=4 11703 B17R1.6374 CCOC(=O)CN1CCCCC1CCCOC 269982a_100011804088_100000188475 [0,0,1,1,0,0|2,0,0]=4 11704 B17R1.6374 CCOC(=O)CN1CCCCC1CCCOC 34a_100011804088_100000188475 [0,0,1,1,0,0|2,0,0]=4 11705 B17R1.6374 CCOCCN1CCCCC1CC(=O)OCC 2230a_100116209990_100011215890 [0,0,1,1,0,0|2,0,0]=4 11706 B17R1.6374 CCOCCN1CCCCC1CC(=O)OCC 269982a_100116209990_100011215890 [0,0,1,1,0,0|2,0,0]=4 11707 B17R1.11019 CCCCCCCCCCCCC(=O)C1CC1 1458a_100000210395_100000759014 [0,0,1,1,0,0|1,0,0]=3 11708 B17R1.11019 CCCCCCCCCCCCC(=O)C1CO1 1458a_100000701028_100000759014 [0,0,1,1,0,0|2,0,0]=4 11709 B17R1.11019 CCCCCCCCCCCNC(=O)C1CC1 11a_200011215754_100000210395 [0,0,1,1,0,0|1,0,0]=3 11710 B17R1.11019 CCCCCCCCCCCNC(=O)C1CC1 1626a_200011215754_100000210395 [0,0,1,1,0,0|1,0,0]=3 11711 B17R1.11019 CCCCCCCCCCCNC(=O)C1CC1 240690a_200011215754_100000210395 [0,0,1,1,0,0|1,0,0]=3 11712 B17R1.11019 CCCCCCCCCCCNC(=O)C1CC1 527a_200011215754_100000210395 [0,0,1,1,0,0|1,0,0]=3 11713 B17R1.11019 CCCCCCCCCCCNC(=O)C1CO1 11a_200011215754_100000701028 [0,0,1,1,0,0|2,0,0]=4 11714 B17R1.11019 CCCCCCCCCCCNC(=O)C1CO1 1626a_200011215754_100000701028 [0,0,1,1,0,0|2,0,0]=4 11715 B17R1.11019 CCCCCCCCCCCNC(=O)C1CO1 240690a_200011215754_100000701028 [0,0,1,1,0,0|2,0,0]=4 11716 B17R1.11019 CCCCCCCCCCCNC(=O)C1CO1 527a_200011215754_100000701028 [0,0,1,1,0,0|2,0,0]=4 11717 B17R1.11019 CCCCCCCCCCCOC(C)C1CC1 34a_100000744524_100011215454 [0,0,1,1,0,0|1,0,1]=4 11718 B17R1.11019 CCCCCCCCCCCOC(C)C1CC1 7a_100000744524_100011215454 [0,0,1,1,0,0|1,0,1]=4 11719 B17R1.11019 CCCCCCCCCCNCC(=O)C1CC1 2230a_100000684558_100000746382 [0,0,1,1,0,0|2,0,0]=4 11720 B17R1.11019 CCCCCCCCCCNCC(=O)C1CC1 34a_100000684558_100000746382 [0,0,1,1,0,0|2,0,0]=4 11721 B17R1.11019 CCCCCCCCCCOCC(=O)C1CC1 34a_100000210711_100000746382 [0,0,1,1,0,0|2,0,0]=4 11722 B17R1.11019 CCCCCCCCCCOCC(=O)C1CC1 34a_100000686663_100000210320 [0,0,1,1,0,0|2,0,0]=4 11723 B17R1.11019 CCCCCCCCCCOCC(=O)C1CC1 7a_100000210711_100000746382 [0,0,1,1,0,0|2,0,0]=4 11724 B17R1.11019 CCCCCCCCCCSCC(=O)C1CC1 62a_100000746382_100000210320 [0,0,1,1,0,0|2,0,0]=4 11725 B17R1.11019 CCCCCCCCCNCOC(=O)C1CC1 2230a_100000212291_100000140896 [0,0,1,1,0,0|1,0,0]=3 11726 B17R1.11019 CCCCCCCCCNCOC(=O)C1CC1 34a_100000212291_100000140896 [0,0,1,1,0,0|1,0,0]=3 11727 B17R1.11019 CCCCCCCCCOCOC(=O)C1CC1 34a_100000210712_100000140896 [0,0,1,1,0,0|1,0,0]=3 11728 B17R1.11019 CCCCCCCCCSCOC(=O)C1CC1 62a_100000140896_100000210670 [0,0,1,1,0,0|1,0,0]=3 11729 B17R1.11019 CCCCCCOCCOCOC(=O)C1CC1 34a_100000691444_100000140896 [0,0,1,1,0,0|2,0,0]=4 11730 B17R1.11019 CCCCNCCCCOCOC(=O)C1CC1 34a_200011216965_100000140896 [0,0,1,1,0,0|2,0,0]=4 11731 B17R1.11019 CCCCOCCCCOCOC(=O)C1CC1 34a_200000760531_100000140896 [0,0,1,1,0,0|2,0,0]=4 11732 B17R1.11019 NCCCCCCCCOCOC(=O)C1CC1 34a_102515433106_100000140896 [0,0,1,1,0,0|2,0,0]=4 11733 B17R1.11019 O=C(CCCCCCCCCCCO)C1CC1 1458a_100000210395_100009812471 [0,0,1,1,0,0|2,0,0]=4 11734 B17R1.11019 O=C(NCCCCCCCCCCO)C1CC1 240690a_100000066964_100000210395 [0,0,1,1,0,0|2,0,0]=4 11735 B17R1.11019 O=C(OCNCCCCCCCCO)C1CC1 2230a_102515433106_100000140896 [0,0,1,1,0,0|2,0,0]=4 11736 B17R1.11019 O=C(OCNCCCCCCCCO)C1CC1 34a_102515433106_100000140896 [0,0,1,1,0,0|2,0,0]=4 11737 B17R1.11019 O=C(OCOCCCCCCCCBr)C1CC1 34a_100009813846_100000140896 [0,0,1,1,0,0|2,0,0]=4 11738 B17R1.11019 O=C(OCOCCCCCCCCCl)C1CC1 34a_100000033203_100000140896 [0,0,1,1,0,0|2,0,0]=4 11739 B17R1.11019 O=C(OCSCCCCCCCCO)C1CC1 62a_100000033203_100000140896 [0,0,1,1,0,0|2,0,0]=4 11740 B17R1.11019 O=C(OCSCCCCCCCCO)C1CC1 62a_100000140896_100000033203 [0,0,1,1,0,0|2,0,0]=4 11741 B17R1.17836 CCOC(=O)CCCCCN1CCC1COC 2230a_100015195929_100000755133 [0,0,1,1,0,0|2,0,0]=4 11742 B17R1.17836 CCOC(=O)CCCCCN1CCC1COC 269982a_100015195929_100000755133 [0,0,1,1,0,0|2,0,0]=4 11743 B17R1.17836 CCOC(=O)CCCCCN1CCC1COC 34a_100015195929_100000755133 [0,0,1,1,0,0|2,0,0]=4 11744 B17R1.19161 CCOC(=O)CCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100009991516 [0,0,1,1,0,0|2,0,0]=4 11745 B17R1.19161 CCOC(=O)CCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100009991516 [0,0,1,1,0,0|2,0,0]=4 11746 B17R1.19161 CCOC(=O)CCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100009991516 [0,0,1,1,0,0|2,0,0]=4 11747 B17R1.19161 CCOC(=O)CCCCCCOCC1CC1C 34a_100000744939_100009814379 [0,0,1,1,0,0|1,0,0]=3 11748 B17R1.19161 CCOC(=O)CCCCCCOCC1CC1C 7a_100000744939_100009814379 [0,0,1,1,0,0|1,0,0]=3 11749 B17R1.19162 CCOC(=O)CCCCCCCCN1CCC1 269982a_100000754969_100010175975 [0,0,1,1,0,0|1,0,0]=3 11750 B17R1.19162 CCOC(=O)CCCCCCCNC1CCC1 2230a_100000749019_100009991516 [0,0,1,1,0,0|1,0,0]=3 11751 B17R1.19162 CCOC(=O)CCCCCCCNC1CCC1 34a_100000749019_100009991516 [0,0,1,1,0,0|1,0,0]=3 11752 B17R1.19162 CCOC(=O)CCCCCCCNC1COC1 2230a_100016991112_100009991516 [0,0,1,1,0,0|2,0,0]=4 11753 B17R1.19162 CCOC(=O)CCCCCCCOC1CCC1 34a_100000748187_100009991516 [0,0,1,1,0,0|1,0,0]=3 11754 B17R1.19162 CCOC(=O)CCCCCCCOC1CSC1 7a_100000072292_100009991516 [0,0,1,1,0,0|2,0,0]=4 11755 B17R1.19162 CCOC(=O)CCCCCCNCC1CCC1 2230a_100000738700_100009814379 [0,0,1,1,0,0|1,0,0]=3 11756 B17R1.19162 CCOC(=O)CCCCCCNCC1CCC1 34a_100000738700_100009814379 [0,0,1,1,0,0|1,0,0]=3 11757 B17R1.19162 CCOC(=O)CCCCCCNCC1COC1 2230a_100015281925_100009814379 [0,0,1,1,0,0|2,0,0]=4 11758 B17R1.19162 CCOC(=O)CCCCCCNCC1COC1 34a_100015281925_100009814379 [0,0,1,1,0,0|2,0,0]=4 11759 B17R1.19162 CCOC(=O)CCCCCCNC[C@@H]1CCO1 2230a_100020831831_100009814379 [0,0,1,1,0,0|2,0,0]=4 11760 B17R1.19162 CCOC(=O)CCCCCCNC[C@@H]1CCO1 34a_100020831831_100009814379 [0,0,1,1,0,0|2,0,0]=4 11761 B17R1.19162 CCOC(=O)CCCCCCOCC1CCC1 34a_100000760304_100009814379 [0,0,1,1,0,0|1,0,0]=3 11762 B17R1.19162 CCOC(=O)CCCCCCOCC1CCO1 34a_100000039022_100009814379 [0,0,1,1,0,0|2,0,0]=4 11763 B17R1.19162 CCOC(=O)CCCCCCOCC1CNC1 34a_100016987283_100009814379 [0,0,1,1,0,0|2,0,0]=4 11764 B17R1.19162 CCOC(=O)CCCCCCOCC1COC1 34a_100000060846_100009814379 [0,0,1,1,0,0|2,0,0]=4 11765 B17R1.19162 CCOC(=O)CCCCCCSCC1CCC1 62a_100000763275_100009814379 [0,0,1,1,0,0|1,0,0]=3 11766 B17R1.19162 CCOC(=O)CCCCCCSCC1CCO1 62a_100000103362_100009814379 [0,0,1,1,0,0|2,0,0]=4 11767 B17R1.19162 CCOC(=O)CCCCCCSCC1COC1 62a_100010264016_100009814379 [0,0,1,1,0,0|2,0,0]=4 11768 B17R1.19162 CCOC(=O)CCCCCOCCC1COC1 34a_100009855314_100000755133 [0,0,1,1,0,0|2,0,0]=4 11769 B17R1.21117 CCOC(=O)CCCCCCCCNC1CC1 34a_100000212008_100010175975 [0,0,1,1,0,0|1,0,0]=3 11770 B17R1.21117 CCOC(=O)CCCCCCCNCC1CC1 2230a_100000735609_100009991516 [0,0,1,1,0,0|1,0,0]=3 11771 B17R1.21117 CCOC(=O)CCCCCCCNCC1CC1 34a_100000735609_100009991516 [0,0,1,1,0,0|1,0,0]=3 11772 B17R1.21117 CCOC(=O)CCCCCCCOCC1CC1 34a_100000211283_100009991516 [0,0,1,1,0,0|1,0,0]=3 11773 B17R1.21117 CCOC(=O)CCCCCCCOC[C@@H]1CO1 34a_100000757423_100009991516 [0,0,1,1,0,0|2,0,0]=4 11774 B17R1.21117 CCOC(=O)CCCCCCCSCC1CC1 62a_100000756562_100009991516 [0,0,1,1,0,0|1,0,0]=3 11775 B17R1.21117 CCOC(=O)CCCCCCCSCC1CO1 62a_102125554688_100009991516 [0,0,1,1,0,0|2,0,0]=4 11776 B17R1.21117 CCOC(=O)CCCCCCCSCC1CS1 62a_100000031435_100009991516 [0,0,1,1,0,0|2,0,0]=4 11777 B17R1.21117 CCOC(=O)CCCCCCCSC[C@@H]1CO1 62a_100000745022_100009991516 [0,0,1,1,0,0|2,0,0]=4 11778 B17R1.21117 CCOC(=O)CCCCCCNCCC1CC1 34a_100000764129_100009814379 [0,0,1,1,0,0|1,0,0]=3 11779 B17R1.21117 CCOC(=O)CCCCCCOCCC1CC1 34a_100000754188_100009814379 [0,0,1,1,0,0|1,0,0]=3 11780 B17R1.21117 CCOC(=O)CCCCCCOCCC1CC1 7a_100000754188_100009814379 [0,0,1,1,0,0|1,0,0]=3 11781 B17R1.21117 CCOC(=O)CCCCCCOCC[C@@H]1CO1 34a_100009820653_100009814379 [0,0,1,1,0,0|2,0,0]=4 11782 B17R1.21117 CCOC(=O)CCCCCCSCCC1CC1 62a_100000764125_100009814379 [0,0,1,1,0,0|1,0,0]=3 11783 B17R1.21117 CCOC(=O)CCCCCCSCCC1CO1 62a_100000732470_100009814379 [0,0,1,1,0,0|2,0,0]=4 11784 B17R1.21117 CCOC(=O)CCCCCOCCCC1CO1 7a_100011214988_100000733510 [0,0,1,1,0,0|2,0,0]=4 11785 B17R1.21117 CCOC(=O)CCCCCOCCNC1CC1 34a_100000738766_100000755133 [0,0,1,1,0,0|2,0,0]=4 11786 B17R1.21117 CCOC(=O)CCCCCSCCCC1CO1 62a_100000733510_100000755133 [0,0,1,1,0,0|2,0,0]=4 11787 B17R1.21117 CCOC(=O)CCCCCSCCCC1CO1 62a_100000755133_100000733510 [0,0,1,1,0,0|2,0,0]=4 11788 B17R1.21186 CCCC(=O)CNCCC1CCCCCCC1 2230a_100011532352_100000747444 [0,0,1,1,0,0|2,0,0]=4 11789 B17R1.21186 CCCC(=O)OCOCC1CCCCCCC1 34a_100011216312_100000034017 [0,0,1,1,0,0|1,0,0]=3 11790 B17R1.21186 CCNC(=O)CCOCC1CCCCCCC1 7a_100011216312_100000737597 [0,0,1,1,0,0|2,0,0]=4 11791 B17R1.21186 CCNC(=O)CNCCC1CCCCCCC1 2230a_100011532352_100000183381 [0,0,1,1,0,0|2,0,0]=4 11792 B17R1.21186 CCNC(=O)CNCCC1CCCCCCC1 34a_100011532352_100000183381 [0,0,1,1,0,0|2,0,0]=4 11793 B17R1.21186 CCOC(=O)CCCCN1CCCCCCC1 2230a_100000211400_100000750268 [0,0,1,1,0,0|1,0,0]=3 11794 B17R1.21186 CCOC(=O)CCCCN1CCCCCCC1 269982a_100000211400_100000750268 [0,0,1,1,0,0|1,0,0]=3 11795 B17R1.21186 CCOC(=O)CCCCN1CCCCCCC1 34a_100000211400_100000750268 [0,0,1,1,0,0|1,0,0]=3 11796 B17R1.21186 CCOC(=O)CCCNC1CCCCCCC1 2230a_100000211152_100009991533 [0,0,1,1,0,0|1,0,0]=3 11797 B17R1.21186 CCOC(=O)CCCNC1CCCCCCC1 34a_100000211152_100009991533 [0,0,1,1,0,0|1,0,0]=3 11798 B17R1.21186 CCOC(=O)CCCOC1CCCCCCC1 34a_100000210054_100009991533 [0,0,1,1,0,0|1,0,0]=3 11799 B17R1.21186 CCOC(=O)CCCOC1CCCCCCC1 7a_100000210054_100011215271 [0,0,1,1,0,0|1,0,0]=3 11800 B17R1.21186 CCOC(=O)CCOCC1CCCCCCC1 34a_100011216312_100000765890 [0,0,1,1,0,0|1,0,0]=3 11801 B17R1.21186 CCOC(=O)CCOCC1CCCCCCC1 7a_100011216312_100011206558 [0,0,1,1,0,0|1,0,0]=3 11802 B17R1.21186 CCOC(=O)CNCCC1CCCCCCC1 2230a_100011532352_100000188475 [0,0,1,1,0,0|1,0,0]=3 11803 B17R1.21186 CCOC(=O)CNCCC1CCCCCCC1 34a_100011532352_100000188475 [0,0,1,1,0,0|1,0,0]=3 11804 B17R1.21186 CCOC(=O)COCCN1CCCCCCC1 2230a_100000211400_100000088970 [0,0,1,1,0,0|2,0,0]=4 11805 B17R1.21186 CCOC(=O)COCCN1CCCCCCC1 269982a_100000211400_100000088970 [0,0,1,1,0,0|2,0,0]=4 11806 B17R1.21186 CCOC(=O)COCCN1CCCCCCC1 34a_100000211400_100000088970 [0,0,1,1,0,0|2,0,0]=4 11807 B17R1.21186 CCOC(=O)NCCOC1CCCCCCC1 7a_100000210054_200011445536 [0,0,1,1,0,0|2,0,0]=4 11808 B17R1.21317 CCOC(=O)CCCCCCN1CCC[C@@H]1C 2230a_100020605311_100009814379 [0,0,1,1,0,0|1,0,0]=3 11809 B17R1.21317 CCOC(=O)CCCCCCN1CCC[C@@H]1C 269982a_100020605311_100009814379 [0,0,1,1,0,0|1,0,0]=3 11810 B17R1.21317 CCOC(=O)CCCCCCN1CCC[C@H]1C 2230a_100015189458_100009814379 [0,0,1,1,0,0|1,0,0]=3 11811 B17R1.21317 CCOC(=O)CCCCCCN1CCC[C@H]1C 269982a_100015189458_100009814379 [0,0,1,1,0,0|1,0,0]=3 11812 B17R1.21317 CCOC(=O)CCCCCCN1CCC[C@H]1C 34a_100015189458_100009814379 [0,0,1,1,0,0|1,0,0]=3 11813 B17R1.21317 CCOC(=O)CCCCCCN1CCSC1C 2230a_200011216479_100009814379 [0,0,1,1,0,0|2,0,0]=4 11814 B17R1.21317 CCOC(=O)CCCCCCN1CCSC1C 269982a_200011216479_100009814379 [0,0,1,1,0,0|2,0,0]=4 11815 B17R1.21317 CCOC(=O)CCCCCCN1CCSC1C 34a_200011216479_100009814379 [0,0,1,1,0,0|2,0,0]=4 11816 B17R1.21317 CCOC(=O)CCCCCOC1CCCC1C 34a_100011216460_100000755133 [0,0,1,1,0,0|1,0,0]=3 11817 B17R1.21317 CCOC(=O)CCCCCOC1CCCC1C 7a_100011216460_100000755133 [0,0,1,1,0,0|1,0,0]=3 11818 B17R1.21317 CCOC(=O)CCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000755133 [0,0,1,1,0,0|2,0,0]=4 11819 B17R1.21317 CCOC(=O)CCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000755133 [0,0,1,1,0,0|2,0,0]=4 11820 B17R1.21317 CCOC(=O)CCCCCO[C@H]1CNC[C@H]1C 34a_200015306588_100000755133 [0,0,1,1,0,0|2,0,0]=4 11821 B17R1.21317 CCOC(=O)CCCCCS[C@@H]1CCC[C@H]1O 62a_100000755133_200016002552 [0,0,1,1,0,0|2,0,0]=4 11822 B17R1.21317 CCOC(=O)CCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000755133 [0,0,1,1,0,0|2,0,0]=4 11823 B17R1.21317 CCOC(=O)CCCCOCC1CCCN1C 34a_100000743107_100000750268 [0,0,1,1,0,0|2,0,0]=4 11824 B17R1.21317 CCOC(=O)CCCOCCC1CCCN1C 34a_100011215177_100009991533 [0,0,1,1,0,0|2,0,0]=4 11825 B17R1.21317 CCOC(=O)CCCOCCC1CCCN1C 7a_100011215177_100011215271 [0,0,1,1,0,0|2,0,0]=4 11826 B17R1.21317 CCOC(=O)CCCOCCC1CCCN1C 7a_100012001163_100000005710 [0,0,1,1,0,0|2,0,0]=4 11827 B17R1.21317 CCOC(=O)CCCSCCC1CCCN1C 62a_100000005710_100009991533 [0,0,1,1,0,0|2,0,0]=4 11828 B17R1.21317 CCOC(=O)CCCSCCC1CCCN1C 62a_100009991533_100000005710 [0,0,1,1,0,0|2,0,0]=4 11829 B17R1.21317 CCOC(=O)COCCCOC1CCCC1C 34a_100011216460_100009893628 [0,0,1,1,0,0|2,0,0]=4 11830 B17R1.21317 CCOC(=O)COCCCOC1CCCC1C 7a_100011216460_100009893628 [0,0,1,1,0,0|2,0,0]=4 11831 B17R1.21325 CCOC(=O)CCCCCCCN1CCC1C 269982a_100000755817_100009991516 [0,0,1,1,0,0|1,0,0]=3 11832 B17R1.21325 CCOC(=O)CCCCCCCN1CCC1C 34a_100000755817_100009991516 [0,0,1,1,0,0|1,0,0]=3 11833 B17R1.21375 CCCC(=O)NCCCCN1CCCCCC1 1626a_100011207362_100000211992 [0,0,1,1,0,0|2,0,0]=4 11834 B17R1.21375 CCCC(=O)NCCCCN1CCCCCC1 240690a_100011207362_100000211992 [0,0,1,1,0,0|2,0,0]=4 11835 B17R1.21375 CCCC(=O)NCCCCN1CCCCCC1 527a_100011207362_100000211992 [0,0,1,1,0,0|2,0,0]=4 11836 B17R1.21375 CCCC(=O)OCNCCC1CCCCCC1 2230a_100011532351_100000034017 [0,0,1,1,0,0|1,0,0]=3 11837 B17R1.21375 CCCC(=O)OCNCCC1CCCCCC1 34a_100011532351_100000034017 [0,0,1,1,0,0|1,0,0]=3 11838 B17R1.21375 CCCC(=O)OCOCCN1CCCCCC1 34a_100000238007_100000034017 [0,0,1,1,0,0|2,0,0]=4 11839 B17R1.21375 CCCC(=O)OCSCCN1CCCCCC1 62a_100000722644_100000034017 [0,0,1,1,0,0|2,0,0]=4 11840 B17R1.21375 CCNC(=O)CCNCCC1CCCCCC1 2230a_100011532351_100000737597 [0,0,1,1,0,0|2,0,0]=4 11841 B17R1.21375 CCOC(=O)CCCCCN1CCCCCC1 2230a_100000185865_100000755133 [0,0,1,1,0,0|1,0,0]=3 11842 B17R1.21375 CCOC(=O)CCCCCN1CCCCCC1 269982a_100000185865_100000755133 [0,0,1,1,0,0|1,0,0]=3 11843 B17R1.21375 CCOC(=O)CCCCCN1CCCCCC1 34a_100000185865_100000755133 [0,0,1,1,0,0|1,0,0]=3 11844 B17R1.21375 CCOC(=O)CCCCCN1CCCOCC1 2230a_100000685342_100000755133 [0,0,1,1,0,0|2,0,0]=4 11845 B17R1.21375 CCOC(=O)CCCCCN1CCCOCC1 269982a_100000685342_100000755133 [0,0,1,1,0,0|2,0,0]=4 11846 B17R1.21375 CCOC(=O)CCCCCN1CCCOCC1 34a_100000685342_100000755133 [0,0,1,1,0,0|2,0,0]=4 11847 B17R1.21375 CCOC(=O)CCCCNC1CCCCCC1 2230a_100000210984_100000750268 [0,0,1,1,0,0|1,0,0]=3 11848 B17R1.21375 CCOC(=O)CCCCNC1CCCCCC1 34a_100000210984_100000750268 [0,0,1,1,0,0|1,0,0]=3 11849 B17R1.21375 CCOC(=O)CCCCOC1CCCCCC1 34a_100000210887_100000750268 [0,0,1,1,0,0|1,0,0]=3 11850 B17R1.21375 CCOC(=O)CCCCOC1CCCCCC1 7a_100000210887_100000750268 [0,0,1,1,0,0|1,0,0]=3 11851 B17R1.21375 CCOC(=O)CCCCSC1CCCCCC1 62a_100000750268_100011217769 [0,0,1,1,0,0|1,0,0]=3 11852 B17R1.21375 CCOC(=O)CCCCSC1CCCCCC1 62a_100011217769_100000750268 [0,0,1,1,0,0|1,0,0]=3 11853 B17R1.21375 CCOC(=O)CCCNCC1CCCCCC1 2230a_100015204231_100009991533 [0,0,1,1,0,0|1,0,0]=3 11854 B17R1.21375 CCOC(=O)CCCNCC1CCCCCC1 34a_100015204231_100009991533 [0,0,1,1,0,0|1,0,0]=3 11855 B17R1.21375 CCOC(=O)CCCOCC1CCCCCC1 34a_100000699130_100009991533 [0,0,1,1,0,0|1,0,0]=3 11856 B17R1.21375 CCOC(=O)CCCOCC1CCCCCC1 7a_100000699130_100011215271 [0,0,1,1,0,0|1,0,0]=3 11857 B17R1.21375 CCOC(=O)CCCOCC1CCCCCC1 7a_100012001163_200000696569 [0,0,1,1,0,0|1,0,0]=3 11858 B17R1.21375 CCOC(=O)CCCSCC1CCCCCC1 62a_100009991533_200000696569 [0,0,1,1,0,0|1,0,0]=3 11859 B17R1.21375 CCOC(=O)CCCSCC1CCCCCC1 62a_200000696569_100009991533 [0,0,1,1,0,0|1,0,0]=3 11860 B17R1.21375 CCOC(=O)CCNCCC1CCCCCC1 2230a_100011532351_100011206558 [0,0,1,1,0,0|1,0,0]=3 11861 B17R1.21375 CCOC(=O)CCNCCC1CCCCCC1 34a_100011532351_100000765890 [0,0,1,1,0,0|1,0,0]=3 11862 B17R1.21375 CCOC(=O)CCOCCN1CCCCCC1 34a_100000238007_100000765890 [0,0,1,1,0,0|2,0,0]=4 11863 B17R1.21375 CCOC(=O)CCSCCN1CCCCCC1 62a_100000722644_100000765890 [0,0,1,1,0,0|2,0,0]=4 11864 B17R1.21375 CCOC(=O)CCSCCN1CCCCCC1 62a_100000765890_100000722644 [0,0,1,1,0,0|2,0,0]=4 11865 B17R1.21375 CCOC(=O)COCCCN1CCCCCC1 2230a_100000185865_100009893628 [0,0,1,1,0,0|2,0,0]=4 11866 B17R1.21375 CCOC(=O)COCCCN1CCCCCC1 269982a_100000185865_100009893628 [0,0,1,1,0,0|2,0,0]=4 11867 B17R1.21375 CCOC(=O)COCCCN1CCCCCC1 34a_100000185865_100009893628 [0,0,1,1,0,0|2,0,0]=4 11868 B17R1.21375 CCOC(=O)COCCCN1CCCCCC1 34a_100102886287_100000188475 [0,0,1,1,0,0|2,0,0]=4 11869 B17R1.21375 CCOC(=O)COCCCN1CCCCCC1 7a_100102886287_100000188475 [0,0,1,1,0,0|2,0,0]=4 11870 B17R1.21375 CCOC(=O)COCCNC1CCCCCC1 2230a_100000210984_100000088970 [0,0,1,1,0,0|2,0,0]=4 11871 B17R1.21375 CCOC(=O)COCCNC1CCCCCC1 34a_100000210984_100000088970 [0,0,1,1,0,0|2,0,0]=4 11872 B17R1.21375 CCOC(=O)COCCOC1CCCCCC1 34a_100000210887_100000088970 [0,0,1,1,0,0|2,0,0]=4 11873 B17R1.21375 CCOC(=O)COCCOC1CCCCCC1 7a_100000210887_100000088970 [0,0,1,1,0,0|2,0,0]=4 11874 B17R1.21375 CCOC(=O)COCCSC1CCCCCC1 62a_100000088970_100011217769 [0,0,1,1,0,0|2,0,0]=4 11875 B17R1.21375 CCOC(=O)COCCSC1CCCCCC1 62a_100011217769_100000088970 [0,0,1,1,0,0|2,0,0]=4 11876 B17R1.21375 CCOC(=O)NCCOCC1CCCCCC1 34a_100000158857_200000696569 [0,0,1,1,0,0|2,0,0]=4 11877 B17R1.21375 CCOC(=O)NCCOCC1CCCCCC1 7a_100000699130_200011445536 [0,0,1,1,0,0|2,0,0]=4 11878 B17R1.21375 CCOC(=O)NCCSCC1CCCCCC1 62a_200000696569_200011445536 [0,0,1,1,0,0|2,0,0]=4 11879 B17R1.25106 CCCCCCN1CCCCC1C(=O)OCC 2230a_100016990872_100000210314 [0,0,1,1,0,0|1,0,0]=3 11880 B17R1.25106 CCCCCCN1CCCCC1C(=O)OCC 269982a_100016990872_100000210757 [0,0,1,1,0,0|1,0,0]=3 11881 B17R1.25106 CCCCCCN1CCOC[C@H]1C(=O)OCC 2230a_100015229691_100000210314 [0,0,1,1,0,0|2,0,0]=4 11882 B17R1.25106 CCCCCCN1CCOC[C@H]1C(=O)OCC 269982a_100015229691_100000210757 [0,0,1,1,0,0|2,0,0]=4 11883 B17R1.25106 CCCCCCN1CCSCC1C(=O)OCC 2230a_100000735462_100000210314 [0,0,1,1,0,0|2,0,0]=4 11884 B17R1.25106 CCCCCCN1CCSCC1C(=O)OCC 269982a_100000735462_100000210757 [0,0,1,1,0,0|2,0,0]=4 11885 B17R1.25106 CCCCCOC1CCCCC1C(=O)OCC 7a_100000038711_100000210326 [0,0,1,1,0,0|1,0,0]=3 11886 B17R1.25106 CCCCOCN1CCCCC1C(=O)OCC 2230a_100016990872_100011995733 [0,0,1,1,0,0|2,0,0]=4 11887 B17R1.25106 CCCCOCN1CCCCC1C(=O)OCC 269982a_100016990872_100011995733 [0,0,1,1,0,0|2,0,0]=4 11888 B17R1.25106 CCCOCCN1CCCCC1C(=O)OCC 2230a_100016990872_100011215938 [0,0,1,1,0,0|2,0,0]=4 11889 B17R1.25106 CCCOCCN1CCCCC1C(=O)OCC 269982a_100016990872_100011215938 [0,0,1,1,0,0|2,0,0]=4 11890 B17R1.25106 CCOC(=O)C1CCCCC1OCCCCF 7a_100000038711_100000729493 [0,0,1,1,0,0|2,0,0]=4 11891 B17R1.25106 CCOC(=O)C1CCCCC1OCCCCO 7a_100000038711_100000210776 [0,0,1,1,0,0|2,0,0]=4 11892 B17R1.25106 CCOC(=O)C1CCCCC1OCCCOC 7a_100000038711_100000740836 [0,0,1,1,0,0|2,0,0]=4 11893 B17R1.25106 CCOC(=O)C1CCCCC1OCCSCC 7a_100000038711_100000757381 [0,0,1,1,0,0|2,0,0]=4 11894 B17R1.25106 CCOC(=O)C1CCCCN1CCCCCF 2230a_100016990872_100000729378 [0,0,1,1,0,0|2,0,0]=4 11895 B17R1.25106 CCOC(=O)C1CCCCN1CCCCCF 269982a_100016990872_100000729378 [0,0,1,1,0,0|2,0,0]=4 11896 B17R1.25106 CCOC(=O)C1CCCCN1CCCCCO 2230a_100016990872_100000746330 [0,0,1,1,0,0|2,0,0]=4 11897 B17R1.25106 CCOC(=O)C1CCCCN1CCCCCO 269982a_100016990872_100000746330 [0,0,1,1,0,0|2,0,0]=4 11898 B17R1.25106 CCOC(=O)C1CCCCN1CCCCOC 2230a_100016990872_100000730899 [0,0,1,1,0,0|2,0,0]=4 11899 B17R1.25106 CCOC(=O)C1CCCCN1CCCCOC 269982a_100016990872_100000730899 [0,0,1,1,0,0|2,0,0]=4 11900 B17R1.25106 CCOCCCN1CCCCC1C(=O)OCC 2230a_100016990872_100012232248 [0,0,1,1,0,0|2,0,0]=4 11901 B17R1.25106 CCOCCCN1CCCCC1C(=O)OCC 269982a_100016990872_100012232248 [0,0,1,1,0,0|2,0,0]=4 11902 B17R1.25106 CCOCCOC1CCCCC1C(=O)OCC 7a_100000038711_100011215890 [0,0,1,1,0,0|2,0,0]=4 11903 B17R1.25295 CCCCCCCCCN1CCNC(=O)CC1 2230a_100000698595_100011214924 [0,0,1,1,0,0|2,0,0]=4 11904 B17R1.25295 CCCCCCCCCN1CCNC(=O)CC1 269982a_100000698595_100000210670 [0,0,1,1,0,0|2,0,0]=4 11905 B17R1.29104 CCCCCCCN1CCC[C@H]1C(=O)NCC 2230a_100020641767_100000210681 [0,0,1,1,0,0|2,0,0]=4 11906 B17R1.29104 CCCCCCCN1CCC[C@H]1C(=O)NCC 269982a_100020641767_100000210681 [0,0,1,1,0,0|2,0,0]=4 11907 B17R1.29104 CCCCCCCN1CCC[C@H]1C(=O)NCC 34a_100020641767_100000210614 [0,0,1,1,0,0|2,0,0]=4 11908 B17R1.29104 CCCCCCCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100000210681 [0,0,1,1,0,0|1,0,0]=3 11909 B17R1.29104 CCCCCCCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100000210681 [0,0,1,1,0,0|1,0,0]=3 11910 B17R1.29104 CCCCCCCN1CSC[C@H]1C(=O)OCC 269982a_100016989239_100000210681 [0,0,1,1,0,0|2,0,0]=4 11911 B17R1.29104 CCCCCCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100000210314 [0,0,1,1,0,0|1,0,0]=3 11912 B17R1.29104 CCCCOCCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100000743108 [0,0,1,1,0,0|2,0,0]=4 11913 B17R1.29104 CCCCOCCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100000743108 [0,0,1,1,0,0|2,0,0]=4 11914 B17R1.29104 CCCOCCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100011215938 [0,0,1,1,0,0|2,0,0]=4 11915 B17R1.29104 CCOC(=O)[C@@H]1CCCN1CCCCCCF 2230a_100000703725_100015922095 [0,0,1,1,0,0|2,0,0]=4 11916 B17R1.29104 CCOC(=O)[C@@H]1CCCN1CCCCCCF 269982a_100000703725_100015922095 [0,0,1,1,0,0|2,0,0]=4 11917 B17R1.29104 CCOC(=O)[C@@H]1CCCN1CCCCCCO 2230a_100000703725_100000766143 [0,0,1,1,0,0|2,0,0]=4 11918 B17R1.29104 CCOC(=O)[C@@H]1CCCN1CCCCCCO 269982a_100000703725_100000766143 [0,0,1,1,0,0|2,0,0]=4 11919 B17R1.29104 CCOC(=O)[C@@H]1CCC[C@@H]1OCCCCCF 7a_200015395474_100000729378 [0,0,1,1,0,0|2,0,0]=4 11920 B17R1.29104 CCOC(=O)[C@@H]1CCC[C@@H]1OCCCCCO 7a_200015395474_100000746330 [0,0,1,1,0,0|2,0,0]=4 11921 B17R1.29104 CCOC(=O)[C@@H]1CCC[C@@H]1OCCCCOC 7a_200015395474_100000730899 [0,0,1,1,0,0|2,0,0]=4 11922 B17R1.29104 CCOCCCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100012232248 [0,0,1,1,0,0|2,0,0]=4 11923 B17R1.29490 CCCCCCCCN1CCNC(=O)C1CC 2230a_100000187962_100000210759 [0,0,1,1,0,0|2,0,0]=4 11924 B17R1.29490 CCCCCCCCN1CCNC(=O)C1CC 269982a_100000187962_100000210759 [0,0,1,1,0,0|2,0,0]=4 11925 B17R1.29490 CCCCCCCCN1CCNC(=O)C1CC 34a_100000187962_100000210759 [0,0,1,1,0,0|2,0,0]=4 11926 B17R1.30587 CCNC(=O)CCNC1CCCCCCCC1 270004a_100025743525_100000038600 [0,0,1,1,0,0|2,0,0]=4 11927 B17R1.30587 CCOC(=O)CCCN1CCCCCCCC1 2230a_100000039187_100009991533 [0,0,1,1,0,0|1,0,0]=3 11928 B17R1.30587 CCOC(=O)CCCN1CCCCCCCC1 269982a_100000039187_100009991533 [0,0,1,1,0,0|1,0,0]=3 11929 B17R1.30587 CCOC(=O)CCCN1CCCCCCCC1 34a_100000039187_100009991533 [0,0,1,1,0,0|1,0,0]=3 11930 B17R1.30587 CCOC(=O)NCCN1CCCCCCCC1 269982a_100000039187_200011445536 [0,0,1,1,0,0|2,0,0]=4 11931 B17R1.106508 CCCCCCCCCCCOC1(CCC1)C 34a_100000759064_100011215454 [0,0,1,1,0,0|1,0,1]=4 11932 B17R1.106508 CCCCCCCCCCCOC1(CCC1)C 7a_100000759064_100011215454 [0,0,1,1,0,0|1,0,1]=4 11933 B17R1.1045 CCCOC1CCCCCCCCCCC1=O 34a_100000210258_200009990614 [0,0,1,1,0,0|2,0,0]=4 11934 B17R1.1045 CCCSC1CCCCCCCCCCC1=O 62a_100000210303_200009990614 [0,0,1,1,0,0|2,0,0]=4 11935 B17R1.1045 CCCSC1CCCCCCCCCCC1=O 62a_200009990614_100000210303 [0,0,1,1,0,0|2,0,0]=4 11936 B17R1.1261 CCCCCCCCNC1CCCCNC1=O 2230a_100000229939_100000735217 [0,0,1,1,0,0|2,0,0]=4 11937 B17R1.1261 CCCCCCCCNC1CCCCNC1=O 2230a_100000698827_100000210759 [0,0,1,1,0,0|2,0,0]=4 11938 B17R1.1261 CCCCCCCCNC1CCCCNC1=O 34a_100000698827_100000210759 [0,0,1,1,0,0|2,0,0]=4 11939 B17R1.1261 CCCCCCCCOC1CCCCCC1=O 7a_100000210232_100000243696 [0,0,1,1,0,0|2,0,0]=4 11940 B17R1.1261 CCCCCCCCOC1CCCCNC1=O 7a_100000210232_100000735217 [0,0,1,1,0,0|2,0,0]=4 11941 B17R1.1261 CCCCCCCCSC1CCCCCC1=O 62a_100000210759_100000243696 [0,0,1,1,0,0|2,0,0]=4 11942 B17R1.1261 CCCCCCCCSC1CCCCCC1=O 62a_100000243696_100000210317 [0,0,1,1,0,0|2,0,0]=4 11943 B17R1.1261 CCCCCCCCSC1CCCCNC1=O 62a_100000210759_100000735217 [0,0,1,1,0,0|2,0,0]=4 11944 B17R1.1261 CCCCCCCCSC1CCCCNC1=O 62a_100000735217_100000210317 [0,0,1,1,0,0|2,0,0]=4 11945 B17R1.1261 CCCCCNCCCN1CCCCCC1=O 2230a_100000195386_100000210326 [0,0,1,1,0,0|2,0,0]=4 11946 B17R1.1261 CCCCCNCCCN1CCCCCC1=O 34a_100000195386_100000718602 [0,0,1,1,0,0|2,0,0]=4 11947 B17R1.1308 CCCCCCCCC=CC(=O)C1CCCC1 1458a_100015345288_100000179811 [0,0,1,1,0,0|1,0,1]=4 11948 B17R1.1308 CCCCCCCCCCC(=O)C1=CCCC1 1458a_100000038896_100000210319 [0,0,1,1,0,0|1,0,1]=4 11949 B17R1.1308 CCCCCCCCCCC(=O)C1CCCC1 1458a_100000210375_100000179811 [0,0,1,1,0,0|1,0,0]=3 11950 B17R1.1308 CCCCCCCCCCC(=O)C1CCCC1 1458a_100000210718_100000210319 [0,0,1,1,0,0|1,0,0]=3 11951 B17R1.1308 CCCCCCCCCCC(=O)C1CCCS1 1458a_100012002731_100000210319 [0,0,1,1,0,0|2,0,0]=4 11952 B17R1.1308 CCCCCCCCCCC(=O)C1CCOC1 1458a_100000210375_100000690089 [0,0,1,1,0,0|2,0,0]=4 11953 B17R1.1308 CCCCCCCCCCC(=O)C1CCOC1 1458a_100011219752_100000210319 [0,0,1,1,0,0|2,0,0]=4 11954 B17R1.1308 CCCCCCCCCCC(=O)N1CCCC1 240690a_100000188435_100000210375 [0,0,1,1,0,0|1,0,0]=3 11955 B17R1.1308 CCCCCCCCCCC(=O)N1CCSC1 11a_100011215254_100000210375 [0,0,1,1,0,0|2,0,0]=4 11956 B17R1.1308 CCCCCCCCCCC(=O)N1CCSC1 240690a_100011215254_100000210375 [0,0,1,1,0,0|2,0,0]=4 11957 B17R1.1308 CCCCCCCCCCC(=O)[C@@H]1CCCO1 1458a_100000686382_100000210319 [0,0,1,1,0,0|2,0,0]=4 11958 B17R1.1308 CCCCCCCCCNC(=O)C1CCCC1 11a_100000212291_100000210718 [0,0,1,1,0,0|1,0,0]=3 11959 B17R1.1308 CCCCCCCCCNC(=O)C1CCCC1 1626a_100000212291_100000210718 [0,0,1,1,0,0|1,0,0]=3 11960 B17R1.1308 CCCCCCCCCNC(=O)C1CCCC1 240690a_100000212291_100000210718 [0,0,1,1,0,0|1,0,0]=3 11961 B17R1.1308 CCCCCCCCCNC(=O)C1CCCC1 527a_100000212291_100000210718 [0,0,1,1,0,0|1,0,0]=3 11962 B17R1.1308 CCCCCCCCCNC(=O)C1CCCS1 11a_100000212291_100012002731 [0,0,1,1,0,0|2,0,0]=4 11963 B17R1.1308 CCCCCCCCCNC(=O)C1CCCS1 1626a_100000212291_100012002731 [0,0,1,1,0,0|2,0,0]=4 11964 B17R1.1308 CCCCCCCCCNC(=O)C1CCCS1 240690a_100000212291_100012002731 [0,0,1,1,0,0|2,0,0]=4 11965 B17R1.1308 CCCCCCCCCNC(=O)C1CCCS1 527a_100000212291_100012002731 [0,0,1,1,0,0|2,0,0]=4 11966 B17R1.1308 CCCCCCCCCNC(=O)C1CCOC1 11a_100000212291_100011219752 [0,0,1,1,0,0|2,0,0]=4 11967 B17R1.1308 CCCCCCCCCNC(=O)C1CCOC1 1626a_100000212291_100011219752 [0,0,1,1,0,0|2,0,0]=4 11968 B17R1.1308 CCCCCCCCCNC(=O)C1CCOC1 240690a_100000212291_100011219752 [0,0,1,1,0,0|2,0,0]=4 11969 B17R1.1308 CCCCCCCCCNC(=O)C1CCOC1 527a_100000212291_100011219752 [0,0,1,1,0,0|2,0,0]=4 11970 B17R1.1308 CCCCCCCCCNC(=O)N1CCCC1 2708a_100000212291_100000188435 [0,0,1,1,0,0|2,0,0]=4 11971 B17R1.1308 CCCCCCCCCNC(=O)N1CCCC1 273464a_100000212291_100000188435 [0,0,1,1,0,0|2,0,0]=4 11972 B17R1.1308 CCCCCCCCCNC(=O)[C@@H]1CCCO1 11a_100000212291_100000686382 [0,0,1,1,0,0|2,0,0]=4 11973 B17R1.1308 CCCCCCCCCNC(=O)[C@@H]1CCCO1 1626a_100000212291_100000686382 [0,0,1,1,0,0|2,0,0]=4 11974 B17R1.1308 CCCCCCCCCNC(=O)[C@@H]1CCCO1 240690a_100000212291_100000686382 [0,0,1,1,0,0|2,0,0]=4 11975 B17R1.1308 CCCCCCCCCNC(=O)[C@@H]1CCCO1 527a_100000212291_100000686382 [0,0,1,1,0,0|2,0,0]=4 11976 B17R1.1308 CCCCCCCCCOC(C)C1CCCC1 34a_100011216366_100011214924 [0,0,1,1,0,0|1,0,1]=4 11977 B17R1.1308 CCCCCCCCCOC(C)C1CCCC1 7a_100011216366_100000210328 [0,0,1,1,0,0|1,0,1]=4 11978 B17R1.1308 CCCCCCCCNCC(=O)N1CCCC1 2230a_100000229939_100000183516 [0,0,1,1,0,0|2,0,0]=4 11979 B17R1.1308 CCCCCCCCNCC(=O)N1CCCC1 2230a_100000751844_100000210759 [0,0,1,1,0,0|2,0,0]=4 11980 B17R1.1308 CCCCCCCCNCC(=O)N1CCCC1 34a_100000229939_100000183516 [0,0,1,1,0,0|2,0,0]=4 11981 B17R1.1308 CCCCCCCCOCC(=O)C1CCCC1 1458a_100000759886_100000179811 [0,0,1,1,0,0|2,0,0]=4 11982 B17R1.1308 CCCCCCCCOCC(=O)N1CCCC1 240690a_100000188435_100000759886 [0,0,1,1,0,0|2,0,0]=4 11983 B17R1.1308 CCCCCCCCOCC(=O)N1CCCC1 34a_100000210232_100000183516 [0,0,1,1,0,0|2,0,0]=4 11984 B17R1.1308 CCCCCCCCOCC(=O)N1CCCC1 527a_100000188435_100000759886 [0,0,1,1,0,0|2,0,0]=4 11985 B17R1.1308 CCCCCCCCOCC(=O)N1CCCC1 7a_100000210232_100000183516 [0,0,1,1,0,0|2,0,0]=4 11986 B17R1.1308 CCCCCCCCOCC(=O)N1CCCC1 7a_200000752455_100000210759 [0,0,1,1,0,0|2,0,0]=4 11987 B17R1.1308 CCCCCCCCSCC(=O)N1CCCC1 62a_100000183516_100000210317 [0,0,1,1,0,0|2,0,0]=4 11988 B17R1.1308 CCCCCCCCSCC(=O)N1CCCC1 62a_100000210759_100000183516 [0,0,1,1,0,0|2,0,0]=4 11989 B17R1.1308 CCCCCCCNCCC(=O)N1CCCC1 2230a_100000229938_100011194422 [0,0,1,1,0,0|2,0,0]=4 11990 B17R1.1308 CCCCCCCOCCC(=O)N1CCCC1 34a_100000210272_100011194422 [0,0,1,1,0,0|2,0,0]=4 11991 B17R1.1308 CCCCCCCOCCC(=O)N1CCCC1 7a_100000210272_100011194422 [0,0,1,1,0,0|2,0,0]=4 11992 B17R1.1308 CCCCCCCSCCC(=O)N1CCCC1 62a_100000210614_100011194422 [0,0,1,1,0,0|2,0,0]=4 11993 B17R1.1308 CCCCCCCSCCC(=O)N1CCCC1 62a_100011194422_100000210316 [0,0,1,1,0,0|2,0,0]=4 11994 B17R1.1308 O=C(CCCCCCCCCF)C1CCCC1 1458a_200009909015_100000179811 [0,0,1,1,0,0|2,0,0]=4 11995 B17R1.1308 O=C(CCCCCCCCCF)N1CCCC1 240690a_100000188435_200009909015 [0,0,1,1,0,0|2,0,0]=4 11996 B17R1.1308 O=C(CCCCCCCCCF)N1CCCC1 527a_100000188435_200009909015 [0,0,1,1,0,0|2,0,0]=4 11997 B17R1.1308 O=C(CCCCCCCCCO)C1CCCC1 1458a_100000210718_100009813782 [0,0,1,1,0,0|2,0,0]=4 11998 B17R1.1308 O=C(CCCCCCCCCO)N1CCCC1 240690a_100000188435_100000032657 [0,0,1,1,0,0|2,0,0]=4 11999 B17R1.1308 O=C(NCCCCCCCCO)C1CCCC1 240690a_102515433106_100000210718 [0,0,1,1,0,0|2,0,0]=4 12000 B17R1.1843 CCC1CCCCC1OCC(=O)OCCOC 34a_100000210738_200000040189 [0,0,1,1,0,0|2,0,0]=4 12001 B17R1.1843 CCC1CCCCC1OCC(=O)OCCOC 7a_100000210738_200000040189 [0,0,1,1,0,0|2,0,0]=4 12002 B17R1.1843 CCCCCC(=O)COC1CCCCC1CC 34a_100000210738_200012276598 [0,0,1,1,0,0|2,0,0]=4 12003 B17R1.1843 CCCCCC(=O)COC1CCCCC1CC 7a_100000210738_200012276598 [0,0,1,1,0,0|2,0,0]=4 12004 B17R1.1843 CCCCCC(=O)NCC1CCCCN1CC 11a_100000754393_100000212188 [0,0,1,1,0,0|2,0,0]=4 12005 B17R1.1843 CCCCCC(=O)NCC1CCCCN1CC 1626a_100000754393_100000212188 [0,0,1,1,0,0|2,0,0]=4 12006 B17R1.1843 CCCCCC(=O)NCC1CCCCN1CC 240690a_100000754393_100000212188 [0,0,1,1,0,0|2,0,0]=4 12007 B17R1.1843 CCCCCC(=O)NCC1CCCCN1CC 527a_100000754393_100000212188 [0,0,1,1,0,0|2,0,0]=4 12008 B17R1.1843 CCCCNC(=O)COC1CCCCC1CC 34a_100000210738_100000182744 [0,0,1,1,0,0|2,0,0]=4 12009 B17R1.1843 CCCCNC(=O)COC1CCCCC1CC 7a_100000210738_100000182744 [0,0,1,1,0,0|2,0,0]=4 12010 B17R1.1843 CCCCOC(=O)CNC1CCCCC1OC 34a_100011208099_100000211628 [0,0,1,1,0,0|2,0,0]=4 12011 B17R1.1843 CCCCOC(=O)COC1CCCCC1CC 34a_100000210738_100000211628 [0,0,1,1,0,0|1,0,0]=3 12012 B17R1.1843 CCCCOC(=O)COC1CCCCC1CC 7a_100000210738_100000211628 [0,0,1,1,0,0|1,0,0]=3 12013 B17R1.1843 CCCCOC(=O)COC1CCCCC1CN 34a_100011216029_100000211628 [0,0,1,1,0,0|2,0,0]=4 12014 B17R1.1843 CCCCOC(=O)CO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100000211628 [0,0,1,1,0,0|2,0,0]=4 12015 B17R1.1843 CCCCOC(=O)CO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000211628 [0,0,1,1,0,0|2,0,0]=4 12016 B17R1.1843 CCCCOC(=O)CO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000211628 [0,0,1,1,0,0|2,0,0]=4 12017 B17R1.1854 CCCCCC(=O)CCCCC1CCCCC1 1458a_200011215547_100000210326 [0,0,1,1,0,0|1,0,0]=3 12018 B17R1.1854 CCCCCC(=O)CCCCN1CCCCC1 1458a_100000754417_100000210326 [0,0,1,1,0,0|2,0,0]=4 12019 B17R1.1854 CCCCCC(=O)CNCCC1CCCCC1 2230a_100000738074_200012276598 [0,0,1,1,0,0|2,0,0]=4 12020 B17R1.1854 CCCCCC(=O)CNCCC1CCCCC1 34a_100000738074_200012276598 [0,0,1,1,0,0|2,0,0]=4 12021 B17R1.1854 CCCCCC(=O)COCCC1CCCCC1 34a_100011217863_200012276598 [0,0,1,1,0,0|2,0,0]=4 12022 B17R1.1854 CCCCCC(=O)COCCC1CCCCC1 7a_100011217863_200012276598 [0,0,1,1,0,0|2,0,0]=4 12023 B17R1.1854 CCCCCC(=O)CSCCC1CCCCC1 62a_100012355289_200012276598 [0,0,1,1,0,0|2,0,0]=4 12024 B17R1.1854 CCCCCC(=O)CSCCC1CCCCC1 62a_200012276598_100012355289 [0,0,1,1,0,0|2,0,0]=4 12025 B17R1.1854 CCCCCC(=O)NCCCC1CCCCC1 11a_100011211642_100000212188 [0,0,1,1,0,0|1,0,0]=3 12026 B17R1.1854 CCCCCC(=O)NCCCC1CCCCC1 1626a_100011211642_100000212188 [0,0,1,1,0,0|1,0,0]=3 12027 B17R1.1854 CCCCCC(=O)NCCCC1CCCCC1 240690a_100011211642_100000212188 [0,0,1,1,0,0|1,0,0]=3 12028 B17R1.1854 CCCCCC(=O)NCCCC1CCCCC1 527a_100011211642_100000212188 [0,0,1,1,0,0|1,0,0]=3 12029 B17R1.1854 CCCCCC(=O)NCCCN1CCCCC1 240690a_100000204581_100000212188 [0,0,1,1,0,0|2,0,0]=4 12030 B17R1.1854 CCCCCC(=O)NCCCN1CCCCC1 527a_100000204581_100000212188 [0,0,1,1,0,0|2,0,0]=4 12031 B17R1.1854 CCCCCC(=O)NCCOC1CCCCC1 11a_100015206981_100000212188 [0,0,1,1,0,0|2,0,0]=4 12032 B17R1.1854 CCCCCC(=O)NCCOC1CCCCC1 1626a_100015206981_100000212188 [0,0,1,1,0,0|2,0,0]=4 12033 B17R1.1854 CCCCCC(=O)NCCOC1CCCCC1 240690a_100015206981_100000212188 [0,0,1,1,0,0|2,0,0]=4 12034 B17R1.1854 CCCCCC(=O)NCCOC1CCCCC1 527a_100015206981_100000212188 [0,0,1,1,0,0|2,0,0]=4 12035 B17R1.1854 CCCCCC(C)OCCCC1CCCCC1 34a_100000198086_200011218191 [0,0,1,1,0,0|1,0,1]=4 12036 B17R1.1854 CCCCCC(C)OCCCC1CCCCC1 34a_100011215632_100011713725 [0,0,1,1,0,0|1,0,1]=4 12037 B17R1.1854 CCCCCC(C)OCCCC1CCCCC1 7a_100000198086_200011218191 [0,0,1,1,0,0|1,0,1]=4 12038 B17R1.1854 CCCCCC(C)OCCCC1CCCCC1 7a_100011215632_100011713725 [0,0,1,1,0,0|1,0,1]=4 12039 B17R1.1854 CCCCNC(=O)CCCCC1CCCCC1 11a_100000102301_200011215547 [0,0,1,1,0,0|1,0,0]=3 12040 B17R1.1854 CCCCNC(=O)CCCCC1CCCCC1 1626a_100000102301_200011215547 [0,0,1,1,0,0|1,0,0]=3 12041 B17R1.1854 CCCCNC(=O)CCCCC1CCCCC1 240690a_100000102301_200011215547 [0,0,1,1,0,0|1,0,0]=3 12042 B17R1.1854 CCCCNC(=O)CCCCC1CCCCC1 527a_100000102301_200011215547 [0,0,1,1,0,0|1,0,0]=3 12043 B17R1.1854 CCCCNC(=O)CCCCN1CCCCC1 11a_100000102301_100000754417 [0,0,1,1,0,0|2,0,0]=4 12044 B17R1.1854 CCCCNC(=O)CCCCN1CCCCC1 240690a_100000102301_100000754417 [0,0,1,1,0,0|2,0,0]=4 12045 B17R1.1854 CCCCNC(=O)CNCCC1CCCCC1 2230a_100000738074_100000182744 [0,0,1,1,0,0|2,0,0]=4 12046 B17R1.1854 CCCCNC(=O)CNCCC1CCCCC1 34a_100000738074_100000182744 [0,0,1,1,0,0|2,0,0]=4 12047 B17R1.1854 CCCCNC(=O)COCCC1CCCCC1 34a_100011217863_100000182744 [0,0,1,1,0,0|2,0,0]=4 12048 B17R1.1854 CCCCNC(=O)COCCC1CCCCC1 7a_100011217863_100000182744 [0,0,1,1,0,0|2,0,0]=4 12049 B17R1.1854 CCCCNC(=O)CSCCC1CCCCC1 62a_100000182744_100012355289 [0,0,1,1,0,0|2,0,0]=4 12050 B17R1.1854 CCCCNC(=O)CSCCC1CCCCC1 62a_100012355289_100000182744 [0,0,1,1,0,0|2,0,0]=4 12051 B17R1.1854 CCCCNC(=O)NCCCC1CCCCC1 2708a_100000102301_100011211642 [0,0,1,1,0,0|2,0,0]=4 12052 B17R1.1854 CCCCNC(=O)NCCCC1CCCCC1 2708a_100011211642_100000102301 [0,0,1,1,0,0|2,0,0]=4 12053 B17R1.1854 CCCCNC(=O)NCCCC1CCCCC1 273464a_100000102301_100011211642 [0,0,1,1,0,0|2,0,0]=4 12054 B17R1.1854 CCCCNC(=O)NCCCC1CCCCC1 273464a_100011211642_100000102301 [0,0,1,1,0,0|2,0,0]=4 12055 B17R1.1854 CCCCNC(=O)NCCCC1CCCCC1 512a_100000102301_100011211642 [0,0,1,1,0,0|2,0,0]=4 12056 B17R1.1854 CCCCNC(=O)NCCCC1CCCCC1 512a_100011211642_100000102301 [0,0,1,1,0,0|2,0,0]=4 12057 B17R1.1854 CCCCOC(=O)CNCCC1CCCCC1 2230a_100000738074_100000211628 [0,0,1,1,0,0|1,0,0]=3 12058 B17R1.1854 CCCCOC(=O)CNCCC1CCCCC1 34a_100000738074_100000211628 [0,0,1,1,0,0|1,0,0]=3 12059 B17R1.1854 CCCCOC(=O)CNCCC1CCCCO1 2230a_100015183643_100000211628 [0,0,1,1,0,0|2,0,0]=4 12060 B17R1.1854 CCCCOC(=O)CNCCC1CCCCO1 34a_100015183643_100000211628 [0,0,1,1,0,0|2,0,0]=4 12061 B17R1.1854 CCCCOC(=O)CNCCC1CCOCC1 2230a_100000755988_100000211628 [0,0,1,1,0,0|2,0,0]=4 12062 B17R1.1854 CCCCOC(=O)CNCCC1CCOCC1 34a_100000755988_100000211628 [0,0,1,1,0,0|2,0,0]=4 12063 B17R1.1854 CCCCOC(=O)COCCC1CCCCC1 34a_100011217863_100000211628 [0,0,1,1,0,0|1,0,0]=3 12064 B17R1.1854 CCCCOC(=O)COCCC1CCCCC1 7a_100011217863_100000211628 [0,0,1,1,0,0|1,0,0]=3 12065 B17R1.1854 CCCCOC(=O)COCCC1CCCCN1 34a_100000211664_100000211628 [0,0,1,1,0,0|2,0,0]=4 12066 B17R1.1854 CCCCOC(=O)COCCC1CCCNC1 34a_100000752241_100000211628 [0,0,1,1,0,0|2,0,0]=4 12067 B17R1.1854 CCCCOC(=O)COCCC1CCNCC1 34a_100015190746_100000211628 [0,0,1,1,0,0|2,0,0]=4 12068 B17R1.1854 CCCCOC(=O)COCCC1CCOCC1 34a_100011933979_100000211628 [0,0,1,1,0,0|2,0,0]=4 12069 B17R1.1854 CCCCOC(=O)COCCC1CCOCC1 7a_100011933979_100000211628 [0,0,1,1,0,0|2,0,0]=4 12070 B17R1.1854 CCCCOC(=O)CSCCC1CCCCC1 62a_100000211628_100012355289 [0,0,1,1,0,0|1,0,0]=3 12071 B17R1.1854 CCCCOC(=O)CSCCC1CCCCC1 62a_100012355289_100000211628 [0,0,1,1,0,0|1,0,0]=3 12072 B17R1.1854 CCCCOC(=O)CSCCC1CCOCC1 62a_100000211628_100011934994 [0,0,1,1,0,0|2,0,0]=4 12073 B17R1.1854 CCCCOC(=O)CSCCC1CCOCC1 62a_100011934994_100000211628 [0,0,1,1,0,0|2,0,0]=4 12074 B17R1.1854 CCCCOC(=O)CSCCN1CCCCC1 62a_100000211628_100000739454 [0,0,1,1,0,0|2,0,0]=4 12075 B17R1.1854 CCCCOC(=O)CSCCN1CCCCC1 62a_100000739454_100000211628 [0,0,1,1,0,0|2,0,0]=4 12076 B17R1.1854 CCCCOC(=O)CSCOC1CCCCC1 62a_100000211628_100011935260 [0,0,1,1,0,0|2,0,0]=4 12077 B17R1.1854 CCCCOC(=O)CSCOC1CCCCC1 62a_100011935260_100000211628 [0,0,1,1,0,0|2,0,0]=4 12078 B17R1.1854 CCCNNC(=O)CCCCC1CCCCC1 22a_100000740057_200011215547 [0,0,1,1,0,0|2,0,0]=4 12079 B17R1.1854 CCCOCC(=O)NCCCC1CCCCC1 11a_100011211642_100000745993 [0,0,1,1,0,0|2,0,0]=4 12080 B17R1.1854 CCCOCC(=O)NCCCC1CCCCC1 1626a_100011211642_100000745993 [0,0,1,1,0,0|2,0,0]=4 12081 B17R1.1854 CCCOCC(=O)NCCCC1CCCCC1 240690a_100011211642_100000745993 [0,0,1,1,0,0|2,0,0]=4 12082 B17R1.1854 CCCOCC(=O)NCCCC1CCCCC1 34a_100000210258_200000048884 [0,0,1,1,0,0|2,0,0]=4 12083 B17R1.1854 CCCOCC(=O)NCCCC1CCCCC1 527a_100011211642_100000745993 [0,0,1,1,0,0|2,0,0]=4 12084 B17R1.1854 CCCSCC(=O)NCCCC1CCCCC1 11a_100011211642_100000217233 [0,0,1,1,0,0|2,0,0]=4 12085 B17R1.1854 CCCSCC(=O)NCCCC1CCCCC1 1626a_100011211642_100000217233 [0,0,1,1,0,0|2,0,0]=4 12086 B17R1.1854 CCCSCC(=O)NCCCC1CCCCC1 240690a_100011211642_100000217233 [0,0,1,1,0,0|2,0,0]=4 12087 B17R1.1854 CCCSCC(=O)NCCCC1CCCCC1 527a_100011211642_100000217233 [0,0,1,1,0,0|2,0,0]=4 12088 B17R1.1854 CCCSCC(=O)NCCCC1CCCCC1 62a_100000210303_200000048884 [0,0,1,1,0,0|2,0,0]=4 12089 B17R1.1854 CCCSCC(=O)NCCCC1CCCCC1 62a_200000048884_100000210303 [0,0,1,1,0,0|2,0,0]=4 12090 B17R1.1854 CCOCCC(=O)CCCCC1CCCCC1 1458a_200011215547_100011215890 [0,0,1,1,0,0|2,0,0]=4 12091 B17R1.1854 CCOCCC(=O)NCCCC1CCCCC1 11a_100011211642_100000749530 [0,0,1,1,0,0|2,0,0]=4 12092 B17R1.1854 CCOCCC(=O)NCCCC1CCCCC1 1626a_100011211642_100000749530 [0,0,1,1,0,0|2,0,0]=4 12093 B17R1.1854 CCOCCC(=O)NCCCC1CCCCC1 240690a_100011211642_100000749530 [0,0,1,1,0,0|2,0,0]=4 12094 B17R1.1854 CCOCCC(=O)NCCCC1CCCCC1 527a_100011211642_100000749530 [0,0,1,1,0,0|2,0,0]=4 12095 B17R1.1854 CCSCCC(=O)CCCCC1CCCCC1 1458a_200011215547_100000757381 [0,0,1,1,0,0|2,0,0]=4 12096 B17R1.1854 CCSCCC(=O)NCCCC1CCCCC1 11a_100011211642_100000230768 [0,0,1,1,0,0|2,0,0]=4 12097 B17R1.1854 CCSCCC(=O)NCCCC1CCCCC1 1626a_100011211642_100000230768 [0,0,1,1,0,0|2,0,0]=4 12098 B17R1.1854 CCSCCC(=O)NCCCC1CCCCC1 240690a_100011211642_100000230768 [0,0,1,1,0,0|2,0,0]=4 12099 B17R1.1854 CCSCCC(=O)NCCCC1CCCCC1 527a_100011211642_100000230768 [0,0,1,1,0,0|2,0,0]=4 12100 B17R1.1854 COCCCC(=O)CCCCC1CCCCC1 1458a_200011215547_100000740836 [0,0,1,1,0,0|2,0,0]=4 12101 B17R1.1854 COCCCC(=O)NCCCC1CCCCC1 11a_100011211642_100000741012 [0,0,1,1,0,0|2,0,0]=4 12102 B17R1.1854 COCCCC(=O)NCCCC1CCCCC1 1626a_100011211642_100000741012 [0,0,1,1,0,0|2,0,0]=4 12103 B17R1.1854 COCCCC(=O)NCCCC1CCCCC1 240690a_100011211642_100000741012 [0,0,1,1,0,0|2,0,0]=4 12104 B17R1.1854 COCCCC(=O)NCCCC1CCCCC1 527a_100011211642_100000741012 [0,0,1,1,0,0|2,0,0]=4 12105 B17R1.1854 COCCNC(=O)CCCCC1CCCCC1 1626a_100000209980_200011215547 [0,0,1,1,0,0|2,0,0]=4 12106 B17R1.1854 COCCNC(=O)CCCCC1CCCCC1 240690a_100000209980_200011215547 [0,0,1,1,0,0|2,0,0]=4 12107 B17R1.1854 COCCNC(=O)CCCCC1CCCCC1 527a_100000209980_200011215547 [0,0,1,1,0,0|2,0,0]=4 12108 B17R1.1854 COCCOC(=O)CNCCC1CCCCC1 2230a_100000738074_200000040189 [0,0,1,1,0,0|2,0,0]=4 12109 B17R1.1854 COCCOC(=O)CNCCC1CCCCC1 34a_100000738074_200000040189 [0,0,1,1,0,0|2,0,0]=4 12110 B17R1.1854 COCCOC(=O)COCCC1CCCCC1 34a_100011217863_200000040189 [0,0,1,1,0,0|2,0,0]=4 12111 B17R1.1854 COCCOC(=O)COCCC1CCCCC1 7a_100011217863_200000040189 [0,0,1,1,0,0|2,0,0]=4 12112 B17R1.1854 COCCOC(=O)CSCCC1CCCCC1 62a_100012355289_200000040189 [0,0,1,1,0,0|2,0,0]=4 12113 B17R1.1854 COCCOC(=O)CSCCC1CCCCC1 62a_200000040189_100012355289 [0,0,1,1,0,0|2,0,0]=4 12114 B17R1.1854 CSCCCC(=O)NCCCC1CCCCC1 11a_100011211642_100000173376 [0,0,1,1,0,0|2,0,0]=4 12115 B17R1.1854 CSCCCC(=O)NCCCC1CCCCC1 1626a_100011211642_100000173376 [0,0,1,1,0,0|2,0,0]=4 12116 B17R1.1854 CSCCCC(=O)NCCCC1CCCCC1 240690a_100011211642_100000173376 [0,0,1,1,0,0|2,0,0]=4 12117 B17R1.1854 CSCCCC(=O)NCCCC1CCCCC1 527a_100011211642_100000173376 [0,0,1,1,0,0|2,0,0]=4 12118 B17R1.1854 CSCCNC(=O)CCCCC1CCCCC1 11a_100020590264_200011215547 [0,0,1,1,0,0|2,0,0]=4 12119 B17R1.1854 CSCCNC(=O)CCCCC1CCCCC1 1626a_100020590264_200011215547 [0,0,1,1,0,0|2,0,0]=4 12120 B17R1.1854 CSCCNC(=O)CCCCC1CCCCC1 240690a_100020590264_200011215547 [0,0,1,1,0,0|2,0,0]=4 12121 B17R1.1854 CSCCNC(=O)CCCCC1CCCCC1 527a_100020590264_200011215547 [0,0,1,1,0,0|2,0,0]=4 12122 B17R1.1854 O=C(CCCCC1CCCCC1)NCCCF 11a_100015189416_200011215547 [0,0,1,1,0,0|2,0,0]=4 12123 B17R1.1854 O=C(CCCCC1CCCCC1)NCCCF 1626a_100015189416_200011215547 [0,0,1,1,0,0|2,0,0]=4 12124 B17R1.1854 O=C(CCCCC1CCCCC1)NCCCF 240690a_100015189416_200011215547 [0,0,1,1,0,0|2,0,0]=4 12125 B17R1.1854 O=C(CCCCC1CCCCC1)NCCCF 527a_100015189416_200011215547 [0,0,1,1,0,0|2,0,0]=4 12126 B17R1.1854 O=C(CCCCC1CCCCC1)NCCCO 240690a_100000182051_200011215547 [0,0,1,1,0,0|2,0,0]=4 12127 B17R1.1854 O=C(CCCCC1CCCCC1)NCCCO 527a_100000182051_200011215547 [0,0,1,1,0,0|2,0,0]=4 12128 B17R1.1854 O=C(CCCCF)CCCCC1CCCCC1 1458a_200011215547_100000729493 [0,0,1,1,0,0|2,0,0]=4 12129 B17R1.1854 O=C(CCCCO)CCCCC1CCCCC1 1458a_200011215547_100000210776 [0,0,1,1,0,0|2,0,0]=4 12130 B17R1.1854 O=C(CCCCO)NCCCC1CCCCC1 1626a_100011211642_100000695505 [0,0,1,1,0,0|2,0,0]=4 12131 B17R1.1873 CCCCCC(=O)CNCCCC1CCCC1 2230a_100000736752_200012276598 [0,0,1,1,0,0|2,0,0]=4 12132 B17R1.1873 CCCCCC(=O)CNCCCC1CCCC1 34a_100000736752_200012276598 [0,0,1,1,0,0|2,0,0]=4 12133 B17R1.1873 CCCCCC(=O)COCCCC1CCCC1 34a_100011215328_200012276598 [0,0,1,1,0,0|2,0,0]=4 12134 B17R1.1873 CCCCCC(=O)COCCCC1CCCC1 7a_100011215328_200012276598 [0,0,1,1,0,0|2,0,0]=4 12135 B17R1.1873 CCCCCC(=O)CSCCCC1CCCC1 62a_100011713738_200012276598 [0,0,1,1,0,0|2,0,0]=4 12136 B17R1.1873 CCCCCC(=O)CSCCCC1CCCC1 62a_200012276598_100011713738 [0,0,1,1,0,0|2,0,0]=4 12137 B17R1.1873 CCCCCC(=O)NCCCCN1CCCC1 1626a_100000740493_100000212188 [0,0,1,1,0,0|2,0,0]=4 12138 B17R1.1873 CCCCCC(=O)NCCCCN1CCCC1 240690a_100000740493_100000212188 [0,0,1,1,0,0|2,0,0]=4 12139 B17R1.1873 CCCCCC(=O)NCCCOC1CCCC1 11a_100000747560_100000212188 [0,0,1,1,0,0|2,0,0]=4 12140 B17R1.1873 CCCCCC(=O)NCCCOC1CCCC1 1626a_100000747560_100000212188 [0,0,1,1,0,0|2,0,0]=4 12141 B17R1.1873 CCCCCC(=O)NCCCOC1CCCC1 240690a_100000747560_100000212188 [0,0,1,1,0,0|2,0,0]=4 12142 B17R1.1873 CCCCCC(=O)NCCCOC1CCCC1 527a_100000747560_100000212188 [0,0,1,1,0,0|2,0,0]=4 12143 B17R1.1873 CCCCNC(=O)CNCCCC1CCCC1 2230a_100000736752_100000182744 [0,0,1,1,0,0|2,0,0]=4 12144 B17R1.1873 CCCCNC(=O)CNCCCC1CCCC1 34a_100000736752_100000182744 [0,0,1,1,0,0|2,0,0]=4 12145 B17R1.1873 CCCCNC(=O)COCCCC1CCCC1 34a_100011215328_100000182744 [0,0,1,1,0,0|2,0,0]=4 12146 B17R1.1873 CCCCNC(=O)COCCCC1CCCC1 7a_100011215328_100000182744 [0,0,1,1,0,0|2,0,0]=4 12147 B17R1.1873 CCCCNC(=O)CSCCCC1CCCC1 62a_100000182744_100011713738 [0,0,1,1,0,0|2,0,0]=4 12148 B17R1.1873 CCCCNC(=O)CSCCCC1CCCC1 62a_100011713738_100000182744 [0,0,1,1,0,0|2,0,0]=4 12149 B17R1.1873 CCCCOC(=O)CNCCCC1CCCC1 2230a_100000736752_100000211628 [0,0,1,1,0,0|1,0,0]=3 12150 B17R1.1873 CCCCOC(=O)CNCCCC1CCCC1 34a_100000736752_100000211628 [0,0,1,1,0,0|1,0,0]=3 12151 B17R1.1873 CCCCOC(=O)CNCCOC1CCCC1 34a_100000741755_100000211628 [0,0,1,1,0,0|2,0,0]=4 12152 B17R1.1873 CCCCOC(=O)COCCCC1CCCC1 34a_100011215328_100000211628 [0,0,1,1,0,0|1,0,0]=3 12153 B17R1.1873 CCCCOC(=O)COCCCC1CCCC1 7a_100011215328_100000211628 [0,0,1,1,0,0|1,0,0]=3 12154 B17R1.1873 CCCCOC(=O)COCCNC1CCCC1 34a_200000200444_100000211628 [0,0,1,1,0,0|2,0,0]=4 12155 B17R1.1873 CCCCOC(=O)COCCOC1CCCC1 34a_100000738311_100000211628 [0,0,1,1,0,0|2,0,0]=4 12156 B17R1.1873 CCCCOC(=O)COCCOC1CCCC1 7a_100000738311_100000211628 [0,0,1,1,0,0|2,0,0]=4 12157 B17R1.1873 CCCCOC(=O)CSCCCC1CCCC1 62a_100000211628_100011713738 [0,0,1,1,0,0|1,0,0]=3 12158 B17R1.1873 CCCCOC(=O)CSCCCC1CCCC1 62a_100011713738_100000211628 [0,0,1,1,0,0|1,0,0]=3 12159 B17R1.1873 CCCCOC(=O)CSCCCN1CCCC1 62a_100000211628_100011445909 [0,0,1,1,0,0|2,0,0]=4 12160 B17R1.1873 CCCCOC(=O)CSCCCN1CCCC1 62a_100016991639_100000211628 [0,0,1,1,0,0|2,0,0]=4 12161 B17R1.1873 COCCOC(=O)CNCCCC1CCCC1 2230a_100000736752_200000040189 [0,0,1,1,0,0|2,0,0]=4 12162 B17R1.1873 COCCOC(=O)CNCCCC1CCCC1 34a_100000736752_200000040189 [0,0,1,1,0,0|2,0,0]=4 12163 B17R1.1873 COCCOC(=O)COCCCC1CCCC1 34a_100011215328_200000040189 [0,0,1,1,0,0|2,0,0]=4 12164 B17R1.1873 COCCOC(=O)COCCCC1CCCC1 7a_100011215328_200000040189 [0,0,1,1,0,0|2,0,0]=4 12165 B17R1.1873 COCCOC(=O)CSCCCC1CCCC1 62a_100011713738_200000040189 [0,0,1,1,0,0|2,0,0]=4 12166 B17R1.1873 COCCOC(=O)CSCCCC1CCCC1 62a_200000040189_100011713738 [0,0,1,1,0,0|2,0,0]=4 12167 B17R1.1884 CCCCOC(=O)CNCC1CCCN1CC 2230a_100000211693_100000211628 [0,0,1,1,0,0|2,0,0]=4 12168 B17R1.1884 CCCCOC(=O)COC[C@H]1CCCN1CC 34a_100011739246_100000211628 [0,0,1,1,0,0|2,0,0]=4 12169 B17R1.1884 CCCCOC(=O)COC[C@H]1CCCN1CC 7a_100011739246_100000211628 [0,0,1,1,0,0|2,0,0]=4 12170 B17R1.1891 CCCCCC(=O)N1CCCCC1CCCO 240690a_100011934581_100000212188 [0,0,1,1,0,0|2,0,0]=4 12171 B17R1.1891 CCCCCC(=O)N1CCCCC1CCOC 11a_100015186528_100000212188 [0,0,1,1,0,0|2,0,0]=4 12172 B17R1.1891 CCCCCC(=O)N1CCCCC1CCOC 1626a_100015186528_100000212188 [0,0,1,1,0,0|2,0,0]=4 12173 B17R1.1891 CCCCCC(=O)N1CCCCC1CCOC 240690a_100015186528_100000212188 [0,0,1,1,0,0|2,0,0]=4 12174 B17R1.1891 CCCCCC(=O)N1CCCCC1CCOC 527a_100015186528_100000212188 [0,0,1,1,0,0|2,0,0]=4 12175 B17R1.3300 CCCCCC(=O)CCN1CCCCCCC1 1458a_200015187237_100000210326 [0,0,1,1,0,0|2,0,0]=4 12176 B17R1.3300 CCCCCC(=O)CNC1CCCCCCC1 2230a_100000211152_200012276598 [0,0,1,1,0,0|2,0,0]=4 12177 B17R1.3300 CCCCCC(=O)CNC1CCCCCCC1 34a_100000211152_200012276598 [0,0,1,1,0,0|2,0,0]=4 12178 B17R1.3300 CCCCCC(=O)COC1CCCCCCC1 34a_100000210054_200012276598 [0,0,1,1,0,0|2,0,0]=4 12179 B17R1.3300 CCCCCC(=O)COC1CCCCCCC1 7a_100000210054_200012276598 [0,0,1,1,0,0|2,0,0]=4 12180 B17R1.3300 CCCCCC(C)OCC1CCCCCCC1 34a_100011216312_200011218191 [0,0,1,1,0,0|1,0,1]=4 12181 B17R1.3300 CCCCCC(C)OCC1CCCCCCC1 7a_100011216312_200011218191 [0,0,1,1,0,0|1,0,1]=4 12182 B17R1.3300 CCCCNC(=O)CCN1CCCCCCC1 240690a_100000102301_200015187237 [0,0,1,1,0,0|2,0,0]=4 12183 B17R1.3300 CCCCNC(=O)CNC1CCCCCCC1 2230a_100000211152_100000182744 [0,0,1,1,0,0|2,0,0]=4 12184 B17R1.3300 CCCCNC(=O)CNC1CCCCCCC1 34a_100000211152_100000182744 [0,0,1,1,0,0|2,0,0]=4 12185 B17R1.3300 CCCCNC(=O)COC1CCCCCCC1 34a_100000210054_100000182744 [0,0,1,1,0,0|2,0,0]=4 12186 B17R1.3300 CCCCNC(=O)COC1CCCCCCC1 7a_100000210054_100000182744 [0,0,1,1,0,0|2,0,0]=4 12187 B17R1.3300 CCCCOC(=O)CNC1CCCCCCC1 2230a_100000211152_100000211628 [0,0,1,1,0,0|1,0,0]=3 12188 B17R1.3300 CCCCOC(=O)CNC1CCCCCCC1 34a_100000211152_100000211628 [0,0,1,1,0,0|1,0,0]=3 12189 B17R1.3300 CCCCOC(=O)COC1CCCCCCC1 34a_100000210054_100000211628 [0,0,1,1,0,0|1,0,0]=3 12190 B17R1.3300 CCCCOC(=O)COC1CCCCCCC1 7a_100000210054_100000211628 [0,0,1,1,0,0|1,0,0]=3 12191 B17R1.3300 COCCOC(=O)CNC1CCCCCCC1 2230a_100000211152_200000040189 [0,0,1,1,0,0|2,0,0]=4 12192 B17R1.3300 COCCOC(=O)CNC1CCCCCCC1 34a_100000211152_200000040189 [0,0,1,1,0,0|2,0,0]=4 12193 B17R1.3300 COCCOC(=O)COC1CCCCCCC1 34a_100000210054_200000040189 [0,0,1,1,0,0|2,0,0]=4 12194 B17R1.3300 COCCOC(=O)COC1CCCCCCC1 7a_100000210054_200000040189 [0,0,1,1,0,0|2,0,0]=4 12195 B17R1.3499 CCCCCC(=O)CNCC1CCCCCC1 2230a_100015204231_200012276598 [0,0,1,1,0,0|2,0,0]=4 12196 B17R1.3499 CCCCCC(=O)CNCC1CCCCCC1 34a_100015204231_200012276598 [0,0,1,1,0,0|2,0,0]=4 12197 B17R1.3499 CCCCCC(=O)COCC1CCCCCC1 34a_100000699130_200012276598 [0,0,1,1,0,0|2,0,0]=4 12198 B17R1.3499 CCCCCC(=O)COCC1CCCCCC1 7a_100000699130_200012276598 [0,0,1,1,0,0|2,0,0]=4 12199 B17R1.3499 CCCCCC(=O)CSCC1CCCCCC1 62a_200000696569_200012276598 [0,0,1,1,0,0|2,0,0]=4 12200 B17R1.3499 CCCCCC(=O)CSCC1CCCCCC1 62a_200012276598_200000696569 [0,0,1,1,0,0|2,0,0]=4 12201 B17R1.3499 CCCCCC(=O)NCCC1CCCCCC1 11a_100011532351_100000212188 [0,0,1,1,0,0|1,0,0]=3 12202 B17R1.3499 CCCCCC(=O)NCCC1CCCCCC1 1626a_100011532351_100000212188 [0,0,1,1,0,0|1,0,0]=3 12203 B17R1.3499 CCCCCC(=O)NCCC1CCCCCC1 240690a_100011532351_100000212188 [0,0,1,1,0,0|1,0,0]=3 12204 B17R1.3499 CCCCCC(=O)NCCC1CCCCCC1 527a_100011532351_100000212188 [0,0,1,1,0,0|1,0,0]=3 12205 B17R1.3499 CCCCCC(=O)NCCN1CCCCCC1 11a_100000738142_100000212188 [0,0,1,1,0,0|2,0,0]=4 12206 B17R1.3499 CCCCCC(=O)NCCN1CCCCCC1 240690a_100000738142_100000212188 [0,0,1,1,0,0|2,0,0]=4 12207 B17R1.3499 CCCCCC(=O)NCCN1CCCCCC1 527a_100000738142_100000212188 [0,0,1,1,0,0|2,0,0]=4 12208 B17R1.3499 CCCCNC(=O)CNCC1CCCCCC1 2230a_100015204231_100000182744 [0,0,1,1,0,0|2,0,0]=4 12209 B17R1.3499 CCCCNC(=O)CNCC1CCCCCC1 34a_100015204231_100000182744 [0,0,1,1,0,0|2,0,0]=4 12210 B17R1.3499 CCCCNC(=O)COCC1CCCCCC1 34a_100000699130_100000182744 [0,0,1,1,0,0|2,0,0]=4 12211 B17R1.3499 CCCCNC(=O)COCC1CCCCCC1 7a_100000699130_100000182744 [0,0,1,1,0,0|2,0,0]=4 12212 B17R1.3499 CCCCNC(=O)CSCC1CCCCCC1 62a_100000182744_200000696569 [0,0,1,1,0,0|2,0,0]=4 12213 B17R1.3499 CCCCNC(=O)CSCC1CCCCCC1 62a_200000696569_100000182744 [0,0,1,1,0,0|2,0,0]=4 12214 B17R1.3499 CCCCNC(=O)NCCC1CCCCCC1 2708a_100000102301_100011532351 [0,0,1,1,0,0|2,0,0]=4 12215 B17R1.3499 CCCCNC(=O)NCCC1CCCCCC1 2708a_100011532351_100000102301 [0,0,1,1,0,0|2,0,0]=4 12216 B17R1.3499 CCCCNC(=O)NCCC1CCCCCC1 273464a_100000102301_100011532351 [0,0,1,1,0,0|2,0,0]=4 12217 B17R1.3499 CCCCNC(=O)NCCC1CCCCCC1 273464a_100011532351_100000102301 [0,0,1,1,0,0|2,0,0]=4 12218 B17R1.3499 CCCCNC(=O)NCCC1CCCCCC1 512a_100000102301_100011532351 [0,0,1,1,0,0|2,0,0]=4 12219 B17R1.3499 CCCCOC(=O)CNCC1CCCCCC1 2230a_100015204231_100000211628 [0,0,1,1,0,0|1,0,0]=3 12220 B17R1.3499 CCCCOC(=O)CNCC1CCCCCC1 34a_100015204231_100000211628 [0,0,1,1,0,0|1,0,0]=3 12221 B17R1.3499 CCCCOC(=O)COCC1CCCCCC1 34a_100000699130_100000211628 [0,0,1,1,0,0|1,0,0]=3 12222 B17R1.3499 CCCCOC(=O)COCC1CCCCCC1 7a_100000699130_100000211628 [0,0,1,1,0,0|1,0,0]=3 12223 B17R1.3499 CCCCOC(=O)CSCC1CCCCCC1 62a_100000211628_200000696569 [0,0,1,1,0,0|1,0,0]=3 12224 B17R1.3499 CCCCOC(=O)CSCC1CCCCCC1 62a_200000696569_100000211628 [0,0,1,1,0,0|1,0,0]=3 12225 B17R1.3499 CCCOCC(=O)NCCC1CCCCCC1 11a_100011532351_100000745993 [0,0,1,1,0,0|2,0,0]=4 12226 B17R1.3499 CCCOCC(=O)NCCC1CCCCCC1 1626a_100011532351_100000745993 [0,0,1,1,0,0|2,0,0]=4 12227 B17R1.3499 CCCOCC(=O)NCCC1CCCCCC1 240690a_100011532351_100000745993 [0,0,1,1,0,0|2,0,0]=4 12228 B17R1.3499 CCCOCC(=O)NCCC1CCCCCC1 527a_100011532351_100000745993 [0,0,1,1,0,0|2,0,0]=4 12229 B17R1.3499 CCCSCC(=O)NCCC1CCCCCC1 11a_100011532351_100000217233 [0,0,1,1,0,0|2,0,0]=4 12230 B17R1.3499 CCCSCC(=O)NCCC1CCCCCC1 1626a_100011532351_100000217233 [0,0,1,1,0,0|2,0,0]=4 12231 B17R1.3499 CCCSCC(=O)NCCC1CCCCCC1 240690a_100011532351_100000217233 [0,0,1,1,0,0|2,0,0]=4 12232 B17R1.3499 CCCSCC(=O)NCCC1CCCCCC1 527a_100011532351_100000217233 [0,0,1,1,0,0|2,0,0]=4 12233 B17R1.3499 CCOCCC(=O)NCCC1CCCCCC1 11a_100011532351_100000749530 [0,0,1,1,0,0|2,0,0]=4 12234 B17R1.3499 CCOCCC(=O)NCCC1CCCCCC1 1626a_100011532351_100000749530 [0,0,1,1,0,0|2,0,0]=4 12235 B17R1.3499 CCOCCC(=O)NCCC1CCCCCC1 240690a_100011532351_100000749530 [0,0,1,1,0,0|2,0,0]=4 12236 B17R1.3499 CCOCCC(=O)NCCC1CCCCCC1 527a_100011532351_100000749530 [0,0,1,1,0,0|2,0,0]=4 12237 B17R1.3499 CCSCCC(=O)NCCC1CCCCCC1 11a_100011532351_100000230768 [0,0,1,1,0,0|2,0,0]=4 12238 B17R1.3499 CCSCCC(=O)NCCC1CCCCCC1 1626a_100011532351_100000230768 [0,0,1,1,0,0|2,0,0]=4 12239 B17R1.3499 CCSCCC(=O)NCCC1CCCCCC1 240690a_100011532351_100000230768 [0,0,1,1,0,0|2,0,0]=4 12240 B17R1.3499 CCSCCC(=O)NCCC1CCCCCC1 527a_100011532351_100000230768 [0,0,1,1,0,0|2,0,0]=4 12241 B17R1.3499 COCCCC(=O)NCCC1CCCCCC1 11a_100011532351_100000741012 [0,0,1,1,0,0|2,0,0]=4 12242 B17R1.3499 COCCCC(=O)NCCC1CCCCCC1 1626a_100011532351_100000741012 [0,0,1,1,0,0|2,0,0]=4 12243 B17R1.3499 COCCCC(=O)NCCC1CCCCCC1 240690a_100011532351_100000741012 [0,0,1,1,0,0|2,0,0]=4 12244 B17R1.3499 COCCCC(=O)NCCC1CCCCCC1 527a_100011532351_100000741012 [0,0,1,1,0,0|2,0,0]=4 12245 B17R1.3499 COCCOC(=O)CNCC1CCCCCC1 2230a_100015204231_200000040189 [0,0,1,1,0,0|2,0,0]=4 12246 B17R1.3499 COCCOC(=O)CNCC1CCCCCC1 34a_100015204231_200000040189 [0,0,1,1,0,0|2,0,0]=4 12247 B17R1.3499 COCCOC(=O)COCC1CCCCCC1 34a_100000699130_200000040189 [0,0,1,1,0,0|2,0,0]=4 12248 B17R1.3499 COCCOC(=O)COCC1CCCCCC1 7a_100000699130_200000040189 [0,0,1,1,0,0|2,0,0]=4 12249 B17R1.3499 COCCOC(=O)CSCC1CCCCCC1 62a_200000040189_200000696569 [0,0,1,1,0,0|2,0,0]=4 12250 B17R1.3499 COCCOC(=O)CSCC1CCCCCC1 62a_200000696569_200000040189 [0,0,1,1,0,0|2,0,0]=4 12251 B17R1.3499 CSCCCC(=O)NCCC1CCCCCC1 11a_100011532351_100000173376 [0,0,1,1,0,0|2,0,0]=4 12252 B17R1.3499 CSCCCC(=O)NCCC1CCCCCC1 1626a_100011532351_100000173376 [0,0,1,1,0,0|2,0,0]=4 12253 B17R1.3499 CSCCCC(=O)NCCC1CCCCCC1 240690a_100011532351_100000173376 [0,0,1,1,0,0|2,0,0]=4 12254 B17R1.3499 CSCCCC(=O)NCCC1CCCCCC1 527a_100011532351_100000173376 [0,0,1,1,0,0|2,0,0]=4 12255 B17R1.3499 O=C(CCCCO)NCCC1CCCCCC1 1626a_100011532351_100000695505 [0,0,1,1,0,0|2,0,0]=4 12256 B17R1.3711 CCCC1CCCCN1CC(=O)OCCOC 2230a_100000701414_200000040189 [0,0,1,1,0,0|2,0,0]=4 12257 B17R1.3711 CCCC1CCCCN1CC(=O)OCCOC 269982a_100000701414_200000040189 [0,0,1,1,0,0|2,0,0]=4 12258 B17R1.3711 CCCC1CCCCN1CC(=O)OCCOC 34a_100000701414_200000040189 [0,0,1,1,0,0|2,0,0]=4 12259 B17R1.3711 CCCCCC(=O)CN1CCCCC1CCC 2230a_100000701414_200012276598 [0,0,1,1,0,0|2,0,0]=4 12260 B17R1.3711 CCCCCC(=O)CN1CCCCC1CCC 269982a_100000701414_200012276598 [0,0,1,1,0,0|2,0,0]=4 12261 B17R1.3711 CCCCCC(=O)CN1CCCCC1CCC 34a_100000701414_200012276598 [0,0,1,1,0,0|2,0,0]=4 12262 B17R1.3711 CCCCCC(C)OC1CCCCC1CCC 34a_100011217265_200011218191 [0,0,1,1,0,0|1,0,1]=4 12263 B17R1.3711 CCCCCC(C)OC1CCCCC1CCC 7a_100011217265_200011218191 [0,0,1,1,0,0|1,0,1]=4 12264 B17R1.3711 CCCCNC(=O)CN1CCCCC1CCC 2230a_100000701414_100000182744 [0,0,1,1,0,0|2,0,0]=4 12265 B17R1.3711 CCCCNC(=O)CN1CCCCC1CCC 269982a_100000701414_100000182744 [0,0,1,1,0,0|2,0,0]=4 12266 B17R1.3711 CCCCNC(=O)CN1CCCCC1CCC 34a_100000701414_100000182744 [0,0,1,1,0,0|2,0,0]=4 12267 B17R1.3711 CCCCOC(=O)CN1CCCCC1CCC 2230a_100000701414_100000211628 [0,0,1,1,0,0|1,0,0]=3 12268 B17R1.3711 CCCCOC(=O)CN1CCCCC1CCC 269982a_100000701414_100000211628 [0,0,1,1,0,0|1,0,0]=3 12269 B17R1.3711 CCCCOC(=O)CN1CCCCC1CCC 34a_100000701414_100000211628 [0,0,1,1,0,0|1,0,0]=3 12270 B17R1.3711 CCCCOC(=O)CN1CCCCC1CCO 2230a_100000211664_100000211628 [0,0,1,1,0,0|2,0,0]=4 12271 B17R1.3711 CCCCOC(=O)CN1CCCCC1CCO 269982a_100000211664_100000211628 [0,0,1,1,0,0|2,0,0]=4 12272 B17R1.3711 CCCCOC(=O)CN1CCCCC1CCO 34a_100000211664_100000211628 [0,0,1,1,0,0|2,0,0]=4 12273 B17R1.3711 CCCCOC(=O)CN1CCCCC1COC 2230a_100015184032_100000211628 [0,0,1,1,0,0|2,0,0]=4 12274 B17R1.3711 CCCCOC(=O)CN1CCCCC1COC 269982a_100015184032_100000211628 [0,0,1,1,0,0|2,0,0]=4 12275 B17R1.3711 CCCCOC(=O)CN1CCCCC1COC 34a_100015184032_100000211628 [0,0,1,1,0,0|2,0,0]=4 12276 B17R1.3711 CCCCOC(=O)CN1CCOCC1CCC 2230a_102495339903_100000211628 [0,0,1,1,0,0|2,0,0]=4 12277 B17R1.3711 CCCCOC(=O)CN1CCOCC1CCC 269982a_102495339903_100000211628 [0,0,1,1,0,0|2,0,0]=4 12278 B17R1.3711 CCCCOC(=O)CN1CCOCC1CCC 34a_102495339903_100000211628 [0,0,1,1,0,0|2,0,0]=4 12279 B17R1.3714 CCCCCC(=O)CN1CCCCCCCC1 2230a_100000039187_200012276598 [0,0,1,1,0,0|2,0,0]=4 12280 B17R1.3714 CCCCCC(=O)CN1CCCCCCCC1 269982a_100000039187_200012276598 [0,0,1,1,0,0|2,0,0]=4 12281 B17R1.3714 CCCCCC(=O)CN1CCCCCCCC1 34a_100000039187_200012276598 [0,0,1,1,0,0|2,0,0]=4 12282 B17R1.3714 CCCCNC(=O)CN1CCCCCCCC1 2230a_100000039187_100000182744 [0,0,1,1,0,0|2,0,0]=4 12283 B17R1.3714 CCCCNC(=O)CN1CCCCCCCC1 269982a_100000039187_100000182744 [0,0,1,1,0,0|2,0,0]=4 12284 B17R1.3714 CCCCNC(=O)CN1CCCCCCCC1 34a_100000039187_100000182744 [0,0,1,1,0,0|2,0,0]=4 12285 B17R1.3714 CCCCOC(=O)CN1CCCCCCCC1 2230a_100000039187_100000211628 [0,0,1,1,0,0|1,0,0]=3 12286 B17R1.3714 CCCCOC(=O)CN1CCCCCCCC1 269982a_100000039187_100000211628 [0,0,1,1,0,0|1,0,0]=3 12287 B17R1.3714 CCCCOC(=O)CN1CCCCCCCC1 34a_100000039187_100000211628 [0,0,1,1,0,0|1,0,0]=3 12288 B17R1.3714 COCCOC(=O)CN1CCCCCCCC1 2230a_100000039187_200000040189 [0,0,1,1,0,0|2,0,0]=4 12289 B17R1.3714 COCCOC(=O)CN1CCCCCCCC1 269982a_100000039187_200000040189 [0,0,1,1,0,0|2,0,0]=4 12290 B17R1.3714 COCCOC(=O)CN1CCCCCCCC1 34a_100000039187_200000040189 [0,0,1,1,0,0|2,0,0]=4 12291 B17R1.6340 CCCCOC(=O)COCCC1CCCN1C 34a_100011215177_100000211628 [0,0,1,1,0,0|2,0,0]=4 12292 B17R1.6340 CCCCOC(=O)COCCC1CCCN1C 7a_100011215177_100000211628 [0,0,1,1,0,0|2,0,0]=4 12293 B17R1.6340 CCCCOC(=O)CSCCC1CCCN1C 62a_100000005710_100000211628 [0,0,1,1,0,0|2,0,0]=4 12294 B17R1.6340 CCCCOC(=O)CSCCC1CCCN1C 62a_100000211628_100000005710 [0,0,1,1,0,0|2,0,0]=4 12295 B17R1.6363 CCCCOC1CCCCCCCCCCC1 34a_100000211378_100000210210 [0,0,1,1,0,0|1,0,1]=4 12296 B17R1.6363 CCCCOC1CCCCCCCCCCC1 7a_100000211378_100000210211 [0,0,1,1,0,0|1,0,1]=4 12297 B17R1.8944 CCCCCC(=O)NCCN1CCCCC1C 240690a_100000739827_100000212188 [0,0,1,1,0,0|2,0,0]=4 12298 B17R1.8944 CCCCCC(=O)NCCN1CCCCC1C 527a_100000739827_100000212188 [0,0,1,1,0,0|2,0,0]=4 12299 B17R1.8944 CCCCOC(=O)CNCC1CCCCC1O 34a_100011216029_100000211628 [0,0,1,1,0,0|2,0,0]=4 12300 B17R1.8944 CCCCOC(=O)CNCC1CCCCN1C 34a_100011228421_100000211628 [0,0,1,1,0,0|2,0,0]=4 12301 B17R1.8944 CCCCOC(=O)COCC1CCCCN1C 34a_100000225079_100000211628 [0,0,1,1,0,0|2,0,0]=4 12302 B17R1.8944 CCCCOC(=O)CSCC1CCCCN1C 62a_100000211628_100015185383 [0,0,1,1,0,0|2,0,0]=4 12303 B17R1.8944 CCCCOC(=O)CSCC1CCCCN1C 62a_100015185383_100000211628 [0,0,1,1,0,0|2,0,0]=4 12304 B17R1.26143 CCC1CC1C(=O)CCCCCCCCCO 1458a_200011661523_100009813782 [0,0,1,1,0,0|2,0,0]=4 12305 B17R1.26143 CCC1CC1C(=O)NCCCCCCCCO 240690a_102515433106_200011661523 [0,0,1,1,0,0|2,0,0]=4 12306 B17R1.26143 CCCCCCCCCCC(=O)C1CC1CC 1458a_200011661523_100000210319 [0,0,1,1,0,0|1,0,0]=3 12307 B17R1.26143 CCCCCCCCCNC(=O)C1CC1CC 11a_100000212291_200011661523 [0,0,1,1,0,0|1,0,0]=3 12308 B17R1.26143 CCCCCCCCCNC(=O)C1CC1CC 1626a_100000212291_200011661523 [0,0,1,1,0,0|1,0,0]=3 12309 B17R1.26143 CCCCCCCCCNC(=O)C1CC1CC 240690a_100000212291_200011661523 [0,0,1,1,0,0|1,0,0]=3 12310 B17R1.26143 CCCCCCCCCNC(=O)C1CC1CC 527a_100000212291_200011661523 [0,0,1,1,0,0|1,0,0]=3 12311 B17R1.26144 CCCCCCCCCCC(=O)N[C@@H]1C[C@@H]1F 240690a_100015190264_100000210375 [0,0,1,1,0,0|2,0,0]=4 12312 B17R1.26144 CCCCCCCCCCC(=O)N[C@@H]1C[C@H]1F 11a_100025746932_100000210375 [0,0,1,1,0,0|2,0,0]=4 12313 B17R1.26144 CCCCCCCCCCC(=O)N[C@@H]1C[C@H]1F 1626a_100025746932_100000210375 [0,0,1,1,0,0|2,0,0]=4 12314 B17R1.26144 CCCCCCCCCCC(=O)N[C@@H]1C[C@H]1F 240690a_100025746932_100000210375 [0,0,1,1,0,0|2,0,0]=4 12315 B17R1.26145 CCCCCCCCC=CC(=O)CC1CCC1 1458a_100015345288_100000763275 [0,0,1,1,0,0|1,0,1]=4 12316 B17R1.26145 CCCCCCCCCCC(=O)C=C1CCC1 1458a_100000686340_100000210319 [0,0,1,1,0,0|1,0,1]=4 12317 B17R1.26145 CCCCCCCCCCC(=O)CC1CCC1 1458a_100000210375_100000763275 [0,0,1,1,0,0|1,0,0]=3 12318 B17R1.26145 CCCCCCCCCCC(=O)CC1CCC1 1458a_100000763092_100000210319 [0,0,1,1,0,0|1,0,0]=3 12319 B17R1.26145 CCCCCCCCCCC(=O)CC1CCO1 1458a_100000210375_100000103362 [0,0,1,1,0,0|2,0,0]=4 12320 B17R1.26145 CCCCCCCCCCC(=O)CC1COC1 1458a_100000210375_100010264016 [0,0,1,1,0,0|2,0,0]=4 12321 B17R1.26145 CCCCCCCCCCC(=O)CC1COC1 1458a_100000687760_100000210319 [0,0,1,1,0,0|2,0,0]=4 12322 B17R1.26145 CCCCCCCCCCC(=O)NC1CCC1 11a_100000749019_100000210375 [0,0,1,1,0,0|1,0,0]=3 12323 B17R1.26145 CCCCCCCCCCC(=O)NC1CCC1 1626a_100000749019_100000210375 [0,0,1,1,0,0|1,0,0]=3 12324 B17R1.26145 CCCCCCCCCCC(=O)NC1CCC1 240690a_100000749019_100000210375 [0,0,1,1,0,0|1,0,0]=3 12325 B17R1.26145 CCCCCCCCCCC(=O)NC1COC1 11a_100016991112_100000210375 [0,0,1,1,0,0|2,0,0]=4 12326 B17R1.26145 CCCCCCCCCCC(=O)NC1COC1 1626a_100016991112_100000210375 [0,0,1,1,0,0|2,0,0]=4 12327 B17R1.26145 CCCCCCCCCCC(=O)NC1COC1 240690a_100016991112_100000210375 [0,0,1,1,0,0|2,0,0]=4 12328 B17R1.26145 CCCCCCCCCCC(=O)NC1CSC1 11a_100016994217_100000210375 [0,0,1,1,0,0|2,0,0]=4 12329 B17R1.26145 CCCCCCCCCCC(=O)NC1CSC1 1626a_100016994217_100000210375 [0,0,1,1,0,0|2,0,0]=4 12330 B17R1.26145 CCCCCCCCCCC(=O)NC1CSC1 240690a_100016994217_100000210375 [0,0,1,1,0,0|2,0,0]=4 12331 B17R1.26145 CCCCCCCCCCC(C)OC1CCC1 34a_100011215000_100000749161 [0,0,1,1,0,0|1,0,1]=4 12332 B17R1.26145 CCCCCCCCCNC(=O)CC1CCC1 11a_100000212291_100000763092 [0,0,1,1,0,0|1,0,0]=3 12333 B17R1.26145 CCCCCCCCCNC(=O)CC1CCC1 1626a_100000212291_100000763092 [0,0,1,1,0,0|1,0,0]=3 12334 B17R1.26145 CCCCCCCCCNC(=O)CC1CCC1 240690a_100000212291_100000763092 [0,0,1,1,0,0|1,0,0]=3 12335 B17R1.26145 CCCCCCCCCNC(=O)CC1CCC1 527a_100000212291_100000763092 [0,0,1,1,0,0|1,0,0]=3 12336 B17R1.26145 CCCCCCCCCNC(=O)CC1COC1 11a_100000212291_100000687760 [0,0,1,1,0,0|2,0,0]=4 12337 B17R1.26145 CCCCCCCCCNC(=O)CC1COC1 1626a_100000212291_100000687760 [0,0,1,1,0,0|2,0,0]=4 12338 B17R1.26145 CCCCCCCCCNC(=O)NC1CCC1 2708a_100000212291_100000749019 [0,0,1,1,0,0|2,0,0]=4 12339 B17R1.26145 CCCCCCCCCNC(=O)NC1CCC1 273464a_100000212291_100000749019 [0,0,1,1,0,0|2,0,0]=4 12340 B17R1.26145 CCCCCCCCCNC(=O)NC1CCC1 273464a_100000749019_100000212291 [0,0,1,1,0,0|2,0,0]=4 12341 B17R1.26145 CCCCCCCCCNC(=O)NC1CCC1 512a_100000212291_100000749019 [0,0,1,1,0,0|2,0,0]=4 12342 B17R1.26145 CCCCCCCCCNC(=O)NC1CCC1 512a_100000749019_100000212291 [0,0,1,1,0,0|2,0,0]=4 12343 B17R1.26145 CCCCCCCCOCC(=O)CC1CCC1 1458a_100000759886_100000763275 [0,0,1,1,0,0|2,0,0]=4 12344 B17R1.26145 CCCCCCCCOCC(=O)NC1CCC1 11a_100000749019_100000759886 [0,0,1,1,0,0|2,0,0]=4 12345 B17R1.26145 CCCCCCCCOCC(=O)NC1CCC1 1626a_100000749019_100000759886 [0,0,1,1,0,0|2,0,0]=4 12346 B17R1.26145 CCCCCCCCOCC(=O)NC1CCC1 240690a_100000749019_100000759886 [0,0,1,1,0,0|2,0,0]=4 12347 B17R1.26145 CCCCCCCCOCC(=O)NC1CCC1 527a_100000749019_100000759886 [0,0,1,1,0,0|2,0,0]=4 12348 B17R1.26145 O=C(CC1CCC1)NCCCCCCCCO 240690a_102515433106_100000763092 [0,0,1,1,0,0|2,0,0]=4 12349 B17R1.26145 O=C(CCCCCCCCCF)CC1CCC1 1458a_200009909015_100000763275 [0,0,1,1,0,0|2,0,0]=4 12350 B17R1.26145 O=C(CCCCCCCCCF)NC1CCC1 11a_100000749019_200009909015 [0,0,1,1,0,0|2,0,0]=4 12351 B17R1.26145 O=C(CCCCCCCCCF)NC1CCC1 240690a_100000749019_200009909015 [0,0,1,1,0,0|2,0,0]=4 12352 B17R1.26145 O=C(CCCCCCCCCF)NC1CCC1 527a_100000749019_200009909015 [0,0,1,1,0,0|2,0,0]=4 12353 B17R1.26145 O=C(CCCCCCCCCO)CC1CCC1 1458a_100000763092_100009813782 [0,0,1,1,0,0|2,0,0]=4 12354 B17R1.26145 O=C(CCCCCCCCCO)NC1CCC1 240690a_100000749019_100000032657 [0,0,1,1,0,0|2,0,0]=4 12355 B17R1.26146 CCCCCCCCC=CC(=O)CCC1CC1 1458a_100015345288_100000694398 [0,0,1,1,0,0|1,0,1]=4 12356 B17R1.26146 CCCCCCCCCCC(=O)C=CC1CC1 1458a_100102529529_100000210319 [0,0,1,1,0,0|1,0,1]=4 12357 B17R1.26146 CCCCCCCCCCC(=O)CCC1CC1 1458a_100000210375_100000694398 [0,0,1,1,0,0|1,0,0]=3 12358 B17R1.26146 CCCCCCCCCCC(=O)CCC1CC1 1458a_100000756386_100000210319 [0,0,1,1,0,0|1,0,0]=3 12359 B17R1.26146 CCCCCCCCCCC(=O)CCC1CO1 1458a_100000210375_100000732470 [0,0,1,1,0,0|2,0,0]=4 12360 B17R1.26146 CCCCCCCCCCC(=O)NCC1CC1 11a_100000735609_100000210375 [0,0,1,1,0,0|1,0,0]=3 12361 B17R1.26146 CCCCCCCCCCC(=O)NCC1CC1 1626a_100000735609_100000210375 [0,0,1,1,0,0|1,0,0]=3 12362 B17R1.26146 CCCCCCCCCCC(=O)NCC1CC1 240690a_100000735609_100000210375 [0,0,1,1,0,0|1,0,0]=3 12363 B17R1.26146 CCCCCCCCCCC(=O)NNC1CC1 22a_100000701032_100000210375 [0,0,1,1,0,0|2,0,0]=4 12364 B17R1.26146 CCCCCCCCCCC(C)OCC1CC1 34a_100011215000_100000742324 [0,0,1,1,0,0|1,0,1]=4 12365 B17R1.26146 CCCCCCCCCCC(C)OCC1CC1 7a_100011215000_100000742324 [0,0,1,1,0,0|1,0,1]=4 12366 B17R1.26146 CCCCCCCCCNC(=O)CCC1CC1 11a_100000212291_100000756386 [0,0,1,1,0,0|1,0,0]=3 12367 B17R1.26146 CCCCCCCCCNC(=O)CCC1CC1 1626a_100000212291_100000756386 [0,0,1,1,0,0|1,0,0]=3 12368 B17R1.26146 CCCCCCCCCNC(=O)CCC1CC1 240690a_100000212291_100000756386 [0,0,1,1,0,0|1,0,0]=3 12369 B17R1.26146 CCCCCCCCCNC(=O)CCC1CC1 527a_100000212291_100000756386 [0,0,1,1,0,0|1,0,0]=3 12370 B17R1.26146 CCCCCCCCCNC(=O)NCC1CC1 2708a_100000212291_100000735609 [0,0,1,1,0,0|2,0,0]=4 12371 B17R1.26146 CCCCCCCCCNC(=O)NCC1CC1 2708a_100000735609_100000212291 [0,0,1,1,0,0|2,0,0]=4 12372 B17R1.26146 CCCCCCCCCNC(=O)NCC1CC1 273464a_100000212291_100000735609 [0,0,1,1,0,0|2,0,0]=4 12373 B17R1.26146 CCCCCCCCCNC(=O)NCC1CC1 273464a_100000735609_100000212291 [0,0,1,1,0,0|2,0,0]=4 12374 B17R1.26146 CCCCCCCCCNC(=O)NCC1CC1 512a_100000212291_100000735609 [0,0,1,1,0,0|2,0,0]=4 12375 B17R1.26146 CCCCCCCCCNC(=O)NCC1CC1 512a_100000735609_100000212291 [0,0,1,1,0,0|2,0,0]=4 12376 B17R1.26146 CCCCCCCCOCC(=O)CCC1CC1 1458a_100000759886_100000694398 [0,0,1,1,0,0|2,0,0]=4 12377 B17R1.26146 CCCCCCCCOCC(=O)NCC1CC1 11a_100000735609_100000759886 [0,0,1,1,0,0|2,0,0]=4 12378 B17R1.26146 CCCCCCCCOCC(=O)NCC1CC1 1626a_100000735609_100000759886 [0,0,1,1,0,0|2,0,0]=4 12379 B17R1.26146 CCCCCCCCOCC(=O)NCC1CC1 240690a_100000735609_100000759886 [0,0,1,1,0,0|2,0,0]=4 12380 B17R1.26146 CCCCCCCCOCC(=O)NCC1CC1 527a_100000735609_100000759886 [0,0,1,1,0,0|2,0,0]=4 12381 B17R1.26146 O=C(CCC1CC1)NCCCCCCCCO 240690a_102515433106_100000756386 [0,0,1,1,0,0|2,0,0]=4 12382 B17R1.26146 O=C(CCCCCCCCCF)CCC1CC1 1458a_200009909015_100000694398 [0,0,1,1,0,0|2,0,0]=4 12383 B17R1.26146 O=C(CCCCCCCCCF)NCC1CC1 11a_100000735609_200009909015 [0,0,1,1,0,0|2,0,0]=4 12384 B17R1.26146 O=C(CCCCCCCCCF)NCC1CC1 240690a_100000735609_200009909015 [0,0,1,1,0,0|2,0,0]=4 12385 B17R1.26146 O=C(CCCCCCCCCF)NCC1CC1 527a_100000735609_200009909015 [0,0,1,1,0,0|2,0,0]=4 12386 B17R1.26146 O=C(CCCCCCCCCO)CCC1CC1 1458a_100000756386_100009813782 [0,0,1,1,0,0|2,0,0]=4 12387 B17R1.26146 O=C(CCCCCCCCCO)NCC1CC1 240690a_100000735609_100000032657 [0,0,1,1,0,0|2,0,0]=4 12388 B17R1.26147 CC1CCN1C(=O)CCCCCCCCCF 11a_100000755817_200009909015 [0,0,1,1,0,0|2,0,0]=4 12389 B17R1.26147 CC1CCN1C(=O)CCCCCCCCCF 240690a_100000755817_200009909015 [0,0,1,1,0,0|2,0,0]=4 12390 B17R1.26147 CC1CCN1C(=O)CCCCCCCCCF 527a_100000755817_200009909015 [0,0,1,1,0,0|2,0,0]=4 12391 B17R1.26147 CC1CCN1C(=O)CCCCCCCCCO 240690a_100000755817_100000032657 [0,0,1,1,0,0|2,0,0]=4 12392 B17R1.26147 CCCCCCCCCCC(=O)N1CCC1C 11a_100000755817_100000210375 [0,0,1,1,0,0|1,0,0]=3 12393 B17R1.26147 CCCCCCCCCCC(=O)N1CCC1C 240690a_100000755817_100000210375 [0,0,1,1,0,0|1,0,0]=3 12394 B17R1.26147 CCCCCCCCCNC(=O)N1CCC1C 2708a_100000212291_100000755817 [0,0,1,1,0,0|2,0,0]=4 12395 B17R1.26147 CCCCCCCCCNC(=O)N1CCC1C 273464a_100000212291_100000755817 [0,0,1,1,0,0|2,0,0]=4 12396 B17R1.26147 CCCCCCCCOCC(=O)N1CCC1C 11a_100000755817_100000759886 [0,0,1,1,0,0|2,0,0]=4 12397 B17R1.26147 CCCCCCCCOCC(=O)N1CCC1C 240690a_100000755817_100000759886 [0,0,1,1,0,0|2,0,0]=4 12398 B17R1.26147 CCCCCCCCOCC(=O)N1CCC1C 527a_100000755817_100000759886 [0,0,1,1,0,0|2,0,0]=4 12399 B17R1.29199 CCCCCCCCCOC1CCCCCC1 34a_100000210712_100011217769 [0,0,1,1,0,0|1,0,1]=4 12400 B17R1.29199 CCCCCCCCCOC1CCCCCC1 34a_100000210887_100011214924 [0,0,1,1,0,0|1,0,1]=4 12401 B17R1.29199 CCCCCCCCCOC1CCCCCC1 7a_100000210887_100000210328 [0,0,1,1,0,0|1,0,1]=4 12402 B17R1.106509 CCCCCCCCCOC1(CCCCC1)C 34a_100011215885_100011214924 [0,0,1,1,0,0|1,0,1]=4 12403 B17R1.106509 CCCCCCCCCOC1(CCCCC1)C 7a_100011215885_100000210328 [0,0,1,1,0,0|1,0,1]=4 12404 B17R1.1287 CCCCCC#CC(=O)CCC1CCCCC1 1458a_100011215388_100011273959 [0,0,1,1,0,0|1,0,1]=4 12405 B17R1.1287 CCCCCC=CC(=O)CCC1CCCCC1 1458a_100016263427_100011273959 [0,0,1,1,0,0|1,0,1]=4 12406 B17R1.1287 CCCCCCCC(=O)C=CC1CCCCC1 1458a_100102566626_100000210614 [0,0,1,1,0,0|1,0,1]=4 12407 B17R1.1287 CCCCCCCC(=O)CCC1CCCCC1 1458a_100000211375_100000210614 [0,0,1,1,0,0|1,0,0]=3 12408 B17R1.1287 CCCCCCCC(=O)CCC1CCCCC1 1458a_100000211969_100011273959 [0,0,1,1,0,0|1,0,0]=3 12409 B17R1.1287 CCCCCCCC(=O)CCC1CCOCC1 1458a_100000211969_100011934994 [0,0,1,1,0,0|2,0,0]=4 12410 B17R1.1287 CCCCCCCC(=O)CCN1CCCCC1 1458a_100000211969_100000739454 [0,0,1,1,0,0|2,0,0]=4 12411 B17R1.1287 CCCCCCCC(=O)CCN1CCCCC1 1458a_100000743487_100000210614 [0,0,1,1,0,0|2,0,0]=4 12412 B17R1.1287 CCCCCCCC(=O)COC1CCCCC1 1458a_100000211969_100011935260 [0,0,1,1,0,0|2,0,0]=4 12413 B17R1.1287 CCCCCCCC(=O)COC1CCCCC1 1458a_100011223303_100000210614 [0,0,1,1,0,0|2,0,0]=4 12414 B17R1.1287 CCCCCCCC(=O)NCC1CCCCC1 11a_100000210473_100000211969 [0,0,1,1,0,0|1,0,0]=3 12415 B17R1.1287 CCCCCCCC(=O)NCC1CCCCC1 1626a_100000210473_100000211969 [0,0,1,1,0,0|1,0,0]=3 12416 B17R1.1287 CCCCCCCC(=O)NCC1CCCCC1 240690a_100000210473_100000211969 [0,0,1,1,0,0|1,0,0]=3 12417 B17R1.1287 CCCCCCCC(=O)NCC1CCCCC1 527a_100000210473_100000211969 [0,0,1,1,0,0|1,0,0]=3 12418 B17R1.1287 CCCCCCCC(=O)NCC1CCCCO1 11a_100000174945_100000211969 [0,0,1,1,0,0|2,0,0]=4 12419 B17R1.1287 CCCCCCCC(=O)NCC1CCCCO1 1626a_100000174945_100000211969 [0,0,1,1,0,0|2,0,0]=4 12420 B17R1.1287 CCCCCCCC(=O)NCC1CCCCO1 240690a_100000174945_100000211969 [0,0,1,1,0,0|2,0,0]=4 12421 B17R1.1287 CCCCCCCC(=O)NCC1CCCCO1 527a_100000174945_100000211969 [0,0,1,1,0,0|2,0,0]=4 12422 B17R1.1287 CCCCCCCC(=O)NCC1CCCOC1 11a_100000720124_100000211969 [0,0,1,1,0,0|2,0,0]=4 12423 B17R1.1287 CCCCCCCC(=O)NCC1CCCOC1 1626a_100000720124_100000211969 [0,0,1,1,0,0|2,0,0]=4 12424 B17R1.1287 CCCCCCCC(=O)NCC1CCCOC1 240690a_100000720124_100000211969 [0,0,1,1,0,0|2,0,0]=4 12425 B17R1.1287 CCCCCCCC(=O)NCC1CCCOC1 527a_100000720124_100000211969 [0,0,1,1,0,0|2,0,0]=4 12426 B17R1.1287 CCCCCCCC(=O)NCC1CCOCC1 11a_100000746373_100000211969 [0,0,1,1,0,0|2,0,0]=4 12427 B17R1.1287 CCCCCCCC(=O)NCC1CCOCC1 1626a_100000746373_100000211969 [0,0,1,1,0,0|2,0,0]=4 12428 B17R1.1287 CCCCCCCC(=O)NCC1CCOCC1 240690a_100000746373_100000211969 [0,0,1,1,0,0|2,0,0]=4 12429 B17R1.1287 CCCCCCCC(=O)NCC1CCOCC1 527a_100000746373_100000211969 [0,0,1,1,0,0|2,0,0]=4 12430 B17R1.1287 CCCCCCCC(=O)NCC1CCSCC1 11a_100015188806_100000211969 [0,0,1,1,0,0|2,0,0]=4 12431 B17R1.1287 CCCCCCCC(=O)NCC1CCSCC1 240690a_100015188806_100000211969 [0,0,1,1,0,0|2,0,0]=4 12432 B17R1.1287 CCCCCCCC(=O)NCC1CCSCC1 527a_100015188806_100000211969 [0,0,1,1,0,0|2,0,0]=4 12433 B17R1.1287 CCCCCCCC(=O)NNC1CCCCC1 22a_100000709804_100000211969 [0,0,1,1,0,0|2,0,0]=4 12434 B17R1.1287 CCCCCCCC(=O)OCN1CCCOC1 2230a_100000131196_100009852258 [0,0,1,1,0,0|2,0,0]=4 12435 B17R1.1287 CCCCCCCC(=O)OCN1CCCOC1 269982a_100000131196_100009852258 [0,0,1,1,0,0|2,0,0]=4 12436 B17R1.1287 CCCCCCCC(=O)OCN1CCCOC1 34a_100000131196_100009852258 [0,0,1,1,0,0|2,0,0]=4 12437 B17R1.1287 CCCCCCCC(=O)OCN1CCOCC1 2230a_100015191051_100009852258 [0,0,1,1,0,0|2,0,0]=4 12438 B17R1.1287 CCCCCCCC(=O)OCN1CCOCC1 269982a_100015191051_100009852258 [0,0,1,1,0,0|2,0,0]=4 12439 B17R1.1287 CCCCCCCC(=O)OCN1CCOCC1 34a_100015191051_100009852258 [0,0,1,1,0,0|2,0,0]=4 12440 B17R1.1287 CCCCCCCC(=O)OCN1CCSCC1 2230a_100000737611_100009852258 [0,0,1,1,0,0|2,0,0]=4 12441 B17R1.1287 CCCCCCCC(=O)OCN1CCSCC1 269982a_100000737611_100009852258 [0,0,1,1,0,0|2,0,0]=4 12442 B17R1.1287 CCCCCCCC(C)OCC1CCCCC1 34a_100000212181_200011218727 [0,0,1,1,0,0|1,0,1]=4 12443 B17R1.1287 CCCCCCCC(C)OCC1CCCCC1 34a_200011215852_100000211423 [0,0,1,1,0,0|1,0,1]=4 12444 B17R1.1287 CCCCCCCC(C)OCC1CCCCC1 7a_100000212181_200011218727 [0,0,1,1,0,0|1,0,1]=4 12445 B17R1.1287 CCCCCCCC(C)OCC1CCCCC1 7a_200011215852_100000211423 [0,0,1,1,0,0|1,0,1]=4 12446 B17R1.1287 CCCCCCNC(=O)CCC1CCCCC1 11a_100000210581_100000211375 [0,0,1,1,0,0|1,0,0]=3 12447 B17R1.1287 CCCCCCNC(=O)CCC1CCCCC1 1626a_100000210581_100000211375 [0,0,1,1,0,0|1,0,0]=3 12448 B17R1.1287 CCCCCCNC(=O)CCC1CCCCC1 240690a_100000210581_100000211375 [0,0,1,1,0,0|1,0,0]=3 12449 B17R1.1287 CCCCCCNC(=O)CCC1CCCCC1 527a_100000210581_100000211375 [0,0,1,1,0,0|1,0,0]=3 12450 B17R1.1287 CCCCCCNC(=O)CCN1CCCCC1 240690a_100000210581_100000743487 [0,0,1,1,0,0|2,0,0]=4 12451 B17R1.1287 CCCCCCNC(=O)CNC1CCCCC1 2230a_100000182618_100000230325 [0,0,1,1,0,0|2,0,0]=4 12452 B17R1.1287 CCCCCCNC(=O)CNC1CCCCC1 34a_100000182618_100000230325 [0,0,1,1,0,0|2,0,0]=4 12453 B17R1.1287 CCCCCCNC(=O)COC1CCCCC1 11a_100000210581_100011223303 [0,0,1,1,0,0|2,0,0]=4 12454 B17R1.1287 CCCCCCNC(=O)COC1CCCCC1 1626a_100000210581_100011223303 [0,0,1,1,0,0|2,0,0]=4 12455 B17R1.1287 CCCCCCNC(=O)COC1CCCCC1 240690a_100000210581_100011223303 [0,0,1,1,0,0|2,0,0]=4 12456 B17R1.1287 CCCCCCNC(=O)COC1CCCCC1 34a_100000210231_100000230325 [0,0,1,1,0,0|2,0,0]=4 12457 B17R1.1287 CCCCCCNC(=O)COC1CCCCC1 527a_100000210581_100011223303 [0,0,1,1,0,0|2,0,0]=4 12458 B17R1.1287 CCCCCCNC(=O)COC1CCCCC1 7a_100000210231_100000230325 [0,0,1,1,0,0|2,0,0]=4 12459 B17R1.1287 CCCCCCNC(=O)CSC1CCCCC1 62a_100000230325_100000210327 [0,0,1,1,0,0|2,0,0]=4 12460 B17R1.1287 CCCCCCNC(=O)NCC1CCCCC1 2708a_100000210473_100000210581 [0,0,1,1,0,0|2,0,0]=4 12461 B17R1.1287 CCCCCCNC(=O)NCC1CCCCC1 2708a_100000210581_100000210473 [0,0,1,1,0,0|2,0,0]=4 12462 B17R1.1287 CCCCCCNC(=O)NCC1CCCCC1 273464a_100000210473_100000210581 [0,0,1,1,0,0|2,0,0]=4 12463 B17R1.1287 CCCCCCNC(=O)NCC1CCCCC1 273464a_100000210581_100000210473 [0,0,1,1,0,0|2,0,0]=4 12464 B17R1.1287 CCCCCCNC(=O)NCC1CCCCC1 512a_100000210581_100000210473 [0,0,1,1,0,0|2,0,0]=4 12465 B17R1.1287 CCCCCNCC(=O)NCC1CCCCC1 2230a_100000209983_100000183341 [0,0,1,1,0,0|2,0,0]=4 12466 B17R1.1287 CCCCCNNC(=O)CCC1CCCCC1 22a_100000694160_100000211375 [0,0,1,1,0,0|2,0,0]=4 12467 B17R1.1287 CCCCCOCC(=O)NCC1CCCCC1 34a_100000210253_100000183341 [0,0,1,1,0,0|2,0,0]=4 12468 B17R1.1287 CCCCCOCC(=O)NCC1CCCCC1 7a_100000210253_100000183341 [0,0,1,1,0,0|2,0,0]=4 12469 B17R1.1287 CCCCCSCC(=O)NCC1CCCCC1 62a_100000183341_100000210326 [0,0,1,1,0,0|2,0,0]=4 12470 B17R1.1287 CCCCCSCC(=O)NCC1CCCCC1 62a_100000210326_100000183341 [0,0,1,1,0,0|2,0,0]=4 12471 B17R1.1287 CCCCOCCC(=O)CCC1CCCCC1 1458a_100000211375_100000743108 [0,0,1,1,0,0|2,0,0]=4 12472 B17R1.1287 CCCOCCNC(=O)CCC1CCCCC1 1626a_100161115042_100000211375 [0,0,1,1,0,0|2,0,0]=4 12473 B17R1.1287 CCCOCCNC(=O)CCC1CCCCC1 240690a_100161115042_100000211375 [0,0,1,1,0,0|2,0,0]=4 12474 B17R1.1287 CCCOCCNC(=O)CCC1CCCCC1 527a_100161115042_100000211375 [0,0,1,1,0,0|2,0,0]=4 12475 B17R1.1287 CCCSCCNC(=O)CCC1CCCCC1 11a_100020603323_100000211375 [0,0,1,1,0,0|2,0,0]=4 12476 B17R1.1287 CCCSCCNC(=O)CCC1CCCCC1 240690a_100020603323_100000211375 [0,0,1,1,0,0|2,0,0]=4 12477 B17R1.1287 CCCSCCNC(=O)CCC1CCCCC1 527a_100020603323_100000211375 [0,0,1,1,0,0|2,0,0]=4 12478 B17R1.1287 CCOCCCNC(=O)CCC1CCCCC1 11a_100000210961_100000211375 [0,0,1,1,0,0|2,0,0]=4 12479 B17R1.1287 CCOCCCNC(=O)CCC1CCCCC1 1626a_100000210961_100000211375 [0,0,1,1,0,0|2,0,0]=4 12480 B17R1.1287 CCOCCCNC(=O)CCC1CCCCC1 240690a_100000210961_100000211375 [0,0,1,1,0,0|2,0,0]=4 12481 B17R1.1287 CCOCCCNC(=O)CCC1CCCCC1 527a_100000210961_100000211375 [0,0,1,1,0,0|2,0,0]=4 12482 B17R1.1287 COCCCCCC(=O)CCC1CCCCC1 1458a_100011935119_100011273959 [0,0,1,1,0,0|2,0,0]=4 12483 B17R1.1287 COCCCCCC(=O)NCC1CCCCC1 11a_100000210473_100011935119 [0,0,1,1,0,0|2,0,0]=4 12484 B17R1.1287 COCCCCCC(=O)NCC1CCCCC1 1626a_100000210473_100011935119 [0,0,1,1,0,0|2,0,0]=4 12485 B17R1.1287 COCCCCCC(=O)NCC1CCCCC1 240690a_100000210473_100011935119 [0,0,1,1,0,0|2,0,0]=4 12486 B17R1.1287 COCCCCCC(=O)NCC1CCCCC1 527a_100000210473_100011935119 [0,0,1,1,0,0|2,0,0]=4 12487 B17R1.1287 O=C(CCC1CCCCC1)NCCCCCO 240690a_100000762737_100000211375 [0,0,1,1,0,0|2,0,0]=4 12488 B17R1.1287 O=C(CCCCCCF)CCC1CCCCC1 1458a_100000211375_100015922095 [0,0,1,1,0,0|2,0,0]=4 12489 B17R1.1287 O=C(CCCCCCO)CCC1CCCCC1 1458a_100000211375_100000766143 [0,0,1,1,0,0|2,0,0]=4 12490 B17R1.1287 O=C(CCCCCCO)CCC1CCCCC1 1458a_100011996774_100011273959 [0,0,1,1,0,0|2,0,0]=4 12491 B17R1.1287 O=C(CCCCCCO)NCC1CCCCC1 240690a_100000210473_100011996774 [0,0,1,1,0,0|2,0,0]=4 12492 B17R1.1292 CCCCCCC=CC(=O)CC1CCCCC1 1458a_200015324643_100000211423 [0,0,1,1,0,0|1,0,1]=4 12493 B17R1.1292 CCCCCCCCC(=O)C=C1CCCCC1 1458a_100000743792_100000210759 [0,0,1,1,0,0|1,0,1]=4 12494 B17R1.1292 CCCCCCCCC(=O)CC1CCCCC1 1458a_100000210188_100000211423 [0,0,1,1,0,0|1,0,0]=3 12495 B17R1.1292 CCCCCCCCC(=O)CC1CCCCC1 1458a_100000211666_100000210759 [0,0,1,1,0,0|1,0,0]=3 12496 B17R1.1292 CCCCCCCCC(=O)CC1CCCCO1 1458a_100000210188_100000211543 [0,0,1,1,0,0|2,0,0]=4 12497 B17R1.1292 CCCCCCCCC(=O)CC1CCCCO1 1458a_100000238585_100000210759 [0,0,1,1,0,0|2,0,0]=4 12498 B17R1.1292 CCCCCCCCC(=O)CC1CCCOC1 1458a_100000210188_100000741521 [0,0,1,1,0,0|2,0,0]=4 12499 B17R1.1292 CCCCCCCCC(=O)CC1CCCOC1 1458a_100000741523_100000210759 [0,0,1,1,0,0|2,0,0]=4 12500 B17R1.1292 CCCCCCCCC(=O)CC1CCOCC1 1458a_100000210188_100000754603 [0,0,1,1,0,0|2,0,0]=4 12501 B17R1.1292 CCCCCCCCC(=O)CC1CCOCC1 1458a_100000757261_100000210759 [0,0,1,1,0,0|2,0,0]=4 12502 B17R1.1292 CCCCCCCCC(=O)CN1CCCCC1 1458a_100000740322_100000210759 [0,0,1,1,0,0|2,0,0]=4 12503 B17R1.1292 CCCCCCCCC(=O)NC1CCCCC1 11a_100000182618_100000210188 [0,0,1,1,0,0|1,0,0]=3 12504 B17R1.1292 CCCCCCCCC(=O)NC1CCCCC1 1626a_100000182618_100000210188 [0,0,1,1,0,0|1,0,0]=3 12505 B17R1.1292 CCCCCCCCC(=O)NC1CCCCC1 240690a_100000182618_100000210188 [0,0,1,1,0,0|1,0,0]=3 12506 B17R1.1292 CCCCCCCCC(=O)NC1CCCCC1 527a_100000182618_100000210188 [0,0,1,1,0,0|1,0,0]=3 12507 B17R1.1292 CCCCCCCCC(=O)NC1CCCOC1 11a_100000719290_100000210188 [0,0,1,1,0,0|2,0,0]=4 12508 B17R1.1292 CCCCCCCCC(=O)NC1CCCOC1 1626a_100000719290_100000210188 [0,0,1,1,0,0|2,0,0]=4 12509 B17R1.1292 CCCCCCCCC(=O)NC1CCCOC1 240690a_100000719290_100000210188 [0,0,1,1,0,0|2,0,0]=4 12510 B17R1.1292 CCCCCCCCC(=O)NC1CCCOC1 527a_100000719290_100000210188 [0,0,1,1,0,0|2,0,0]=4 12511 B17R1.1292 CCCCCCCCC(=O)NC1CCOCC1 11a_100000741149_100000210188 [0,0,1,1,0,0|2,0,0]=4 12512 B17R1.1292 CCCCCCCCC(=O)NC1CCOCC1 1626a_100000741149_100000210188 [0,0,1,1,0,0|2,0,0]=4 12513 B17R1.1292 CCCCCCCCC(=O)NC1CCOCC1 240690a_100000741149_100000210188 [0,0,1,1,0,0|2,0,0]=4 12514 B17R1.1292 CCCCCCCCC(=O)NC1CCOCC1 527a_100000741149_100000210188 [0,0,1,1,0,0|2,0,0]=4 12515 B17R1.1292 CCCCCCCCC(=O)NC1CCSCC1 11a_100000748639_100000210188 [0,0,1,1,0,0|2,0,0]=4 12516 B17R1.1292 CCCCCCCCC(=O)NC1CCSCC1 1626a_100000748639_100000210188 [0,0,1,1,0,0|2,0,0]=4 12517 B17R1.1292 CCCCCCCCC(=O)NC1CCSCC1 240690a_100000748639_100000210188 [0,0,1,1,0,0|2,0,0]=4 12518 B17R1.1292 CCCCCCCCC(=O)NC1CCSCC1 527a_100000748639_100000210188 [0,0,1,1,0,0|2,0,0]=4 12519 B17R1.1292 CCCCCCCCC(C)OC1CCCCC1 34a_100000210740_100000210327 [0,0,1,1,0,0|1,0,1]=4 12520 B17R1.1292 CCCCCCCCC(C)OC1CCCCC1 7a_100000210740_100000210327 [0,0,1,1,0,0|1,0,1]=4 12521 B17R1.1292 CCCCCCCNC(=O)CC1CCCCC1 11a_100000229938_100000211666 [0,0,1,1,0,0|1,0,0]=3 12522 B17R1.1292 CCCCCCCNC(=O)CC1CCCCC1 1626a_100000229938_100000211666 [0,0,1,1,0,0|1,0,0]=3 12523 B17R1.1292 CCCCCCCNC(=O)CC1CCCCC1 240690a_100000229938_100000211666 [0,0,1,1,0,0|1,0,0]=3 12524 B17R1.1292 CCCCCCCNC(=O)CC1CCCCC1 527a_100000229938_100000211666 [0,0,1,1,0,0|1,0,0]=3 12525 B17R1.1292 CCCCCCCNC(=O)CC1CCCCO1 11a_100000229938_100000238585 [0,0,1,1,0,0|2,0,0]=4 12526 B17R1.1292 CCCCCCCNC(=O)CC1CCCCO1 1626a_100000229938_100000238585 [0,0,1,1,0,0|2,0,0]=4 12527 B17R1.1292 CCCCCCCNC(=O)CC1CCCCO1 240690a_100000229938_100000238585 [0,0,1,1,0,0|2,0,0]=4 12528 B17R1.1292 CCCCCCCNC(=O)CC1CCCCO1 527a_100000229938_100000238585 [0,0,1,1,0,0|2,0,0]=4 12529 B17R1.1292 CCCCCCCNC(=O)CC1CCCOC1 11a_100000229938_100000741523 [0,0,1,1,0,0|2,0,0]=4 12530 B17R1.1292 CCCCCCCNC(=O)CC1CCCOC1 1626a_100000229938_100000741523 [0,0,1,1,0,0|2,0,0]=4 12531 B17R1.1292 CCCCCCCNC(=O)CC1CCCOC1 240690a_100000229938_100000741523 [0,0,1,1,0,0|2,0,0]=4 12532 B17R1.1292 CCCCCCCNC(=O)CC1CCCOC1 527a_100000229938_100000741523 [0,0,1,1,0,0|2,0,0]=4 12533 B17R1.1292 CCCCCCCNC(=O)CC1CCOCC1 11a_100000229938_100000757261 [0,0,1,1,0,0|2,0,0]=4 12534 B17R1.1292 CCCCCCCNC(=O)CC1CCOCC1 1626a_100000229938_100000757261 [0,0,1,1,0,0|2,0,0]=4 12535 B17R1.1292 CCCCCCCNC(=O)CC1CCOCC1 240690a_100000229938_100000757261 [0,0,1,1,0,0|2,0,0]=4 12536 B17R1.1292 CCCCCCCNC(=O)CC1CCOCC1 527a_100000229938_100000757261 [0,0,1,1,0,0|2,0,0]=4 12537 B17R1.1292 CCCCCCCNC(=O)CN1CCCCC1 11a_100000229938_100000740322 [0,0,1,1,0,0|2,0,0]=4 12538 B17R1.1292 CCCCCCCNC(=O)CN1CCCCC1 240690a_100000229938_100000740322 [0,0,1,1,0,0|2,0,0]=4 12539 B17R1.1292 CCCCCCCNC(=O)CN1CCCCC1 527a_100000229938_100000740322 [0,0,1,1,0,0|2,0,0]=4 12540 B17R1.1292 CCCCCCCNC(=O)NC1CCCCC1 2708a_100000182618_100000229938 [0,0,1,1,0,0|2,0,0]=4 12541 B17R1.1292 CCCCCCCNC(=O)NC1CCCCC1 2708a_100000229938_100000182618 [0,0,1,1,0,0|2,0,0]=4 12542 B17R1.1292 CCCCCCCNC(=O)NC1CCCCC1 273464a_100000182618_100000229938 [0,0,1,1,0,0|2,0,0]=4 12543 B17R1.1292 CCCCCCCNC(=O)NC1CCCCC1 273464a_100000229938_100000182618 [0,0,1,1,0,0|2,0,0]=4 12544 B17R1.1292 CCCCCCNCC(=O)NC1CCCCC1 2230a_100000210581_100000183541 [0,0,1,1,0,0|2,0,0]=4 12545 B17R1.1292 CCCCCCNCC(=O)NC1CCCCC1 2230a_100015207117_100000210314 [0,0,1,1,0,0|2,0,0]=4 12546 B17R1.1292 CCCCCCNCC(=O)OC1CCCCC1 2230a_100000210581_100000041653 [0,0,1,1,0,0|1,0,0]=3 12547 B17R1.1292 CCCCCCOCC(=O)NC1CCCCC1 34a_100000210259_100000183541 [0,0,1,1,0,0|2,0,0]=4 12548 B17R1.1292 CCCCCCOCC(=O)NC1CCCCC1 7a_100000210259_100000183541 [0,0,1,1,0,0|2,0,0]=4 12549 B17R1.1292 CCCCCCOCC(=O)OC1CCCCC1 34a_100000210259_100000041653 [0,0,1,1,0,0|1,0,0]=3 12550 B17R1.1292 CCCCCCOCC(=O)OC1CCCCC1 7a_100000210259_100000041653 [0,0,1,1,0,0|1,0,0]=3 12551 B17R1.1292 CCCCCCSCC(=O)NC1CCCCC1 62a_100000183541_100000210757 [0,0,1,1,0,0|2,0,0]=4 12552 B17R1.1292 CCCCCCSCC(=O)NC1CCCCC1 62a_100000210314_100000183541 [0,0,1,1,0,0|2,0,0]=4 12553 B17R1.1292 CCCCCCSCC(=O)OC1CCCCC1 62a_100000041653_100000210757 [0,0,1,1,0,0|1,0,0]=3 12554 B17R1.1292 CCCCCCSCC(=O)OC1CCCCC1 62a_100000210314_100000041653 [0,0,1,1,0,0|1,0,0]=3 12555 B17R1.1292 CCCCCNCCC(=O)NC1CCCCC1 2230a_100000209983_100000188762 [0,0,1,1,0,0|2,0,0]=4 12556 B17R1.1292 CCCCCNCCC(=O)NC1CCCCC1 2230a_100000743080_100000210326 [0,0,1,1,0,0|2,0,0]=4 12557 B17R1.1292 CCCCCNCCC(=O)NC1CCCCC1 34a_100000743080_100000718602 [0,0,1,1,0,0|2,0,0]=4 12558 B17R1.1292 CCCCCOCCC(=O)NC1CCCCC1 7a_100000210253_100000188762 [0,0,1,1,0,0|2,0,0]=4 12559 B17R1.1292 CCCCCSCCC(=O)NC1CCCCC1 62a_100000188762_100000210326 [0,0,1,1,0,0|2,0,0]=4 12560 B17R1.1292 CCCCCSCCC(=O)NC1CCCCC1 62a_100000210326_100000188762 [0,0,1,1,0,0|2,0,0]=4 12561 B17R1.1292 CCCCOCSCC(=O)OC1CCCCC1 62a_100000041653_100011995733 [0,0,1,1,0,0|2,0,0]=4 12562 B17R1.1292 CCCCOCSCC(=O)OC1CCCCC1 62a_100011995733_100000041653 [0,0,1,1,0,0|2,0,0]=4 12563 B17R1.1292 CCCCSCCNC(=O)CC1CCCCC1 11a_100025743550_100000211666 [0,0,1,1,0,0|2,0,0]=4 12564 B17R1.1292 CCCCSCCNC(=O)CC1CCCCC1 1626a_100025743550_100000211666 [0,0,1,1,0,0|2,0,0]=4 12565 B17R1.1292 CCCCSCCNC(=O)CC1CCCCC1 240690a_100025743550_100000211666 [0,0,1,1,0,0|2,0,0]=4 12566 B17R1.1292 CCCCSCCNC(=O)CC1CCCCC1 527a_100025743550_100000211666 [0,0,1,1,0,0|2,0,0]=4 12567 B17R1.1292 CCCOCCCNC(=O)CC1CCCCC1 1626a_100011217757_100000211666 [0,0,1,1,0,0|2,0,0]=4 12568 B17R1.1292 CCCOCCCNC(=O)CC1CCCCC1 240690a_100011217757_100000211666 [0,0,1,1,0,0|2,0,0]=4 12569 B17R1.1292 CCCOCCCNC(=O)CC1CCCCC1 527a_100011217757_100000211666 [0,0,1,1,0,0|2,0,0]=4 12570 B17R1.1292 CCCOCCNCC(=O)OC1CCCCC1 2230a_100161115042_100000041653 [0,0,1,1,0,0|2,0,0]=4 12571 B17R1.1292 CCCOCCNCC(=O)OC1CCCCC1 34a_100161115042_100000041653 [0,0,1,1,0,0|2,0,0]=4 12572 B17R1.1292 CCCOCCOCC(=O)OC1CCCCC1 34a_100000752267_100000041653 [0,0,1,1,0,0|2,0,0]=4 12573 B17R1.1292 CCCOCCOCC(=O)OC1CCCCC1 7a_100000752267_100000041653 [0,0,1,1,0,0|2,0,0]=4 12574 B17R1.1292 CCCOCCSCC(=O)OC1CCCCC1 62a_100000041653_100011215938 [0,0,1,1,0,0|2,0,0]=4 12575 B17R1.1292 CCCOCCSCC(=O)OC1CCCCC1 62a_100011215938_100000041653 [0,0,1,1,0,0|2,0,0]=4 12576 B17R1.1292 CCCSCCNCC(=O)OC1CCCCC1 2230a_100020603323_100000041653 [0,0,1,1,0,0|2,0,0]=4 12577 B17R1.1292 CCCSCCOCC(=O)OC1CCCCC1 34a_200000230433_100000041653 [0,0,1,1,0,0|2,0,0]=4 12578 B17R1.1292 CCCSCCOCC(=O)OC1CCCCC1 7a_200000230433_100000041653 [0,0,1,1,0,0|2,0,0]=4 12579 B17R1.1292 CCOCCCNCC(=O)OC1CCCCC1 2230a_100000210961_100000041653 [0,0,1,1,0,0|2,0,0]=4 12580 B17R1.1292 CCOCCCNCC(=O)OC1CCCCC1 34a_100000210961_100000041653 [0,0,1,1,0,0|2,0,0]=4 12581 B17R1.1292 CCOCCCOCC(=O)OC1CCCCC1 34a_100000757476_100000041653 [0,0,1,1,0,0|2,0,0]=4 12582 B17R1.1292 CCOCCCOCC(=O)OC1CCCCC1 7a_100000757476_100000041653 [0,0,1,1,0,0|2,0,0]=4 12583 B17R1.1292 CCOCCCSCC(=O)OC1CCCCC1 62a_100000041653_100012232248 [0,0,1,1,0,0|2,0,0]=4 12584 B17R1.1292 CCOCCCSCC(=O)OC1CCCCC1 62a_100012232248_100000041653 [0,0,1,1,0,0|2,0,0]=4 12585 B17R1.1292 CCSCCCOCC(=O)OC1CCCCC1 34a_100011216438_100000041653 [0,0,1,1,0,0|2,0,0]=4 12586 B17R1.1292 CCSCCCOCC(=O)OC1CCCCC1 7a_100011216438_100000041653 [0,0,1,1,0,0|2,0,0]=4 12587 B17R1.1292 COCCCCCCC(=O)CC1CCCCC1 1458a_100000211666_100011998445 [0,0,1,1,0,0|2,0,0]=4 12588 B17R1.1292 COCCCCCNC(=O)CC1CCCCC1 11a_100000747528_100000211666 [0,0,1,1,0,0|2,0,0]=4 12589 B17R1.1292 COCCCCCNC(=O)CC1CCCCC1 1626a_100000747528_100000211666 [0,0,1,1,0,0|2,0,0]=4 12590 B17R1.1292 COCCCCCNC(=O)CC1CCCCC1 240690a_100000747528_100000211666 [0,0,1,1,0,0|2,0,0]=4 12591 B17R1.1292 COCCCCCNC(=O)CC1CCCCC1 527a_100000747528_100000211666 [0,0,1,1,0,0|2,0,0]=4 12592 B17R1.1292 COCCCCOCC(=O)OC1CCCCC1 34a_100000740925_100000041653 [0,0,1,1,0,0|2,0,0]=4 12593 B17R1.1292 COCCCCSCC(=O)OC1CCCCC1 62a_100000041653_100000730899 [0,0,1,1,0,0|2,0,0]=4 12594 B17R1.1292 COCCCCSCC(=O)OC1CCCCC1 62a_100000730899_100000041653 [0,0,1,1,0,0|2,0,0]=4 12595 B17R1.1292 CSCCCCOCC(=O)OC1CCCCC1 34a_100011217163_100000041653 [0,0,1,1,0,0|2,0,0]=4 12596 B17R1.1292 CSCCCCOCC(=O)OC1CCCCC1 7a_100011217163_100000041653 [0,0,1,1,0,0|2,0,0]=4 12597 B17R1.1292 NCCCCCOCC(=O)OC1CCCCC1 34a_100000762737_100000041653 [0,0,1,1,0,0|2,0,0]=4 12598 B17R1.1292 O=C(CC1CCCCC1)NCCCCCCO 240690a_100000686447_100000211666 [0,0,1,1,0,0|2,0,0]=4 12599 B17R1.1292 O=C(CC1CCCCC1)NCCCCCCO 527a_100000686447_100000211666 [0,0,1,1,0,0|2,0,0]=4 12600 B17R1.1292 O=C(CCCCCCCO)CC1CCCCC1 1458a_100000211666_100000760002 [0,0,1,1,0,0|2,0,0]=4 12601 B17R1.1292 O=C(CCCCCCCO)CC1CCCCC1 1458a_100011219782_100000211423 [0,0,1,1,0,0|2,0,0]=4 12602 B17R1.1292 O=C(CCCCCCCO)NC1CCCCC1 240690a_100000182618_100011219782 [0,0,1,1,0,0|2,0,0]=4 12603 B17R1.1292 O=C(CNCCCCCO)OC1CCCCC1 2230a_100000762737_100000041653 [0,0,1,1,0,0|2,0,0]=4 12604 B17R1.1292 O=C(CNCCCCCO)OC1CCCCC1 34a_100000762737_100000041653 [0,0,1,1,0,0|2,0,0]=4 12605 B17R1.1292 O=C(COCCCCCBr)OC1CCCCC1 34a_100000746331_100000041653 [0,0,1,1,0,0|2,0,0]=4 12606 B17R1.1292 O=C(COCCCCCBr)OC1CCCCC1 7a_100000746331_100000041653 [0,0,1,1,0,0|2,0,0]=4 12607 B17R1.1292 O=C(COCCCCCCl)OC1CCCCC1 34a_100000746330_100000041653 [0,0,1,1,0,0|2,0,0]=4 12608 B17R1.1292 O=C(COCCCCCCl)OC1CCCCC1 7a_100000746330_100000041653 [0,0,1,1,0,0|2,0,0]=4 12609 B17R1.1292 O=C(COCCCCCI)OC1CCCCC1 34a_200012148887_100000041653 [0,0,1,1,0,0|2,0,0]=4 12610 B17R1.1292 O=C(COCCCCCI)OC1CCCCC1 7a_200012148887_100000041653 [0,0,1,1,0,0|2,0,0]=4 12611 B17R1.1292 O=C(CSCCCCCF)OC1CCCCC1 62a_100000041653_100000729378 [0,0,1,1,0,0|2,0,0]=4 12612 B17R1.1292 O=C(CSCCCCCF)OC1CCCCC1 62a_100000729378_100000041653 [0,0,1,1,0,0|2,0,0]=4 12613 B17R1.1292 O=C(CSCCCCCO)OC1CCCCC1 62a_100000041653_100000746330 [0,0,1,1,0,0|2,0,0]=4 12614 B17R1.1292 O=C(CSCCCCCO)OC1CCCCC1 62a_100000746330_100000041653 [0,0,1,1,0,0|2,0,0]=4 12615 B17R1.1478 CCCCCCC=CC(=O)CCC1CCCC1 1458a_200015324643_100000760354 [0,0,1,1,0,0|1,0,1]=4 12616 B17R1.1478 CCCCCCCCC(=O)CCC1CCCC1 1458a_100000210188_100000760354 [0,0,1,1,0,0|1,0,0]=3 12617 B17R1.1478 CCCCCCCCC(=O)CCC1CCCC1 1458a_100000211120_100000210759 [0,0,1,1,0,0|1,0,0]=3 12618 B17R1.1478 CCCCCCCCC(=O)CCC1CCCO1 1458a_100011247709_100000210759 [0,0,1,1,0,0|2,0,0]=4 12619 B17R1.1478 CCCCCCCCC(=O)CCN1CCCC1 1458a_100000210188_100000004467 [0,0,1,1,0,0|2,0,0]=4 12620 B17R1.1478 CCCCCCCCC(=O)CCN1CCCC1 1458a_100000738983_100000210759 [0,0,1,1,0,0|2,0,0]=4 12621 B17R1.1478 CCCCCCCCC(=O)COC1CCCC1 1458a_100000741352_100000210759 [0,0,1,1,0,0|2,0,0]=4 12622 B17R1.1478 CCCCCCCCC(=O)NCC1CCCC1 11a_100000737975_100000210188 [0,0,1,1,0,0|1,0,0]=3 12623 B17R1.1478 CCCCCCCCC(=O)NCC1CCCC1 1626a_100000737975_100000210188 [0,0,1,1,0,0|1,0,0]=3 12624 B17R1.1478 CCCCCCCCC(=O)NCC1CCCC1 240690a_100000737975_100000210188 [0,0,1,1,0,0|1,0,0]=3 12625 B17R1.1478 CCCCCCCCC(=O)NCC1CCCC1 527a_100000737975_100000210188 [0,0,1,1,0,0|1,0,0]=3 12626 B17R1.1478 CCCCCCCCC(=O)NCC1CCOC1 11a_100000737293_100000210188 [0,0,1,1,0,0|2,0,0]=4 12627 B17R1.1478 CCCCCCCCC(=O)NCC1CCOC1 1626a_100000737293_100000210188 [0,0,1,1,0,0|2,0,0]=4 12628 B17R1.1478 CCCCCCCCC(=O)NCC1CCOC1 240690a_100000737293_100000210188 [0,0,1,1,0,0|2,0,0]=4 12629 B17R1.1478 CCCCCCCCC(=O)NCC1CCOC1 527a_100000737293_100000210188 [0,0,1,1,0,0|2,0,0]=4 12630 B17R1.1478 CCCCCCCCC(=O)NC[C@@H]1CCCO1 11a_100020590478_100000210188 [0,0,1,1,0,0|2,0,0]=4 12631 B17R1.1478 CCCCCCCCC(=O)NC[C@@H]1CCCO1 1626a_100020590478_100000210188 [0,0,1,1,0,0|2,0,0]=4 12632 B17R1.1478 CCCCCCCCC(=O)NC[C@@H]1CCCO1 240690a_100020590478_100000210188 [0,0,1,1,0,0|2,0,0]=4 12633 B17R1.1478 CCCCCCCCC(=O)NC[C@@H]1CCCO1 527a_100020590478_100000210188 [0,0,1,1,0,0|2,0,0]=4 12634 B17R1.1478 CCCCCCCCC(=O)NNC1CCCC1 22a_100000737850_100000210188 [0,0,1,1,0,0|2,0,0]=4 12635 B17R1.1478 CCCCCCCCC(C)OCC1CCCC1 34a_100000210740_100000740388 [0,0,1,1,0,0|1,0,1]=4 12636 B17R1.1478 CCCCCCCCC(C)OCC1CCCC1 7a_100000210740_100000740388 [0,0,1,1,0,0|1,0,1]=4 12637 B17R1.1478 CCCCCCCNC(=O)CCC1CCCC1 11a_100000229938_100000211120 [0,0,1,1,0,0|1,0,0]=3 12638 B17R1.1478 CCCCCCCNC(=O)CCC1CCCC1 1626a_100000229938_100000211120 [0,0,1,1,0,0|1,0,0]=3 12639 B17R1.1478 CCCCCCCNC(=O)CCC1CCCC1 240690a_100000229938_100000211120 [0,0,1,1,0,0|1,0,0]=3 12640 B17R1.1478 CCCCCCCNC(=O)CCC1CCCC1 527a_100000229938_100000211120 [0,0,1,1,0,0|1,0,0]=3 12641 B17R1.1478 CCCCCCCNC(=O)CCC1CCCO1 11a_100000229938_100011247709 [0,0,1,1,0,0|2,0,0]=4 12642 B17R1.1478 CCCCCCCNC(=O)CCC1CCCO1 1626a_100000229938_100011247709 [0,0,1,1,0,0|2,0,0]=4 12643 B17R1.1478 CCCCCCCNC(=O)CCC1CCCO1 240690a_100000229938_100011247709 [0,0,1,1,0,0|2,0,0]=4 12644 B17R1.1478 CCCCCCCNC(=O)CCC1CCCO1 527a_100000229938_100011247709 [0,0,1,1,0,0|2,0,0]=4 12645 B17R1.1478 CCCCCCCNC(=O)CCN1CCCC1 240690a_100000229938_100000738983 [0,0,1,1,0,0|2,0,0]=4 12646 B17R1.1478 CCCCCCCNC(=O)COC1CCCC1 11a_100000229938_100000741352 [0,0,1,1,0,0|2,0,0]=4 12647 B17R1.1478 CCCCCCCNC(=O)COC1CCCC1 1626a_100000229938_100000741352 [0,0,1,1,0,0|2,0,0]=4 12648 B17R1.1478 CCCCCCCNC(=O)COC1CCCC1 240690a_100000229938_100000741352 [0,0,1,1,0,0|2,0,0]=4 12649 B17R1.1478 CCCCCCCNC(=O)COC1CCCC1 527a_100000229938_100000741352 [0,0,1,1,0,0|2,0,0]=4 12650 B17R1.1478 CCCCCCCNC(=O)NCC1CCCC1 2708a_100000229938_100000737975 [0,0,1,1,0,0|2,0,0]=4 12651 B17R1.1478 CCCCCCCNC(=O)NCC1CCCC1 2708a_100000737975_100000229938 [0,0,1,1,0,0|2,0,0]=4 12652 B17R1.1478 CCCCCCCNC(=O)NCC1CCCC1 273464a_100000229938_100000737975 [0,0,1,1,0,0|2,0,0]=4 12653 B17R1.1478 CCCCCCCNC(=O)NCC1CCCC1 273464a_100000737975_100000229938 [0,0,1,1,0,0|2,0,0]=4 12654 B17R1.1478 CCCCCCCNC(=O)NCC1CCCC1 512a_100000229938_100000737975 [0,0,1,1,0,0|2,0,0]=4 12655 B17R1.1478 CCCCCCCNC(=O)NCC1CCCC1 512a_100000737975_100000229938 [0,0,1,1,0,0|2,0,0]=4 12656 B17R1.1478 CCCCSCCNC(=O)CCC1CCCC1 11a_100025743550_100000211120 [0,0,1,1,0,0|2,0,0]=4 12657 B17R1.1478 CCCCSCCNC(=O)CCC1CCCC1 1626a_100025743550_100000211120 [0,0,1,1,0,0|2,0,0]=4 12658 B17R1.1478 CCCCSCCNC(=O)CCC1CCCC1 240690a_100025743550_100000211120 [0,0,1,1,0,0|2,0,0]=4 12659 B17R1.1478 CCCCSCCNC(=O)CCC1CCCC1 527a_100025743550_100000211120 [0,0,1,1,0,0|2,0,0]=4 12660 B17R1.1478 CCCOCCCNC(=O)CCC1CCCC1 1626a_100011217757_100000211120 [0,0,1,1,0,0|2,0,0]=4 12661 B17R1.1478 CCCOCCCNC(=O)CCC1CCCC1 240690a_100011217757_100000211120 [0,0,1,1,0,0|2,0,0]=4 12662 B17R1.1478 CCCOCCCNC(=O)CCC1CCCC1 527a_100011217757_100000211120 [0,0,1,1,0,0|2,0,0]=4 12663 B17R1.1478 COCCCCCCC(=O)CCC1CCCC1 1458a_100000211120_100011998445 [0,0,1,1,0,0|2,0,0]=4 12664 B17R1.1478 COCCCCCNC(=O)CCC1CCCC1 11a_100000747528_100000211120 [0,0,1,1,0,0|2,0,0]=4 12665 B17R1.1478 COCCCCCNC(=O)CCC1CCCC1 1626a_100000747528_100000211120 [0,0,1,1,0,0|2,0,0]=4 12666 B17R1.1478 COCCCCCNC(=O)CCC1CCCC1 240690a_100000747528_100000211120 [0,0,1,1,0,0|2,0,0]=4 12667 B17R1.1478 COCCCCCNC(=O)CCC1CCCC1 527a_100000747528_100000211120 [0,0,1,1,0,0|2,0,0]=4 12668 B17R1.1478 O=C(CCC1CCCC1)NCCCCCCO 240690a_100000686447_100000211120 [0,0,1,1,0,0|2,0,0]=4 12669 B17R1.1478 O=C(CCC1CCCC1)NCCCCCCO 527a_100000686447_100000211120 [0,0,1,1,0,0|2,0,0]=4 12670 B17R1.1478 O=C(CCCCCCCO)CCC1CCCC1 1458a_100000211120_100000760002 [0,0,1,1,0,0|2,0,0]=4 12671 B17R1.1478 O=C(CCCCCCCO)CCC1CCCC1 1458a_100011219782_100000760354 [0,0,1,1,0,0|2,0,0]=4 12672 B17R1.1478 O=C(CCCCCCCO)NCC1CCCC1 240690a_100000737975_100011219782 [0,0,1,1,0,0|2,0,0]=4 12673 B17R1.5200 CCCCCC#CC(=O)CCCC1CCCC1 1458a_100011215388_100011713738 [0,0,1,1,0,0|1,0,1]=4 12674 B17R1.5200 CCCCCC=CC(=O)CCCC1CCCC1 1458a_100016263427_100011713738 [0,0,1,1,0,0|1,0,1]=4 12675 B17R1.5200 CCCCCCCC(=O)CCCC1CCCC1 1458a_100000211969_100011713738 [0,0,1,1,0,0|1,0,0]=3 12676 B17R1.5200 CCCCCCCC(=O)CCCN1CCCC1 1458a_100000211969_100011445909 [0,0,1,1,0,0|2,0,0]=4 12677 B17R1.5200 CCCCCCCC(=O)CCCN1CCCC1 1458a_100000743284_100000210614 [0,0,1,1,0,0|2,0,0]=4 12678 B17R1.5200 CCCCCCCC(=O)NCCC1CCCC1 11a_100000739158_100000211969 [0,0,1,1,0,0|1,0,0]=3 12679 B17R1.5200 CCCCCCCC(=O)NCCC1CCCC1 1626a_100000739158_100000211969 [0,0,1,1,0,0|1,0,0]=3 12680 B17R1.5200 CCCCCCCC(=O)NCCC1CCCC1 240690a_100000739158_100000211969 [0,0,1,1,0,0|1,0,0]=3 12681 B17R1.5200 CCCCCCCC(=O)NCCC1CCCC1 527a_100000739158_100000211969 [0,0,1,1,0,0|1,0,0]=3 12682 B17R1.5200 CCCCCCCC(=O)NCCN1CCCC1 240690a_100000212299_100000211969 [0,0,1,1,0,0|2,0,0]=4 12683 B17R1.5200 CCCCCCCC(=O)OCNC1CCCC1 2230a_100000211070_100009852258 [0,0,1,1,0,0|1,0,0]=3 12684 B17R1.5200 CCCCCCCC(=O)OCNC1CCCC1 34a_100000211070_100009852258 [0,0,1,1,0,0|1,0,0]=3 12685 B17R1.5200 CCCCCCCC(=O)OCN[C@@H]1CCOC1 2230a_200015188469_100009852258 [0,0,1,1,0,0|2,0,0]=4 12686 B17R1.5200 CCCCCCCC(=O)OCN[C@H]1CCOC1 2230a_100015188467_100009852258 [0,0,1,1,0,0|2,0,0]=4 12687 B17R1.5200 CCCCCCCC(=O)OCN[C@H]1CCOC1 34a_100015188467_100009852258 [0,0,1,1,0,0|2,0,0]=4 12688 B17R1.5200 CCCCCCCC(=O)OCOC1CCCC1 34a_100000210269_100009852258 [0,0,1,1,0,0|1,0,0]=3 12689 B17R1.5200 CCCCCCCC(=O)OCOC1CCCC1 7a_100000210269_100009852258 [0,0,1,1,0,0|1,0,0]=3 12690 B17R1.5200 CCCCCCCC(=O)OCOC1CCCO1 34a_100000085407_100009852258 [0,0,1,1,0,0|2,0,0]=4 12691 B17R1.5200 CCCCCCCC(=O)OCOC1CCSC1 7a_100011232664_100009852258 [0,0,1,1,0,0|2,0,0]=4 12692 B17R1.5200 CCCCCCCC(=O)OCO[C@H]1CCOC1 34a_100000717292_100009852258 [0,0,1,1,0,0|2,0,0]=4 12693 B17R1.5200 CCCCCCCC(=O)OCSC1CCCC1 62a_100011217020_100009852258 [0,0,1,1,0,0|1,0,0]=3 12694 B17R1.5200 CCCCCCCC(C)OCCC1CCCC1 34a_100000749090_200011218727 [0,0,1,1,0,0|1,0,1]=4 12695 B17R1.5200 CCCCCCCC(C)OCCC1CCCC1 34a_200011215852_100000760354 [0,0,1,1,0,0|1,0,1]=4 12696 B17R1.5200 CCCCCCCC(C)OCCC1CCCC1 7a_100000749090_200011218727 [0,0,1,1,0,0|1,0,1]=4 12697 B17R1.5200 CCCCCCCC(C)OCCC1CCCC1 7a_200011215852_100000760354 [0,0,1,1,0,0|1,0,1]=4 12698 B17R1.5200 CCCCCCNC(=O)CCCN1CCCC1 240690a_100000210581_100000743284 [0,0,1,1,0,0|2,0,0]=4 12699 B17R1.5200 CCCCCCNC(=O)CNCC1CCCC1 2230a_100000737975_100000230325 [0,0,1,1,0,0|2,0,0]=4 12700 B17R1.5200 CCCCCCNC(=O)CNCC1CCCC1 34a_100000737975_100000230325 [0,0,1,1,0,0|2,0,0]=4 12701 B17R1.5200 CCCCCCNC(=O)COCC1CCCC1 34a_100000742336_100000230325 [0,0,1,1,0,0|2,0,0]=4 12702 B17R1.5200 CCCCCCNC(=O)COCC1CCCC1 7a_100000742336_100000230325 [0,0,1,1,0,0|2,0,0]=4 12703 B17R1.5200 CCCCCCNC(=O)CSCC1CCCC1 62a_100000230325_100000740388 [0,0,1,1,0,0|2,0,0]=4 12704 B17R1.5200 CCCCCCNC(=O)NCCC1CCCC1 2708a_100000210581_100000739158 [0,0,1,1,0,0|2,0,0]=4 12705 B17R1.5200 CCCCCCNC(=O)NCCC1CCCC1 2708a_100000739158_100000210581 [0,0,1,1,0,0|2,0,0]=4 12706 B17R1.5200 CCCCCCNC(=O)NCCC1CCCC1 273464a_100000210581_100000739158 [0,0,1,1,0,0|2,0,0]=4 12707 B17R1.5200 CCCCCCNC(=O)NCCC1CCCC1 273464a_100000739158_100000210581 [0,0,1,1,0,0|2,0,0]=4 12708 B17R1.5200 CCCCCCNC(=O)NCCC1CCCC1 512a_100000210581_100000739158 [0,0,1,1,0,0|2,0,0]=4 12709 B17R1.5200 CCCCCCNC(=O)NCCC1CCCC1 512a_100000739158_100000210581 [0,0,1,1,0,0|2,0,0]=4 12710 B17R1.5200 COCCCCCC(=O)CCCC1CCCC1 1458a_100011935119_100011713738 [0,0,1,1,0,0|2,0,0]=4 12711 B17R1.5200 COCCCCCC(=O)NCCC1CCCC1 11a_100000739158_100011935119 [0,0,1,1,0,0|2,0,0]=4 12712 B17R1.5200 COCCCCCC(=O)NCCC1CCCC1 1626a_100000739158_100011935119 [0,0,1,1,0,0|2,0,0]=4 12713 B17R1.5200 COCCCCCC(=O)NCCC1CCCC1 240690a_100000739158_100011935119 [0,0,1,1,0,0|2,0,0]=4 12714 B17R1.5200 COCCCCCC(=O)NCCC1CCCC1 527a_100000739158_100011935119 [0,0,1,1,0,0|2,0,0]=4 12715 B17R1.5200 O=C(CCCCCCO)CCCC1CCCC1 1458a_100011996774_100011713738 [0,0,1,1,0,0|2,0,0]=4 12716 B17R1.5200 O=C(CCCCCCO)NCCC1CCCC1 240690a_100000739158_100011996774 [0,0,1,1,0,0|2,0,0]=4 12717 B17R1.6947 CC1CCCCC1C(=O)CCCCCCCO 1458a_100011215568_100000760002 [0,0,1,1,0,0|2,0,0]=4 12718 B17R1.6947 CC1CCCCC1C(=O)NCCCCCCO 240690a_100000686447_100011215568 [0,0,1,1,0,0|2,0,0]=4 12719 B17R1.6947 CC1CCCCC1C(=O)NCCCCCCO 527a_100000686447_100011215568 [0,0,1,1,0,0|2,0,0]=4 12720 B17R1.6947 CC1CCCCN1C(=O)CCCCCCCO 240690a_100000211376_100011219782 [0,0,1,1,0,0|2,0,0]=4 12721 B17R1.6947 CCCCCCCCC(=O)C1CCCCC1C 1458a_100011215568_100000210759 [0,0,1,1,0,0|1,0,0]=3 12722 B17R1.6947 CCCCCCCCC(=O)C1CCCCC1O 1458a_100011803323_100000210759 [0,0,1,1,0,0|2,0,0]=4 12723 B17R1.6947 CCCCCCCCC(=O)N1CCCCC1C 11a_100000211376_100000210188 [0,0,1,1,0,0|1,0,0]=3 12724 B17R1.6947 CCCCCCCCC(=O)N1CCCCC1C 1626a_100000211376_100000210188 [0,0,1,1,0,0|1,0,0]=3 12725 B17R1.6947 CCCCCCCCC(=O)N1CCCCC1C 240690a_100000211376_100000210188 [0,0,1,1,0,0|1,0,0]=3 12726 B17R1.6947 CCCCCCCCC(=O)N1CCCCC1C 527a_100000211376_100000210188 [0,0,1,1,0,0|1,0,0]=3 12727 B17R1.6947 CCCCCCCCC(=O)N1CCOC[C@@H]1C 11a_100009815349_100000210188 [0,0,1,1,0,0|2,0,0]=4 12728 B17R1.6947 CCCCCCCCC(=O)N1CCOC[C@@H]1C 240690a_100009815349_100000210188 [0,0,1,1,0,0|2,0,0]=4 12729 B17R1.6947 CCCCCCCCC(=O)N1CCOC[C@@H]1C 527a_100009815349_100000210188 [0,0,1,1,0,0|2,0,0]=4 12730 B17R1.6947 CCCCCCCCC(=O)[C@H]1CCCCN1C 1458a_100000767060_100000210759 [0,0,1,1,0,0|2,0,0]=4 12731 B17R1.6947 CCCCCCCNC(=O)C1CCCCC1C 11a_100000229938_100011215568 [0,0,1,1,0,0|1,0,0]=3 12732 B17R1.6947 CCCCCCCNC(=O)C1CCCCC1C 1626a_100000229938_100011215568 [0,0,1,1,0,0|1,0,0]=3 12733 B17R1.6947 CCCCCCCNC(=O)C1CCCCC1C 240690a_100000229938_100011215568 [0,0,1,1,0,0|1,0,0]=3 12734 B17R1.6947 CCCCCCCNC(=O)C1CCCCC1C 527a_100000229938_100011215568 [0,0,1,1,0,0|1,0,0]=3 12735 B17R1.6947 CCCCCCCNC(=O)N1CCCCC1C 2708a_100000229938_100000211376 [0,0,1,1,0,0|2,0,0]=4 12736 B17R1.6947 CCCCCCCNC(=O)N1CCCCC1C 273464a_100000229938_100000211376 [0,0,1,1,0,0|2,0,0]=4 12737 B17R1.6947 CCCCCCCNC(=O)[C@H]1CCCCN1C 11a_100000229938_100000767060 [0,0,1,1,0,0|2,0,0]=4 12738 B17R1.6947 CCCCCCCNC(=O)[C@H]1CCCCN1C 1626a_100000229938_100000767060 [0,0,1,1,0,0|2,0,0]=4 12739 B17R1.6947 CCCCCCCNC(=O)[C@H]1CCCCN1C 240690a_100000229938_100000767060 [0,0,1,1,0,0|2,0,0]=4 12740 B17R1.6947 CCCCCCCNC(=O)[C@H]1CCCCN1C 527a_100000229938_100000767060 [0,0,1,1,0,0|2,0,0]=4 12741 B17R1.6947 CCCCCCNCC(=O)N1CCCCC1C 2230a_100000210581_100000182743 [0,0,1,1,0,0|2,0,0]=4 12742 B17R1.6947 CCCCCCOCC(=O)N1CCCCC1C 34a_100000210259_100000182743 [0,0,1,1,0,0|2,0,0]=4 12743 B17R1.6947 CCCCCCOCC(=O)N1CCCCC1C 7a_100000210259_100000182743 [0,0,1,1,0,0|2,0,0]=4 12744 B17R1.6947 CCCCCCSCC(=O)N1CCCCC1C 62a_100000182743_100000210757 [0,0,1,1,0,0|2,0,0]=4 12745 B17R1.6947 CCCCCCSCC(=O)N1CCCCC1C 62a_100000210314_100000182743 [0,0,1,1,0,0|2,0,0]=4 12746 B17R1.6947 CCCCCNCCC(=O)N1CCCCC1C 34a_100025749213_100000718602 [0,0,1,1,0,0|2,0,0]=4 12747 B17R1.6947 CCCCSCCNC(=O)C1CCCCC1C 11a_100025743550_100011215568 [0,0,1,1,0,0|2,0,0]=4 12748 B17R1.6947 CCCCSCCNC(=O)C1CCCCC1C 1626a_100025743550_100011215568 [0,0,1,1,0,0|2,0,0]=4 12749 B17R1.6947 CCCCSCCNC(=O)C1CCCCC1C 240690a_100025743550_100011215568 [0,0,1,1,0,0|2,0,0]=4 12750 B17R1.6947 CCCCSCCNC(=O)C1CCCCC1C 527a_100025743550_100011215568 [0,0,1,1,0,0|2,0,0]=4 12751 B17R1.6947 CCCOCCCNC(=O)C1CCCCC1C 1626a_100011217757_100011215568 [0,0,1,1,0,0|2,0,0]=4 12752 B17R1.6947 CCCOCCCNC(=O)C1CCCCC1C 240690a_100011217757_100011215568 [0,0,1,1,0,0|2,0,0]=4 12753 B17R1.6947 CCCOCCCNC(=O)C1CCCCC1C 527a_100011217757_100011215568 [0,0,1,1,0,0|2,0,0]=4 12754 B17R1.6947 COCCCCCCC(=O)C1CCCCC1C 1458a_100011215568_100011998445 [0,0,1,1,0,0|2,0,0]=4 12755 B17R1.6947 COCCCCCNC(=O)C1CCCCC1C 11a_100000747528_100011215568 [0,0,1,1,0,0|2,0,0]=4 12756 B17R1.6947 COCCCCCNC(=O)C1CCCCC1C 1626a_100000747528_100011215568 [0,0,1,1,0,0|2,0,0]=4 12757 B17R1.6947 COCCCCCNC(=O)C1CCCCC1C 240690a_100000747528_100011215568 [0,0,1,1,0,0|2,0,0]=4 12758 B17R1.6947 COCCCCCNC(=O)C1CCCCC1C 527a_100000747528_100011215568 [0,0,1,1,0,0|2,0,0]=4 12759 B17R1.6953 CCCCCCCCC(=O)N1CCC1COC 11a_100015195929_100000210188 [0,0,1,1,0,0|2,0,0]=4 12760 B17R1.6953 CCCCCCCCC(=O)N1CCC1COC 1626a_100015195929_100000210188 [0,0,1,1,0,0|2,0,0]=4 12761 B17R1.6953 CCCCCCCCC(=O)N1CCC1COC 240690a_100015195929_100000210188 [0,0,1,1,0,0|2,0,0]=4 12762 B17R1.6953 CCCCCCCCC(=O)N1CCC1COC 527a_100015195929_100000210188 [0,0,1,1,0,0|2,0,0]=4 12763 B17R1.6954 CCC1CCCN1C(=O)CCCCCCCO 240690a_100000754278_100011219782 [0,0,1,1,0,0|2,0,0]=4 12764 B17R1.6954 CCCCCCCCC(=O)C1CCCN1CC 1458a_106256033941_100000210759 [0,0,1,1,0,0|2,0,0]=4 12765 B17R1.6954 CCCCCCCCC(=O)N1CCCC1CC 11a_100000754278_100000210188 [0,0,1,1,0,0|1,0,0]=3 12766 B17R1.6954 CCCCCCCCC(=O)N1CCCC1CC 1626a_100000754278_100000210188 [0,0,1,1,0,0|1,0,0]=3 12767 B17R1.6954 CCCCCCCCC(=O)N1CCCC1CC 240690a_100000754278_100000210188 [0,0,1,1,0,0|1,0,0]=3 12768 B17R1.6954 CCCCCCCCC(=O)N1CCCC1CC 527a_100000754278_100000210188 [0,0,1,1,0,0|1,0,0]=3 12769 B17R1.6954 CCCCCCCCC(=O)N1CCC[C@@H]1CO 240690a_100000745186_100000210188 [0,0,1,1,0,0|2,0,0]=4 12770 B17R1.6954 CCCCCCCCC(=O)N1CCC[C@@H]1CO 527a_100000745186_100000210188 [0,0,1,1,0,0|2,0,0]=4 12771 B17R1.6954 CCCCCCCNC(=O)C1CCCN1CC 240690a_100000229938_106256033941 [0,0,1,1,0,0|2,0,0]=4 12772 B17R1.6954 CCCCCCCNC(=O)C1CCCN1CC 527a_100000229938_106256033941 [0,0,1,1,0,0|2,0,0]=4 12773 B17R1.6954 CCCCCCCNC(=O)N1CCCC1CC 2708a_100000229938_100000754278 [0,0,1,1,0,0|2,0,0]=4 12774 B17R1.6954 CCCCCCCNC(=O)N1CCCC1CC 273464a_100000229938_100000754278 [0,0,1,1,0,0|2,0,0]=4 12775 B17R1.6956 CCCCCCCCC(=O)N[C@H]1CCC[C@@H]1O 11a_100000748460_100000210188 [0,0,1,1,0,0|2,0,0]=4 12776 B17R1.6956 CCCCCCCCC(=O)N[C@H]1CCC[C@@H]1O 240690a_100000748460_100000210188 [0,0,1,1,0,0|2,0,0]=4 12777 B17R1.9245 CCCCCCNC(=O)CN1CCCC1CC 2230a_100000754278_100000230325 [0,0,1,1,0,0|2,0,0]=4 12778 B17R1.9245 CCCCCCNC(=O)CN1CCCC1CC 269982a_100000754278_100000230325 [0,0,1,1,0,0|2,0,0]=4 12779 B17R1.9245 CCCCCCNC(=O)CN1CCCC1CC 34a_100000754278_100000230325 [0,0,1,1,0,0|2,0,0]=4 12780 B17R1.9246 CCCCCCCC(=O)CCC1CCCN1C 1458a_100000211969_100000005710 [0,0,1,1,0,0|2,0,0]=4 12781 B17R1.9246 CCCCCCCC(=O)NC[C@@H]1CCCN1C 240690a_100009821018_100000211969 [0,0,1,1,0,0|2,0,0]=4 12782 B17R1.9246 CCCCCCCC(=O)NC[C@@H]1CCCN1C 527a_100009821018_100000211969 [0,0,1,1,0,0|2,0,0]=4 12783 B17R1.9246 CCCCCCCC(=O)OCN1CCC[C@@H]1C 2230a_100020605311_100009852258 [0,0,1,1,0,0|1,0,0]=3 12784 B17R1.9246 CCCCCCCC(=O)OCN1CCC[C@@H]1C 269982a_100020605311_100009852258 [0,0,1,1,0,0|1,0,0]=3 12785 B17R1.9246 CCCCCCCC(=O)OCN1CCC[C@H]1C 2230a_100015189458_100009852258 [0,0,1,1,0,0|1,0,0]=3 12786 B17R1.9246 CCCCCCCC(=O)OCN1CCC[C@H]1C 269982a_100015189458_100009852258 [0,0,1,1,0,0|1,0,0]=3 12787 B17R1.9246 CCCCCCCC(=O)OCN1CCC[C@H]1C 34a_100015189458_100009852258 [0,0,1,1,0,0|1,0,0]=3 12788 B17R1.9246 CCCCCCCC(=O)OCN1CCSC1C 2230a_200011216479_100009852258 [0,0,1,1,0,0|2,0,0]=4 12789 B17R1.9246 CCCCCCCC(=O)OCN1CCSC1C 269982a_200011216479_100009852258 [0,0,1,1,0,0|2,0,0]=4 12790 B17R1.9246 CCCCCCCC(=O)OCN1CCSC1C 34a_200011216479_100009852258 [0,0,1,1,0,0|2,0,0]=4 12791 B17R1.9246 CCCCCCNC(=O)COC1CCCC1C 34a_100011216460_100000230325 [0,0,1,1,0,0|2,0,0]=4 12792 B17R1.9246 CCCCCCNC(=O)COC1CCCC1C 7a_100011216460_100000230325 [0,0,1,1,0,0|2,0,0]=4 12793 B17R1.9249 CCCCCCCC(=O)OCOCC1CC1C 34a_100000744939_100009852258 [0,0,1,1,0,0|1,0,0]=3 12794 B17R1.9249 CCCCCCCC(=O)OCOCC1CC1C 7a_100000744939_100009852258 [0,0,1,1,0,0|1,0,0]=3 12795 B17R1.9250 CCCCCCCC(=O)OCNCC1CCC1 2230a_100000738700_100009852258 [0,0,1,1,0,0|1,0,0]=3 12796 B17R1.9250 CCCCCCCC(=O)OCNCC1CCC1 34a_100000738700_100009852258 [0,0,1,1,0,0|1,0,0]=3 12797 B17R1.9250 CCCCCCCC(=O)OCNCC1COC1 2230a_100015281925_100009852258 [0,0,1,1,0,0|2,0,0]=4 12798 B17R1.9250 CCCCCCCC(=O)OCNCC1COC1 34a_100015281925_100009852258 [0,0,1,1,0,0|2,0,0]=4 12799 B17R1.9250 CCCCCCCC(=O)OCNC[C@@H]1CCO1 2230a_100020831831_100009852258 [0,0,1,1,0,0|2,0,0]=4 12800 B17R1.9250 CCCCCCCC(=O)OCNC[C@@H]1CCO1 34a_100020831831_100009852258 [0,0,1,1,0,0|2,0,0]=4 12801 B17R1.9250 CCCCCCCC(=O)OCOCC1CCC1 34a_100000760304_100009852258 [0,0,1,1,0,0|1,0,0]=3 12802 B17R1.9250 CCCCCCCC(=O)OCOCC1CCO1 34a_100000039022_100009852258 [0,0,1,1,0,0|2,0,0]=4 12803 B17R1.9250 CCCCCCCC(=O)OCOCC1CNC1 34a_100016987283_100009852258 [0,0,1,1,0,0|2,0,0]=4 12804 B17R1.9250 CCCCCCCC(=O)OCOCC1COC1 34a_100000060846_100009852258 [0,0,1,1,0,0|2,0,0]=4 12805 B17R1.9250 CCCCCCCC(=O)OCSCC1CCC1 62a_100000763275_100009852258 [0,0,1,1,0,0|1,0,0]=3 12806 B17R1.9250 CCCCCCCC(=O)OCSCC1CCO1 62a_100000103362_100009852258 [0,0,1,1,0,0|2,0,0]=4 12807 B17R1.9250 CCCCCCCC(=O)OCSCC1COC1 62a_100010264016_100009852258 [0,0,1,1,0,0|2,0,0]=4 12808 B17R1.9257 CCCCCCCC(=O)OCNCCC1CC1 34a_100000764129_100009852258 [0,0,1,1,0,0|1,0,0]=3 12809 B17R1.9257 CCCCCCCC(=O)OCOCCC1CC1 34a_100000754188_100009852258 [0,0,1,1,0,0|1,0,0]=3 12810 B17R1.9257 CCCCCCCC(=O)OCOCCC1CC1 7a_100000754188_100009852258 [0,0,1,1,0,0|1,0,0]=3 12811 B17R1.9257 CCCCCCCC(=O)OCOCC[C@@H]1CO1 34a_100009820653_100009852258 [0,0,1,1,0,0|2,0,0]=4 12812 B17R1.9257 CCCCCCCC(=O)OCSCCC1CC1 62a_100000764125_100009852258 [0,0,1,1,0,0|1,0,0]=3 12813 B17R1.9257 CCCCCCCC(=O)OCSCCC1CO1 62a_100000732470_100009852258 [0,0,1,1,0,0|2,0,0]=4 12814 B17R1.9266 CCCCCCCC(=O)C1CCCCCN1C 1458a_100015187800_100000210614 [0,0,1,1,0,0|2,0,0]=4 12815 B17R1.9266 CCCCCCNC(=O)C1CCCCCN1C 240690a_100000210581_100015187800 [0,0,1,1,0,0|2,0,0]=4 12816 B17R1.9266 CCCCCCNC(=O)C1CCCCCN1C 527a_100000210581_100015187800 [0,0,1,1,0,0|2,0,0]=4 12817 B17R1.9267 CCC1CCCCN1C(=O)CCCCCCO 240690a_100000210034_100011996774 [0,0,1,1,0,0|2,0,0]=4 12818 B17R1.9267 CCC1CCCCN1C(=O)CCCCCOC 11a_100000210034_100011935119 [0,0,1,1,0,0|2,0,0]=4 12819 B17R1.9267 CCC1CCCCN1C(=O)CCCCCOC 1626a_100000210034_100011935119 [0,0,1,1,0,0|2,0,0]=4 12820 B17R1.9267 CCC1CCCCN1C(=O)CCCCCOC 240690a_100000210034_100011935119 [0,0,1,1,0,0|2,0,0]=4 12821 B17R1.9267 CCC1CCCCN1C(=O)CCCCCOC 527a_100000210034_100011935119 [0,0,1,1,0,0|2,0,0]=4 12822 B17R1.9267 CCCCCCCC(=O)C1CCCCN1CC 1458a_100000743832_100000210614 [0,0,1,1,0,0|2,0,0]=4 12823 B17R1.9267 CCCCCCCC(=O)N1CCCCC1CC 11a_100000210034_100000211969 [0,0,1,1,0,0|1,0,0]=3 12824 B17R1.9267 CCCCCCCC(=O)N1CCCCC1CC 1626a_100000210034_100000211969 [0,0,1,1,0,0|1,0,0]=3 12825 B17R1.9267 CCCCCCCC(=O)N1CCCCC1CC 240690a_100000210034_100000211969 [0,0,1,1,0,0|1,0,0]=3 12826 B17R1.9267 CCCCCCCC(=O)N1CCCCC1CC 527a_100000210034_100000211969 [0,0,1,1,0,0|1,0,0]=3 12827 B17R1.9267 CCCCCCCC(=O)N1CCCCC1CO 240690a_100000210821_100000211969 [0,0,1,1,0,0|2,0,0]=4 12828 B17R1.9267 CCCCCCCC(=O)N1CCOC[C@@H]1CC 11a_100016988097_100000211969 [0,0,1,1,0,0|2,0,0]=4 12829 B17R1.9267 CCCCCCCC(=O)N1CCOC[C@@H]1CC 1626a_100016988097_100000211969 [0,0,1,1,0,0|2,0,0]=4 12830 B17R1.9267 CCCCCCCC(=O)N1CCOC[C@@H]1CC 240690a_100016988097_100000211969 [0,0,1,1,0,0|2,0,0]=4 12831 B17R1.9267 CCCCCCCC(=O)N1CCOC[C@@H]1CC 527a_100016988097_100000211969 [0,0,1,1,0,0|2,0,0]=4 12832 B17R1.9267 CCCCCCNC(=O)C1CCCCN1CC 11a_100000210581_100000743832 [0,0,1,1,0,0|2,0,0]=4 12833 B17R1.9267 CCCCCCNC(=O)C1CCCCN1CC 240690a_100000210581_100000743832 [0,0,1,1,0,0|2,0,0]=4 12834 B17R1.9267 CCCCCCNC(=O)C1CCCCN1CC 527a_100000210581_100000743832 [0,0,1,1,0,0|2,0,0]=4 12835 B17R1.9267 CCCCCCNC(=O)N1CCCCC1CC 2708a_100000210581_100000210034 [0,0,1,1,0,0|2,0,0]=4 12836 B17R1.9267 CCCCCCNC(=O)N1CCCCC1CC 273464a_100000210581_100000210034 [0,0,1,1,0,0|2,0,0]=4 12837 B17R1.9267 CCCCCNCC(=O)N1CCCCC1CC 2230a_100000209983_100000183412 [0,0,1,1,0,0|2,0,0]=4 12838 B17R1.9267 CCCCCOCC(=O)N1CCCCC1CC 34a_100000210253_100000183412 [0,0,1,1,0,0|2,0,0]=4 12839 B17R1.9267 CCCCCOCC(=O)N1CCCCC1CC 7a_100000210253_100000183412 [0,0,1,1,0,0|2,0,0]=4 12840 B17R1.9267 CCCCCSCC(=O)N1CCCCC1CC 62a_100000183412_100000210326 [0,0,1,1,0,0|2,0,0]=4 12841 B17R1.9267 CCCCCSCC(=O)N1CCCCC1CC 62a_100000210326_100000183412 [0,0,1,1,0,0|2,0,0]=4 12842 B17R1.9271 CCCCCCCC(=O)N1CCC[C@H]1COC 11a_100020646714_100000211969 [0,0,1,1,0,0|2,0,0]=4 12843 B17R1.9271 CCCCCCCC(=O)N1CCC[C@H]1COC 1626a_100020646714_100000211969 [0,0,1,1,0,0|2,0,0]=4 12844 B17R1.9271 CCCCCCCC(=O)N1CCC[C@H]1COC 240690a_100020646714_100000211969 [0,0,1,1,0,0|2,0,0]=4 12845 B17R1.9274 CC1CCCCC1NC(=O)CCCCCCO 240690a_100000211402_100011996774 [0,0,1,1,0,0|2,0,0]=4 12846 B17R1.9274 CCCCCCCC(=O)CC1CCCCN1C 1458a_100000211969_100015185383 [0,0,1,1,0,0|2,0,0]=4 12847 B17R1.9274 CCCCCCCC(=O)NC1CCCCC1C 11a_100000211402_100000211969 [0,0,1,1,0,0|1,0,0]=3 12848 B17R1.9274 CCCCCCCC(=O)NC1CCCCC1C 1626a_100000211402_100000211969 [0,0,1,1,0,0|1,0,0]=3 12849 B17R1.9274 CCCCCCCC(=O)NC1CCCCC1C 240690a_100000211402_100000211969 [0,0,1,1,0,0|1,0,0]=3 12850 B17R1.9274 CCCCCCCC(=O)NC1CCCCC1C 527a_100000211402_100000211969 [0,0,1,1,0,0|1,0,0]=3 12851 B17R1.9274 CCCCCCCC(=O)N[C@@H]1CCCC[C@@H]1O 240690a_100015191688_100000211969 [0,0,1,1,0,0|2,0,0]=4 12852 B17R1.9274 CCCCCCCC(=O)N[C@@H]1CCCC[C@@H]1O 527a_100015191688_100000211969 [0,0,1,1,0,0|2,0,0]=4 12853 B17R1.9274 CCCCCCCC(=O)N[C@@H]1CCCC[C@H]1F 11a_100015195156_100000211969 [0,0,1,1,0,0|2,0,0]=4 12854 B17R1.9274 CCCCCCCC(=O)N[C@@H]1CCCC[C@H]1F 1626a_100015195156_100000211969 [0,0,1,1,0,0|2,0,0]=4 12855 B17R1.9274 CCCCCCCC(=O)N[C@@H]1CCCC[C@H]1F 240690a_100015195156_100000211969 [0,0,1,1,0,0|2,0,0]=4 12856 B17R1.9274 CCCCCCCC(=O)N[C@@H]1CCCC[C@H]1F 527a_100015195156_100000211969 [0,0,1,1,0,0|2,0,0]=4 12857 B17R1.9274 CCCCCCCC(C)OC1CCCCC1C 34a_100000211207_200011218727 [0,0,1,1,0,0|1,0,1]=4 12858 B17R1.9274 CCCCCCCC(C)OC1CCCCC1C 7a_100000211207_200011218727 [0,0,1,1,0,0|1,0,1]=4 12859 B17R1.9274 CCCCCCNC(=O)CN1CCCCC1C 2230a_100000211376_100000230325 [0,0,1,1,0,0|2,0,0]=4 12860 B17R1.9274 CCCCCCNC(=O)CN1CCCCC1C 269982a_100000211376_100000230325 [0,0,1,1,0,0|2,0,0]=4 12861 B17R1.9274 CCCCCCNC(=O)CN1CCCCC1C 34a_100000211376_100000230325 [0,0,1,1,0,0|2,0,0]=4 12862 B17R1.9274 CCCCCCNC(=O)NC1CCCCC1C 2708a_100000210581_100000211402 [0,0,1,1,0,0|2,0,0]=4 12863 B17R1.9274 CCCCCCNC(=O)NC1CCCCC1C 2708a_100000211402_100000210581 [0,0,1,1,0,0|2,0,0]=4 12864 B17R1.9274 CCCCCCNC(=O)NC1CCCCC1C 273464a_100000210581_100000211402 [0,0,1,1,0,0|2,0,0]=4 12865 B17R1.9274 CCCCCCNC(=O)NC1CCCCC1C 273464a_100000211402_100000210581 [0,0,1,1,0,0|2,0,0]=4 12866 B17R1.9274 CCCCCCNC(=O)NC1CCCCC1C 512a_100000210581_100000211402 [0,0,1,1,0,0|2,0,0]=4 12867 B17R1.9274 CCCCCCNC(=O)NC1CCCCC1C 512a_100000211402_100000210581 [0,0,1,1,0,0|2,0,0]=4 12868 B17R1.9274 CCCCCNCC(=O)NC1CCCCC1C 2230a_100000209983_100000182742 [0,0,1,1,0,0|2,0,0]=4 12869 B17R1.9274 CCCCCOCC(=O)NC1CCCCC1C 34a_100000210253_100000182742 [0,0,1,1,0,0|2,0,0]=4 12870 B17R1.9274 CCCCCOCC(=O)NC1CCCCC1C 7a_100000210253_100000182742 [0,0,1,1,0,0|2,0,0]=4 12871 B17R1.9274 CCCCCSCC(=O)NC1CCCCC1C 62a_100000182742_100000210326 [0,0,1,1,0,0|2,0,0]=4 12872 B17R1.9274 CCCCCSCC(=O)NC1CCCCC1C 62a_100000210326_100000182742 [0,0,1,1,0,0|2,0,0]=4 12873 B17R1.9274 COCCCCCC(=O)NC1CCCCC1C 11a_100000211402_100011935119 [0,0,1,1,0,0|2,0,0]=4 12874 B17R1.9274 COCCCCCC(=O)NC1CCCCC1C 1626a_100000211402_100011935119 [0,0,1,1,0,0|2,0,0]=4 12875 B17R1.9274 COCCCCCC(=O)NC1CCCCC1C 240690a_100000211402_100011935119 [0,0,1,1,0,0|2,0,0]=4 12876 B17R1.9274 COCCCCCC(=O)NC1CCCCC1C 527a_100000211402_100011935119 [0,0,1,1,0,0|2,0,0]=4 12877 B17R1.29476 CCCCCCCCC(=O)NCCN1CCC1 240690a_100000691440_100000210188 [0,0,1,1,0,0|2,0,0]=4 12878 B17R1.29476 CCCCCCCCC(=O)NNCC1CCC1 22a_200020586977_100000210188 [0,0,1,1,0,0|2,0,0]=4 12879 B17R1.51073 CCCCCCC=CC(=O)C1CCCCCC1 1458a_200015324643_100011217769 [0,0,1,1,0,0|1,0,1]=4 12880 B17R1.51073 CCCCCCCCC(=O)C1CCCCCC1 1458a_100000210188_100011217769 [0,0,1,1,0,0|1,0,0]=3 12881 B17R1.51073 CCCCCCCCC(=O)C1CCCCCC1 1458a_100000749507_100000210759 [0,0,1,1,0,0|1,0,0]=3 12882 B17R1.51073 CCCCCCCCC(=O)N1CCCCCC1 11a_100000185865_100000210188 [0,0,1,1,0,0|1,0,0]=3 12883 B17R1.51073 CCCCCCCCC(=O)N1CCCCCC1 1626a_100000185865_100000210188 [0,0,1,1,0,0|1,0,0]=3 12884 B17R1.51073 CCCCCCCCC(=O)N1CCCCCC1 240690a_100000185865_100000210188 [0,0,1,1,0,0|1,0,0]=3 12885 B17R1.51073 CCCCCCCCC(=O)N1CCCCCC1 527a_100000185865_100000210188 [0,0,1,1,0,0|1,0,0]=3 12886 B17R1.51073 CCCCCCCCC(=O)N1CCCOCC1 11a_100000685342_100000210188 [0,0,1,1,0,0|2,0,0]=4 12887 B17R1.51073 CCCCCCCCC(=O)N1CCCOCC1 1626a_100000685342_100000210188 [0,0,1,1,0,0|2,0,0]=4 12888 B17R1.51073 CCCCCCCCC(=O)N1CCCOCC1 240690a_100000685342_100000210188 [0,0,1,1,0,0|2,0,0]=4 12889 B17R1.51073 CCCCCCCCC(=O)N1CCCOCC1 527a_100000685342_100000210188 [0,0,1,1,0,0|2,0,0]=4 12890 B17R1.51073 CCCCCCCNC(=O)C1CCCCCC1 11a_100000229938_100000749507 [0,0,1,1,0,0|1,0,0]=3 12891 B17R1.51073 CCCCCCCNC(=O)C1CCCCCC1 1626a_100000229938_100000749507 [0,0,1,1,0,0|1,0,0]=3 12892 B17R1.51073 CCCCCCCNC(=O)C1CCCCCC1 240690a_100000229938_100000749507 [0,0,1,1,0,0|1,0,0]=3 12893 B17R1.51073 CCCCCCCNC(=O)C1CCCCCC1 527a_100000229938_100000749507 [0,0,1,1,0,0|1,0,0]=3 12894 B17R1.51073 CCCCCCCNC(=O)N1CCCCCC1 2708a_100000229938_100000185865 [0,0,1,1,0,0|2,0,0]=4 12895 B17R1.51073 CCCCCCCNC(=O)N1CCCCCC1 273464a_100000229938_100000185865 [0,0,1,1,0,0|2,0,0]=4 12896 B17R1.51073 CCCCCCNCC(=O)N1CCCCCC1 2230a_100000210581_100000182869 [0,0,1,1,0,0|2,0,0]=4 12897 B17R1.51073 CCCCCCOCC(=O)N1CCCCCC1 34a_100000210259_100000182869 [0,0,1,1,0,0|2,0,0]=4 12898 B17R1.51073 CCCCCCOCC(=O)N1CCCCCC1 7a_100000210259_100000182869 [0,0,1,1,0,0|2,0,0]=4 12899 B17R1.51073 CCCCCCSCC(=O)N1CCCCCC1 62a_100000182869_100000210757 [0,0,1,1,0,0|2,0,0]=4 12900 B17R1.51073 CCCCCCSCC(=O)N1CCCCCC1 62a_100000210314_100000182869 [0,0,1,1,0,0|2,0,0]=4 12901 B17R1.51073 CCCCSCCNC(=O)C1CCCCCC1 11a_100025743550_100000749507 [0,0,1,1,0,0|2,0,0]=4 12902 B17R1.51073 CCCCSCCNC(=O)C1CCCCCC1 1626a_100025743550_100000749507 [0,0,1,1,0,0|2,0,0]=4 12903 B17R1.51073 CCCCSCCNC(=O)C1CCCCCC1 240690a_100025743550_100000749507 [0,0,1,1,0,0|2,0,0]=4 12904 B17R1.51073 CCCCSCCNC(=O)C1CCCCCC1 527a_100025743550_100000749507 [0,0,1,1,0,0|2,0,0]=4 12905 B17R1.51073 CCCOCCCNC(=O)C1CCCCCC1 1626a_100011217757_100000749507 [0,0,1,1,0,0|2,0,0]=4 12906 B17R1.51073 CCCOCCCNC(=O)C1CCCCCC1 240690a_100011217757_100000749507 [0,0,1,1,0,0|2,0,0]=4 12907 B17R1.51073 CCCOCCCNC(=O)C1CCCCCC1 527a_100011217757_100000749507 [0,0,1,1,0,0|2,0,0]=4 12908 B17R1.51073 COCCCCCCC(=O)C1CCCCCC1 1458a_100000749507_100011998445 [0,0,1,1,0,0|2,0,0]=4 12909 B17R1.51073 COCCCCCNC(=O)C1CCCCCC1 11a_100000747528_100000749507 [0,0,1,1,0,0|2,0,0]=4 12910 B17R1.51073 COCCCCCNC(=O)C1CCCCCC1 1626a_100000747528_100000749507 [0,0,1,1,0,0|2,0,0]=4 12911 B17R1.51073 COCCCCCNC(=O)C1CCCCCC1 240690a_100000747528_100000749507 [0,0,1,1,0,0|2,0,0]=4 12912 B17R1.51073 COCCCCCNC(=O)C1CCCCCC1 527a_100000747528_100000749507 [0,0,1,1,0,0|2,0,0]=4 12913 B17R1.51073 O=C(CCCCCCCO)C1CCCCCC1 1458a_100000749507_100000760002 [0,0,1,1,0,0|2,0,0]=4 12914 B17R1.51073 O=C(CCCCCCCO)C1CCCCCC1 1458a_100011219782_100011217769 [0,0,1,1,0,0|2,0,0]=4 12915 B17R1.51073 O=C(CCCCCCCO)N1CCCCCC1 240690a_100000185865_100011219782 [0,0,1,1,0,0|2,0,0]=4 12916 B17R1.51073 O=C(NCCCCCCO)C1CCCCCC1 240690a_100000686447_100000749507 [0,0,1,1,0,0|2,0,0]=4 12917 B17R1.51073 O=C(NCCCCCCO)C1CCCCCC1 527a_100000686447_100000749507 [0,0,1,1,0,0|2,0,0]=4 12918 B17R1.66797 CCCCCCCC(=O)N1CCCCCCC1 11a_100000211400_100000211969 [0,0,1,1,0,0|1,0,0]=3 12919 B17R1.66797 CCCCCCCC(=O)N1CCCCCCC1 1626a_100000211400_100000211969 [0,0,1,1,0,0|1,0,0]=3 12920 B17R1.66797 CCCCCCCC(=O)N1CCCCCCC1 240690a_100000211400_100000211969 [0,0,1,1,0,0|1,0,0]=3 12921 B17R1.66797 CCCCCCCC(=O)N1CCCCCCC1 527a_100000211400_100000211969 [0,0,1,1,0,0|1,0,0]=3 12922 B17R1.66797 CCCCCCNC(=O)N1CCCCCCC1 2708a_100000210581_100000211400 [0,0,1,1,0,0|2,0,0]=4 12923 B17R1.66797 CCCCCCNC(=O)N1CCCCCCC1 273464a_100000210581_100000211400 [0,0,1,1,0,0|2,0,0]=4 12924 B17R1.66797 CCCCCNCC(=O)N1CCCCCCC1 2230a_100000209983_100000230191 [0,0,1,1,0,0|2,0,0]=4 12925 B17R1.66797 CCCCCOCC(=O)N1CCCCCCC1 34a_100000210253_100000230191 [0,0,1,1,0,0|2,0,0]=4 12926 B17R1.66797 CCCCCOCC(=O)N1CCCCCCC1 7a_100000210253_100000230191 [0,0,1,1,0,0|2,0,0]=4 12927 B17R1.66797 CCCCCSCC(=O)N1CCCCCCC1 62a_100000210326_100000230191 [0,0,1,1,0,0|2,0,0]=4 12928 B17R1.66797 CCCCCSCC(=O)N1CCCCCCC1 62a_100000230191_100000210326 [0,0,1,1,0,0|2,0,0]=4 12929 B17R1.66797 COCCCCCC(=O)N1CCCCCCC1 11a_100000211400_100011935119 [0,0,1,1,0,0|2,0,0]=4 12930 B17R1.66797 COCCCCCC(=O)N1CCCCCCC1 1626a_100000211400_100011935119 [0,0,1,1,0,0|2,0,0]=4 12931 B17R1.66797 COCCCCCC(=O)N1CCCCCCC1 240690a_100000211400_100011935119 [0,0,1,1,0,0|2,0,0]=4 12932 B17R1.66797 COCCCCCC(=O)N1CCCCCCC1 527a_100000211400_100011935119 [0,0,1,1,0,0|2,0,0]=4 12933 B17R1.66797 O=C(CCCCCCO)N1CCCCCCC1 240690a_100000211400_100011996774 [0,0,1,1,0,0|2,0,0]=4 12934 B17R1.66922 CCCCCC#CC(=O)CC1CCCCCC1 1458a_100011215388_200000696569 [0,0,1,1,0,0|1,0,1]=4 12935 B17R1.66922 CCCCCC=CC(=O)CC1CCCCCC1 1458a_100016263427_200000696569 [0,0,1,1,0,0|1,0,1]=4 12936 B17R1.66922 CCCCCCCC(=O)C=C1CCCCCC1 1458a_100011240665_100000210614 [0,0,1,1,0,0|1,0,1]=4 12937 B17R1.66922 CCCCCCCC(=O)CC1CCCCCC1 1458a_100000211969_200000696569 [0,0,1,1,0,0|1,0,0]=3 12938 B17R1.66922 CCCCCCCC(=O)CC1CCCCCC1 1458a_100000685095_100000210614 [0,0,1,1,0,0|1,0,0]=3 12939 B17R1.66922 CCCCCCCC(=O)CN1CCCCCC1 1458a_100000740298_100000210614 [0,0,1,1,0,0|2,0,0]=4 12940 B17R1.66922 CCCCCCCC(=O)NC1CCCCCC1 11a_100000210984_100000211969 [0,0,1,1,0,0|1,0,0]=3 12941 B17R1.66922 CCCCCCCC(=O)NC1CCCCCC1 1626a_100000210984_100000211969 [0,0,1,1,0,0|1,0,0]=3 12942 B17R1.66922 CCCCCCCC(=O)NC1CCCCCC1 240690a_100000210984_100000211969 [0,0,1,1,0,0|1,0,0]=3 12943 B17R1.66922 CCCCCCCC(=O)NC1CCCCCC1 527a_100000210984_100000211969 [0,0,1,1,0,0|1,0,0]=3 12944 B17R1.66922 CCCCCCCC(C)OC1CCCCCC1 34a_100000210887_200011218727 [0,0,1,1,0,0|1,0,1]=4 12945 B17R1.66922 CCCCCCCC(C)OC1CCCCCC1 34a_200011215852_100011217769 [0,0,1,1,0,0|1,0,1]=4 12946 B17R1.66922 CCCCCCCC(C)OC1CCCCCC1 7a_100000210887_200011218727 [0,0,1,1,0,0|1,0,1]=4 12947 B17R1.66922 CCCCCCNC(=O)CC1CCCCCC1 11a_100000210581_100000685095 [0,0,1,1,0,0|1,0,0]=3 12948 B17R1.66922 CCCCCCNC(=O)CC1CCCCCC1 1626a_100000210581_100000685095 [0,0,1,1,0,0|1,0,0]=3 12949 B17R1.66922 CCCCCCNC(=O)CC1CCCCCC1 240690a_100000210581_100000685095 [0,0,1,1,0,0|1,0,0]=3 12950 B17R1.66922 CCCCCCNC(=O)CC1CCCCCC1 527a_100000210581_100000685095 [0,0,1,1,0,0|1,0,0]=3 12951 B17R1.66922 CCCCCCNC(=O)CN1CCCCCC1 11a_100000210581_100000740298 [0,0,1,1,0,0|2,0,0]=4 12952 B17R1.66922 CCCCCCNC(=O)CN1CCCCCC1 2230a_100000185865_100000230325 [0,0,1,1,0,0|2,0,0]=4 12953 B17R1.66922 CCCCCCNC(=O)CN1CCCCCC1 240690a_100000210581_100000740298 [0,0,1,1,0,0|2,0,0]=4 12954 B17R1.66922 CCCCCCNC(=O)CN1CCCCCC1 269982a_100000185865_100000230325 [0,0,1,1,0,0|2,0,0]=4 12955 B17R1.66922 CCCCCCNC(=O)CN1CCCCCC1 34a_100000185865_100000230325 [0,0,1,1,0,0|2,0,0]=4 12956 B17R1.66922 CCCCCCNC(=O)CN1CCCCCC1 527a_100000210581_100000740298 [0,0,1,1,0,0|2,0,0]=4 12957 B17R1.66922 CCCCCCNC(=O)NC1CCCCCC1 2708a_100000210581_100000210984 [0,0,1,1,0,0|2,0,0]=4 12958 B17R1.66922 CCCCCCNC(=O)NC1CCCCCC1 2708a_100000210984_100000210581 [0,0,1,1,0,0|2,0,0]=4 12959 B17R1.66922 CCCCCCNC(=O)NC1CCCCCC1 273464a_100000210581_100000210984 [0,0,1,1,0,0|2,0,0]=4 12960 B17R1.66922 CCCCCCNC(=O)NC1CCCCCC1 273464a_100000210984_100000210581 [0,0,1,1,0,0|2,0,0]=4 12961 B17R1.66922 CCCCCCNC(=O)NC1CCCCCC1 512a_100000210581_100000210984 [0,0,1,1,0,0|2,0,0]=4 12962 B17R1.66922 CCCCCNCC(=O)NC1CCCCCC1 2230a_100000209983_100000183474 [0,0,1,1,0,0|2,0,0]=4 12963 B17R1.66922 CCCCCNNC(=O)CC1CCCCCC1 22a_100000694160_100000685095 [0,0,1,1,0,0|2,0,0]=4 12964 B17R1.66922 CCCCCOCC(=O)NC1CCCCCC1 34a_100000210253_100000183474 [0,0,1,1,0,0|2,0,0]=4 12965 B17R1.66922 CCCCCOCC(=O)NC1CCCCCC1 7a_100000210253_100000183474 [0,0,1,1,0,0|2,0,0]=4 12966 B17R1.66922 CCCCCSCC(=O)NC1CCCCCC1 62a_100000183474_100000210326 [0,0,1,1,0,0|2,0,0]=4 12967 B17R1.66922 CCCCCSCC(=O)NC1CCCCCC1 62a_100000210326_100000183474 [0,0,1,1,0,0|2,0,0]=4 12968 B17R1.66922 CCCCNCCC(=O)NC1CCCCCC1 2230a_100000102301_200011271707 [0,0,1,1,0,0|2,0,0]=4 12969 B17R1.66922 CCCCNCCC(=O)NC1CCCCCC1 7a_106832991798_200011271707 [0,0,1,1,0,0|2,0,0]=4 12970 B17R1.66922 CCCCOCCC(=O)CC1CCCCCC1 1458a_100000685095_100000743108 [0,0,1,1,0,0|2,0,0]=4 12971 B17R1.66922 CCCCOCCC(=O)NC1CCCCCC1 7a_100000210227_200011271707 [0,0,1,1,0,0|2,0,0]=4 12972 B17R1.66922 CCCCSCCC(=O)NC1CCCCCC1 62a_100000210211_200011271707 [0,0,1,1,0,0|2,0,0]=4 12973 B17R1.66922 CCCCSCCC(=O)NC1CCCCCC1 62a_200011271707_100000210210 [0,0,1,1,0,0|2,0,0]=4 12974 B17R1.66922 CCCOCCNC(=O)CC1CCCCCC1 1626a_100161115042_100000685095 [0,0,1,1,0,0|2,0,0]=4 12975 B17R1.66922 CCCOCCNC(=O)CC1CCCCCC1 240690a_100161115042_100000685095 [0,0,1,1,0,0|2,0,0]=4 12976 B17R1.66922 CCCOCCNC(=O)CC1CCCCCC1 527a_100161115042_100000685095 [0,0,1,1,0,0|2,0,0]=4 12977 B17R1.66922 CCCSCCNC(=O)CC1CCCCCC1 11a_100020603323_100000685095 [0,0,1,1,0,0|2,0,0]=4 12978 B17R1.66922 CCCSCCNC(=O)CC1CCCCCC1 240690a_100020603323_100000685095 [0,0,1,1,0,0|2,0,0]=4 12979 B17R1.66922 CCCSCCNC(=O)CC1CCCCCC1 527a_100020603323_100000685095 [0,0,1,1,0,0|2,0,0]=4 12980 B17R1.66922 CCOCCCNC(=O)CC1CCCCCC1 11a_100000210961_100000685095 [0,0,1,1,0,0|2,0,0]=4 12981 B17R1.66922 CCOCCCNC(=O)CC1CCCCCC1 1626a_100000210961_100000685095 [0,0,1,1,0,0|2,0,0]=4 12982 B17R1.66922 CCOCCCNC(=O)CC1CCCCCC1 240690a_100000210961_100000685095 [0,0,1,1,0,0|2,0,0]=4 12983 B17R1.66922 CCOCCCNC(=O)CC1CCCCCC1 527a_100000210961_100000685095 [0,0,1,1,0,0|2,0,0]=4 12984 B17R1.66922 COCCCCCC(=O)CC1CCCCCC1 1458a_100011935119_200000696569 [0,0,1,1,0,0|2,0,0]=4 12985 B17R1.66922 COCCCCCC(=O)NC1CCCCCC1 11a_100000210984_100011935119 [0,0,1,1,0,0|2,0,0]=4 12986 B17R1.66922 COCCCCCC(=O)NC1CCCCCC1 1626a_100000210984_100011935119 [0,0,1,1,0,0|2,0,0]=4 12987 B17R1.66922 COCCCCCC(=O)NC1CCCCCC1 240690a_100000210984_100011935119 [0,0,1,1,0,0|2,0,0]=4 12988 B17R1.66922 COCCCCCC(=O)NC1CCCCCC1 527a_100000210984_100011935119 [0,0,1,1,0,0|2,0,0]=4 12989 B17R1.66922 O=C(CC1CCCCCC1)NCCCCCO 240690a_100000762737_100000685095 [0,0,1,1,0,0|2,0,0]=4 12990 B17R1.66922 O=C(CCCCCCF)CC1CCCCCC1 1458a_100000685095_100015922095 [0,0,1,1,0,0|2,0,0]=4 12991 B17R1.66922 O=C(CCCCCCO)CC1CCCCCC1 1458a_100000685095_100000766143 [0,0,1,1,0,0|2,0,0]=4 12992 B17R1.66922 O=C(CCCCCCO)CC1CCCCCC1 1458a_100011996774_200000696569 [0,0,1,1,0,0|2,0,0]=4 12993 B17R1.66922 O=C(CCCCCCO)NC1CCCCCC1 240690a_100000210984_100011996774 [0,0,1,1,0,0|2,0,0]=4 12994 B17R1.11 CCCCCCCCCNC1CCC(=O)NC1 2230a_100000748762_100011214924 [0,0,1,1,0,0|2,0,0]=4 12995 B17R1.11 CCCCCCCCCNC1CCC(=O)NC1 34a_100000748762_100011214924 [0,0,1,1,0,0|2,0,0]=4 12996 B17R1.11 CCCCCCCCCOC1CCC(=O)CC1 34a_100000764474_100011214924 [0,0,1,1,0,0|2,0,0]=4 12997 B17R1.11 CCCCCCCCCOC1CCC(=O)CC1 7a_100000764474_100000210328 [0,0,1,1,0,0|2,0,0]=4 12998 B17R1.11 CCCCCCCCCOC1CCC(=O)NC1 34a_100000079199_100011214924 [0,0,1,1,0,0|2,0,0]=4 12999 B17R1.11 CCCCCCCCOCC1CCC(=O)CC1 34a_100000062911_100000210759 [0,0,1,1,0,0|2,0,0]=4 13000 B17R1.23 CCCCCCCCCN1CCNC(=O)C1C 2230a_100000750721_100011214924 [0,0,1,1,0,0|2,0,0]=4 13001 B17R1.23 CCCCCCCCCN1CCNC(=O)C1C 269982a_100000750721_100000210670 [0,0,1,1,0,0|2,0,0]=4 13002 B17R1.23 CCCCCCCCCN1CCNC(=O)C1C 34a_100000750721_100011214924 [0,0,1,1,0,0|2,0,0]=4 13003 B17R1.23 CCCCCCCNCC1CCCC(=O)N1C 2230a_200010383782_100000210681 [0,0,1,1,0,0|2,0,0]=4 13004 B17R1.23 CCCCCCCNCC1CCCC(=O)N1C 34a_200010383782_100000210614 [0,0,1,1,0,0|2,0,0]=4 13005 B17R1.323 CCCCCCN1CCOCC1CC(=O)OC 2230a_100000731486_100000210314 [0,0,1,1,0,0|2,0,0]=4 13006 B17R1.323 CCCCCCN1CCOCC1CC(=O)OC 34a_100000731486_100000210314 [0,0,1,1,0,0|2,0,0]=4 13007 B17R1.347 CCCC1CCCCC1NCCCC(=O)NC 269862a_100000740002_100011218038 [0,0,1,1,0,0|2,0,0]=4 13008 B17R1.347 CCCC1CCCCC1NCCCC(=O)NC 270004a_100000740002_100011218038 [0,0,1,1,0,0|2,0,0]=4 13009 B17R1.347 CCCC1CCCCC1NCCNC(=O)CC 269862a_100132302217_100011218038 [0,0,1,1,0,0|2,0,0]=4 13010 B17R1.347 CCCC1CCCCC1NCCNC(=O)CC 270004a_100132302217_100011218038 [0,0,1,1,0,0|2,0,0]=4 13011 B17R1.347 CCCC1CCCCC1OCCCC(=O)NC 34a_100011217265_100000741757 [0,0,1,1,0,0|2,0,0]=4 13012 B17R1.347 CCCC1CCCCC1OCCCC(=O)NC 7a_100011217265_100000741757 [0,0,1,1,0,0|2,0,0]=4 13013 B17R1.347 CCCC1CCCCC1OCCCC(=O)OC 34a_100011217265_100000742333 [0,0,1,1,0,0|1,0,0]=3 13014 B17R1.347 CCCC1CCCCC1OCCCC(=O)OC 7a_100011217265_100011218270 [0,0,1,1,0,0|1,0,0]=3 13015 B17R1.347 CCCC1CCCCC1OCCOC(=O)NC 34a_100011217265_200011997002 [0,0,1,1,0,0|2,0,0]=4 13016 B17R1.347 CCCC1CCCCC1OCCOC(=O)NC 7a_100011217265_200011997002 [0,0,1,1,0,0|2,0,0]=4 13017 B17R1.347 CCCC1CCCCN1CCCCC(=O)OC 2230a_100000701414_100000204269 [0,0,1,1,0,0|1,0,0]=3 13018 B17R1.347 CCCC1CCCCN1CCCCC(=O)OC 269982a_100000701414_100000204269 [0,0,1,1,0,0|1,0,0]=3 13019 B17R1.347 CCCC1CCCCN1CCCCC(=O)OC 34a_100000701414_100000204269 [0,0,1,1,0,0|1,0,0]=3 13020 B17R1.347 CCCC1CCCCN1CCOCC(=O)OC 2230a_100000701414_100000090808 [0,0,1,1,0,0|2,0,0]=4 13021 B17R1.347 CCCC1CCCCN1CCOCC(=O)OC 34a_100000701414_100000090808 [0,0,1,1,0,0|2,0,0]=4 13022 B17R1.347 CCCC1COCCN1CCCCC(=O)OC 2230a_102495339903_100000204269 [0,0,1,1,0,0|2,0,0]=4 13023 B17R1.347 CCCC1COCCN1CCCCC(=O)OC 269982a_102495339903_100000204269 [0,0,1,1,0,0|2,0,0]=4 13024 B17R1.347 CCCC1COCCN1CCCCC(=O)OC 34a_102495339903_100000204269 [0,0,1,1,0,0|2,0,0]=4 13025 B17R1.347 COC(=O)CCCCN1CCCCC1CCO 2230a_100000211664_100000204269 [0,0,1,1,0,0|2,0,0]=4 13026 B17R1.347 COC(=O)CCCCN1CCCCC1CCO 269982a_100000211664_100000204269 [0,0,1,1,0,0|2,0,0]=4 13027 B17R1.347 COC(=O)CCCCN1CCCCC1CCO 34a_100000211664_100000204269 [0,0,1,1,0,0|2,0,0]=4 13028 B17R1.347 COCC1CCCCN1CCCCC(=O)OC 2230a_100015184032_100000204269 [0,0,1,1,0,0|2,0,0]=4 13029 B17R1.347 COCC1CCCCN1CCCCC(=O)OC 269982a_100015184032_100000204269 [0,0,1,1,0,0|2,0,0]=4 13030 B17R1.347 COCC1CCCCN1CCCCC(=O)OC 34a_100015184032_100000204269 [0,0,1,1,0,0|2,0,0]=4 13031 B17R1.361 CCCN1CCCC1COCCCC(=O)OC 34a_200000694710_100000742333 [0,0,1,1,0,0|2,0,0]=4 13032 B17R1.361 CCCN1CCCC1COCCCC(=O)OC 7a_200000694710_100011218270 [0,0,1,1,0,0|2,0,0]=4 13033 B17R1.361 COC[C@@H]1CCCN1CCCCCC(=O)OC 2230a_100020646714_100009816466 [0,0,1,1,0,0|2,0,0]=4 13034 B17R1.361 COC[C@@H]1CCCN1CCCCCC(=O)OC 269982a_100020646714_100009816466 [0,0,1,1,0,0|2,0,0]=4 13035 B17R1.361 COC[C@@H]1CCCN1CCCCCC(=O)OC 34a_100020646714_100009816466 [0,0,1,1,0,0|2,0,0]=4 13036 B17R1.1158 CCC(=O)NCCNCCCC1CCCCC1 34a_100132302217_100011713725 [0,0,1,1,0,0|2,0,0]=4 13037 B17R1.1158 CCC(=O)NCCOCCCC1CCCCC1 34a_200000158885_100011713725 [0,0,1,1,0,0|2,0,0]=4 13038 B17R1.1158 CCC(=O)NCCOCCCC1CCCCC1 7a_200000158885_100011713725 [0,0,1,1,0,0|2,0,0]=4 13039 B17R1.1158 CCC(=O)OCCOCCCC1CCCCC1 7a_200000031056_100011713725 [0,0,1,1,0,0|1,0,0]=3 13040 B17R1.1158 CCC(=O)OCCOCCCN1CCCCC1 7a_200000031056_100000007876 [0,0,1,1,0,0|2,0,0]=4 13041 B17R1.1158 CCC(=O)OCCOCCOC1CCCCC1 7a_200000031056_100011211530 [0,0,1,1,0,0|2,0,0]=4 13042 B17R1.1158 CNC(=O)CCCNCCCC1CCCCC1 2230a_100000740002_100011713725 [0,0,1,1,0,0|2,0,0]=4 13043 B17R1.1158 CNC(=O)CCCNCCCC1CCCCC1 2230a_100011211642_100000741757 [0,0,1,1,0,0|2,0,0]=4 13044 B17R1.1158 CNC(=O)CCCNCCCC1CCCCC1 34a_100000740002_100011713725 [0,0,1,1,0,0|2,0,0]=4 13045 B17R1.1158 CNC(=O)CCCNCCCC1CCCCC1 34a_100011211642_100000741757 [0,0,1,1,0,0|2,0,0]=4 13046 B17R1.1158 CNC(=O)CCCOCCCC1CCCCC1 34a_100000198086_100000741757 [0,0,1,1,0,0|2,0,0]=4 13047 B17R1.1158 CNC(=O)CCCOCCCC1CCCCC1 7a_100000198086_100000741757 [0,0,1,1,0,0|2,0,0]=4 13048 B17R1.1158 CNC(=O)CCCSCCCC1CCCCC1 62a_100000741757_100011713725 [0,0,1,1,0,0|2,0,0]=4 13049 B17R1.1158 CNC(=O)CCCSCCCC1CCCCC1 62a_100011713725_100000741757 [0,0,1,1,0,0|2,0,0]=4 13050 B17R1.1158 CNC(=O)CCOCCCCC1CCCCC1 34a_100011215267_100012179268 [0,0,1,1,0,0|2,0,0]=4 13051 B17R1.1158 CNC(=O)CCOCCCCC1CCCCC1 7a_100011215267_100000737683 [0,0,1,1,0,0|2,0,0]=4 13052 B17R1.1158 CNC(=O)OCCNCCCC1CCCCC1 34a_100011211642_200011997002 [0,0,1,1,0,0|2,0,0]=4 13053 B17R1.1158 CNC(=O)OCCOCCCC1CCCCC1 34a_100000198086_200011997002 [0,0,1,1,0,0|2,0,0]=4 13054 B17R1.1158 CNC(=O)OCCOCCCC1CCCCC1 7a_100000198086_200011997002 [0,0,1,1,0,0|2,0,0]=4 13055 B17R1.1158 CNC(=O)OCCSCCCC1CCCCC1 62a_100011713725_200011997002 [0,0,1,1,0,0|2,0,0]=4 13056 B17R1.1158 CNC(=O)OCCSCCCC1CCCCC1 62a_200011997002_100011713725 [0,0,1,1,0,0|2,0,0]=4 13057 B17R1.1158 COC(=O)CCCCCCCN1CCCOC1 2230a_100000131196_100010004213 [0,0,1,1,0,0|2,0,0]=4 13058 B17R1.1158 COC(=O)CCCCCCCN1CCCOC1 269982a_100000131196_100010004213 [0,0,1,1,0,0|2,0,0]=4 13059 B17R1.1158 COC(=O)CCCCCCCN1CCCOC1 34a_100000131196_100010004213 [0,0,1,1,0,0|2,0,0]=4 13060 B17R1.1158 COC(=O)CCCCCCCN1CCOCC1 2230a_100015191051_100010004213 [0,0,1,1,0,0|2,0,0]=4 13061 B17R1.1158 COC(=O)CCCCCCCN1CCOCC1 269982a_100015191051_100010004213 [0,0,1,1,0,0|2,0,0]=4 13062 B17R1.1158 COC(=O)CCCCCCCN1CCOCC1 34a_100015191051_100010004213 [0,0,1,1,0,0|2,0,0]=4 13063 B17R1.1158 COC(=O)CCCCCCCN1CCSCC1 2230a_100000737611_100010004213 [0,0,1,1,0,0|2,0,0]=4 13064 B17R1.1158 COC(=O)CCCCCCCN1CCSCC1 269982a_100000737611_100010004213 [0,0,1,1,0,0|2,0,0]=4 13065 B17R1.1158 COC(=O)CCCCCCNC1CCCCC1 2230a_100000182618_100009815986 [0,0,1,1,0,0|1,0,0]=3 13066 B17R1.1158 COC(=O)CCCCCCNC1CCCCC1 34a_100000182618_100009815986 [0,0,1,1,0,0|1,0,0]=3 13067 B17R1.1158 COC(=O)CCCCCCNC1CCCOC1 2230a_100000719290_100009815986 [0,0,1,1,0,0|2,0,0]=4 13068 B17R1.1158 COC(=O)CCCCCCNC1CCCOC1 34a_100000719290_100009815986 [0,0,1,1,0,0|2,0,0]=4 13069 B17R1.1158 COC(=O)CCCCCCNC1CCOCC1 2230a_100000741149_100009815986 [0,0,1,1,0,0|2,0,0]=4 13070 B17R1.1158 COC(=O)CCCCCCNC1CCOCC1 34a_100000741149_100009815986 [0,0,1,1,0,0|2,0,0]=4 13071 B17R1.1158 COC(=O)CCCCCCNC1CCSCC1 2230a_100000748639_100009815986 [0,0,1,1,0,0|2,0,0]=4 13072 B17R1.1158 COC(=O)CCCCCCNC1CCSCC1 34a_100000748639_100009815986 [0,0,1,1,0,0|2,0,0]=4 13073 B17R1.1158 COC(=O)CCCCCCOC1CCCCC1 34a_100000210231_100009815986 [0,0,1,1,0,0|1,0,0]=3 13074 B17R1.1158 COC(=O)CCCCCCOC1CCCCC1 34a_100009863599_100000210327 [0,0,1,1,0,0|1,0,0]=3 13075 B17R1.1158 COC(=O)CCCCCCOC1CCCCC1 7a_100000210231_100009815986 [0,0,1,1,0,0|1,0,0]=3 13076 B17R1.1158 COC(=O)CCCCCCOC1CCCCC1 7a_100009863599_100000210327 [0,0,1,1,0,0|1,0,0]=3 13077 B17R1.1158 COC(=O)CCCCCCOC1CCCCO1 34a_100000033831_100009815986 [0,0,1,1,0,0|2,0,0]=4 13078 B17R1.1158 COC(=O)CCCCCCOC1CCCOC1 34a_100000754041_100009815986 [0,0,1,1,0,0|2,0,0]=4 13079 B17R1.1158 COC(=O)CCCCCCOC1CCCOC1 34a_100009863599_100000693364 [0,0,1,1,0,0|2,0,0]=4 13080 B17R1.1158 COC(=O)CCCCCCOC1CCCOC1 7a_100009863599_100000693364 [0,0,1,1,0,0|2,0,0]=4 13081 B17R1.1158 COC(=O)CCCCCCOC1CCCSC1 7a_100015962668_100009815986 [0,0,1,1,0,0|2,0,0]=4 13082 B17R1.1158 COC(=O)CCCCCCOC1CCOCC1 34a_100000744328_100009815986 [0,0,1,1,0,0|2,0,0]=4 13083 B17R1.1158 COC(=O)CCCCCCOC1CCOCC1 7a_100009863599_100000686592 [0,0,1,1,0,0|2,0,0]=4 13084 B17R1.1158 COC(=O)CCCCCCOC1CCSCC1 34a_100000731022_100009815986 [0,0,1,1,0,0|2,0,0]=4 13085 B17R1.1158 COC(=O)CCCCCCOC1CCSCC1 34a_100009863599_100000069128 [0,0,1,1,0,0|2,0,0]=4 13086 B17R1.1158 COC(=O)CCCCCCOC1CCSCC1 7a_100000731022_100009815986 [0,0,1,1,0,0|2,0,0]=4 13087 B17R1.1158 COC(=O)CCCCCCOC1CCSCC1 7a_100009863599_100011500858 [0,0,1,1,0,0|2,0,0]=4 13088 B17R1.1158 COC(=O)CCCCCCSC1CCCCC1 62a_100000210327_100009815986 [0,0,1,1,0,0|1,0,0]=3 13089 B17R1.1158 COC(=O)CCCCCCSC1CCCCC1 62a_100009815986_100000210327 [0,0,1,1,0,0|1,0,0]=3 13090 B17R1.1158 COC(=O)CCCCCCSC1CCCOC1 62a_100009815986_100000693364 [0,0,1,1,0,0|2,0,0]=4 13091 B17R1.1158 COC(=O)CCCCCCSC1CCOCC1 62a_100009815986_100011324220 [0,0,1,1,0,0|2,0,0]=4 13092 B17R1.1158 COC(=O)CCCCCCSC1CCSCC1 62a_100009815986_100000069128 [0,0,1,1,0,0|2,0,0]=4 13093 B17R1.1158 COC(=O)CCCCCNCC1CCCCC1 2230a_100000210473_100009816466 [0,0,1,1,0,0|1,0,0]=3 13094 B17R1.1158 COC(=O)CCCCCNCC1CCCCC1 34a_100000210473_100009816466 [0,0,1,1,0,0|1,0,0]=3 13095 B17R1.1158 COC(=O)CCCCCNCC1CCCCO1 2230a_100000174945_100009816466 [0,0,1,1,0,0|2,0,0]=4 13096 B17R1.1158 COC(=O)CCCCCNCC1CCCCO1 34a_100000174945_100009816466 [0,0,1,1,0,0|2,0,0]=4 13097 B17R1.1158 COC(=O)CCCCCNCC1CCCOC1 2230a_100000720124_100009816466 [0,0,1,1,0,0|2,0,0]=4 13098 B17R1.1158 COC(=O)CCCCCNCC1CCCOC1 34a_100000720124_100009816466 [0,0,1,1,0,0|2,0,0]=4 13099 B17R1.1158 COC(=O)CCCCCNCC1CCOCC1 2230a_100000746373_100009816466 [0,0,1,1,0,0|2,0,0]=4 13100 B17R1.1158 COC(=O)CCCCCNCC1CCOCC1 34a_100000746373_100009816466 [0,0,1,1,0,0|2,0,0]=4 13101 B17R1.1158 COC(=O)CCCCCNCC1CCSCC1 2230a_100015188806_100009816466 [0,0,1,1,0,0|2,0,0]=4 13102 B17R1.1158 COC(=O)CCCCCNCC1CCSCC1 34a_100015188806_100009816466 [0,0,1,1,0,0|2,0,0]=4 13103 B17R1.1158 COC(=O)CCCCCOCC1CCCCC1 34a_100000074720_100000211423 [0,0,1,1,0,0|1,0,0]=3 13104 B17R1.1158 COC(=O)CCCCCOCC1CCCCC1 34a_100000212181_100009816466 [0,0,1,1,0,0|1,0,0]=3 13105 B17R1.1158 COC(=O)CCCCCOCC1CCCCC1 7a_100000074720_100000211423 [0,0,1,1,0,0|1,0,0]=3 13106 B17R1.1158 COC(=O)CCCCCOCC1CCCCC1 7a_100000212181_100009816466 [0,0,1,1,0,0|1,0,0]=3 13107 B17R1.1158 COC(=O)CCCCCOCC1CCCCN1 34a_100000210821_100009816466 [0,0,1,1,0,0|2,0,0]=4 13108 B17R1.1158 COC(=O)CCCCCOCC1CCCCO1 34a_100000074720_100000211543 [0,0,1,1,0,0|2,0,0]=4 13109 B17R1.1158 COC(=O)CCCCCOCC1CCCCO1 34a_100000211370_100009816466 [0,0,1,1,0,0|2,0,0]=4 13110 B17R1.1158 COC(=O)CCCCCOCC1CCCCO1 7a_100000074720_100000211543 [0,0,1,1,0,0|2,0,0]=4 13111 B17R1.1158 COC(=O)CCCCCOCC1CCCCO1 7a_100000211370_100009816466 [0,0,1,1,0,0|2,0,0]=4 13112 B17R1.1158 COC(=O)CCCCCOCC1CCCNC1 34a_100000211344_100009816466 [0,0,1,1,0,0|2,0,0]=4 13113 B17R1.1158 COC(=O)CCCCCOCC1CCCOC1 34a_100000074720_100000741521 [0,0,1,1,0,0|2,0,0]=4 13114 B17R1.1158 COC(=O)CCCCCOCC1CCCOC1 34a_100000741520_100009816466 [0,0,1,1,0,0|2,0,0]=4 13115 B17R1.1158 COC(=O)CCCCCOCC1CCCOC1 7a_100000074720_100000741521 [0,0,1,1,0,0|2,0,0]=4 13116 B17R1.1158 COC(=O)CCCCCOCC1CCNCC1 34a_100000738675_100009816466 [0,0,1,1,0,0|2,0,0]=4 13117 B17R1.1158 COC(=O)CCCCCOCC1CCOCC1 34a_100000074720_100000754603 [0,0,1,1,0,0|2,0,0]=4 13118 B17R1.1158 COC(=O)CCCCCOCC1CCOCC1 34a_100000749013_100009816466 [0,0,1,1,0,0|2,0,0]=4 13119 B17R1.1158 COC(=O)CCCCCOCC1CCOCC1 7a_100000074720_100000754603 [0,0,1,1,0,0|2,0,0]=4 13120 B17R1.1158 COC(=O)CCCCCOCC1CCSCC1 34a_100000070558_100009816466 [0,0,1,1,0,0|2,0,0]=4 13121 B17R1.1158 COC(=O)CCCCCOCC1CCSCC1 7a_100000070558_100009816466 [0,0,1,1,0,0|2,0,0]=4 13122 B17R1.1158 COC(=O)CCCCCSCC1CCCCC1 62a_100000211423_100009816466 [0,0,1,1,0,0|1,0,0]=3 13123 B17R1.1158 COC(=O)CCCCCSCC1CCCCC1 62a_100009816466_100000211423 [0,0,1,1,0,0|1,0,0]=3 13124 B17R1.1158 COC(=O)CCCCCSCC1CCCCO1 62a_100000211543_100009816466 [0,0,1,1,0,0|2,0,0]=4 13125 B17R1.1158 COC(=O)CCCCCSCC1CCCCO1 62a_100009816466_100000211543 [0,0,1,1,0,0|2,0,0]=4 13126 B17R1.1158 COC(=O)CCCCCSCC1CCCOC1 62a_100000741521_100009816466 [0,0,1,1,0,0|2,0,0]=4 13127 B17R1.1158 COC(=O)CCCCCSCC1CCCOC1 62a_100009816466_100000741521 [0,0,1,1,0,0|2,0,0]=4 13128 B17R1.1158 COC(=O)CCCCCSCC1CCOCC1 62a_100000754603_100009816466 [0,0,1,1,0,0|2,0,0]=4 13129 B17R1.1158 COC(=O)CCCCCSCC1CCOCC1 62a_100009816466_100000749018 [0,0,1,1,0,0|2,0,0]=4 13130 B17R1.1158 COC(=O)CCCCNCCC1CCCCC1 2230a_100000738074_100000204269 [0,0,1,1,0,0|1,0,0]=3 13131 B17R1.1158 COC(=O)CCCCNCCC1CCCCC1 34a_100000738074_100000204269 [0,0,1,1,0,0|1,0,0]=3 13132 B17R1.1158 COC(=O)CCCCNCCC1CCCCO1 2230a_100015183643_100000204269 [0,0,1,1,0,0|2,0,0]=4 13133 B17R1.1158 COC(=O)CCCCNCCC1CCCCO1 34a_100015183643_100000204269 [0,0,1,1,0,0|2,0,0]=4 13134 B17R1.1158 COC(=O)CCCCNCCC1CCOCC1 2230a_100000755988_100000204269 [0,0,1,1,0,0|2,0,0]=4 13135 B17R1.1158 COC(=O)CCCCNCCC1CCOCC1 34a_100000755988_100000204269 [0,0,1,1,0,0|2,0,0]=4 13136 B17R1.1158 COC(=O)CCCCOCCC1CCCCC1 34a_100000059025_100011209188 [0,0,1,1,0,0|1,0,0]=3 13137 B17R1.1158 COC(=O)CCCCOCCC1CCCCC1 34a_100011217863_100000204269 [0,0,1,1,0,0|1,0,0]=3 13138 B17R1.1158 COC(=O)CCCCOCCC1CCCCC1 7a_100000059025_100011273959 [0,0,1,1,0,0|1,0,0]=3 13139 B17R1.1158 COC(=O)CCCCOCCC1CCCCC1 7a_100011217863_100000204269 [0,0,1,1,0,0|1,0,0]=3 13140 B17R1.1158 COC(=O)CCCCOCCC1CCCCN1 34a_100000211664_100000204269 [0,0,1,1,0,0|2,0,0]=4 13141 B17R1.1158 COC(=O)CCCCOCCC1CCCNC1 34a_100000752241_100000204269 [0,0,1,1,0,0|2,0,0]=4 13142 B17R1.1158 COC(=O)CCCCOCCC1CCNCC1 34a_100015190746_100000204269 [0,0,1,1,0,0|2,0,0]=4 13143 B17R1.1158 COC(=O)CCCCOCCC1CCOCC1 34a_100000059025_100011934994 [0,0,1,1,0,0|2,0,0]=4 13144 B17R1.1158 COC(=O)CCCCOCCC1CCOCC1 34a_100011933979_100000204269 [0,0,1,1,0,0|2,0,0]=4 13145 B17R1.1158 COC(=O)CCCCOCCC1CCOCC1 7a_100000059025_100011934994 [0,0,1,1,0,0|2,0,0]=4 13146 B17R1.1158 COC(=O)CCCCOCCC1CCOCC1 7a_100011933979_100000204269 [0,0,1,1,0,0|2,0,0]=4 13147 B17R1.1158 COC(=O)CCCCOCCN1CCCCC1 34a_100000059025_100000739454 [0,0,1,1,0,0|2,0,0]=4 13148 B17R1.1158 COC(=O)CCCCOCCN1CCCCC1 7a_100000059025_100000739454 [0,0,1,1,0,0|2,0,0]=4 13149 B17R1.1158 COC(=O)CCCCOCOC1CCCCC1 34a_100000059025_100011935260 [0,0,1,1,0,0|2,0,0]=4 13150 B17R1.1158 COC(=O)CCCCOCOC1CCCCC1 7a_100000059025_100011935260 [0,0,1,1,0,0|2,0,0]=4 13151 B17R1.1158 COC(=O)CCCCSCCC1CCCCC1 62a_100000204269_100012355289 [0,0,1,1,0,0|1,0,0]=3 13152 B17R1.1158 COC(=O)CCCCSCCC1CCCCC1 62a_100012355289_100000204269 [0,0,1,1,0,0|1,0,0]=3 13153 B17R1.1158 COC(=O)CCCCSCCC1CCOCC1 62a_100000204269_100011934994 [0,0,1,1,0,0|2,0,0]=4 13154 B17R1.1158 COC(=O)CCCCSCCC1CCOCC1 62a_100011934994_100000204269 [0,0,1,1,0,0|2,0,0]=4 13155 B17R1.1158 COC(=O)CCCCSCCN1CCCCC1 62a_100000204269_100000739454 [0,0,1,1,0,0|2,0,0]=4 13156 B17R1.1158 COC(=O)CCCCSCCN1CCCCC1 62a_100000739454_100000204269 [0,0,1,1,0,0|2,0,0]=4 13157 B17R1.1158 COC(=O)CCCCSCOC1CCCCC1 62a_100000204269_100011935260 [0,0,1,1,0,0|2,0,0]=4 13158 B17R1.1158 COC(=O)CCCCSCOC1CCCCC1 62a_100011935260_100000204269 [0,0,1,1,0,0|2,0,0]=4 13159 B17R1.1158 COC(=O)CCCNCCCC1CCCCC1 2230a_100011211642_100011218270 [0,0,1,1,0,0|1,0,0]=3 13160 B17R1.1158 COC(=O)CCCNCCCC1CCCCC1 34a_100011211642_100000742333 [0,0,1,1,0,0|1,0,0]=3 13161 B17R1.1158 COC(=O)CCCNCCOC1CCCCC1 34a_100015206981_100000742333 [0,0,1,1,0,0|2,0,0]=4 13162 B17R1.1158 COC(=O)CCCOCCCC1CCCCC1 34a_100000198086_100000742333 [0,0,1,1,0,0|1,0,0]=3 13163 B17R1.1158 COC(=O)CCCOCCCC1CCCCC1 7a_100000198086_100011218270 [0,0,1,1,0,0|1,0,0]=3 13164 B17R1.1158 COC(=O)CCCOCCCC1CCCCN1 34a_100011934581_100000742333 [0,0,1,1,0,0|2,0,0]=4 13165 B17R1.1158 COC(=O)CCCOCCCC1CCCNC1 34a_100150707839_100000742333 [0,0,1,1,0,0|2,0,0]=4 13166 B17R1.1158 COC(=O)CCCOCCCC1CCNCC1 34a_100016988962_100000742333 [0,0,1,1,0,0|2,0,0]=4 13167 B17R1.1158 COC(=O)CCCOCCCN1CCCCC1 34a_100000212458_100000742333 [0,0,1,1,0,0|2,0,0]=4 13168 B17R1.1158 COC(=O)CCCOCCNC1CCCCC1 34a_100000200466_100000742333 [0,0,1,1,0,0|2,0,0]=4 13169 B17R1.1158 COC(=O)CCCOCCOC1CCCCC1 34a_100011249652_100000742333 [0,0,1,1,0,0|2,0,0]=4 13170 B17R1.1158 COC(=O)CCCOCCOC1CCCCC1 7a_100011249652_100011218270 [0,0,1,1,0,0|2,0,0]=4 13171 B17R1.1158 COC(=O)CCCSCCCC1CCCCC1 62a_100011218270_100011713725 [0,0,1,1,0,0|1,0,0]=3 13172 B17R1.1158 COC(=O)CCCSCCCC1CCCCC1 62a_100011713725_100011218270 [0,0,1,1,0,0|1,0,0]=3 13173 B17R1.1158 COC(=O)CCCSCCCN1CCCCC1 62a_100011218270_100000007876 [0,0,1,1,0,0|2,0,0]=4 13174 B17R1.1158 COC(=O)CCCSCCCN1CCCCC1 62a_100132302099_100011218270 [0,0,1,1,0,0|2,0,0]=4 13175 B17R1.1158 COC(=O)CCCSCCOC1CCCCC1 62a_100011211530_100011218270 [0,0,1,1,0,0|2,0,0]=4 13176 B17R1.1158 COC(=O)CCCSCCOC1CCCCC1 62a_100011218270_100011211530 [0,0,1,1,0,0|2,0,0]=4 13177 B17R1.1158 COC(=O)CCNCCCOC1CCCCC1 34a_100000205933_100000742370 [0,0,1,1,0,0|2,0,0]=4 13178 B17R1.1158 COC(=O)CCOCCCCC1CCCCC1 34a_100011215267_100000742370 [0,0,1,1,0,0|1,0,0]=3 13179 B17R1.1158 COC(=O)CCOCCCCC1CCCCC1 7a_100011215267_100000204255 [0,0,1,1,0,0|1,0,0]=3 13180 B17R1.1158 COC(=O)CCOCCCCC1CCNCC1 34a_100016989291_100000742370 [0,0,1,1,0,0|2,0,0]=4 13181 B17R1.1158 COC(=O)COCCCCCN1CCCCC1 34a_100011216611_100000747449 [0,0,1,1,0,0|2,0,0]=4 13182 B17R1.1158 COC(=O)COCCCCCN1CCCCC1 7a_100011216611_100000747449 [0,0,1,1,0,0|2,0,0]=4 13183 B17R1.1158 COC(=O)COCCNCCC1CCCCC1 2230a_100000738074_100000090808 [0,0,1,1,0,0|2,0,0]=4 13184 B17R1.1158 COC(=O)COCCNCCC1CCCCC1 34a_100000738074_100000090808 [0,0,1,1,0,0|2,0,0]=4 13185 B17R1.1158 COC(=O)COCCOCCC1CCCCC1 34a_100011217863_100000090808 [0,0,1,1,0,0|2,0,0]=4 13186 B17R1.1158 COC(=O)COCCOCCC1CCCCC1 7a_100011217863_100000090808 [0,0,1,1,0,0|2,0,0]=4 13187 B17R1.1158 COC(=O)COCCSCCC1CCCCC1 62a_100000090808_100012355289 [0,0,1,1,0,0|2,0,0]=4 13188 B17R1.1158 COC(=O)COCCSCCC1CCCCC1 62a_100012355289_100000090808 [0,0,1,1,0,0|2,0,0]=4 13189 B17R1.1158 COC(=O)NCCOCCCC1CCCCC1 34a_100000757965_100011713725 [0,0,1,1,0,0|2,0,0]=4 13190 B17R1.1158 COC(=O)OCCOCCCC1CCCCC1 34a_100010262106_100011713725 [0,0,1,1,0,0|2,0,0]=4 13191 B17R1.1241 CCCCCCCCCCCN1CNC(=O)C1 2230a_200000708111_100011215454 [0,0,1,1,0,0|2,0,0]=4 13192 B17R1.1241 CCCCCCCCCCNC1CNC(=O)C1 2230a_100000697751_100000210320 [0,0,1,1,0,0|2,0,0]=4 13193 B17R1.1241 CCCCCCCCCCNC1COC(=O)O1 34a_100000684558_100000032252 [0,0,1,1,0,0|2,0,0]=4 13194 B17R1.1241 CCCCCCCCCCOC1CCC(=O)C1 34a_100012614533_100000210320 [0,0,1,1,0,0|2,0,0]=4 13195 B17R1.1241 CCCCCCCCCCOC1CNC(=O)C1 34a_100000690082_100000210320 [0,0,1,1,0,0|2,0,0]=4 13196 B17R1.1241 CCCCCCCCCCOC1COC(=O)O1 34a_100000210711_100000032252 [0,0,1,1,0,0|2,0,0]=4 13197 B17R1.1241 CCCCCCCCCNCC1CNC(=O)C1 2230a_100016993742_100011214924 [0,0,1,1,0,0|2,0,0]=4 13198 B17R1.1241 CCCCCCCCCNCC1CNC(=O)C1 34a_100016993742_100011214924 [0,0,1,1,0,0|2,0,0]=4 13199 B17R1.1241 CCCCCCCCCNCC1CNC(=O)O1 2230a_100000212291_100000181169 [0,0,1,1,0,0|2,0,0]=4 13200 B17R1.1241 CCCCCCCCCNCC1CNC(=O)O1 34a_100000212291_100000181169 [0,0,1,1,0,0|2,0,0]=4 13201 B17R1.1241 CCCCCCCCCNCC1COC(=O)O1 34a_100000212291_100000073702 [0,0,1,1,0,0|2,0,0]=4 13202 B17R1.1241 CCCCCCCCCNC[C@@H]1CCC(=O)N1 2230a_100000212291_100015189358 [0,0,1,1,0,0|2,0,0]=4 13203 B17R1.1241 CCCCCCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100011214924 [0,0,1,1,0,0|2,0,0]=4 13204 B17R1.1241 CCCCCCCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100011214924 [0,0,1,1,0,0|2,0,0]=4 13205 B17R1.1241 CCCCCCCCCNC[C@H]1COC(=O)N1 2230a_100000212291_100015307671 [0,0,1,1,0,0|2,0,0]=4 13206 B17R1.1241 CCCCCCCCCNC[C@H]1COC(=O)N1 34a_100000212291_100015307671 [0,0,1,1,0,0|2,0,0]=4 13207 B17R1.1241 CCCCCCCCCOCC1CCC(=O)N1 34a_100000737831_100011214924 [0,0,1,1,0,0|2,0,0]=4 13208 B17R1.1241 CCCCCCCCCOCC1CNC(=O)C1 34a_100016041077_100011214924 [0,0,1,1,0,0|2,0,0]=4 13209 B17R1.1241 CCCCCCCCCOCC1CNC(=O)O1 34a_100000210712_100000181169 [0,0,1,1,0,0|2,0,0]=4 13210 B17R1.1241 CCCCCCCCCOCC1CNC(=O)O1 34a_100011315639_100011214924 [0,0,1,1,0,0|2,0,0]=4 13211 B17R1.1241 CCCCCCCCCOCC1CNC(=O)O1 7a_100000210712_100000181169 [0,0,1,1,0,0|2,0,0]=4 13212 B17R1.1241 CCCCCCCCCOCC1COC(=O)O1 34a_100000210712_100000073702 [0,0,1,1,0,0|2,0,0]=4 13213 B17R1.1241 CCCCCCCCCOC[C@@H]1CCC(=O)N1 7a_100000210712_100015189358 [0,0,1,1,0,0|2,0,0]=4 13214 B17R1.1241 CCCCCCCCCOC[C@H]1COC(=O)N1 34a_100000210712_100015307671 [0,0,1,1,0,0|2,0,0]=4 13215 B17R1.1241 CCCCCCCCCOC[C@H]1COC(=O)N1 7a_100000210712_100015307671 [0,0,1,1,0,0|2,0,0]=4 13216 B17R1.1241 CCCCCCCCCSCC1CNC(=O)O1 62a_100000181169_100000210670 [0,0,1,1,0,0|2,0,0]=4 13217 B17R1.1241 CCCCCCCCCSCC1COC(=O)O1 62a_100000073702_100000210670 [0,0,1,1,0,0|2,0,0]=4 13218 B17R1.1241 CCCCCCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210670 [0,0,1,1,0,0|2,0,0]=4 13219 B17R1.1241 CCCCCCCCCSC[C@H]1COC(=O)N1 62a_100015307671_100000210670 [0,0,1,1,0,0|2,0,0]=4 13220 B17R1.1295 COC(=O)CCCN1CCCCC1CCCO 2230a_100011934581_100011218270 [0,0,1,1,0,0|2,0,0]=4 13221 B17R1.1295 COC(=O)CCCN1CCCCC1CCCO 269982a_100011934581_100011218270 [0,0,1,1,0,0|2,0,0]=4 13222 B17R1.1295 COC(=O)CCCN1CCCCC1CCCO 34a_100011934581_100000742333 [0,0,1,1,0,0|2,0,0]=4 13223 B17R1.1295 COCCC1CCCCN1CCCC(=O)OC 2230a_100015186528_100011218270 [0,0,1,1,0,0|2,0,0]=4 13224 B17R1.1295 COCCC1CCCCN1CCCC(=O)OC 269982a_100015186528_100011218270 [0,0,1,1,0,0|2,0,0]=4 13225 B17R1.1295 COCCC1CCCCN1CCCC(=O)OC 34a_100015186528_100000742333 [0,0,1,1,0,0|2,0,0]=4 13226 B17R1.1338 CCC(=O)OCCOCCC1CCCCN1C 7a_200000031056_100000211948 [0,0,1,1,0,0|2,0,0]=4 13227 B17R1.1338 COC(=O)CCCCCCN1CCCCC1C 2230a_100000211376_100009815986 [0,0,1,1,0,0|1,0,0]=3 13228 B17R1.1338 COC(=O)CCCCCCN1CCCCC1C 269982a_100000211376_100009815986 [0,0,1,1,0,0|1,0,0]=3 13229 B17R1.1338 COC(=O)CCCCCCN1CCCCC1C 34a_100000211376_100009815986 [0,0,1,1,0,0|1,0,0]=3 13230 B17R1.1338 COC(=O)CCCCCCN1CCOC[C@@H]1C 2230a_100009815349_100009815986 [0,0,1,1,0,0|2,0,0]=4 13231 B17R1.1338 COC(=O)CCCCCCN1CCOC[C@@H]1C 269982a_100009815349_100009815986 [0,0,1,1,0,0|2,0,0]=4 13232 B17R1.1338 COC(=O)CCCCCCN1CCOC[C@@H]1C 34a_100009815349_100009815986 [0,0,1,1,0,0|2,0,0]=4 13233 B17R1.1338 COC(=O)CCCCCNC1CCCCC1C 2230a_100000211402_100009816466 [0,0,1,1,0,0|1,0,0]=3 13234 B17R1.1338 COC(=O)CCCCCNC1CCCCC1C 34a_100000211402_100009816466 [0,0,1,1,0,0|1,0,0]=3 13235 B17R1.1338 COC(=O)CCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100009816466 [0,0,1,1,0,0|2,0,0]=4 13236 B17R1.1338 COC(=O)CCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100009816466 [0,0,1,1,0,0|2,0,0]=4 13237 B17R1.1338 COC(=O)CCCCCOC1CCCCC1C 34a_100000211207_100009816466 [0,0,1,1,0,0|1,0,0]=3 13238 B17R1.1338 COC(=O)CCCCCOC1CCCCC1C 7a_100000211207_100009816466 [0,0,1,1,0,0|1,0,0]=3 13239 B17R1.1338 COC(=O)CCCCCOC1CCCCC1Cl 34a_100000038908_100009816466 [0,0,1,1,0,0|2,0,0]=4 13240 B17R1.1338 COC(=O)CCCCCOC1CCCCC1Cl 7a_100000038908_100009816466 [0,0,1,1,0,0|2,0,0]=4 13241 B17R1.1338 COC(=O)CCCCCOC1CCCCC1F 34a_100000074720_100015423560 [0,0,1,1,0,0|2,0,0]=4 13242 B17R1.1338 COC(=O)CCCCCOC1CCCCC1O 34a_100000074720_100000038908 [0,0,1,1,0,0|2,0,0]=4 13243 B17R1.1338 COC(=O)CCCCCOC1CCNCC1C 34a_100011998114_100009816466 [0,0,1,1,0,0|2,0,0]=4 13244 B17R1.1338 COC(=O)CCCCCOC1CNCCC1C 34a_100000696640_100009816466 [0,0,1,1,0,0|2,0,0]=4 13245 B17R1.1338 COC(=O)CCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100009816466 [0,0,1,1,0,0|2,0,0]=4 13246 B17R1.1338 COC(=O)CCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100009816466 [0,0,1,1,0,0|2,0,0]=4 13247 B17R1.1338 COC(=O)CCCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100009816466 [0,0,1,1,0,0|2,0,0]=4 13248 B17R1.1338 COC(=O)CCCCCSC1CCCCC1F 62a_100009816466_100015423560 [0,0,1,1,0,0|2,0,0]=4 13249 B17R1.1338 COC(=O)CCCCCSC1CCCCC1F 62a_100015423560_100009816466 [0,0,1,1,0,0|2,0,0]=4 13250 B17R1.1338 COC(=O)CCCCCSC1CCCCC1O 62a_100000038908_100009816466 [0,0,1,1,0,0|2,0,0]=4 13251 B17R1.1338 COC(=O)CCCCCSC1CCCCC1O 62a_100009816466_100000038908 [0,0,1,1,0,0|2,0,0]=4 13252 B17R1.1338 COC(=O)CCCCNCC1CCCCC1O 34a_100011216029_100000204269 [0,0,1,1,0,0|2,0,0]=4 13253 B17R1.1338 COC(=O)CCCCNCC1CCCCN1C 34a_100011228421_100000204269 [0,0,1,1,0,0|2,0,0]=4 13254 B17R1.1338 COC(=O)CCCCOCC1CCCCN1C 34a_100000059025_100015186950 [0,0,1,1,0,0|2,0,0]=4 13255 B17R1.1338 COC(=O)CCCCOCC1CCCCN1C 34a_100000225079_100000204269 [0,0,1,1,0,0|2,0,0]=4 13256 B17R1.1338 COC(=O)CCCCOCC1CCCCN1C 7a_100000059025_100015185383 [0,0,1,1,0,0|2,0,0]=4 13257 B17R1.1338 COC(=O)CCCCSCC1CCCCN1C 62a_100000204269_100015185383 [0,0,1,1,0,0|2,0,0]=4 13258 B17R1.1338 COC(=O)CCCCSCC1CCCCN1C 62a_100015185383_100000204269 [0,0,1,1,0,0|2,0,0]=4 13259 B17R1.1338 COC(=O)CCCNCCN1CCCCC1C 2230a_100000739827_100011218270 [0,0,1,1,0,0|2,0,0]=4 13260 B17R1.1338 COC(=O)CCCNCCN1CCCCC1C 34a_100000739827_100000742333 [0,0,1,1,0,0|2,0,0]=4 13261 B17R1.1338 COC(=O)CCCOCCN1CCCCC1C 34a_100011305533_100000742333 [0,0,1,1,0,0|2,0,0]=4 13262 B17R1.1338 COC(=O)CCCSCCC1CCCCN1C 62a_100000211948_100011218270 [0,0,1,1,0,0|2,0,0]=4 13263 B17R1.1338 COC(=O)CCCSCCC1CCCCN1C 62a_100011218270_100000211948 [0,0,1,1,0,0|2,0,0]=4 13264 B17R1.1338 COC(=O)CCNCCCN1CCCCC1C 34a_100000212276_100000742370 [0,0,1,1,0,0|2,0,0]=4 13265 B17R1.1338 COC(=O)CCOCCCN1CCCCC1C 34a_100000213889_100000742370 [0,0,1,1,0,0|2,0,0]=4 13266 B17R1.1338 COC(=O)CCOCCCN1CCCCC1C 7a_100000213889_100000204255 [0,0,1,1,0,0|2,0,0]=4 13267 B17R1.1377 COC(=O)CCCCCCCCN1CCCC1 2230a_100000188435_100010282707 [0,0,1,1,0,0|1,0,0]=3 13268 B17R1.1377 COC(=O)CCCCCCCCN1CCCC1 269982a_100000188435_100010282707 [0,0,1,1,0,0|1,0,0]=3 13269 B17R1.1377 COC(=O)CCCCCCCCN1CCSC1 2230a_100011215254_100010282707 [0,0,1,1,0,0|2,0,0]=4 13270 B17R1.1377 COC(=O)CCCCCCCCN1CCSC1 269982a_100011215254_100010282707 [0,0,1,1,0,0|2,0,0]=4 13271 B17R1.1377 COC(=O)CCCCCCCNC1CCCC1 2230a_100000211070_100010004213 [0,0,1,1,0,0|1,0,0]=3 13272 B17R1.1377 COC(=O)CCCCCCCNC1CCCC1 34a_100000211070_100010004213 [0,0,1,1,0,0|1,0,0]=3 13273 B17R1.1377 COC(=O)CCCCCCCN[C@@H]1CCOC1 2230a_200015188469_100010004213 [0,0,1,1,0,0|2,0,0]=4 13274 B17R1.1377 COC(=O)CCCCCCCN[C@H]1CCOC1 2230a_100015188467_100010004213 [0,0,1,1,0,0|2,0,0]=4 13275 B17R1.1377 COC(=O)CCCCCCCN[C@H]1CCOC1 34a_100015188467_100010004213 [0,0,1,1,0,0|2,0,0]=4 13276 B17R1.1377 COC(=O)CCCCCCCOC1CCCC1 34a_100000210269_100010004213 [0,0,1,1,0,0|1,0,0]=3 13277 B17R1.1377 COC(=O)CCCCCCCOC1CCCC1 34a_100011022521_100000179811 [0,0,1,1,0,0|1,0,0]=3 13278 B17R1.1377 COC(=O)CCCCCCCOC1CCCC1 7a_100000210269_100010004213 [0,0,1,1,0,0|1,0,0]=3 13279 B17R1.1377 COC(=O)CCCCCCCOC1CCCC1 7a_100011022521_100000179811 [0,0,1,1,0,0|1,0,0]=3 13280 B17R1.1377 COC(=O)CCCCCCCOC1CCCO1 34a_100000085407_100010004213 [0,0,1,1,0,0|2,0,0]=4 13281 B17R1.1377 COC(=O)CCCCCCCOC1CCOC1 34a_100011022521_100000690089 [0,0,1,1,0,0|2,0,0]=4 13282 B17R1.1377 COC(=O)CCCCCCCOC1CCOC1 7a_100011022521_100000731011 [0,0,1,1,0,0|2,0,0]=4 13283 B17R1.1377 COC(=O)CCCCCCCOC1CCSC1 7a_100011232664_100010004213 [0,0,1,1,0,0|2,0,0]=4 13284 B17R1.1377 COC(=O)CCCCCCCO[C@H]1CCOC1 34a_100000717292_100010004213 [0,0,1,1,0,0|2,0,0]=4 13285 B17R1.1377 COC(=O)CCCCCCCSC1CCCC1 62a_100010004213_100000179811 [0,0,1,1,0,0|1,0,0]=3 13286 B17R1.1377 COC(=O)CCCCCCCSC1CCCC1 62a_100011217020_100010004213 [0,0,1,1,0,0|1,0,0]=3 13287 B17R1.1377 COC(=O)CCCCCCCSC1CCOC1 62a_100010004213_100000690089 [0,0,1,1,0,0|2,0,0]=4 13288 B17R1.1377 COC(=O)CCCCCCNCC1CCCC1 2230a_100000737975_100009815986 [0,0,1,1,0,0|1,0,0]=3 13289 B17R1.1377 COC(=O)CCCCCCNCC1CCCC1 34a_100000737975_100009815986 [0,0,1,1,0,0|1,0,0]=3 13290 B17R1.1377 COC(=O)CCCCCCNCC1CCOC1 2230a_100000737293_100009815986 [0,0,1,1,0,0|2,0,0]=4 13291 B17R1.1377 COC(=O)CCCCCCNCC1CCOC1 34a_100000737293_100009815986 [0,0,1,1,0,0|2,0,0]=4 13292 B17R1.1377 COC(=O)CCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100009815986 [0,0,1,1,0,0|2,0,0]=4 13293 B17R1.1377 COC(=O)CCCCCCNC[C@@H]1CCCO1 34a_100020590478_100009815986 [0,0,1,1,0,0|2,0,0]=4 13294 B17R1.1377 COC(=O)CCCCCCOCC1CCCC1 34a_100000742336_100009815986 [0,0,1,1,0,0|1,0,0]=3 13295 B17R1.1377 COC(=O)CCCCCCOCC1CCCC1 34a_100009863599_100000740388 [0,0,1,1,0,0|1,0,0]=3 13296 B17R1.1377 COC(=O)CCCCCCOCC1CCCC1 7a_100000742336_100009815986 [0,0,1,1,0,0|1,0,0]=3 13297 B17R1.1377 COC(=O)CCCCCCOCC1CCCC1 7a_100009863599_100000740388 [0,0,1,1,0,0|1,0,0]=3 13298 B17R1.1377 COC(=O)CCCCCCOCC1CCCO1 34a_100000210270_100009815986 [0,0,1,1,0,0|2,0,0]=4 13299 B17R1.1377 COC(=O)CCCCCCOCC1CCCO1 7a_100000210270_100009815986 [0,0,1,1,0,0|2,0,0]=4 13300 B17R1.1377 COC(=O)CCCCCCOCC1CCCO1 7a_100009863599_100000203698 [0,0,1,1,0,0|2,0,0]=4 13301 B17R1.1377 COC(=O)CCCCCCOCC1CCNC1 34a_100000748654_100009815986 [0,0,1,1,0,0|2,0,0]=4 13302 B17R1.1377 COC(=O)CCCCCCOCC1CCOC1 34a_100000740260_100009815986 [0,0,1,1,0,0|2,0,0]=4 13303 B17R1.1377 COC(=O)CCCCCCOCC1CCOC1 34a_100009863599_100011261433 [0,0,1,1,0,0|2,0,0]=4 13304 B17R1.1377 COC(=O)CCCCCCOCC1CCOC1 7a_100009863599_100000702531 [0,0,1,1,0,0|2,0,0]=4 13305 B17R1.1377 COC(=O)CCCCCCOC[C@H]1CCCN1 34a_100000745186_100009815986 [0,0,1,1,0,0|2,0,0]=4 13306 B17R1.1377 COC(=O)CCCCCCSCC1CCCC1 62a_100000740388_100009815986 [0,0,1,1,0,0|1,0,0]=3 13307 B17R1.1377 COC(=O)CCCCCCSCC1CCCC1 62a_100009815986_100000740388 [0,0,1,1,0,0|1,0,0]=3 13308 B17R1.1377 COC(=O)CCCCCCSCC1CCCO1 62a_100000203698_100009815986 [0,0,1,1,0,0|2,0,0]=4 13309 B17R1.1377 COC(=O)CCCCCCSCC1CCCO1 62a_100009815986_100000203698 [0,0,1,1,0,0|2,0,0]=4 13310 B17R1.1377 COC(=O)CCCCCCSCC1CCOC1 62a_100000702531_100009815986 [0,0,1,1,0,0|2,0,0]=4 13311 B17R1.1377 COC(=O)CCCCCCSCC1CCOC1 62a_100009815986_100000702531 [0,0,1,1,0,0|2,0,0]=4 13312 B17R1.1377 COC(=O)CCCCCNCCC1CCCC1 2230a_100000739158_100009816466 [0,0,1,1,0,0|1,0,0]=3 13313 B17R1.1377 COC(=O)CCCCCNCCC1CCCC1 34a_100000739158_100009816466 [0,0,1,1,0,0|1,0,0]=3 13314 B17R1.1377 COC(=O)CCCCCOCCC1CCCC1 34a_100000074720_100000760354 [0,0,1,1,0,0|1,0,0]=3 13315 B17R1.1377 COC(=O)CCCCCOCCC1CCCC1 34a_100000749090_100009816466 [0,0,1,1,0,0|1,0,0]=3 13316 B17R1.1377 COC(=O)CCCCCOCCC1CCCC1 7a_100000074720_100000760354 [0,0,1,1,0,0|1,0,0]=3 13317 B17R1.1377 COC(=O)CCCCCOCCC1CCCC1 7a_100000749090_100009816466 [0,0,1,1,0,0|1,0,0]=3 13318 B17R1.1377 COC(=O)CCCCCOCCC1CCNC1 34a_100016987287_100009816466 [0,0,1,1,0,0|2,0,0]=4 13319 B17R1.1377 COC(=O)CCCCCOCCC1CCOC1 34a_100011879284_100009816466 [0,0,1,1,0,0|2,0,0]=4 13320 B17R1.1377 COC(=O)CCCCCOCCN1CCCC1 7a_100000074720_100000004467 [0,0,1,1,0,0|2,0,0]=4 13321 B17R1.1377 COC(=O)CCCCCSCCC1CCCC1 62a_100000760354_100009816466 [0,0,1,1,0,0|1,0,0]=3 13322 B17R1.1377 COC(=O)CCCCCSCCC1CCCC1 62a_100009816466_100000760354 [0,0,1,1,0,0|1,0,0]=3 13323 B17R1.1377 COC(=O)CCCCCSCCN1CCCC1 62a_100000700749_100009816466 [0,0,1,1,0,0|2,0,0]=4 13324 B17R1.1377 COC(=O)CCCCCSCCN1CCCC1 62a_100009816466_100000004467 [0,0,1,1,0,0|2,0,0]=4 13325 B17R1.1377 COC(=O)CCCCNCCCC1CCCC1 2230a_100000736752_100000204269 [0,0,1,1,0,0|1,0,0]=3 13326 B17R1.1377 COC(=O)CCCCNCCCC1CCCC1 34a_100000736752_100000204269 [0,0,1,1,0,0|1,0,0]=3 13327 B17R1.1377 COC(=O)CCCCNCCOC1CCCC1 34a_100000741755_100000204269 [0,0,1,1,0,0|2,0,0]=4 13328 B17R1.1377 COC(=O)CCCCOCCCC1CCCC1 34a_100000059025_100011713738 [0,0,1,1,0,0|1,0,0]=3 13329 B17R1.1377 COC(=O)CCCCOCCCC1CCCC1 34a_100011215328_100000204269 [0,0,1,1,0,0|1,0,0]=3 13330 B17R1.1377 COC(=O)CCCCOCCCC1CCCC1 7a_100000059025_100011713738 [0,0,1,1,0,0|1,0,0]=3 13331 B17R1.1377 COC(=O)CCCCOCCCC1CCCC1 7a_100011215328_100000204269 [0,0,1,1,0,0|1,0,0]=3 13332 B17R1.1377 COC(=O)CCCCOCCCN1CCCC1 34a_100000059025_100016991639 [0,0,1,1,0,0|2,0,0]=4 13333 B17R1.1377 COC(=O)CCCCOCCCN1CCCC1 7a_100000059025_100011445909 [0,0,1,1,0,0|2,0,0]=4 13334 B17R1.1377 COC(=O)CCCCOCCNC1CCCC1 34a_200000200444_100000204269 [0,0,1,1,0,0|2,0,0]=4 13335 B17R1.1377 COC(=O)CCCCOCCOC1CCCC1 34a_100000738311_100000204269 [0,0,1,1,0,0|2,0,0]=4 13336 B17R1.1377 COC(=O)CCCCOCCOC1CCCC1 7a_100000738311_100000204269 [0,0,1,1,0,0|2,0,0]=4 13337 B17R1.1377 COC(=O)CCCCSCCCC1CCCC1 62a_100000204269_100011713738 [0,0,1,1,0,0|1,0,0]=3 13338 B17R1.1377 COC(=O)CCCCSCCCC1CCCC1 62a_100011713738_100000204269 [0,0,1,1,0,0|1,0,0]=3 13339 B17R1.1377 COC(=O)CCCCSCCCN1CCCC1 62a_100000204269_100011445909 [0,0,1,1,0,0|2,0,0]=4 13340 B17R1.1377 COC(=O)CCCCSCCCN1CCCC1 62a_100016991639_100000204269 [0,0,1,1,0,0|2,0,0]=4 13341 B17R1.1377 COC(=O)CCCNCCCOC1CCCC1 34a_100000747560_100000742333 [0,0,1,1,0,0|2,0,0]=4 13342 B17R1.1377 COC(=O)COCCNCCCC1CCCC1 2230a_100000736752_100000090808 [0,0,1,1,0,0|2,0,0]=4 13343 B17R1.1377 COC(=O)COCCNCCCC1CCCC1 34a_100000736752_100000090808 [0,0,1,1,0,0|2,0,0]=4 13344 B17R1.1377 COC(=O)COCCOCCCC1CCCC1 34a_100011215328_100000090808 [0,0,1,1,0,0|2,0,0]=4 13345 B17R1.1377 COC(=O)COCCOCCCC1CCCC1 7a_100011215328_100000090808 [0,0,1,1,0,0|2,0,0]=4 13346 B17R1.1377 COC(=O)COCCSCCCC1CCCC1 62a_100000090808_100011713738 [0,0,1,1,0,0|2,0,0]=4 13347 B17R1.1377 COC(=O)COCCSCCCC1CCCC1 62a_100011713738_100000090808 [0,0,1,1,0,0|2,0,0]=4 13348 B17R1.1420 CCC1CCCCC1OCCCCC(=O)OC 34a_100000210738_100000204269 [0,0,1,1,0,0|1,0,0]=3 13349 B17R1.1420 CCC1CCCCC1OCCCCC(=O)OC 7a_100000210738_100000204269 [0,0,1,1,0,0|1,0,0]=3 13350 B17R1.1420 CCC1CCCCC1OCCOCC(=O)OC 34a_100000210738_100000090808 [0,0,1,1,0,0|2,0,0]=4 13351 B17R1.1420 CCC1CCCCC1OCCOCC(=O)OC 7a_100000210738_100000090808 [0,0,1,1,0,0|2,0,0]=4 13352 B17R1.1420 CCC1CCCCN1CCCCCC(=O)OC 2230a_100000210034_100009816466 [0,0,1,1,0,0|1,0,0]=3 13353 B17R1.1420 CCC1CCCCN1CCCCCC(=O)OC 269982a_100000210034_100009816466 [0,0,1,1,0,0|1,0,0]=3 13354 B17R1.1420 CCC1CCCCN1CCCCCC(=O)OC 34a_100000210034_100009816466 [0,0,1,1,0,0|1,0,0]=3 13355 B17R1.1420 CCC1CCCCN1CCCNCC(=O)OC 34a_100011191702_100000747449 [0,0,1,1,0,0|2,0,0]=4 13356 B17R1.1420 CCC1CCCCN1CCNCCC(=O)OC 2230a_100000755458_100000204255 [0,0,1,1,0,0|2,0,0]=4 13357 B17R1.1420 CCC1CCCCN1CCNCCC(=O)OC 34a_100000755458_100000742370 [0,0,1,1,0,0|2,0,0]=4 13358 B17R1.1420 CCN1CCCCC1CNCCCC(=O)OC 2230a_100000754393_100011218270 [0,0,1,1,0,0|2,0,0]=4 13359 B17R1.1420 CCN1CCCCC1CNCCCC(=O)OC 34a_100000754393_100000742333 [0,0,1,1,0,0|2,0,0]=4 13360 B17R1.1420 CCN1CCCCC1COCCCC(=O)OC 34a_100000225091_100000742333 [0,0,1,1,0,0|2,0,0]=4 13361 B17R1.1420 CCN1CCCCC1COCCCC(=O)OC 7a_100000225091_100011218270 [0,0,1,1,0,0|2,0,0]=4 13362 B17R1.1420 CC[C@H]1COCCN1CCCCCC(=O)OC 2230a_100016988097_100009816466 [0,0,1,1,0,0|2,0,0]=4 13363 B17R1.1420 CC[C@H]1COCCN1CCCCCC(=O)OC 269982a_100016988097_100009816466 [0,0,1,1,0,0|2,0,0]=4 13364 B17R1.1420 CC[C@H]1COCCN1CCCCCC(=O)OC 34a_100016988097_100009816466 [0,0,1,1,0,0|2,0,0]=4 13365 B17R1.1420 CN[C@@H]1CCCC[C@H]1OCCCCC(=O)OC 34a_100000708425_100000204269 [0,0,1,1,0,0|2,0,0]=4 13366 B17R1.1420 COC(=O)CCCCCN1CCCCC1CO 2230a_100000210821_100009816466 [0,0,1,1,0,0|2,0,0]=4 13367 B17R1.1420 COC(=O)CCCCCN1CCCCC1CO 269982a_100000210821_100009816466 [0,0,1,1,0,0|2,0,0]=4 13368 B17R1.1420 COC(=O)CCCCCN1CCCCC1CO 34a_100000210821_100009816466 [0,0,1,1,0,0|2,0,0]=4 13369 B17R1.1420 COC(=O)CCCCNC1CCCCC1OC 34a_100011208099_100000204269 [0,0,1,1,0,0|2,0,0]=4 13370 B17R1.1420 COC(=O)CCCCOC1CCCCC1CN 34a_100011216029_100000204269 [0,0,1,1,0,0|2,0,0]=4 13371 B17R1.1420 COC(=O)CCCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000204269 [0,0,1,1,0,0|2,0,0]=4 13372 B17R1.1420 COC(=O)CCCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000204269 [0,0,1,1,0,0|2,0,0]=4 13373 B17R1.1504 CCCCCC1CCCC1NCCC(=O)NC 269862a_100000738227_200000198059 [0,0,1,1,0,0|2,0,0]=4 13374 B17R1.1504 CCCCCC1CCCC1NCCC(=O)NC 270004a_100000738227_200000198059 [0,0,1,1,0,0|2,0,0]=4 13375 B17R1.4157 CCCCCCCN1CCCCC1C(=O)NC 2230a_100011209383_100000210681 [0,0,1,1,0,0|2,0,0]=4 13376 B17R1.4157 CCCCCCCN1CCCCC1C(=O)NC 269982a_100011209383_100000210681 [0,0,1,1,0,0|2,0,0]=4 13377 B17R1.4157 CCCCCCCN1CCCCC1C(=O)NC 34a_100011209383_100000210614 [0,0,1,1,0,0|2,0,0]=4 13378 B17R1.4157 CCCCCCCN1CCCCC1C(=O)OC 2230a_100000734855_100000210681 [0,0,1,1,0,0|1,0,0]=3 13379 B17R1.4157 CCCCCCCN1CCCCC1C(=O)OC 269982a_100000734855_100000210681 [0,0,1,1,0,0|1,0,0]=3 13380 B17R1.4157 CCCCCCCN1CCCCC1C(=O)OC 34a_100000734855_100000210614 [0,0,1,1,0,0|1,0,0]=3 13381 B17R1.4157 CCCCCCCN1CCOCC1C(=O)OC 2230a_100000765174_100000210681 [0,0,1,1,0,0|2,0,0]=4 13382 B17R1.4157 CCCCCCCN1CCOCC1C(=O)OC 34a_100000765174_100000210614 [0,0,1,1,0,0|2,0,0]=4 13383 B17R1.4157 CCCCCCOC1CCNCC1C(=O)OC 34a_200103168510_100000210314 [0,0,1,1,0,0|2,0,0]=4 13384 B17R1.4157 CCCCCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000210314 [0,0,1,1,0,0|1,0,0]=3 13385 B17R1.4157 CCCCCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000210314 [0,0,1,1,0,0|1,0,0]=3 13386 B17R1.4157 CCCCOCCN1CCCCC1C(=O)OC 2230a_100000734855_100000743108 [0,0,1,1,0,0|2,0,0]=4 13387 B17R1.4157 CCCCOCCN1CCCCC1C(=O)OC 269982a_100000734855_100000743108 [0,0,1,1,0,0|2,0,0]=4 13388 B17R1.4157 CCCCOCCN1CCCCC1C(=O)OC 34a_100000734855_100000743108 [0,0,1,1,0,0|2,0,0]=4 13389 B17R1.4157 CCCCOCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100011995733 [0,0,1,1,0,0|2,0,0]=4 13390 B17R1.4157 CCCOCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100011215938 [0,0,1,1,0,0|2,0,0]=4 13391 B17R1.4157 CCCOCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100011215938 [0,0,1,1,0,0|2,0,0]=4 13392 B17R1.4157 CCOCCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100012232248 [0,0,1,1,0,0|2,0,0]=4 13393 B17R1.4157 CCOCCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100012232248 [0,0,1,1,0,0|2,0,0]=4 13394 B17R1.4157 COC(=O)C1CCCCN1CCCCCCF 2230a_100000734855_100015922095 [0,0,1,1,0,0|2,0,0]=4 13395 B17R1.4157 COC(=O)C1CCCCN1CCCCCCF 269982a_100000734855_100015922095 [0,0,1,1,0,0|2,0,0]=4 13396 B17R1.4157 COC(=O)C1CCCCN1CCCCCCF 34a_100000734855_100015922095 [0,0,1,1,0,0|2,0,0]=4 13397 B17R1.4157 COC(=O)C1CCCCN1CCCCCCO 2230a_100000734855_100000766143 [0,0,1,1,0,0|2,0,0]=4 13398 B17R1.4157 COC(=O)C1CCCCN1CCCCCCO 269982a_100000734855_100000766143 [0,0,1,1,0,0|2,0,0]=4 13399 B17R1.4157 COC(=O)C1CCCCN1CCCCCCO 34a_100000734855_100000766143 [0,0,1,1,0,0|2,0,0]=4 13400 B17R1.4157 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCCF 34a_100015709673_100000729378 [0,0,1,1,0,0|2,0,0]=4 13401 B17R1.4157 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCCF 7a_100015709673_100000729378 [0,0,1,1,0,0|2,0,0]=4 13402 B17R1.4157 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCCO 34a_100015709673_100000746330 [0,0,1,1,0,0|2,0,0]=4 13403 B17R1.4157 COC(=O)[C@@H]1CCCC[C@@H]1OCCCCCO 7a_100015709673_100000746330 [0,0,1,1,0,0|2,0,0]=4 13404 B17R1.4157 COCCCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000755781 [0,0,1,1,0,0|2,0,0]=4 13405 B17R1.4157 COCCCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000730899 [0,0,1,1,0,0|2,0,0]=4 13406 B17R1.4167 CCCCCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000210681 [0,0,1,1,0,0|1,0,0]=3 13407 B17R1.4167 CCCCCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000210681 [0,0,1,1,0,0|1,0,0]=3 13408 B17R1.4167 CCCCCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000210614 [0,0,1,1,0,0|1,0,0]=3 13409 B17R1.4167 CCCCOCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000743108 [0,0,1,1,0,0|2,0,0]=4 13410 B17R1.4167 CCCCOCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000743108 [0,0,1,1,0,0|2,0,0]=4 13411 B17R1.4167 CCCCOCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000743108 [0,0,1,1,0,0|2,0,0]=4 13412 B17R1.4167 COC(=O)C[C@H]1CCCN1CCCCCCF 2230a_100025726698_100015922095 [0,0,1,1,0,0|2,0,0]=4 13413 B17R1.4167 COC(=O)C[C@H]1CCCN1CCCCCCF 269982a_100025726698_100015922095 [0,0,1,1,0,0|2,0,0]=4 13414 B17R1.4167 COC(=O)C[C@H]1CCCN1CCCCCCF 34a_100025726698_100015922095 [0,0,1,1,0,0|2,0,0]=4 13415 B17R1.4167 COC(=O)C[C@H]1CCCN1CCCCCCO 2230a_100025726698_100000766143 [0,0,1,1,0,0|2,0,0]=4 13416 B17R1.4167 COC(=O)C[C@H]1CCCN1CCCCCCO 269982a_100025726698_100000766143 [0,0,1,1,0,0|2,0,0]=4 13417 B17R1.4167 COC(=O)C[C@H]1CCCN1CCCCCCO 34a_100025726698_100000766143 [0,0,1,1,0,0|2,0,0]=4 13418 B17R1.5249 CCCCCCCCCCCNC1CCC1=O 34a_200011215754_100009892977 [0,0,1,1,0,0|2,0,0]=4 13419 B17R1.5249 CCCCCCCCCCCOC1CCC1=O 34a_100000210809_100009892977 [0,0,1,1,0,0|2,0,0]=4 13420 B17R1.5249 CCCCCCCCCCCOC1CCC1=O 7a_100000210809_100009892977 [0,0,1,1,0,0|2,0,0]=4 13421 B17R1.5249 CCCCCCCCCCCSC1CCC1=O 62a_100009892977_100011215454 [0,0,1,1,0,0|2,0,0]=4 13422 B17R1.5249 CCCCCCCCCNCCC1CCC1=O 2230a_100000212291_200016118888 [0,0,1,1,0,0|2,0,0]=4 13423 B17R1.5249 CCCCCCCCCOCCC1CCC1=O 7a_100000210712_200016118888 [0,0,1,1,0,0|2,0,0]=4 13424 B17R1.5249 CCCCCCCCCSCCC1CCC1=O 62a_200016118888_100000210670 [0,0,1,1,0,0|2,0,0]=4 13425 B17R1.5256 CCCCC1CCCC1NCCCC(=O)NC 269862a_100000740002_100000750825 [0,0,1,1,0,0|2,0,0]=4 13426 B17R1.5256 CCCCC1CCCC1NCCCC(=O)NC 270004a_100000740002_100000750825 [0,0,1,1,0,0|2,0,0]=4 13427 B17R1.5256 CCCCC1CCCC1NCCNC(=O)CC 269862a_100132302217_100000750825 [0,0,1,1,0,0|2,0,0]=4 13428 B17R1.5256 CCCCC1CCCC1NCCNC(=O)CC 270004a_100132302217_100000750825 [0,0,1,1,0,0|2,0,0]=4 13429 B17R1.7892 CCCCCCCCCCCCOC1CCC1 34a_100000210810_100000749161 [0,0,1,1,0,0|1,0,1]=4 13430 B17R1.7892 CCCCCCCCCCCCOC1CCC1 34a_100000748187_100000759014 [0,0,1,1,0,0|1,0,1]=4 13431 B17R1.7908 CCCCCCCCN1CCC[C@H]1C(=O)NC 2230a_100015185040_100000210759 [0,0,1,1,0,0|2,0,0]=4 13432 B17R1.7908 CCCCCCCCN1CCC[C@H]1C(=O)NC 269982a_100015185040_100000210759 [0,0,1,1,0,0|2,0,0]=4 13433 B17R1.7908 CCCCCCCCN1CCC[C@H]1C(=O)NC 34a_100015185040_100000210759 [0,0,1,1,0,0|2,0,0]=4 13434 B17R1.7908 CCCCCCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000210759 [0,0,1,1,0,0|1,0,0]=3 13435 B17R1.7908 CCCCCCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000210759 [0,0,1,1,0,0|1,0,0]=3 13436 B17R1.7908 CCCCCCCCN1CCSC1C(=O)OC 2230a_100015296106_100000210759 [0,0,1,1,0,0|2,0,0]=4 13437 B17R1.7908 CCCCCCCCN1CCSC1C(=O)OC 269982a_100015296106_100000210759 [0,0,1,1,0,0|2,0,0]=4 13438 B17R1.7908 CCCCCCCCN1CSCC1C(=O)OC 269982a_200000724679_100000210759 [0,0,1,1,0,0|2,0,0]=4 13439 B17R1.7908 CCCCCCCOC1CCCC1C(=O)OC 34a_200000081814_100000210614 [0,0,1,1,0,0|1,0,0]=3 13440 B17R1.7908 CCCCCCCOC1CCCC1C(=O)OC 7a_200000081814_100000210614 [0,0,1,1,0,0|1,0,0]=3 13441 B17R1.7908 CCCCOCCOC1CCCC1C(=O)OC 34a_200000081814_100000743108 [0,0,1,1,0,0|2,0,0]=4 13442 B17R1.7908 CCCCOCCOC1CCCC1C(=O)OC 7a_200000081814_100000743108 [0,0,1,1,0,0|2,0,0]=4 13443 B17R1.7908 COC(=O)C1CCCC1OCCCCCCF 34a_200000081814_100015922095 [0,0,1,1,0,0|2,0,0]=4 13444 B17R1.7908 COC(=O)C1CCCC1OCCCCCCF 7a_200000081814_100015922095 [0,0,1,1,0,0|2,0,0]=4 13445 B17R1.7908 COC(=O)C1CCCC1OCCCCCCO 34a_200000081814_100000766143 [0,0,1,1,0,0|2,0,0]=4 13446 B17R1.7908 COC(=O)C1CCCC1OCCCCCCO 7a_200000081814_100000766143 [0,0,1,1,0,0|2,0,0]=4 13447 B17R1.7908 COC(=O)[C@@H]1CCCN1CCCCCCCO 2230a_100000752040_100000760002 [0,0,1,1,0,0|2,0,0]=4 13448 B17R1.7908 COC(=O)[C@@H]1CCCN1CCCCCCCO 269982a_100000752040_100000760002 [0,0,1,1,0,0|2,0,0]=4 13449 B17R1.7908 COCCCCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100011998445 [0,0,1,1,0,0|2,0,0]=4 13450 B17R1.7908 COCCCCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100011998445 [0,0,1,1,0,0|2,0,0]=4 13451 B17R1.10629 CCCCCCCCCCCCOC1(CC1)C 7a_100011725673_100000759014 [0,0,1,1,0,0|1,0,1]=4 13452 B17R1.16941 COCCCC1CCCCN1CCC(=O)OC 2230a_100011804088_100000204255 [0,0,1,1,0,0|2,0,0]=4 13453 B17R1.16941 COCCCC1CCCCN1CCC(=O)OC 269982a_100011804088_100000204255 [0,0,1,1,0,0|2,0,0]=4 13454 B17R1.16941 COCCCC1CCCCN1CCC(=O)OC 34a_100011804088_100000742370 [0,0,1,1,0,0|2,0,0]=4 13455 B17R1.17837 COCC1CCN1CCCCCCC(=O)OC 2230a_100015195929_100009815986 [0,0,1,1,0,0|2,0,0]=4 13456 B17R1.17837 COCC1CCN1CCCCCCC(=O)OC 269982a_100015195929_100009815986 [0,0,1,1,0,0|2,0,0]=4 13457 B17R1.17837 COCC1CCN1CCCCCCC(=O)OC 34a_100015195929_100009815986 [0,0,1,1,0,0|2,0,0]=4 13458 B17R1.24151 COC(=O)CCCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100010282707 [0,0,1,1,0,0|2,0,0]=4 13459 B17R1.24151 COC(=O)CCCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100010282707 [0,0,1,1,0,0|2,0,0]=4 13460 B17R1.24151 COC(=O)CCCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100010282707 [0,0,1,1,0,0|2,0,0]=4 13461 B17R1.24151 COC(=O)CCCCCCCOCC1CC1C 34a_100000744939_100010004213 [0,0,1,1,0,0|1,0,0]=3 13462 B17R1.24151 COC(=O)CCCCCCCOCC1CC1C 7a_100000744939_100010004213 [0,0,1,1,0,0|1,0,0]=3 13463 B17R1.24152 COC(=O)CCCCCCCCCN1CCC1 269982a_100000754969_100009813843 [0,0,1,1,0,0|1,0,0]=3 13464 B17R1.24152 COC(=O)CCCCCCCCNC1CCC1 2230a_100000749019_100010282707 [0,0,1,1,0,0|1,0,0]=3 13465 B17R1.24152 COC(=O)CCCCCCCCNC1CCC1 34a_100000749019_100010282707 [0,0,1,1,0,0|1,0,0]=3 13466 B17R1.24152 COC(=O)CCCCCCCCNC1COC1 2230a_100016991112_100010282707 [0,0,1,1,0,0|2,0,0]=4 13467 B17R1.24152 COC(=O)CCCCCCCCOC1CCC1 34a_100000035544_100000749161 [0,0,1,1,0,0|1,0,0]=3 13468 B17R1.24152 COC(=O)CCCCCCCCOC1CCC1 34a_100000748187_100010282707 [0,0,1,1,0,0|1,0,0]=3 13469 B17R1.24152 COC(=O)CCCCCCCCOC1COC1 34a_100000035544_100009818527 [0,0,1,1,0,0|2,0,0]=4 13470 B17R1.24152 COC(=O)CCCCCCCCOC1COC1 7a_100000035544_100009818527 [0,0,1,1,0,0|2,0,0]=4 13471 B17R1.24152 COC(=O)CCCCCCCCOC1CSC1 7a_100000072292_100010282707 [0,0,1,1,0,0|2,0,0]=4 13472 B17R1.24152 COC(=O)CCCCCCCCSC1CCC1 62a_100010282707_100000749161 [0,0,1,1,0,0|1,0,0]=3 13473 B17R1.24152 COC(=O)CCCCCCCCSC1COC1 62a_100010282707_100009818527 [0,0,1,1,0,0|2,0,0]=4 13474 B17R1.24152 COC(=O)CCCCCCCNCC1CCC1 2230a_100000738700_100010004213 [0,0,1,1,0,0|1,0,0]=3 13475 B17R1.24152 COC(=O)CCCCCCCNCC1CCC1 34a_100000738700_100010004213 [0,0,1,1,0,0|1,0,0]=3 13476 B17R1.24152 COC(=O)CCCCCCCNCC1COC1 2230a_100015281925_100010004213 [0,0,1,1,0,0|2,0,0]=4 13477 B17R1.24152 COC(=O)CCCCCCCNCC1COC1 34a_100015281925_100010004213 [0,0,1,1,0,0|2,0,0]=4 13478 B17R1.24152 COC(=O)CCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100010004213 [0,0,1,1,0,0|2,0,0]=4 13479 B17R1.24152 COC(=O)CCCCCCCNC[C@@H]1CCO1 34a_100020831831_100010004213 [0,0,1,1,0,0|2,0,0]=4 13480 B17R1.24152 COC(=O)CCCCCCCOCC1CCC1 34a_100000760304_100010004213 [0,0,1,1,0,0|1,0,0]=3 13481 B17R1.24152 COC(=O)CCCCCCCOCC1CCC1 34a_100011022521_100000763275 [0,0,1,1,0,0|1,0,0]=3 13482 B17R1.24152 COC(=O)CCCCCCCOCC1CCC1 7a_100011022521_100000763275 [0,0,1,1,0,0|1,0,0]=3 13483 B17R1.24152 COC(=O)CCCCCCCOCC1CCO1 34a_100000039022_100010004213 [0,0,1,1,0,0|2,0,0]=4 13484 B17R1.24152 COC(=O)CCCCCCCOCC1CCO1 34a_100011022521_100000103362 [0,0,1,1,0,0|2,0,0]=4 13485 B17R1.24152 COC(=O)CCCCCCCOCC1CCO1 7a_100011022521_100000103362 [0,0,1,1,0,0|2,0,0]=4 13486 B17R1.24152 COC(=O)CCCCCCCOCC1CNC1 34a_100016987283_100010004213 [0,0,1,1,0,0|2,0,0]=4 13487 B17R1.24152 COC(=O)CCCCCCCOCC1COC1 34a_100000060846_100010004213 [0,0,1,1,0,0|2,0,0]=4 13488 B17R1.24152 COC(=O)CCCCCCCOCC1COC1 34a_100011022521_100010264016 [0,0,1,1,0,0|2,0,0]=4 13489 B17R1.24152 COC(=O)CCCCCCCOCC1COC1 7a_100011022521_100010264016 [0,0,1,1,0,0|2,0,0]=4 13490 B17R1.24152 COC(=O)CCCCCCCSCC1CCC1 62a_100000763275_100010004213 [0,0,1,1,0,0|1,0,0]=3 13491 B17R1.24152 COC(=O)CCCCCCCSCC1CCC1 62a_100010004213_100000763275 [0,0,1,1,0,0|1,0,0]=3 13492 B17R1.24152 COC(=O)CCCCCCCSCC1CCO1 62a_100000103362_100010004213 [0,0,1,1,0,0|2,0,0]=4 13493 B17R1.24152 COC(=O)CCCCCCCSCC1CCO1 62a_100010004213_100000103362 [0,0,1,1,0,0|2,0,0]=4 13494 B17R1.24152 COC(=O)CCCCCCCSCC1COC1 62a_100010004213_100010264016 [0,0,1,1,0,0|2,0,0]=4 13495 B17R1.24152 COC(=O)CCCCCCCSCC1COC1 62a_100010264016_100010004213 [0,0,1,1,0,0|2,0,0]=4 13496 B17R1.24152 COC(=O)CCCCCCOCCC1COC1 34a_100009855314_100009815986 [0,0,1,1,0,0|2,0,0]=4 13497 B17R1.24253 CNC(=O)CCCOCC1CCCCCCC1 34a_100011216312_100000741757 [0,0,1,1,0,0|2,0,0]=4 13498 B17R1.24253 CNC(=O)CCCOCC1CCCCCCC1 7a_100011216312_100000741757 [0,0,1,1,0,0|2,0,0]=4 13499 B17R1.24253 CNC(=O)CCNCCC1CCCCCCC1 2230a_100011532352_100000737683 [0,0,1,1,0,0|2,0,0]=4 13500 B17R1.24253 CNC(=O)CCNCCC1CCCCCCC1 34a_100011532352_100012179268 [0,0,1,1,0,0|2,0,0]=4 13501 B17R1.24253 CNC(=O)OCCOCC1CCCCCCC1 34a_100011216312_200011997002 [0,0,1,1,0,0|2,0,0]=4 13502 B17R1.24253 CNC(=O)OCCOCC1CCCCCCC1 7a_100011216312_200011997002 [0,0,1,1,0,0|2,0,0]=4 13503 B17R1.24253 COC(=O)CCCCCN1CCCCCCC1 2230a_100000211400_100009816466 [0,0,1,1,0,0|1,0,0]=3 13504 B17R1.24253 COC(=O)CCCCCN1CCCCCCC1 269982a_100000211400_100009816466 [0,0,1,1,0,0|1,0,0]=3 13505 B17R1.24253 COC(=O)CCCCCN1CCCCCCC1 34a_100000211400_100009816466 [0,0,1,1,0,0|1,0,0]=3 13506 B17R1.24253 COC(=O)CCCCNC1CCCCCCC1 2230a_100000211152_100000204269 [0,0,1,1,0,0|1,0,0]=3 13507 B17R1.24253 COC(=O)CCCCNC1CCCCCCC1 34a_100000211152_100000204269 [0,0,1,1,0,0|1,0,0]=3 13508 B17R1.24253 COC(=O)CCCCOC1CCCCCCC1 34a_100000210054_100000204269 [0,0,1,1,0,0|1,0,0]=3 13509 B17R1.24253 COC(=O)CCCCOC1CCCCCCC1 7a_100000210054_100000204269 [0,0,1,1,0,0|1,0,0]=3 13510 B17R1.24253 COC(=O)CCCOCC1CCCCCCC1 34a_100011216312_100000742333 [0,0,1,1,0,0|1,0,0]=3 13511 B17R1.24253 COC(=O)CCCOCC1CCCCCCC1 7a_100011216312_100011218270 [0,0,1,1,0,0|1,0,0]=3 13512 B17R1.24253 COC(=O)CCNCCC1CCCCCCC1 2230a_100011532352_100000204255 [0,0,1,1,0,0|1,0,0]=3 13513 B17R1.24253 COC(=O)CCNCCC1CCCCCCC1 34a_100011532352_100000742370 [0,0,1,1,0,0|1,0,0]=3 13514 B17R1.24253 COC(=O)COCCNC1CCCCCCC1 2230a_100000211152_100000090808 [0,0,1,1,0,0|2,0,0]=4 13515 B17R1.24253 COC(=O)COCCNC1CCCCCCC1 34a_100000211152_100000090808 [0,0,1,1,0,0|2,0,0]=4 13516 B17R1.24253 COC(=O)COCCOC1CCCCCCC1 34a_100000210054_100000090808 [0,0,1,1,0,0|2,0,0]=4 13517 B17R1.24253 COC(=O)COCCOC1CCCCCCC1 7a_100000210054_100000090808 [0,0,1,1,0,0|2,0,0]=4 13518 B17R1.24374 COC(=O)CCCCCCCN1CCC[C@@H]1C 2230a_100020605311_100010004213 [0,0,1,1,0,0|1,0,0]=3 13519 B17R1.24374 COC(=O)CCCCCCCN1CCC[C@@H]1C 269982a_100020605311_100010004213 [0,0,1,1,0,0|1,0,0]=3 13520 B17R1.24374 COC(=O)CCCCCCCN1CCC[C@H]1C 2230a_100015189458_100010004213 [0,0,1,1,0,0|1,0,0]=3 13521 B17R1.24374 COC(=O)CCCCCCCN1CCC[C@H]1C 269982a_100015189458_100010004213 [0,0,1,1,0,0|1,0,0]=3 13522 B17R1.24374 COC(=O)CCCCCCCN1CCC[C@H]1C 34a_100015189458_100010004213 [0,0,1,1,0,0|1,0,0]=3 13523 B17R1.24374 COC(=O)CCCCCCCN1CCSC1C 2230a_200011216479_100010004213 [0,0,1,1,0,0|2,0,0]=4 13524 B17R1.24374 COC(=O)CCCCCCCN1CCSC1C 269982a_200011216479_100010004213 [0,0,1,1,0,0|2,0,0]=4 13525 B17R1.24374 COC(=O)CCCCCCCN1CCSC1C 34a_200011216479_100010004213 [0,0,1,1,0,0|2,0,0]=4 13526 B17R1.24374 COC(=O)CCCCCCOC1CCCC1C 34a_100011216460_100009815986 [0,0,1,1,0,0|1,0,0]=3 13527 B17R1.24374 COC(=O)CCCCCCOC1CCCC1C 7a_100011216460_100009815986 [0,0,1,1,0,0|1,0,0]=3 13528 B17R1.24374 COC(=O)CCCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100009815986 [0,0,1,1,0,0|2,0,0]=4 13529 B17R1.24374 COC(=O)CCCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100009815986 [0,0,1,1,0,0|2,0,0]=4 13530 B17R1.24374 COC(=O)CCCCCCO[C@H]1CNC[C@H]1C 34a_200015306588_100009815986 [0,0,1,1,0,0|2,0,0]=4 13531 B17R1.24374 COC(=O)CCCCCCS[C@@H]1CCC[C@H]1O 62a_100009815986_200016002552 [0,0,1,1,0,0|2,0,0]=4 13532 B17R1.24374 COC(=O)CCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100009815986 [0,0,1,1,0,0|2,0,0]=4 13533 B17R1.24374 COC(=O)CCCCCOCC1CCCN1C 34a_100000743107_100009816466 [0,0,1,1,0,0|2,0,0]=4 13534 B17R1.24374 COC(=O)CCCCOCCC1CCCN1C 34a_100000059025_100000005710 [0,0,1,1,0,0|2,0,0]=4 13535 B17R1.24374 COC(=O)CCCCOCCC1CCCN1C 34a_100011215177_100000204269 [0,0,1,1,0,0|2,0,0]=4 13536 B17R1.24374 COC(=O)CCCCOCCC1CCCN1C 7a_100000059025_100000005710 [0,0,1,1,0,0|2,0,0]=4 13537 B17R1.24374 COC(=O)CCCCOCCC1CCCN1C 7a_100011215177_100000204269 [0,0,1,1,0,0|2,0,0]=4 13538 B17R1.24374 COC(=O)CCCCSCCC1CCCN1C 62a_100000005710_100000204269 [0,0,1,1,0,0|2,0,0]=4 13539 B17R1.24374 COC(=O)CCCCSCCC1CCCN1C 62a_100000204269_100000005710 [0,0,1,1,0,0|2,0,0]=4 13540 B17R1.24379 COC(=O)CCCCCCCCN1CCC1C 269982a_100000755817_100010282707 [0,0,1,1,0,0|1,0,0]=3 13541 B17R1.24379 COC(=O)CCCCCCCCN1CCC1C 34a_100000755817_100010282707 [0,0,1,1,0,0|1,0,0]=3 13542 B17R1.25096 CCCCCCC1CCCC1NCC(=O)NC 269862a_100000693194_100000189428 [0,0,1,1,0,0|2,0,0]=4 13543 B17R1.25096 CCCCCCC1CCCC1NCC(=O)NC 270004a_100000693194_100000189428 [0,0,1,1,0,0|2,0,0]=4 13544 B17R1.25273 CCCCCCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100011214924 [0,0,1,1,0,0|1,0,0]=3 13545 B17R1.25273 CCCCCCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100000210670 [0,0,1,1,0,0|1,0,0]=3 13546 B17R1.25273 COC(=O)[C@@H]1CCN1CCCCCCCCO 2230a_102516456887_100000033203 [0,0,1,1,0,0|2,0,0]=4 13547 B17R1.25273 COC(=O)[C@@H]1CCN1CCCCCCCCO 269982a_102516456887_100000033203 [0,0,1,1,0,0|2,0,0]=4 13548 B17R1.26472 CCC(=O)NCCNC1CCCCCCCC1 270004a_100132302217_100000038600 [0,0,1,1,0,0|2,0,0]=4 13549 B17R1.26472 CNC(=O)CCCNC1CCCCCCCC1 270004a_100000740002_100000038600 [0,0,1,1,0,0|2,0,0]=4 13550 B17R1.26472 COC(=O)CCCCN1CCCCCCCC1 2230a_100000039187_100000204269 [0,0,1,1,0,0|1,0,0]=3 13551 B17R1.26472 COC(=O)CCCCN1CCCCCCCC1 269982a_100000039187_100000204269 [0,0,1,1,0,0|1,0,0]=3 13552 B17R1.26472 COC(=O)CCCCN1CCCCCCCC1 34a_100000039187_100000204269 [0,0,1,1,0,0|1,0,0]=3 13553 B17R1.26472 COC(=O)COCCN1CCCCCCCC1 2230a_100000039187_100000090808 [0,0,1,1,0,0|2,0,0]=4 13554 B17R1.26472 COC(=O)COCCN1CCCCCCCC1 34a_100000039187_100000090808 [0,0,1,1,0,0|2,0,0]=4 13555 B17R1.26506 CCC(=O)OCCOCCN1CCCCCC1 7a_200000031056_100000722644 [0,0,1,1,0,0|2,0,0]=4 13556 B17R1.26506 CNC(=O)CCCNCCC1CCCCCC1 2230a_100011532351_100000741757 [0,0,1,1,0,0|2,0,0]=4 13557 B17R1.26506 CNC(=O)CCCNCCC1CCCCCC1 34a_100011532351_100000741757 [0,0,1,1,0,0|2,0,0]=4 13558 B17R1.26506 CNC(=O)OCCNCCC1CCCCCC1 34a_100011532351_200011997002 [0,0,1,1,0,0|2,0,0]=4 13559 B17R1.26506 COC(=O)CCCCCCN1CCCCCC1 2230a_100000185865_100009815986 [0,0,1,1,0,0|1,0,0]=3 13560 B17R1.26506 COC(=O)CCCCCCN1CCCCCC1 269982a_100000185865_100009815986 [0,0,1,1,0,0|1,0,0]=3 13561 B17R1.26506 COC(=O)CCCCCCN1CCCCCC1 34a_100000185865_100009815986 [0,0,1,1,0,0|1,0,0]=3 13562 B17R1.26506 COC(=O)CCCCCCN1CCCOCC1 2230a_100000685342_100009815986 [0,0,1,1,0,0|2,0,0]=4 13563 B17R1.26506 COC(=O)CCCCCCN1CCCOCC1 269982a_100000685342_100009815986 [0,0,1,1,0,0|2,0,0]=4 13564 B17R1.26506 COC(=O)CCCCCCN1CCCOCC1 34a_100000685342_100009815986 [0,0,1,1,0,0|2,0,0]=4 13565 B17R1.26506 COC(=O)CCCCCNC1CCCCCC1 2230a_100000210984_100009816466 [0,0,1,1,0,0|1,0,0]=3 13566 B17R1.26506 COC(=O)CCCCCNC1CCCCCC1 34a_100000210984_100009816466 [0,0,1,1,0,0|1,0,0]=3 13567 B17R1.26506 COC(=O)CCCCCOC1CCCCCC1 34a_100000074720_100011217769 [0,0,1,1,0,0|1,0,0]=3 13568 B17R1.26506 COC(=O)CCCCCOC1CCCCCC1 34a_100000210887_100009816466 [0,0,1,1,0,0|1,0,0]=3 13569 B17R1.26506 COC(=O)CCCCCOC1CCCCCC1 7a_100000210887_100009816466 [0,0,1,1,0,0|1,0,0]=3 13570 B17R1.26506 COC(=O)CCCCCSC1CCCCCC1 62a_100009816466_100011217769 [0,0,1,1,0,0|1,0,0]=3 13571 B17R1.26506 COC(=O)CCCCCSC1CCCCCC1 62a_100011217769_100009816466 [0,0,1,1,0,0|1,0,0]=3 13572 B17R1.26506 COC(=O)CCCCNCC1CCCCCC1 2230a_100015204231_100000204269 [0,0,1,1,0,0|1,0,0]=3 13573 B17R1.26506 COC(=O)CCCCNCC1CCCCCC1 34a_100015204231_100000204269 [0,0,1,1,0,0|1,0,0]=3 13574 B17R1.26506 COC(=O)CCCCOCC1CCCCCC1 34a_100000059025_200000696569 [0,0,1,1,0,0|1,0,0]=3 13575 B17R1.26506 COC(=O)CCCCOCC1CCCCCC1 34a_100000699130_100000204269 [0,0,1,1,0,0|1,0,0]=3 13576 B17R1.26506 COC(=O)CCCCOCC1CCCCCC1 7a_100000059025_200000696569 [0,0,1,1,0,0|1,0,0]=3 13577 B17R1.26506 COC(=O)CCCCOCC1CCCCCC1 7a_100000699130_100000204269 [0,0,1,1,0,0|1,0,0]=3 13578 B17R1.26506 COC(=O)CCCCSCC1CCCCCC1 62a_100000204269_200000696569 [0,0,1,1,0,0|1,0,0]=3 13579 B17R1.26506 COC(=O)CCCCSCC1CCCCCC1 62a_200000696569_100000204269 [0,0,1,1,0,0|1,0,0]=3 13580 B17R1.26506 COC(=O)CCCNCCC1CCCCCC1 2230a_100011532351_100011218270 [0,0,1,1,0,0|1,0,0]=3 13581 B17R1.26506 COC(=O)CCCNCCC1CCCCCC1 34a_100011532351_100000742333 [0,0,1,1,0,0|1,0,0]=3 13582 B17R1.26506 COC(=O)CCCOCCN1CCCCCC1 34a_100000238007_100000742333 [0,0,1,1,0,0|2,0,0]=4 13583 B17R1.26506 COC(=O)CCCSCCN1CCCCCC1 62a_100000722644_100011218270 [0,0,1,1,0,0|2,0,0]=4 13584 B17R1.26506 COC(=O)CCCSCCN1CCCCCC1 62a_100011218270_100000722644 [0,0,1,1,0,0|2,0,0]=4 13585 B17R1.26506 COC(=O)CCOCCCN1CCCCCC1 34a_100102886287_100000742370 [0,0,1,1,0,0|2,0,0]=4 13586 B17R1.26506 COC(=O)CCOCCCN1CCCCCC1 7a_100102886287_100000204255 [0,0,1,1,0,0|2,0,0]=4 13587 B17R1.26506 COC(=O)COCCCCN1CCCCCC1 34a_100011305542_100000747449 [0,0,1,1,0,0|2,0,0]=4 13588 B17R1.26506 COC(=O)COCCNCC1CCCCCC1 2230a_100015204231_100000090808 [0,0,1,1,0,0|2,0,0]=4 13589 B17R1.26506 COC(=O)COCCNCC1CCCCCC1 34a_100015204231_100000090808 [0,0,1,1,0,0|2,0,0]=4 13590 B17R1.26506 COC(=O)COCCOCC1CCCCCC1 34a_100000699130_100000090808 [0,0,1,1,0,0|2,0,0]=4 13591 B17R1.26506 COC(=O)COCCOCC1CCCCCC1 7a_100000699130_100000090808 [0,0,1,1,0,0|2,0,0]=4 13592 B17R1.26506 COC(=O)COCCSCC1CCCCCC1 62a_100000090808_200000696569 [0,0,1,1,0,0|2,0,0]=4 13593 B17R1.26506 COC(=O)COCCSCC1CCCCCC1 62a_200000696569_100000090808 [0,0,1,1,0,0|2,0,0]=4 13594 B17R1.26687 COC(=O)CCCCCCCCCNC1CC1 34a_100000212008_100009813843 [0,0,1,1,0,0|1,0,0]=3 13595 B17R1.26687 COC(=O)CCCCCCCCNCC1CC1 2230a_100000735609_100010282707 [0,0,1,1,0,0|1,0,0]=3 13596 B17R1.26687 COC(=O)CCCCCCCCNCC1CC1 34a_100000735609_100010282707 [0,0,1,1,0,0|1,0,0]=3 13597 B17R1.26687 COC(=O)CCCCCCCCOCC1CC1 34a_100000035544_100000742324 [0,0,1,1,0,0|1,0,0]=3 13598 B17R1.26687 COC(=O)CCCCCCCCOCC1CC1 34a_100000211283_100010282707 [0,0,1,1,0,0|1,0,0]=3 13599 B17R1.26687 COC(=O)CCCCCCCCOCC1CC1 7a_100000035544_100000742324 [0,0,1,1,0,0|1,0,0]=3 13600 B17R1.26687 COC(=O)CCCCCCCCOCC1CO1 34a_100000035544_102125554688 [0,0,1,1,0,0|2,0,0]=4 13601 B17R1.26687 COC(=O)CCCCCCCCOCC1CO1 7a_100000035544_102125554688 [0,0,1,1,0,0|2,0,0]=4 13602 B17R1.26687 COC(=O)CCCCCCCCOCC1CS1 7a_100000035544_100000031435 [0,0,1,1,0,0|2,0,0]=4 13603 B17R1.26687 COC(=O)CCCCCCCCOC[C@@H]1CO1 34a_100000757423_100010282707 [0,0,1,1,0,0|2,0,0]=4 13604 B17R1.26687 COC(=O)CCCCCCCCOC[C@@H]1CO1 7a_100000035544_100000745022 [0,0,1,1,0,0|2,0,0]=4 13605 B17R1.26687 COC(=O)CCCCCCCCSCC1CC1 62a_100000756562_100010282707 [0,0,1,1,0,0|1,0,0]=3 13606 B17R1.26687 COC(=O)CCCCCCCCSCC1CC1 62a_100010282707_100000742324 [0,0,1,1,0,0|1,0,0]=3 13607 B17R1.26687 COC(=O)CCCCCCCCSCC1CO1 62a_100010282707_102125554688 [0,0,1,1,0,0|2,0,0]=4 13608 B17R1.26687 COC(=O)CCCCCCCCSCC1CO1 62a_102125554688_100010282707 [0,0,1,1,0,0|2,0,0]=4 13609 B17R1.26687 COC(=O)CCCCCCCCSCC1CS1 62a_100000031435_100010282707 [0,0,1,1,0,0|2,0,0]=4 13610 B17R1.26687 COC(=O)CCCCCCCCSCC1CS1 62a_100010282707_100000031435 [0,0,1,1,0,0|2,0,0]=4 13611 B17R1.26687 COC(=O)CCCCCCCCSC[C@@H]1CO1 62a_100000745022_100010282707 [0,0,1,1,0,0|2,0,0]=4 13612 B17R1.26687 COC(=O)CCCCCCCCSC[C@@H]1CO1 62a_100010282707_100000745022 [0,0,1,1,0,0|2,0,0]=4 13613 B17R1.26687 COC(=O)CCCCCCCNCCC1CC1 34a_100000764129_100010004213 [0,0,1,1,0,0|1,0,0]=3 13614 B17R1.26687 COC(=O)CCCCCCCOCCC1CC1 34a_100000754188_100010004213 [0,0,1,1,0,0|1,0,0]=3 13615 B17R1.26687 COC(=O)CCCCCCCOCCC1CC1 34a_100011022521_100000694398 [0,0,1,1,0,0|1,0,0]=3 13616 B17R1.26687 COC(=O)CCCCCCCOCCC1CC1 7a_100000754188_100010004213 [0,0,1,1,0,0|1,0,0]=3 13617 B17R1.26687 COC(=O)CCCCCCCOCCC1CC1 7a_100011022521_100000764125 [0,0,1,1,0,0|1,0,0]=3 13618 B17R1.26687 COC(=O)CCCCCCCOCCC1CO1 34a_100011022521_100000732470 [0,0,1,1,0,0|2,0,0]=4 13619 B17R1.26687 COC(=O)CCCCCCCOCCC1CO1 7a_100011022521_100000732470 [0,0,1,1,0,0|2,0,0]=4 13620 B17R1.26687 COC(=O)CCCCCCCOCC[C@@H]1CO1 34a_100009820653_100010004213 [0,0,1,1,0,0|2,0,0]=4 13621 B17R1.26687 COC(=O)CCCCCCCSCCC1CC1 62a_100000764125_100010004213 [0,0,1,1,0,0|1,0,0]=3 13622 B17R1.26687 COC(=O)CCCCCCCSCCC1CC1 62a_100010004213_100000764125 [0,0,1,1,0,0|1,0,0]=3 13623 B17R1.26687 COC(=O)CCCCCCCSCCC1CO1 62a_100000732470_100010004213 [0,0,1,1,0,0|2,0,0]=4 13624 B17R1.26687 COC(=O)CCCCCCCSCCC1CO1 62a_100010004213_100000732470 [0,0,1,1,0,0|2,0,0]=4 13625 B17R1.26687 COC(=O)CCCCCCOCCCC1CO1 34a_100009863599_100000733510 [0,0,1,1,0,0|2,0,0]=4 13626 B17R1.26687 COC(=O)CCCCCCOCCCC1CO1 7a_100009863599_100000733510 [0,0,1,1,0,0|2,0,0]=4 13627 B17R1.26687 COC(=O)CCCCCCOCCNC1CC1 34a_100000738766_100009815986 [0,0,1,1,0,0|2,0,0]=4 13628 B17R1.26687 COC(=O)CCCCCCSCCCC1CO1 62a_100000733510_100009815986 [0,0,1,1,0,0|2,0,0]=4 13629 B17R1.26687 COC(=O)CCCCCCSCCCC1CO1 62a_100009815986_100000733510 [0,0,1,1,0,0|2,0,0]=4 13630 B17R1.27076 CCC1CCCN1CCCCCCC(=O)OC 2230a_100000754278_100009815986 [0,0,1,1,0,0|1,0,0]=3 13631 B17R1.27076 CCC1CCCN1CCCCCCC(=O)OC 269982a_100000754278_100009815986 [0,0,1,1,0,0|1,0,0]=3 13632 B17R1.27076 CCC1CCCN1CCCCCCC(=O)OC 34a_100000754278_100009815986 [0,0,1,1,0,0|1,0,0]=3 13633 B17R1.27076 CCN1CCCC1CNCCCCC(=O)OC 2230a_100000211693_100000204269 [0,0,1,1,0,0|2,0,0]=4 13634 B17R1.27076 CCN1CCC[C@@H]1COCCCCC(=O)OC 34a_100011739246_100000204269 [0,0,1,1,0,0|2,0,0]=4 13635 B17R1.27076 CCN1CCC[C@@H]1COCCCCC(=O)OC 7a_100011739246_100000204269 [0,0,1,1,0,0|2,0,0]=4 13636 B17R1.27076 COC(=O)CCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100009815986 [0,0,1,1,0,0|2,0,0]=4 13637 B17R1.27076 COC(=O)CCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100009815986 [0,0,1,1,0,0|2,0,0]=4 13638 B17R1.27076 COC(=O)CCCCCCN1CCC[C@@H]1CO 34a_100000745186_100009815986 [0,0,1,1,0,0|2,0,0]=4 13639 B17R1.29214 CCCCCCCCCCN1CC1C(=O)OC 2230a_200009830135_100000210320 [0,0,1,1,0,0|1,0,0]=3 13640 B17R1.29214 COC(=O)C1CN1CCCCCCCCCO 2230a_200009830135_100009813782 [0,0,1,1,0,0|2,0,0]=4 13641 B17R1.180031 CCC(=O)NC1CCCCCCCCCCC1 11a_100011194316_100000210414 [0,0,1,1,0,0|1,0,0]=3 13642 B17R1.180031 CCC(=O)NC1CCCCCCCCCCC1 1626a_100011194316_100000210414 [0,0,1,1,0,0|1,0,0]=3 13643 B17R1.180031 CCC(=O)NC1CCCCCCCCCCC1 240690a_100011194316_100000210414 [0,0,1,1,0,0|1,0,0]=3 13644 B17R1.180031 CCC(=O)NC1CCCCCCCCCCC1 527a_100011194316_100000210414 [0,0,1,1,0,0|1,0,0]=3 13645 B17R1.180031 CCC(C)OC1CCCCCCCCCCC1 34a_100000211378_100011215416 [0,0,1,1,0,0|1,0,1]=4 13646 B17R1.180031 CCC(C)OC1CCCCCCCCCCC1 7a_100000211378_100000758301 [0,0,1,1,0,0|1,0,1]=4 13647 B17R1.180031 CNC(=O)NC1CCCCCCCCCCC1 2708a_100011194316_106832991635 [0,0,1,1,0,0|2,0,0]=4 13648 B17R1.180031 CNC(=O)NC1CCCCCCCCCCC1 2708a_100102657272_100011194316 [0,0,1,1,0,0|2,0,0]=4 13649 B17R1.180031 CNC(=O)NC1CCCCCCCCCCC1 273464a_100011194316_100102657272 [0,0,1,1,0,0|2,0,0]=4 13650 B17R1.180031 CNC(=O)NC1CCCCCCCCCCC1 273464a_100102657272_100011194316 [0,0,1,1,0,0|2,0,0]=4 13651 B17R1.180031 O=C(CO)NC1CCCCCCCCCCC1 240690a_100011194316_100000210174 [0,0,1,1,0,0|2,0,0]=4 13652 B17R1.180031 O=C(CO)NC1CCCCCCCCCCC1 527a_100011194316_100000210174 [0,0,1,1,0,0|2,0,0]=4 13653 B17R1.321 CCCCCCN1CCCCC1CCC(=O)O 269956a_100000694054_100000210757 [0,0,1,1,0,0|1,0,0]=3 13654 B17R1.321 CCCCOCN1CCCCC1CCC(=O)O 269956a_100000694054_100011995733 [0,0,1,1,0,0|2,0,0]=4 13655 B17R1.321 CCCOCCN1CCCCC1CCC(=O)O 269956a_100000694054_100011215938 [0,0,1,1,0,0|2,0,0]=4 13656 B17R1.321 CCOCCCN1CCCCC1CCC(=O)O 269956a_100000694054_100012232248 [0,0,1,1,0,0|2,0,0]=4 13657 B17R1.321 COCCCCN1CCCCC1CCC(=O)O 269956a_100000694054_100000730899 [0,0,1,1,0,0|2,0,0]=4 13658 B17R1.321 O=C(O)CCC1CCCCN1CCCCCF 269956a_100000694054_100000729378 [0,0,1,1,0,0|2,0,0]=4 13659 B17R1.321 O=C(O)CCC1CCCCN1CCCCCO 269956a_100000694054_100000746330 [0,0,1,1,0,0|2,0,0]=4 13660 B17R1.339 CCCCCCC1CCCC1NCCC(=O)N 269862a_100000740010_100000189428 [0,0,1,1,0,0|2,0,0]=4 13661 B17R1.360 CCCC1CCCC1NCCCCNC(=O)C 269862a_200011368371_100000723119 [0,0,1,1,0,0|2,0,0]=4 13662 B17R1.360 CCCC1CCCC1NCCCCNC(=O)C 270004a_200011368371_100000723119 [0,0,1,1,0,0|2,0,0]=4 13663 B17R1.360 CCCN1CCCC1COCCCOC(=O)C 34a_200000694710_100000042594 [0,0,1,1,0,0|2,0,0]=4 13664 B17R1.360 CCCN1CCCC1COCCCOC(=O)C 7a_200000694710_100000042594 [0,0,1,1,0,0|2,0,0]=4 13665 B17R1.360 COC[C@@H]1CCCN1CCCCCOC(=O)C 2230a_100020646714_100009813381 [0,0,1,1,0,0|2,0,0]=4 13666 B17R1.360 COC[C@@H]1CCCN1CCCCCOC(=O)C 269982a_100020646714_100000033007 [0,0,1,1,0,0|2,0,0]=4 13667 B17R1.360 COC[C@@H]1CCCN1CCCCCOC(=O)C 34a_100020646714_100000033007 [0,0,1,1,0,0|2,0,0]=4 13668 B17R1.451 CC(=O)NCCCCCNC1CCCCC1C 269862a_200012022750_100000210921 [0,0,1,1,0,0|2,0,0]=4 13669 B17R1.451 CC(=O)NCCCCCNC1CCCCC1C 270004a_200012022750_100000210921 [0,0,1,1,0,0|2,0,0]=4 13670 B17R1.451 CC(=O)OCCCCCNC1CCCCC1C 2230a_100000211402_100009813381 [0,0,1,1,0,0|1,0,0]=3 13671 B17R1.451 CC(=O)OCCCCCNC1CCCCC1C 34a_100000211402_100000033007 [0,0,1,1,0,0|1,0,0]=3 13672 B17R1.451 CC(=O)OCCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100009813381 [0,0,1,1,0,0|2,0,0]=4 13673 B17R1.451 CC(=O)OCCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000033007 [0,0,1,1,0,0|2,0,0]=4 13674 B17R1.451 CC(=O)OCCCCCOC1CCCCC1C 34a_100000211207_100000033007 [0,0,1,1,0,0|1,0,0]=3 13675 B17R1.451 CC(=O)OCCCCCOC1CCCCC1C 7a_100000211207_100000033007 [0,0,1,1,0,0|1,0,0]=3 13676 B17R1.451 CC(=O)OCCCCCOC1CCCCC1Cl 34a_100000038908_100000033007 [0,0,1,1,0,0|2,0,0]=4 13677 B17R1.451 CC(=O)OCCCCCOC1CCCCC1Cl 7a_100000038908_100000033007 [0,0,1,1,0,0|2,0,0]=4 13678 B17R1.451 CC(=O)OCCCCCOC1CCNCC1C 34a_100011998114_100000033007 [0,0,1,1,0,0|2,0,0]=4 13679 B17R1.451 CC(=O)OCCCCCOC1CNCCC1C 34a_100000696640_100000033007 [0,0,1,1,0,0|2,0,0]=4 13680 B17R1.451 CC(=O)OCCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000033007 [0,0,1,1,0,0|2,0,0]=4 13681 B17R1.451 CC(=O)OCCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000033007 [0,0,1,1,0,0|2,0,0]=4 13682 B17R1.451 CC(=O)OCCCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000033007 [0,0,1,1,0,0|2,0,0]=4 13683 B17R1.451 CC(=O)OCCCCCSC1CCCCC1F 62a_100000033007_100015423560 [0,0,1,1,0,0|2,0,0]=4 13684 B17R1.451 CC(=O)OCCCCCSC1CCCCC1F 62a_100015423560_100000033007 [0,0,1,1,0,0|2,0,0]=4 13685 B17R1.451 CC(=O)OCCCCCSC1CCCCC1O 62a_100000033007_100000038908 [0,0,1,1,0,0|2,0,0]=4 13686 B17R1.451 CC(=O)OCCCCCSC1CCCCC1O 62a_100000038908_100000033007 [0,0,1,1,0,0|2,0,0]=4 13687 B17R1.451 CC(=O)OCCCCNCC1CCCCC1O 34a_100011216029_100000033659 [0,0,1,1,0,0|2,0,0]=4 13688 B17R1.451 CC(=O)OCCCCNCC1CCCCN1C 34a_100011228421_100000033659 [0,0,1,1,0,0|2,0,0]=4 13689 B17R1.451 CC(=O)OCCCCOCC1CCCCN1C 34a_100000073216_100015186950 [0,0,1,1,0,0|2,0,0]=4 13690 B17R1.451 CC(=O)OCCCCOCC1CCCCN1C 34a_100000225079_100000033659 [0,0,1,1,0,0|2,0,0]=4 13691 B17R1.451 CC(=O)OCCCCOCC1CCCCN1C 7a_100000073216_100015185383 [0,0,1,1,0,0|2,0,0]=4 13692 B17R1.451 CC(=O)OCCCCSCC1CCCCN1C 62a_100000033659_100015185383 [0,0,1,1,0,0|2,0,0]=4 13693 B17R1.451 CC(=O)OCCCCSCC1CCCCN1C 62a_100015185383_100000033659 [0,0,1,1,0,0|2,0,0]=4 13694 B17R1.451 CC(=O)OCCCNCCN1CCCCC1C 34a_100000739827_100000042594 [0,0,1,1,0,0|2,0,0]=4 13695 B17R1.451 CC(=O)OCCCOCCN1CCCCC1C 34a_100011305533_100000042594 [0,0,1,1,0,0|2,0,0]=4 13696 B17R1.451 CC(=O)OCCCSCCC1CCCCN1C 62a_100000042594_100000211948 [0,0,1,1,0,0|2,0,0]=4 13697 B17R1.451 CC(=O)OCCCSCCC1CCCCN1C 62a_100000211948_100000042594 [0,0,1,1,0,0|2,0,0]=4 13698 B17R1.451 CC(=O)OCCNCCCN1CCCCC1C 34a_100000212276_100009814007 [0,0,1,1,0,0|2,0,0]=4 13699 B17R1.451 CC(=O)OCCOCCCN1CCCCC1C 34a_100000213889_100009814007 [0,0,1,1,0,0|2,0,0]=4 13700 B17R1.451 CC(=O)OCCOCCCN1CCCCC1C 7a_100000213889_100009814007 [0,0,1,1,0,0|2,0,0]=4 13701 B17R1.451 CC(=O)OCCOCCNC1CCCCC1C 2230a_100000211402_200000083610 [0,0,1,1,0,0|2,0,0]=4 13702 B17R1.451 CC(=O)OCCOCCNC1CCCCC1C 34a_100000211402_200000083610 [0,0,1,1,0,0|2,0,0]=4 13703 B17R1.451 CC(=O)OCCOCCOC1CCCCC1C 34a_100000211207_200000083610 [0,0,1,1,0,0|2,0,0]=4 13704 B17R1.451 CC(=O)OCCOCCOC1CCCCC1C 7a_100000211207_200000083610 [0,0,1,1,0,0|2,0,0]=4 13705 B17R1.747 CC(=O)OCCCCN1CCCCC1CCO 269982a_100000211664_100000033659 [0,0,1,1,0,0|2,0,0]=4 13706 B17R1.747 CC(=O)OCCCCN1CCCCC1CCO 34a_100000211664_100000033659 [0,0,1,1,0,0|2,0,0]=4 13707 B17R1.747 CCCC1CCCCC1NCCCCC(=O)N 269862a_100000696515_100011218038 [0,0,1,1,0,0|2,0,0]=4 13708 B17R1.747 CCCC1CCCCC1NCCCCC(=O)N 270004a_100000696515_100011218038 [0,0,1,1,0,0|2,0,0]=4 13709 B17R1.747 CCCC1CCCCC1NCCCNC(=O)C 269862a_100000736810_100011218038 [0,0,1,1,0,0|2,0,0]=4 13710 B17R1.747 CCCC1CCCCC1NCCCNC(=O)C 270004a_100000736810_100011218038 [0,0,1,1,0,0|2,0,0]=4 13711 B17R1.747 CCCC1CCCCC1OCCCCC(=O)C 34a_100011217265_100009817362 [0,0,1,1,0,0|2,0,0]=4 13712 B17R1.747 CCCC1CCCCC1OCCCCC(=O)C 7a_100011217265_100000735457 [0,0,1,1,0,0|2,0,0]=4 13713 B17R1.747 CCCC1CCCCC1OCCCOC(=O)C 34a_100011217265_100000042594 [0,0,1,1,0,0|1,0,0]=3 13714 B17R1.747 CCCC1CCCCC1OCCCOC(=O)C 7a_100011217265_100000042594 [0,0,1,1,0,0|1,0,0]=3 13715 B17R1.747 CCCC1CCCCC1OCCCOC(=S)C 34a_100011217265_200135323944 [0,0,1,1,0,0|1,1,0]=4 13716 B17R1.747 CCCC1CCCCC1OCCCOC(=S)C 7a_100011217265_200135323944 [0,0,1,1,0,0|1,1,0]=4 13717 B17R1.747 CCCC1CCCCC1OCCCSC(=O)C 34a_100011217265_100000038929 [0,0,1,1,0,0|1,1,0]=4 13718 B17R1.747 CCCC1CCCCC1OCCCSC(=O)C 7a_100011217265_100000038929 [0,0,1,1,0,0|1,1,0]=4 13719 B17R1.747 CCCC1CCCCN1CCCCCC(=O)N 2230a_100000701414_100009817443 [0,0,1,1,0,0|2,0,0]=4 13720 B17R1.747 CCCC1CCCCN1CCCCCC(=O)N 269982a_100000701414_100009817443 [0,0,1,1,0,0|2,0,0]=4 13721 B17R1.747 CCCC1CCCCN1CCCCCC(=O)N 34a_100000701414_100009817443 [0,0,1,1,0,0|2,0,0]=4 13722 B17R1.747 CCCC1CCCCN1CCCCOC(=O)C 269982a_100000701414_100000033659 [0,0,1,1,0,0|1,0,0]=3 13723 B17R1.747 CCCC1CCCCN1CCCCOC(=O)C 34a_100000701414_100000033659 [0,0,1,1,0,0|1,0,0]=3 13724 B17R1.747 CCCC1CCCCN1CCCCSC(=O)C 2230a_100000701414_200010402107 [0,0,1,1,0,0|1,1,0]=4 13725 B17R1.747 CCCC1CCCCN1CCCCSC(=O)C 269982a_100000701414_200010402107 [0,0,1,1,0,0|1,1,0]=4 13726 B17R1.747 CCCC1CCCCN1CCCCSC(=O)C 34a_100000701414_200010402107 [0,0,1,1,0,0|1,1,0]=4 13727 B17R1.747 CCCC1CCCCN1COCCOC(=O)C 269982a_100000701414_100000076355 [0,0,1,1,0,0|2,0,0]=4 13728 B17R1.747 CCCC1CCCCN1COCCOC(=O)C 34a_100000701414_100000076355 [0,0,1,1,0,0|2,0,0]=4 13729 B17R1.747 CCCC1COCCN1CCCCOC(=O)C 269982a_102495339903_100000033659 [0,0,1,1,0,0|2,0,0]=4 13730 B17R1.747 CCCC1COCCN1CCCCOC(=O)C 34a_102495339903_100000033659 [0,0,1,1,0,0|2,0,0]=4 13731 B17R1.747 COCC1CCCCN1CCCCOC(=O)C 269982a_100015184032_100000033659 [0,0,1,1,0,0|2,0,0]=4 13732 B17R1.747 COCC1CCCCN1CCCCOC(=O)C 34a_100015184032_100000033659 [0,0,1,1,0,0|2,0,0]=4 13733 B17R1.1294 CC(=O)OCCCN1CCCCC1CCCO 269982a_100011934581_100000042594 [0,0,1,1,0,0|2,0,0]=4 13734 B17R1.1294 CC(=O)OCCCN1CCCCC1CCCO 34a_100011934581_100000042594 [0,0,1,1,0,0|2,0,0]=4 13735 B17R1.1294 COCCC1CCCCN1CCCOC(=O)C 269982a_100015186528_100000042594 [0,0,1,1,0,0|2,0,0]=4 13736 B17R1.1294 COCCC1CCCCN1CCCOC(=O)C 34a_100015186528_100000042594 [0,0,1,1,0,0|2,0,0]=4 13737 B17R1.1307 CCCCC1CCCC1NCCCCC(=O)N 269862a_100000696515_100000750825 [0,0,1,1,0,0|2,0,0]=4 13738 B17R1.1307 CCCCC1CCCC1NCCCCC(=O)N 270004a_100000696515_100000750825 [0,0,1,1,0,0|2,0,0]=4 13739 B17R1.1307 CCCCC1CCCC1NCCCNC(=O)C 269862a_100000736810_100000750825 [0,0,1,1,0,0|2,0,0]=4 13740 B17R1.1307 CCCCC1CCCC1NCCCNC(=O)C 270004a_100000736810_100000750825 [0,0,1,1,0,0|2,0,0]=4 13741 B17R1.1311 CC(=O)CCCCNCCCC1CCCCC1 34a_100011211642_100009817362 [0,0,1,1,0,0|2,0,0]=4 13742 B17R1.1311 CC(=O)CCCCOCCCC1CCCCC1 34a_100000198086_100009817362 [0,0,1,1,0,0|2,0,0]=4 13743 B17R1.1311 CC(=O)CCCCOCCCC1CCCCC1 7a_100000198086_100000735457 [0,0,1,1,0,0|2,0,0]=4 13744 B17R1.1311 CC(=O)CCCCSCCCC1CCCCC1 62a_100000735457_100011713725 [0,0,1,1,0,0|2,0,0]=4 13745 B17R1.1311 CC(=O)CCCCSCCCC1CCCCC1 62a_100011713725_100000735457 [0,0,1,1,0,0|2,0,0]=4 13746 B17R1.1311 CC(=O)CCCOCCCCC1CCCCC1 34a_100011215267_100000685027 [0,0,1,1,0,0|2,0,0]=4 13747 B17R1.1311 CC(=O)CCCOCCCCC1CCCCC1 7a_100011215267_100011215641 [0,0,1,1,0,0|2,0,0]=4 13748 B17R1.1311 CC(=O)NCCCCCCNC1CCCCC1 270004a_200011996284_100000210434 [0,0,1,1,0,0|2,0,0]=4 13749 B17R1.1311 CC(=O)NCCCCCCNC1CCCCC1 34a_200011996284_100000210327 [0,0,1,1,0,0|2,0,0]=4 13750 B17R1.1311 CC(=O)NCCCCCNCC1CCCCC1 2230a_200012022750_100000211423 [0,0,1,1,0,0|2,0,0]=4 13751 B17R1.1311 CC(=O)NCCCCCNCC1CCCCC1 269862a_200012022750_100000211278 [0,0,1,1,0,0|2,0,0]=4 13752 B17R1.1311 CC(=O)NCCCCCNCC1CCCCC1 34a_200012022750_100000211423 [0,0,1,1,0,0|2,0,0]=4 13753 B17R1.1311 CC(=O)NCCCCNCCC1CCCCC1 2230a_200011368371_100012355289 [0,0,1,1,0,0|2,0,0]=4 13754 B17R1.1311 CC(=O)NCCCCNCCC1CCCCC1 270004a_200011368371_100011713444 [0,0,1,1,0,0|2,0,0]=4 13755 B17R1.1311 CC(=O)NCCCCNCCC1CCCCC1 34a_200011368371_100011209188 [0,0,1,1,0,0|2,0,0]=4 13756 B17R1.1311 CC(=O)NCCCNCCCC1CCCCC1 34a_100000736810_100011713725 [0,0,1,1,0,0|2,0,0]=4 13757 B17R1.1311 CC(=O)NCCCOCCCC1CCCCC1 34a_100000752032_100011713725 [0,0,1,1,0,0|2,0,0]=4 13758 B17R1.1311 CC(=O)NCCOCCCCC1CCCCC1 7a_100011215267_100000189650 [0,0,1,1,0,0|2,0,0]=4 13759 B17R1.1311 CC(=O)OCCCCCNCC1CCCCC1 2230a_100000210473_100009813381 [0,0,1,1,0,0|1,0,0]=3 13760 B17R1.1311 CC(=O)OCCCCCNCC1CCCCC1 34a_100000210473_100000033007 [0,0,1,1,0,0|1,0,0]=3 13761 B17R1.1311 CC(=O)OCCCCCNCC1CCCCO1 2230a_100000174945_100009813381 [0,0,1,1,0,0|2,0,0]=4 13762 B17R1.1311 CC(=O)OCCCCCNCC1CCCCO1 34a_100000174945_100000033007 [0,0,1,1,0,0|2,0,0]=4 13763 B17R1.1311 CC(=O)OCCCCCNCC1CCCOC1 2230a_100000720124_100009813381 [0,0,1,1,0,0|2,0,0]=4 13764 B17R1.1311 CC(=O)OCCCCCNCC1CCCOC1 34a_100000720124_100000033007 [0,0,1,1,0,0|2,0,0]=4 13765 B17R1.1311 CC(=O)OCCCCCNCC1CCOCC1 2230a_100000746373_100009813381 [0,0,1,1,0,0|2,0,0]=4 13766 B17R1.1311 CC(=O)OCCCCCNCC1CCOCC1 34a_100000746373_100000033007 [0,0,1,1,0,0|2,0,0]=4 13767 B17R1.1311 CC(=O)OCCCCCNCC1CCSCC1 2230a_100015188806_100009813381 [0,0,1,1,0,0|2,0,0]=4 13768 B17R1.1311 CC(=O)OCCCCCNCC1CCSCC1 34a_100015188806_100000033007 [0,0,1,1,0,0|2,0,0]=4 13769 B17R1.1311 CC(=O)OCCCCCOCC1CCCCC1 34a_100000212181_100000033007 [0,0,1,1,0,0|1,0,0]=3 13770 B17R1.1311 CC(=O)OCCCCCOCC1CCCCC1 7a_100000212181_100000033007 [0,0,1,1,0,0|1,0,0]=3 13771 B17R1.1311 CC(=O)OCCCCCOCC1CCCCN1 34a_100000210821_100000033007 [0,0,1,1,0,0|2,0,0]=4 13772 B17R1.1311 CC(=O)OCCCCCOCC1CCCCO1 34a_100000211370_100000033007 [0,0,1,1,0,0|2,0,0]=4 13773 B17R1.1311 CC(=O)OCCCCCOCC1CCCCO1 7a_100000211370_100000033007 [0,0,1,1,0,0|2,0,0]=4 13774 B17R1.1311 CC(=O)OCCCCCOCC1CCCNC1 34a_100000211344_100000033007 [0,0,1,1,0,0|2,0,0]=4 13775 B17R1.1311 CC(=O)OCCCCCOCC1CCCOC1 34a_100000741520_100000033007 [0,0,1,1,0,0|2,0,0]=4 13776 B17R1.1311 CC(=O)OCCCCCOCC1CCNCC1 34a_100000738675_100000033007 [0,0,1,1,0,0|2,0,0]=4 13777 B17R1.1311 CC(=O)OCCCCCOCC1CCOCC1 34a_100000749013_100000033007 [0,0,1,1,0,0|2,0,0]=4 13778 B17R1.1311 CC(=O)OCCCCCOCC1CCSCC1 34a_100000070558_100000033007 [0,0,1,1,0,0|2,0,0]=4 13779 B17R1.1311 CC(=O)OCCCCCOCC1CCSCC1 7a_100000070558_100000033007 [0,0,1,1,0,0|2,0,0]=4 13780 B17R1.1311 CC(=O)OCCCCCSCC1CCCCC1 62a_100000033007_100000211423 [0,0,1,1,0,0|1,0,0]=3 13781 B17R1.1311 CC(=O)OCCCCCSCC1CCCCC1 62a_100000211423_100000033007 [0,0,1,1,0,0|1,0,0]=3 13782 B17R1.1311 CC(=O)OCCCCCSCC1CCCCO1 62a_100000033007_100000211543 [0,0,1,1,0,0|2,0,0]=4 13783 B17R1.1311 CC(=O)OCCCCCSCC1CCCCO1 62a_100000211543_100000033007 [0,0,1,1,0,0|2,0,0]=4 13784 B17R1.1311 CC(=O)OCCCCCSCC1CCCOC1 62a_100000033007_100000741521 [0,0,1,1,0,0|2,0,0]=4 13785 B17R1.1311 CC(=O)OCCCCCSCC1CCCOC1 62a_100000741521_100000033007 [0,0,1,1,0,0|2,0,0]=4 13786 B17R1.1311 CC(=O)OCCCCCSCC1CCOCC1 62a_100000033007_100000749018 [0,0,1,1,0,0|2,0,0]=4 13787 B17R1.1311 CC(=O)OCCCCCSCC1CCOCC1 62a_100000754603_100000033007 [0,0,1,1,0,0|2,0,0]=4 13788 B17R1.1311 CC(=O)OCCCCNCCC1CCCCC1 34a_100000738074_100000033659 [0,0,1,1,0,0|1,0,0]=3 13789 B17R1.1311 CC(=O)OCCCCNCCC1CCCCO1 34a_100015183643_100000033659 [0,0,1,1,0,0|2,0,0]=4 13790 B17R1.1311 CC(=O)OCCCCNCCC1CCOCC1 34a_100000755988_100000033659 [0,0,1,1,0,0|2,0,0]=4 13791 B17R1.1311 CC(=O)OCCCCOCCC1CCCCC1 34a_100000073216_100011209188 [0,0,1,1,0,0|1,0,0]=3 13792 B17R1.1311 CC(=O)OCCCCOCCC1CCCCC1 34a_100011217863_100000033659 [0,0,1,1,0,0|1,0,0]=3 13793 B17R1.1311 CC(=O)OCCCCOCCC1CCCCC1 7a_100000073216_100011273959 [0,0,1,1,0,0|1,0,0]=3 13794 B17R1.1311 CC(=O)OCCCCOCCC1CCCCC1 7a_100011217863_100000033659 [0,0,1,1,0,0|1,0,0]=3 13795 B17R1.1311 CC(=O)OCCCCOCCC1CCCCN1 34a_100000211664_100000033659 [0,0,1,1,0,0|2,0,0]=4 13796 B17R1.1311 CC(=O)OCCCCOCCC1CCCNC1 34a_100000752241_100000033659 [0,0,1,1,0,0|2,0,0]=4 13797 B17R1.1311 CC(=O)OCCCCOCCC1CCNCC1 34a_100015190746_100000033659 [0,0,1,1,0,0|2,0,0]=4 13798 B17R1.1311 CC(=O)OCCCCOCCC1CCOCC1 34a_100000073216_100011934994 [0,0,1,1,0,0|2,0,0]=4 13799 B17R1.1311 CC(=O)OCCCCOCCC1CCOCC1 34a_100011933979_100000033659 [0,0,1,1,0,0|2,0,0]=4 13800 B17R1.1311 CC(=O)OCCCCOCCC1CCOCC1 7a_100000073216_100011934994 [0,0,1,1,0,0|2,0,0]=4 13801 B17R1.1311 CC(=O)OCCCCOCCC1CCOCC1 7a_100011933979_100000033659 [0,0,1,1,0,0|2,0,0]=4 13802 B17R1.1311 CC(=O)OCCCCOCCN1CCCCC1 34a_100000073216_100000739454 [0,0,1,1,0,0|2,0,0]=4 13803 B17R1.1311 CC(=O)OCCCCOCCN1CCCCC1 7a_100000073216_100000739454 [0,0,1,1,0,0|2,0,0]=4 13804 B17R1.1311 CC(=O)OCCCCOCOC1CCCCC1 34a_100000073216_100011935260 [0,0,1,1,0,0|2,0,0]=4 13805 B17R1.1311 CC(=O)OCCCCOCOC1CCCCC1 7a_100000073216_100011935260 [0,0,1,1,0,0|2,0,0]=4 13806 B17R1.1311 CC(=O)OCCCCSCCC1CCCCC1 62a_100000033659_100012355289 [0,0,1,1,0,0|1,0,0]=3 13807 B17R1.1311 CC(=O)OCCCCSCCC1CCCCC1 62a_100012355289_100000033659 [0,0,1,1,0,0|1,0,0]=3 13808 B17R1.1311 CC(=O)OCCCCSCCC1CCOCC1 62a_100000033659_100011934994 [0,0,1,1,0,0|2,0,0]=4 13809 B17R1.1311 CC(=O)OCCCCSCCC1CCOCC1 62a_100011934994_100000033659 [0,0,1,1,0,0|2,0,0]=4 13810 B17R1.1311 CC(=O)OCCCCSCCN1CCCCC1 62a_100000033659_100000739454 [0,0,1,1,0,0|2,0,0]=4 13811 B17R1.1311 CC(=O)OCCCCSCCN1CCCCC1 62a_100000739454_100000033659 [0,0,1,1,0,0|2,0,0]=4 13812 B17R1.1311 CC(=O)OCCCCSCOC1CCCCC1 62a_100000033659_100011935260 [0,0,1,1,0,0|2,0,0]=4 13813 B17R1.1311 CC(=O)OCCCCSCOC1CCCCC1 62a_100011935260_100000033659 [0,0,1,1,0,0|2,0,0]=4 13814 B17R1.1311 CC(=O)OCCCNCCCC1CCCCC1 34a_100011211642_100000042594 [0,0,1,1,0,0|1,0,0]=3 13815 B17R1.1311 CC(=O)OCCCNCCOC1CCCCC1 34a_100015206981_100000042594 [0,0,1,1,0,0|2,0,0]=4 13816 B17R1.1311 CC(=O)OCCCOCCCC1CCCCC1 34a_100000198086_100000042594 [0,0,1,1,0,0|1,0,0]=3 13817 B17R1.1311 CC(=O)OCCCOCCCC1CCCCC1 7a_100000198086_100000042594 [0,0,1,1,0,0|1,0,0]=3 13818 B17R1.1311 CC(=O)OCCCOCCCC1CCCCN1 34a_100011934581_100000042594 [0,0,1,1,0,0|2,0,0]=4 13819 B17R1.1311 CC(=O)OCCCOCCCC1CCCNC1 34a_100150707839_100000042594 [0,0,1,1,0,0|2,0,0]=4 13820 B17R1.1311 CC(=O)OCCCOCCCC1CCNCC1 34a_100016988962_100000042594 [0,0,1,1,0,0|2,0,0]=4 13821 B17R1.1311 CC(=O)OCCCOCCCN1CCCCC1 34a_100000212458_100000042594 [0,0,1,1,0,0|2,0,0]=4 13822 B17R1.1311 CC(=O)OCCCOCCNC1CCCCC1 34a_100000200466_100000042594 [0,0,1,1,0,0|2,0,0]=4 13823 B17R1.1311 CC(=O)OCCCOCCOC1CCCCC1 34a_100011249652_100000042594 [0,0,1,1,0,0|2,0,0]=4 13824 B17R1.1311 CC(=O)OCCCOCCOC1CCCCC1 7a_100011249652_100000042594 [0,0,1,1,0,0|2,0,0]=4 13825 B17R1.1311 CC(=O)OCCCSCCCC1CCCCC1 62a_100000042594_100011713725 [0,0,1,1,0,0|1,0,0]=3 13826 B17R1.1311 CC(=O)OCCCSCCCC1CCCCC1 62a_100011713725_100000042594 [0,0,1,1,0,0|1,0,0]=3 13827 B17R1.1311 CC(=O)OCCCSCCCN1CCCCC1 62a_100000042594_100000007876 [0,0,1,1,0,0|2,0,0]=4 13828 B17R1.1311 CC(=O)OCCCSCCCN1CCCCC1 62a_100132302099_100000042594 [0,0,1,1,0,0|2,0,0]=4 13829 B17R1.1311 CC(=O)OCCCSCCOC1CCCCC1 62a_100000042594_100011211530 [0,0,1,1,0,0|2,0,0]=4 13830 B17R1.1311 CC(=O)OCCCSCCOC1CCCCC1 62a_100011211530_100000042594 [0,0,1,1,0,0|2,0,0]=4 13831 B17R1.1311 CC(=O)OCCNCCCOC1CCCCC1 34a_100000205933_100009814007 [0,0,1,1,0,0|2,0,0]=4 13832 B17R1.1311 CC(=O)OCCOCCCCC1CCCCC1 34a_100011215267_100009814007 [0,0,1,1,0,0|1,0,0]=3 13833 B17R1.1311 CC(=O)OCCOCCCCC1CCCCC1 7a_100011215267_100009814007 [0,0,1,1,0,0|1,0,0]=3 13834 B17R1.1311 CC(=O)OCCOCCCCC1CCNCC1 34a_100016989291_100009814007 [0,0,1,1,0,0|2,0,0]=4 13835 B17R1.1311 CC(=O)OCCOCCNCC1CCCCC1 2230a_100000210473_200000083610 [0,0,1,1,0,0|2,0,0]=4 13836 B17R1.1311 CC(=O)OCCOCCNCC1CCCCC1 34a_100000210473_200000083610 [0,0,1,1,0,0|2,0,0]=4 13837 B17R1.1311 CC(=O)OCCOCCOCC1CCCCC1 34a_100000212181_200000083610 [0,0,1,1,0,0|2,0,0]=4 13838 B17R1.1311 CC(=O)OCCOCCOCC1CCCCC1 7a_100000212181_200000083610 [0,0,1,1,0,0|2,0,0]=4 13839 B17R1.1311 CC(=O)OCCOCCSCC1CCCCC1 62a_100000211423_200000083610 [0,0,1,1,0,0|2,0,0]=4 13840 B17R1.1311 CC(=O)OCCOCCSCC1CCCCC1 62a_200000083610_100000211423 [0,0,1,1,0,0|2,0,0]=4 13841 B17R1.1311 CC(=O)OCCOCNCCC1CCCCC1 34a_100000738074_100000076355 [0,0,1,1,0,0|2,0,0]=4 13842 B17R1.1311 CC(=O)OCCOCOCCC1CCCCC1 34a_100011217863_100000076355 [0,0,1,1,0,0|2,0,0]=4 13843 B17R1.1311 CC(=O)OCCOCSCCC1CCCCC1 62a_100000076355_100012355289 [0,0,1,1,0,0|2,0,0]=4 13844 B17R1.1311 CC(=O)OCCOCSCCC1CCCCC1 62a_100012355289_100000076355 [0,0,1,1,0,0|2,0,0]=4 13845 B17R1.1311 CC(=O)OCOCCCCCN1CCCCC1 34a_100011216611_100009813279 [0,0,1,1,0,0|2,0,0]=4 13846 B17R1.1311 CC(=O)SCCCCCCNC1CCCCC1 270004a_100000704104_100000210434 [0,0,1,1,0,0|1,1,0]=4 13847 B17R1.1311 CC(=O)SCCCCNCCC1CCCCC1 2230a_100000738074_200010402107 [0,0,1,1,0,0|1,1,0]=4 13848 B17R1.1311 CC(=O)SCCCCNCCC1CCCCC1 34a_100000738074_200010402107 [0,0,1,1,0,0|1,1,0]=4 13849 B17R1.1311 CC(=O)SCCCCOCCC1CCCCC1 34a_100011217863_200010402107 [0,0,1,1,0,0|1,1,0]=4 13850 B17R1.1311 CC(=O)SCCCCOCCC1CCCCC1 7a_100011217863_200010402107 [0,0,1,1,0,0|1,1,0]=4 13851 B17R1.1311 CC(=O)SCCCCSCCC1CCCCC1 62a_100012355289_200010402107 [0,0,1,1,0,0|1,1,0]=4 13852 B17R1.1311 CC(=O)SCCCCSCCC1CCCCC1 62a_200010402107_100012355289 [0,0,1,1,0,0|1,1,0]=4 13853 B17R1.1311 CC(=O)SCCCNCCCC1CCCCC1 2230a_100011211642_100000038929 [0,0,1,1,0,0|1,1,0]=4 13854 B17R1.1311 CC(=O)SCCCNCCCC1CCCCC1 34a_100011211642_100000038929 [0,0,1,1,0,0|1,1,0]=4 13855 B17R1.1311 CC(=O)SCCCOCCCC1CCCCC1 34a_100000198086_100000038929 [0,0,1,1,0,0|1,1,0]=4 13856 B17R1.1311 CC(=O)SCCCOCCCC1CCCCC1 7a_100000198086_100000038929 [0,0,1,1,0,0|1,1,0]=4 13857 B17R1.1311 CC(=O)SCCCSCCCC1CCCCC1 62a_100000038929_100011713725 [0,0,1,1,0,0|1,1,0]=4 13858 B17R1.1311 CC(=O)SCCCSCCCC1CCCCC1 62a_100011713725_100000038929 [0,0,1,1,0,0|1,1,0]=4 13859 B17R1.1311 CC(=S)OCCCNCCCC1CCCCC1 2230a_100011211642_200135323944 [0,0,1,1,0,0|1,1,0]=4 13860 B17R1.1311 CC(=S)OCCCNCCCC1CCCCC1 34a_100011211642_200135323944 [0,0,1,1,0,0|1,1,0]=4 13861 B17R1.1311 CC(=S)OCCCOCCCC1CCCCC1 34a_100000198086_200135323944 [0,0,1,1,0,0|1,1,0]=4 13862 B17R1.1311 CC(=S)OCCCOCCCC1CCCCC1 7a_100000198086_200135323944 [0,0,1,1,0,0|1,1,0]=4 13863 B17R1.1311 CC(=S)OCCCSCCCC1CCCCC1 62a_100011713725_200135323944 [0,0,1,1,0,0|1,1,0]=4 13864 B17R1.1311 CC(=S)OCCCSCCCC1CCCCC1 62a_200135323944_100011713725 [0,0,1,1,0,0|1,1,0]=4 13865 B17R1.1311 NC(=O)CCCCCNCCC1CCCCC1 2230a_100000738074_100009817443 [0,0,1,1,0,0|2,0,0]=4 13866 B17R1.1311 NC(=O)CCCCCNCCC1CCCCC1 34a_100000738074_100009817443 [0,0,1,1,0,0|2,0,0]=4 13867 B17R1.1311 NC(=O)CCCCCOCCC1CCCCC1 34a_100000123541_100011209188 [0,0,1,1,0,0|2,0,0]=4 13868 B17R1.1311 NC(=O)CCCCCOCCC1CCCCC1 34a_100011217863_100009817443 [0,0,1,1,0,0|2,0,0]=4 13869 B17R1.1311 NC(=O)CCCCCOCCC1CCCCC1 7a_100000123541_100011273959 [0,0,1,1,0,0|2,0,0]=4 13870 B17R1.1311 NC(=O)CCCCCOCCC1CCCCC1 7a_100011217863_100009817443 [0,0,1,1,0,0|2,0,0]=4 13871 B17R1.1311 NC(=O)CCCCCSCCC1CCCCC1 62a_100009817443_100012355289 [0,0,1,1,0,0|2,0,0]=4 13872 B17R1.1311 NC(=O)CCCCCSCCC1CCCCC1 62a_100012355289_100009817443 [0,0,1,1,0,0|2,0,0]=4 13873 B17R1.1311 NC(=O)CCCCNCCCC1CCCCC1 34a_100000696515_100011713725 [0,0,1,1,0,0|2,0,0]=4 13874 B17R1.1311 NC(=O)CCCCOCCCC1CCCCC1 34a_100012022536_100011713725 [0,0,1,1,0,0|2,0,0]=4 13875 B17R1.1311 NC(=O)CCCCOCCCC1CCCCC1 7a_100012022536_100011713725 [0,0,1,1,0,0|2,0,0]=4 13876 B17R1.1311 NC(=O)CCCOCCCCC1CCCCC1 34a_100011215267_100102525003 [0,0,1,1,0,0|2,0,0]=4 13877 B17R1.1311 NC(=O)CCCOCCCCC1CCCCC1 7a_100011215267_100102525003 [0,0,1,1,0,0|2,0,0]=4 13878 B17R1.1311 NC(=O)OCCOCCCCC1CCCCC1 34a_100011215267_200011214921 [0,0,1,1,0,0|2,0,0]=4 13879 B17R1.1311 NC(=O)OCCOCCCCC1CCCCC1 7a_100011215267_200011214921 [0,0,1,1,0,0|2,0,0]=4 13880 B17R1.1311 O=C(O)COCCNCCCC1CCCCC1 269956a_100000700818_100011713725 [0,0,1,1,0,0|2,0,0]=4 13881 B17R1.1311 O=C([O-])CCCCCOCCC1CCCCC1 7a_100102619762_100011273959 [0,0,1,1,0,0|1,0,1]=4 13882 B17R1.1411 CCC1CCCC1NCCCCCNC(=O)C 269862a_200012022750_100000749056 [0,0,1,1,0,0|2,0,0]=4 13883 B17R1.1411 CCC1CCCC1NCCCCCNC(=O)C 270004a_200012022750_100000749056 [0,0,1,1,0,0|2,0,0]=4 13884 B17R1.1411 CCN1CCC[C@@H]1COCCCCOC(=O)C 34a_100011739246_100000033659 [0,0,1,1,0,0|2,0,0]=4 13885 B17R1.1411 CCN1CCC[C@@H]1COCCCCOC(=O)C 7a_100011739246_100000033659 [0,0,1,1,0,0|2,0,0]=4 13886 B17R1.1419 CC(=O)OCCCCCN1CCCCC1CO 2230a_100000210821_100009813381 [0,0,1,1,0,0|2,0,0]=4 13887 B17R1.1419 CC(=O)OCCCCCN1CCCCC1CO 269982a_100000210821_100000033007 [0,0,1,1,0,0|2,0,0]=4 13888 B17R1.1419 CC(=O)OCCCCCN1CCCCC1CO 34a_100000210821_100000033007 [0,0,1,1,0,0|2,0,0]=4 13889 B17R1.1419 CC(=O)OCCCCOC1CCCCC1CN 34a_100011216029_100000033659 [0,0,1,1,0,0|2,0,0]=4 13890 B17R1.1419 CCC1CCCCC1NCCCCNC(=O)C 269862a_200011368371_100000757040 [0,0,1,1,0,0|2,0,0]=4 13891 B17R1.1419 CCC1CCCCC1NCCCCNC(=O)C 270004a_200011368371_100000757040 [0,0,1,1,0,0|2,0,0]=4 13892 B17R1.1419 CCC1CCCCC1OCCCCCC(=O)N 34a_100000210738_100009817443 [0,0,1,1,0,0|2,0,0]=4 13893 B17R1.1419 CCC1CCCCC1OCCCCCC(=O)N 7a_100000210738_100009817443 [0,0,1,1,0,0|2,0,0]=4 13894 B17R1.1419 CCC1CCCCC1OCCCCOC(=O)C 34a_100000210738_100000033659 [0,0,1,1,0,0|1,0,0]=3 13895 B17R1.1419 CCC1CCCCC1OCCCCOC(=O)C 7a_100000210738_100000033659 [0,0,1,1,0,0|1,0,0]=3 13896 B17R1.1419 CCC1CCCCC1OCCCCSC(=O)C 34a_100000210738_200010402107 [0,0,1,1,0,0|1,1,0]=4 13897 B17R1.1419 CCC1CCCCC1OCCCCSC(=O)C 7a_100000210738_200010402107 [0,0,1,1,0,0|1,1,0]=4 13898 B17R1.1419 CCC1CCCCC1OCOCCOC(=O)C 34a_100000210738_100000076355 [0,0,1,1,0,0|2,0,0]=4 13899 B17R1.1419 CCC1CCCCN1CCCCCOC(=O)C 2230a_100000210034_100009813381 [0,0,1,1,0,0|1,0,0]=3 13900 B17R1.1419 CCC1CCCCN1CCCCCOC(=O)C 269982a_100000210034_100000033007 [0,0,1,1,0,0|1,0,0]=3 13901 B17R1.1419 CCC1CCCCN1CCCCCOC(=O)C 34a_100000210034_100000033007 [0,0,1,1,0,0|1,0,0]=3 13902 B17R1.1419 CCC1CCCCN1CCCNCOC(=O)C 34a_100011191702_100009813279 [0,0,1,1,0,0|2,0,0]=4 13903 B17R1.1419 CCC1CCCCN1CCNCCOC(=O)C 34a_100000755458_100009814007 [0,0,1,1,0,0|2,0,0]=4 13904 B17R1.1419 CCC1CCCCN1CCOCCOC(=O)C 2230a_100000210034_200000083610 [0,0,1,1,0,0|2,0,0]=4 13905 B17R1.1419 CCC1CCCCN1CCOCCOC(=O)C 269982a_100000210034_200000083610 [0,0,1,1,0,0|2,0,0]=4 13906 B17R1.1419 CCC1CCCCN1CCOCCOC(=O)C 34a_100000210034_200000083610 [0,0,1,1,0,0|2,0,0]=4 13907 B17R1.1419 CCN1CCCCC1CNCCCOC(=O)C 34a_100000754393_100000042594 [0,0,1,1,0,0|2,0,0]=4 13908 B17R1.1419 CCN1CCCCC1COCCCOC(=O)C 34a_100000225091_100000042594 [0,0,1,1,0,0|2,0,0]=4 13909 B17R1.1419 CCN1CCCCC1COCCCOC(=O)C 7a_100000225091_100000042594 [0,0,1,1,0,0|2,0,0]=4 13910 B17R1.1419 CC[C@H]1COCCN1CCCCCOC(=O)C 2230a_100016988097_100009813381 [0,0,1,1,0,0|2,0,0]=4 13911 B17R1.1419 CC[C@H]1COCCN1CCCCCOC(=O)C 269982a_100016988097_100000033007 [0,0,1,1,0,0|2,0,0]=4 13912 B17R1.1419 CC[C@H]1COCCN1CCCCCOC(=O)C 34a_100016988097_100000033007 [0,0,1,1,0,0|2,0,0]=4 13913 B17R1.1419 CN[C@@H]1CCCC[C@H]1OCCCCOC(=O)C 34a_100000708425_100000033659 [0,0,1,1,0,0|2,0,0]=4 13914 B17R1.1419 COC1CCCCC1NCCCCOC(=O)C 34a_100011208099_100000033659 [0,0,1,1,0,0|2,0,0]=4 13915 B17R1.1419 CO[C@H]1CCCC[C@@H]1OCCCCOC(=O)C 34a_200009815850_100000033659 [0,0,1,1,0,0|2,0,0]=4 13916 B17R1.1419 CO[C@H]1CCCC[C@@H]1OCCCCOC(=O)C 7a_200009815850_100000033659 [0,0,1,1,0,0|2,0,0]=4 13917 B17R1.1488 CCCCCN1CCCCC1CCNC(=O)C 2230a_200011221479_100000210326 [0,0,1,1,0,0|2,0,0]=4 13918 B17R1.1488 CCCCCN1CCCCC1CCNC(=O)C 269982a_200011221479_100000210215 [0,0,1,1,0,0|2,0,0]=4 13919 B17R1.1488 CCCCCN1CCCCC1CCNC(=O)C 34a_200011221479_100000718602 [0,0,1,1,0,0|2,0,0]=4 13920 B17R1.1488 COCCCC1CCCCN1CCOC(=O)C 269982a_100011804088_100009814007 [0,0,1,1,0,0|2,0,0]=4 13921 B17R1.1488 COCCCC1CCCCN1CCOC(=O)C 34a_100011804088_100009814007 [0,0,1,1,0,0|2,0,0]=4 13922 B17R1.1503 CCCCCC1CCCC1NCCCC(=O)N 269862a_100000739312_200000198059 [0,0,1,1,0,0|2,0,0]=4 13923 B17R1.1503 CCCCCC1CCCC1NCCNC(=O)C 269862a_100000209853_200000198059 [0,0,1,1,0,0|2,0,0]=4 13924 B17R1.1503 CCCCCC1CCCC1NCCSC(=O)C 269862a_100020647217_200000198059 [0,0,1,1,0,0|1,1,0]=4 13925 B17R1.4154 CCCCCCCN1CCCCC1CC(=O)N 2230a_100015184752_100000210681 [0,0,1,1,0,0|2,0,0]=4 13926 B17R1.4154 CCCCCCCN1CCCCC1CC(=O)N 269982a_100015184752_100000210681 [0,0,1,1,0,0|2,0,0]=4 13927 B17R1.4154 CCCCCCCN1CCCCC1CC(=O)N 34a_100015184752_100000210614 [0,0,1,1,0,0|2,0,0]=4 13928 B17R1.5251 CCCCCCCCCN1CCC[C@H]1C(=O)N 2230a_100000003125_100011214924 [0,0,1,1,0,0|2,0,0]=4 13929 B17R1.5251 CCCCCCCCCN1CCC[C@H]1C(=O)O 269956a_100000743916_100000210670 [0,0,1,1,0,0|1,0,0]=3 13930 B17R1.5251 CCCCCCCCCN1CCSC1C(=O)O 269956a_100000035718_100000210670 [0,0,1,1,0,0|2,0,0]=4 13931 B17R1.5251 CCCCCCCCCN1CSC[C@H]1C(=O)O 269956a_100000743924_100000210670 [0,0,1,1,0,0|2,0,0]=4 13932 B17R1.5251 CCCCCCCOC[C@H]1CCCN1C(=O)C 34a_100012242843_100000210614 [0,0,1,1,0,0|2,0,0]=4 13933 B17R1.5251 CCCCCCCOC[C@H]1CCCN1C(=O)C 7a_100012242843_100000210614 [0,0,1,1,0,0|2,0,0]=4 13934 B17R1.5251 O=C(O)[C@@H]1CCCN1CCCCCCCCO 269956a_100000743916_100000033203 [0,0,1,1,0,0|2,0,0]=4 13935 B17R1.5777 CCCCCCCN1CCCCCC1C(=O)O 269956a_100000758484_100000210614 [0,0,1,1,0,0|1,0,0]=3 13936 B17R1.5777 CCCCOCCN1CCCCCC1C(=O)O 269956a_100000758484_100000743108 [0,0,1,1,0,0|2,0,0]=4 13937 B17R1.5777 O=C(O)C1CCCCCN1CCCCCCF 269956a_100000758484_100015922095 [0,0,1,1,0,0|2,0,0]=4 13938 B17R1.5777 O=C(O)C1CCCCCN1CCCCCCO 269956a_100000758484_100000766143 [0,0,1,1,0,0|2,0,0]=4 13939 B17R1.7901 CCCCCCCCN1CCCCC1C(=O)N 2230a_100000181395_100000210759 [0,0,1,1,0,0|2,0,0]=4 13940 B17R1.7901 CCCCCCCCN1CCCCC1C(=O)N 269982a_100000181395_100000210759 [0,0,1,1,0,0|2,0,0]=4 13941 B17R1.7901 CCCCCCCCN1CCCCC1C(=O)N 34a_100000181395_100000210759 [0,0,1,1,0,0|2,0,0]=4 13942 B17R1.7901 CCCCCCCCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100000210759 [0,0,1,1,0,0|1,0,0]=3 13943 B17R1.7901 CCCCCCCCN1CCOC[C@@H]1C(=O)O 269956a_100016993156_100000210759 [0,0,1,1,0,0|2,0,0]=4 13944 B17R1.7901 CCCCCCCCN1CCSCC1C(=O)O 269956a_100011346106_100000210759 [0,0,1,1,0,0|2,0,0]=4 13945 B17R1.7901 CCCCCCCCN1CSCCC1C(=O)O 269956a_100015185162_100000210759 [0,0,1,1,0,0|2,0,0]=4 13946 B17R1.7901 CCCCCCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100000210614 [0,0,1,1,0,0|1,0,0]=3 13947 B17R1.7901 CCCCOCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100000743108 [0,0,1,1,0,0|2,0,0]=4 13948 B17R1.7901 COCCCCCCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100011998445 [0,0,1,1,0,0|2,0,0]=4 13949 B17R1.7901 O=C(O)[C@@H]1CCCC[C@H]1NCCCCCCF 269956a_100009816435_100015922095 [0,0,1,1,0,0|2,0,0]=4 13950 B17R1.7901 O=C(O)[C@@H]1CCCC[C@H]1NCCCCCCO 269956a_100009816435_100000766143 [0,0,1,1,0,0|2,0,0]=4 13951 B17R1.7901 O=C(O)[C@H]1CCCCN1CCCCCCCO 269956a_100000763471_100000760002 [0,0,1,1,0,0|2,0,0]=4 13952 B17R1.9279 CC(=O)NCCCCCCNCC1CCCC1 2230a_200011996284_100000740388 [0,0,1,1,0,0|2,0,0]=4 13953 B17R1.9279 CC(=O)NCCCCCCNCC1CCCC1 269862a_200011996284_100000746403 [0,0,1,1,0,0|2,0,0]=4 13954 B17R1.9279 CC(=O)NCCCCCCNCC1CCCC1 34a_200011996284_100000740388 [0,0,1,1,0,0|2,0,0]=4 13955 B17R1.9279 CC(=O)NCCCCCNCCC1CCCC1 2230a_200012022750_100000760354 [0,0,1,1,0,0|2,0,0]=4 13956 B17R1.9279 CC(=O)NCCCCCNCCC1CCCC1 34a_200012022750_100000760354 [0,0,1,1,0,0|2,0,0]=4 13957 B17R1.9279 CC(=O)NCCCCNCCCC1CCCC1 2230a_200011368371_100011713738 [0,0,1,1,0,0|2,0,0]=4 13958 B17R1.9279 CC(=O)NCCCCNCCCC1CCCC1 34a_200011368371_100011713738 [0,0,1,1,0,0|2,0,0]=4 13959 B17R1.9279 CC(=O)OCCCCCNCCC1CCCC1 2230a_100000739158_100009813381 [0,0,1,1,0,0|1,0,0]=3 13960 B17R1.9279 CC(=O)OCCCCCNCCC1CCCC1 34a_100000739158_100000033007 [0,0,1,1,0,0|1,0,0]=3 13961 B17R1.9279 CC(=O)OCCCCCOCCC1CCCC1 34a_100000749090_100000033007 [0,0,1,1,0,0|1,0,0]=3 13962 B17R1.9279 CC(=O)OCCCCCOCCC1CCCC1 7a_100000749090_100000033007 [0,0,1,1,0,0|1,0,0]=3 13963 B17R1.9279 CC(=O)OCCCCCOCCC1CCNC1 34a_100016987287_100000033007 [0,0,1,1,0,0|2,0,0]=4 13964 B17R1.9279 CC(=O)OCCCCCOCCC1CCOC1 34a_100011879284_100000033007 [0,0,1,1,0,0|2,0,0]=4 13965 B17R1.9279 CC(=O)OCCCCCSCCC1CCCC1 62a_100000033007_100000760354 [0,0,1,1,0,0|1,0,0]=3 13966 B17R1.9279 CC(=O)OCCCCCSCCC1CCCC1 62a_100000760354_100000033007 [0,0,1,1,0,0|1,0,0]=3 13967 B17R1.9279 CC(=O)OCCCCCSCCN1CCCC1 62a_100000033007_100000004467 [0,0,1,1,0,0|2,0,0]=4 13968 B17R1.9279 CC(=O)OCCCCCSCCN1CCCC1 62a_100000700749_100000033007 [0,0,1,1,0,0|2,0,0]=4 13969 B17R1.9279 CC(=O)OCCCCNCCCC1CCCC1 34a_100000736752_100000033659 [0,0,1,1,0,0|1,0,0]=3 13970 B17R1.9279 CC(=O)OCCCCNCCOC1CCCC1 34a_100000741755_100000033659 [0,0,1,1,0,0|2,0,0]=4 13971 B17R1.9279 CC(=O)OCCCCOCCCC1CCCC1 34a_100000073216_100011713738 [0,0,1,1,0,0|1,0,0]=3 13972 B17R1.9279 CC(=O)OCCCCOCCCC1CCCC1 34a_100011215328_100000033659 [0,0,1,1,0,0|1,0,0]=3 13973 B17R1.9279 CC(=O)OCCCCOCCCC1CCCC1 7a_100000073216_100011713738 [0,0,1,1,0,0|1,0,0]=3 13974 B17R1.9279 CC(=O)OCCCCOCCCC1CCCC1 7a_100011215328_100000033659 [0,0,1,1,0,0|1,0,0]=3 13975 B17R1.9279 CC(=O)OCCCCOCCCN1CCCC1 34a_100000073216_100016991639 [0,0,1,1,0,0|2,0,0]=4 13976 B17R1.9279 CC(=O)OCCCCOCCCN1CCCC1 7a_100000073216_100011445909 [0,0,1,1,0,0|2,0,0]=4 13977 B17R1.9279 CC(=O)OCCCCOCCNC1CCCC1 34a_200000200444_100000033659 [0,0,1,1,0,0|2,0,0]=4 13978 B17R1.9279 CC(=O)OCCCCOCCOC1CCCC1 34a_100000738311_100000033659 [0,0,1,1,0,0|2,0,0]=4 13979 B17R1.9279 CC(=O)OCCCCOCCOC1CCCC1 7a_100000738311_100000033659 [0,0,1,1,0,0|2,0,0]=4 13980 B17R1.9279 CC(=O)OCCCCSCCCC1CCCC1 62a_100000033659_100011713738 [0,0,1,1,0,0|1,0,0]=3 13981 B17R1.9279 CC(=O)OCCCCSCCCC1CCCC1 62a_100011713738_100000033659 [0,0,1,1,0,0|1,0,0]=3 13982 B17R1.9279 CC(=O)OCCCCSCCCN1CCCC1 62a_100000033659_100011445909 [0,0,1,1,0,0|2,0,0]=4 13983 B17R1.9279 CC(=O)OCCCCSCCCN1CCCC1 62a_100016991639_100000033659 [0,0,1,1,0,0|2,0,0]=4 13984 B17R1.9279 CC(=O)OCCCNCCCOC1CCCC1 34a_100000747560_100000042594 [0,0,1,1,0,0|2,0,0]=4 13985 B17R1.9279 CC(=O)OCCOCCNCCC1CCCC1 2230a_100000739158_200000083610 [0,0,1,1,0,0|2,0,0]=4 13986 B17R1.9279 CC(=O)OCCOCCNCCC1CCCC1 34a_100000739158_200000083610 [0,0,1,1,0,0|2,0,0]=4 13987 B17R1.9279 CC(=O)OCCOCCOCCC1CCCC1 34a_100000749090_200000083610 [0,0,1,1,0,0|2,0,0]=4 13988 B17R1.9279 CC(=O)OCCOCCOCCC1CCCC1 7a_100000749090_200000083610 [0,0,1,1,0,0|2,0,0]=4 13989 B17R1.9279 CC(=O)OCCOCCSCCC1CCCC1 62a_100000760354_200000083610 [0,0,1,1,0,0|2,0,0]=4 13990 B17R1.9279 CC(=O)OCCOCCSCCC1CCCC1 62a_200000083610_100000760354 [0,0,1,1,0,0|2,0,0]=4 13991 B17R1.9279 CC(=O)OCCOCNCCCC1CCCC1 34a_100000736752_100000076355 [0,0,1,1,0,0|2,0,0]=4 13992 B17R1.9279 CC(=O)OCCOCOCCCC1CCCC1 34a_100011215328_100000076355 [0,0,1,1,0,0|2,0,0]=4 13993 B17R1.9279 CC(=O)OCCOCSCCCC1CCCC1 62a_100000076355_100011713738 [0,0,1,1,0,0|2,0,0]=4 13994 B17R1.9279 CC(=O)OCCOCSCCCC1CCCC1 62a_100011713738_100000076355 [0,0,1,1,0,0|2,0,0]=4 13995 B17R1.9279 CC(=O)SCCCCCCNCC1CCCC1 269862a_100000704104_100000746403 [0,0,1,1,0,0|1,1,0]=4 13996 B17R1.9279 CC(=O)SCCCCNCCCC1CCCC1 2230a_100000736752_200010402107 [0,0,1,1,0,0|1,1,0]=4 13997 B17R1.9279 CC(=O)SCCCCNCCCC1CCCC1 34a_100000736752_200010402107 [0,0,1,1,0,0|1,1,0]=4 13998 B17R1.9279 CC(=O)SCCCCOCCCC1CCCC1 34a_100011215328_200010402107 [0,0,1,1,0,0|1,1,0]=4 13999 B17R1.9279 CC(=O)SCCCCOCCCC1CCCC1 7a_100011215328_200010402107 [0,0,1,1,0,0|1,1,0]=4 14000 B17R1.9279 CC(=O)SCCCCSCCCC1CCCC1 62a_100011713738_200010402107 [0,0,1,1,0,0|1,1,0]=4 14001 B17R1.9279 CC(=O)SCCCCSCCCC1CCCC1 62a_200010402107_100011713738 [0,0,1,1,0,0|1,1,0]=4 14002 B17R1.9279 NC(=O)CCCCCNCCCC1CCCC1 2230a_100000736752_100009817443 [0,0,1,1,0,0|2,0,0]=4 14003 B17R1.9279 NC(=O)CCCCCNCCCC1CCCC1 34a_100000736752_100009817443 [0,0,1,1,0,0|2,0,0]=4 14004 B17R1.9279 NC(=O)CCCCCOCCCC1CCCC1 34a_100000123541_100011713738 [0,0,1,1,0,0|2,0,0]=4 14005 B17R1.9279 NC(=O)CCCCCOCCCC1CCCC1 34a_100011215328_100009817443 [0,0,1,1,0,0|2,0,0]=4 14006 B17R1.9279 NC(=O)CCCCCOCCCC1CCCC1 7a_100000123541_100011713738 [0,0,1,1,0,0|2,0,0]=4 14007 B17R1.9279 NC(=O)CCCCCOCCCC1CCCC1 7a_100011215328_100009817443 [0,0,1,1,0,0|2,0,0]=4 14008 B17R1.9279 NC(=O)CCCCCSCCCC1CCCC1 62a_100009817443_100011713738 [0,0,1,1,0,0|2,0,0]=4 14009 B17R1.9279 NC(=O)CCCCCSCCCC1CCCC1 62a_100011713738_100009817443 [0,0,1,1,0,0|2,0,0]=4 14010 B17R1.9279 O=C([O-])CCCCCOCCCC1CCCC1 7a_100102619762_100011713738 [0,0,1,1,0,0|1,0,1]=4 14011 B17R1.11234 CC(=O)NCCCCCCNC1CCCC1C 269862a_200011996284_100000752053 [0,0,1,1,0,0|2,0,0]=4 14012 B17R1.11234 CC(=O)OCCCCCOCC1CCCN1C 34a_100000743107_100000033007 [0,0,1,1,0,0|2,0,0]=4 14013 B17R1.11234 CC(=O)OCCCCOCCC1CCCN1C 34a_100000073216_100000005710 [0,0,1,1,0,0|2,0,0]=4 14014 B17R1.11234 CC(=O)OCCCCOCCC1CCCN1C 34a_100011215177_100000033659 [0,0,1,1,0,0|2,0,0]=4 14015 B17R1.11234 CC(=O)OCCCCOCCC1CCCN1C 7a_100000073216_100000005710 [0,0,1,1,0,0|2,0,0]=4 14016 B17R1.11234 CC(=O)OCCCCOCCC1CCCN1C 7a_100011215177_100000033659 [0,0,1,1,0,0|2,0,0]=4 14017 B17R1.11234 CC(=O)OCCCCSCCC1CCCN1C 62a_100000005710_100000033659 [0,0,1,1,0,0|2,0,0]=4 14018 B17R1.11234 CC(=O)OCCCCSCCC1CCCN1C 62a_100000033659_100000005710 [0,0,1,1,0,0|2,0,0]=4 14019 B17R1.11234 CC(=O)SCCCCCCNC1CCCC1C 269862a_100000704104_100000752053 [0,0,1,1,0,0|1,1,0]=4 14020 B17R1.16233 NC(=O)CNC1CCCCCCCCCCC1 2230a_100011194316_100000747473 [0,0,1,1,0,0|2,0,0]=4 14021 B17R1.16233 NC(=O)CNC1CCCCCCCCCCC1 34a_100011194316_100000187820 [0,0,1,1,0,0|2,0,0]=4 14022 B17R1.16233 NC(=O)COC1CCCCCCCCCCC1 34a_100000211378_100000187820 [0,0,1,1,0,0|2,0,0]=4 14023 B17R1.16233 NC(=O)COC1CCCCCCCCCCC1 7a_100000211378_100000187820 [0,0,1,1,0,0|2,0,0]=4 14024 B17R1.16233 O=C([O-])CNC1CCCCCCCCCCC1 34a_100011194316_100020667443 [0,0,1,1,0,0|1,0,1]=4 14025 B17R1.16233 O=C([O-])COC1CCCCCCCCCCC1 34a_100000211378_100020667443 [0,0,1,1,0,0|1,0,1]=4 14026 B17R1.16345 CC(=O)NCCCNC1CCCCCCCC1 270004a_100000736810_100000038600 [0,0,1,1,0,0|2,0,0]=4 14027 B17R1.16345 CC(=O)OCCCCN1CCCCCCCC1 269982a_100000039187_100000033659 [0,0,1,1,0,0|1,0,0]=3 14028 B17R1.16345 CC(=O)OCCCCN1CCCCCCCC1 34a_100000039187_100000033659 [0,0,1,1,0,0|1,0,0]=3 14029 B17R1.16345 CC(=O)OCCOCN1CCCCCCCC1 269982a_100000039187_100000076355 [0,0,1,1,0,0|2,0,0]=4 14030 B17R1.16345 CC(=O)OCCOCN1CCCCCCCC1 34a_100000039187_100000076355 [0,0,1,1,0,0|2,0,0]=4 14031 B17R1.16345 CC(=O)SCCCCN1CCCCCCCC1 2230a_100000039187_200010402107 [0,0,1,1,0,0|1,1,0]=4 14032 B17R1.16345 CC(=O)SCCCCN1CCCCCCCC1 269982a_100000039187_200010402107 [0,0,1,1,0,0|1,1,0]=4 14033 B17R1.16345 CC(=O)SCCCCN1CCCCCCCC1 34a_100000039187_200010402107 [0,0,1,1,0,0|1,1,0]=4 14034 B17R1.16345 NC(=O)CCCCCN1CCCCCCCC1 2230a_100000039187_100009817443 [0,0,1,1,0,0|2,0,0]=4 14035 B17R1.16345 NC(=O)CCCCCN1CCCCCCCC1 269982a_100000039187_100009817443 [0,0,1,1,0,0|2,0,0]=4 14036 B17R1.16345 NC(=O)CCCCCN1CCCCCCCC1 34a_100000039187_100009817443 [0,0,1,1,0,0|2,0,0]=4 14037 B17R1.16345 NC(=O)CCCCNC1CCCCCCCC1 270004a_100000696515_100000038600 [0,0,1,1,0,0|2,0,0]=4 14038 B17R1.16396 NC(=O)CCCCCCCCCCN1CCC1 269982a_100000754969_200010167045 [0,0,1,1,0,0|2,0,0]=4 14039 B17R1.16477 NC(=O)CCCCCCCCCCNC1CC1 34a_100000212008_200010167045 [0,0,1,1,0,0|2,0,0]=4 14040 B17R1.16477 NC(=O)CCCCCCCCCCSC1CC1 62a_200010167045_100000211595 [0,0,1,1,0,0|2,0,0]=4 14041 B17R1.17889 CCCCCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000210326 [0,0,1,1,0,0|1,0,0]=3 14042 B17R1.17889 CCOCCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000210147 [0,0,1,1,0,0|2,0,0]=4 14043 B17R1.17889 CCSCCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000757381 [0,0,1,1,0,0|2,0,0]=4 14044 B17R1.17889 COCCCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000740836 [0,0,1,1,0,0|2,0,0]=4 14045 B17R1.17889 O=C(O)[C@H]1CCCCCC[C@H]1NCCCCF 269956a_200049070474_100000729493 [0,0,1,1,0,0|2,0,0]=4 14046 B17R1.17889 O=C(O)[C@H]1CCCCCC[C@H]1NCCCCO 269956a_200049070474_100000210776 [0,0,1,1,0,0|2,0,0]=4 14047 B17R1.25267 CCCCCCCCCN1CCCNC(=O)C1 2230a_100015190381_100011214924 [0,0,1,1,0,0|2,0,0]=4 14048 B17R1.26240 CC(=O)CCCCOCC1CCCCCCC1 34a_100011216312_100009817362 [0,0,1,1,0,0|2,0,0]=4 14049 B17R1.26240 CC(=O)CCCCOCC1CCCCCCC1 7a_100011216312_100000735457 [0,0,1,1,0,0|2,0,0]=4 14050 B17R1.26240 CC(=O)CCCNCCC1CCCCCCC1 34a_100011532352_100000685027 [0,0,1,1,0,0|2,0,0]=4 14051 B17R1.26240 CC(=O)NCCCCNC1CCCCCCC1 270004a_200011368371_100000210524 [0,0,1,1,0,0|2,0,0]=4 14052 B17R1.26240 CC(=O)NCCNCCC1CCCCCCC1 2230a_100011532352_100000189650 [0,0,1,1,0,0|2,0,0]=4 14053 B17R1.26240 CC(=O)OCCCCCN1CCCCCCC1 2230a_100000211400_100009813381 [0,0,1,1,0,0|1,0,0]=3 14054 B17R1.26240 CC(=O)OCCCCCN1CCCCCCC1 269982a_100000211400_100000033007 [0,0,1,1,0,0|1,0,0]=3 14055 B17R1.26240 CC(=O)OCCCCCN1CCCCCCC1 34a_100000211400_100000033007 [0,0,1,1,0,0|1,0,0]=3 14056 B17R1.26240 CC(=O)OCCCCNC1CCCCCCC1 34a_100000211152_100000033659 [0,0,1,1,0,0|1,0,0]=3 14057 B17R1.26240 CC(=O)OCCCCOC1CCCCCCC1 34a_100000210054_100000033659 [0,0,1,1,0,0|1,0,0]=3 14058 B17R1.26240 CC(=O)OCCCCOC1CCCCCCC1 7a_100000210054_100000033659 [0,0,1,1,0,0|1,0,0]=3 14059 B17R1.26240 CC(=O)OCCCOCC1CCCCCCC1 34a_100011216312_100000042594 [0,0,1,1,0,0|1,0,0]=3 14060 B17R1.26240 CC(=O)OCCCOCC1CCCCCCC1 7a_100011216312_100000042594 [0,0,1,1,0,0|1,0,0]=3 14061 B17R1.26240 CC(=O)OCCNCCC1CCCCCCC1 34a_100011532352_100009814007 [0,0,1,1,0,0|1,0,0]=3 14062 B17R1.26240 CC(=O)OCCOCCN1CCCCCCC1 2230a_100000211400_200000083610 [0,0,1,1,0,0|2,0,0]=4 14063 B17R1.26240 CC(=O)OCCOCCN1CCCCCCC1 269982a_100000211400_200000083610 [0,0,1,1,0,0|2,0,0]=4 14064 B17R1.26240 CC(=O)OCCOCCN1CCCCCCC1 34a_100000211400_200000083610 [0,0,1,1,0,0|2,0,0]=4 14065 B17R1.26240 CC(=O)OCCOCNC1CCCCCCC1 34a_100000211152_100000076355 [0,0,1,1,0,0|2,0,0]=4 14066 B17R1.26240 CC(=O)OCCOCOC1CCCCCCC1 34a_100000210054_100000076355 [0,0,1,1,0,0|2,0,0]=4 14067 B17R1.26240 CC(=O)SCCCCNC1CCCCCCC1 2230a_100000211152_200010402107 [0,0,1,1,0,0|1,1,0]=4 14068 B17R1.26240 CC(=O)SCCCCNC1CCCCCCC1 34a_100000211152_200010402107 [0,0,1,1,0,0|1,1,0]=4 14069 B17R1.26240 CC(=O)SCCCCOC1CCCCCCC1 34a_100000210054_200010402107 [0,0,1,1,0,0|1,1,0]=4 14070 B17R1.26240 CC(=O)SCCCCOC1CCCCCCC1 7a_100000210054_200010402107 [0,0,1,1,0,0|1,1,0]=4 14071 B17R1.26240 CC(=O)SCCCOCC1CCCCCCC1 34a_100011216312_100000038929 [0,0,1,1,0,0|1,1,0]=4 14072 B17R1.26240 CC(=O)SCCCOCC1CCCCCCC1 7a_100011216312_100000038929 [0,0,1,1,0,0|1,1,0]=4 14073 B17R1.26240 CC(=S)OCCCOCC1CCCCCCC1 34a_100011216312_200135323944 [0,0,1,1,0,0|1,1,0]=4 14074 B17R1.26240 CC(=S)OCCCOCC1CCCCCCC1 7a_100011216312_200135323944 [0,0,1,1,0,0|1,1,0]=4 14075 B17R1.26240 NC(=O)CCCCCNC1CCCCCCC1 2230a_100000211152_100009817443 [0,0,1,1,0,0|2,0,0]=4 14076 B17R1.26240 NC(=O)CCCCCNC1CCCCCCC1 34a_100000211152_100009817443 [0,0,1,1,0,0|2,0,0]=4 14077 B17R1.26240 NC(=O)CCCCCOC1CCCCCCC1 34a_100000210054_100009817443 [0,0,1,1,0,0|2,0,0]=4 14078 B17R1.26240 NC(=O)CCCCCOC1CCCCCCC1 7a_100000210054_100009817443 [0,0,1,1,0,0|2,0,0]=4 14079 B17R1.26240 NC(=O)CCCNCCC1CCCCCCC1 34a_100011532352_100102525003 [0,0,1,1,0,0|2,0,0]=4 14080 B17R1.26240 NC(=O)OCCNCCC1CCCCCCC1 34a_100011532352_200011214921 [0,0,1,1,0,0|2,0,0]=4 14081 B17R1.29093 CCCCCCCCCCCCCOC1CC1 34a_100000185773_100000211595 [0,0,1,1,0,0|1,0,1]=4 14082 B17R1.29200 CCCCCCCCCCN1CCC1C(=O)O 269956a_100000021838_100000210320 [0,0,1,1,0,0|1,0,0]=3 14083 B17R1.29200 O=C(O)C1CCN1CCCCCCCCCO 269956a_100000021838_100009813782 [0,0,1,1,0,0|2,0,0]=4 14084 B17R1.103159 CC(=O)CCCCNCCC1CCCCCC1 34a_100011532351_100009817362 [0,0,1,1,0,0|2,0,0]=4 14085 B17R1.103159 CC(=O)NCCCCCNC1CCCCCC1 270004a_200012022750_100000210131 [0,0,1,1,0,0|2,0,0]=4 14086 B17R1.103159 CC(=O)NCCCCCNC1CCCCCC1 34a_200012022750_100011217769 [0,0,1,1,0,0|2,0,0]=4 14087 B17R1.103159 CC(=O)NCCCCNCC1CCCCCC1 2230a_200011368371_200000696569 [0,0,1,1,0,0|2,0,0]=4 14088 B17R1.103159 CC(=O)NCCCCNCC1CCCCCC1 269862a_200011368371_200000763224 [0,0,1,1,0,0|2,0,0]=4 14089 B17R1.103159 CC(=O)NCCCCNCC1CCCCCC1 34a_200011368371_200000696569 [0,0,1,1,0,0|2,0,0]=4 14090 B17R1.103159 CC(=O)OCCCCCNC1CCCCCC1 2230a_100000210984_100009813381 [0,0,1,1,0,0|1,0,0]=3 14091 B17R1.103159 CC(=O)OCCCCCNC1CCCCCC1 34a_100000210984_100000033007 [0,0,1,1,0,0|1,0,0]=3 14092 B17R1.103159 CC(=O)OCCCCCOC1CCCCCC1 34a_100000210887_100000033007 [0,0,1,1,0,0|1,0,0]=3 14093 B17R1.103159 CC(=O)OCCCCCOC1CCCCCC1 7a_100000210887_100000033007 [0,0,1,1,0,0|1,0,0]=3 14094 B17R1.103159 CC(=O)OCCCCCSC1CCCCCC1 62a_100000033007_100011217769 [0,0,1,1,0,0|1,0,0]=3 14095 B17R1.103159 CC(=O)OCCCCCSC1CCCCCC1 62a_100011217769_100000033007 [0,0,1,1,0,0|1,0,0]=3 14096 B17R1.103159 CC(=O)OCCCCNCC1CCCCCC1 34a_100015204231_100000033659 [0,0,1,1,0,0|1,0,0]=3 14097 B17R1.103159 CC(=O)OCCCCOCC1CCCCCC1 34a_100000073216_200000696569 [0,0,1,1,0,0|1,0,0]=3 14098 B17R1.103159 CC(=O)OCCCCOCC1CCCCCC1 34a_100000699130_100000033659 [0,0,1,1,0,0|1,0,0]=3 14099 B17R1.103159 CC(=O)OCCCCOCC1CCCCCC1 7a_100000073216_200000696569 [0,0,1,1,0,0|1,0,0]=3 14100 B17R1.103159 CC(=O)OCCCCOCC1CCCCCC1 7a_100000699130_100000033659 [0,0,1,1,0,0|1,0,0]=3 14101 B17R1.103159 CC(=O)OCCCCSCC1CCCCCC1 62a_100000033659_200000696569 [0,0,1,1,0,0|1,0,0]=3 14102 B17R1.103159 CC(=O)OCCCCSCC1CCCCCC1 62a_200000696569_100000033659 [0,0,1,1,0,0|1,0,0]=3 14103 B17R1.103159 CC(=O)OCCCNCCC1CCCCCC1 34a_100011532351_100000042594 [0,0,1,1,0,0|1,0,0]=3 14104 B17R1.103159 CC(=O)OCCCOCCN1CCCCCC1 34a_100000238007_100000042594 [0,0,1,1,0,0|2,0,0]=4 14105 B17R1.103159 CC(=O)OCCCSCCN1CCCCCC1 62a_100000042594_100000722644 [0,0,1,1,0,0|2,0,0]=4 14106 B17R1.103159 CC(=O)OCCCSCCN1CCCCCC1 62a_100000722644_100000042594 [0,0,1,1,0,0|2,0,0]=4 14107 B17R1.103159 CC(=O)OCCOCCCN1CCCCCC1 34a_100102886287_100009814007 [0,0,1,1,0,0|2,0,0]=4 14108 B17R1.103159 CC(=O)OCCOCCCN1CCCCCC1 7a_100102886287_100009814007 [0,0,1,1,0,0|2,0,0]=4 14109 B17R1.103159 CC(=O)OCCOCCNC1CCCCCC1 2230a_100000210984_200000083610 [0,0,1,1,0,0|2,0,0]=4 14110 B17R1.103159 CC(=O)OCCOCCNC1CCCCCC1 34a_100000210984_200000083610 [0,0,1,1,0,0|2,0,0]=4 14111 B17R1.103159 CC(=O)OCCOCCOC1CCCCCC1 34a_100000210887_200000083610 [0,0,1,1,0,0|2,0,0]=4 14112 B17R1.103159 CC(=O)OCCOCCOC1CCCCCC1 7a_100000210887_200000083610 [0,0,1,1,0,0|2,0,0]=4 14113 B17R1.103159 CC(=O)OCCOCCSC1CCCCCC1 62a_100011217769_200000083610 [0,0,1,1,0,0|2,0,0]=4 14114 B17R1.103159 CC(=O)OCCOCCSC1CCCCCC1 62a_200000083610_100011217769 [0,0,1,1,0,0|2,0,0]=4 14115 B17R1.103159 CC(=O)OCCOCNCC1CCCCCC1 34a_100015204231_100000076355 [0,0,1,1,0,0|2,0,0]=4 14116 B17R1.103159 CC(=O)OCCOCOCC1CCCCCC1 34a_100000699130_100000076355 [0,0,1,1,0,0|2,0,0]=4 14117 B17R1.103159 CC(=O)OCCOCSCC1CCCCCC1 62a_100000076355_200000696569 [0,0,1,1,0,0|2,0,0]=4 14118 B17R1.103159 CC(=O)OCCOCSCC1CCCCCC1 62a_200000696569_100000076355 [0,0,1,1,0,0|2,0,0]=4 14119 B17R1.103159 CC(=O)OCOCCCCN1CCCCCC1 34a_100011305542_100009813279 [0,0,1,1,0,0|2,0,0]=4 14120 B17R1.103159 CC(=O)SCCCCNCC1CCCCCC1 2230a_100015204231_200010402107 [0,0,1,1,0,0|1,1,0]=4 14121 B17R1.103159 CC(=O)SCCCCNCC1CCCCCC1 34a_100015204231_200010402107 [0,0,1,1,0,0|1,1,0]=4 14122 B17R1.103159 CC(=O)SCCCCOCC1CCCCCC1 34a_100000699130_200010402107 [0,0,1,1,0,0|1,1,0]=4 14123 B17R1.103159 CC(=O)SCCCCOCC1CCCCCC1 7a_100000699130_200010402107 [0,0,1,1,0,0|1,1,0]=4 14124 B17R1.103159 CC(=O)SCCCCSCC1CCCCCC1 62a_200000696569_200010402107 [0,0,1,1,0,0|1,1,0]=4 14125 B17R1.103159 CC(=O)SCCCCSCC1CCCCCC1 62a_200010402107_200000696569 [0,0,1,1,0,0|1,1,0]=4 14126 B17R1.103159 CC(=O)SCCCNCCC1CCCCCC1 2230a_100011532351_100000038929 [0,0,1,1,0,0|1,1,0]=4 14127 B17R1.103159 CC(=O)SCCCNCCC1CCCCCC1 34a_100011532351_100000038929 [0,0,1,1,0,0|1,1,0]=4 14128 B17R1.103159 CC(=S)OCCCNCCC1CCCCCC1 2230a_100011532351_200135323944 [0,0,1,1,0,0|1,1,0]=4 14129 B17R1.103159 CC(=S)OCCCNCCC1CCCCCC1 34a_100011532351_200135323944 [0,0,1,1,0,0|1,1,0]=4 14130 B17R1.103159 NC(=O)CCCCCNCC1CCCCCC1 2230a_100015204231_100009817443 [0,0,1,1,0,0|2,0,0]=4 14131 B17R1.103159 NC(=O)CCCCCNCC1CCCCCC1 34a_100015204231_100009817443 [0,0,1,1,0,0|2,0,0]=4 14132 B17R1.103159 NC(=O)CCCCCOCC1CCCCCC1 34a_100000123541_200000696569 [0,0,1,1,0,0|2,0,0]=4 14133 B17R1.103159 NC(=O)CCCCCOCC1CCCCCC1 34a_100000699130_100009817443 [0,0,1,1,0,0|2,0,0]=4 14134 B17R1.103159 NC(=O)CCCCCOCC1CCCCCC1 7a_100000123541_200000696569 [0,0,1,1,0,0|2,0,0]=4 14135 B17R1.103159 NC(=O)CCCCCOCC1CCCCCC1 7a_100000699130_100009817443 [0,0,1,1,0,0|2,0,0]=4 14136 B17R1.103159 NC(=O)CCCCCSCC1CCCCCC1 62a_100009817443_200000696569 [0,0,1,1,0,0|2,0,0]=4 14137 B17R1.103159 NC(=O)CCCCCSCC1CCCCCC1 62a_200000696569_100009817443 [0,0,1,1,0,0|2,0,0]=4 14138 B17R1.103159 O=C([O-])CCCCCOCC1CCCCCC1 7a_100102619762_200000696569 [0,0,1,1,0,0|1,0,1]=4 14139 B17R1.315 C=CCCCCCCCN1CCCCC1CO 2230a_100000210821_100012355270 [0,0,1,1,0,0|2,0,0]=4 14140 B17R1.315 C=CCCCCCCCN1CCCCC1CO 269982a_100000210821_100012355270 [0,0,1,1,0,0|2,0,0]=4 14141 B17R1.315 C=CCCCCCCCN1CCCCC1CO 34a_100000210821_100012355270 [0,0,1,1,0,0|2,0,0]=4 14142 B17R1.315 O=CCCCCNCCN1CCCCC1CO 2230a_100011473795_100000139335 [0,0,1,1,0,0|2,0,0]=4 14143 B17R1.1242 C=CCCCCCCCCOC1CCCCO1 34a_100000033831_100011933949 [0,0,1,1,0,0|2,0,0]=4 14144 B17R1.1242 C=CCCCCCCCNCC1CCCCO1 2230a_100000174945_100012355270 [0,0,1,1,0,0|2,0,0]=4 14145 B17R1.1242 C=CCCCCCCCNCC1CCCCO1 34a_100000174945_100012355270 [0,0,1,1,0,0|2,0,0]=4 14146 B17R1.1242 C=CCCCCCCCOCC1CCCCO1 34a_100000211370_100012355270 [0,0,1,1,0,0|2,0,0]=4 14147 B17R1.1242 C=CCCCCCCCOCC1CCCCO1 34a_100000730831_100000211543 [0,0,1,1,0,0|2,0,0]=4 14148 B17R1.1242 C=CCCCCCCCOCC1CCCCO1 7a_100000211370_100012355270 [0,0,1,1,0,0|2,0,0]=4 14149 B17R1.1242 C=CCCCCCCCOCC1CCCCO1 7a_100000730831_100000211543 [0,0,1,1,0,0|2,0,0]=4 14150 B17R1.1242 C=CCCCCCCCSCC1CCCCO1 62a_100000211543_100012355270 [0,0,1,1,0,0|2,0,0]=4 14151 B17R1.1242 C=CCCCCCCCSCC1CCCCO1 62a_100012355270_100000211543 [0,0,1,1,0,0|2,0,0]=4 14152 B17R1.1242 C=CCCCCCCNCCC1CCCCO1 2230a_100015183643_100011215473 [0,0,1,1,0,0|2,0,0]=4 14153 B17R1.1242 C=CCCCCCCNCCC1CCCCO1 34a_100015183643_100011215473 [0,0,1,1,0,0|2,0,0]=4 14154 B17R1.1242 C=COCCCCOCCCC1CCCCC1 34a_100000031558_100011713725 [0,0,1,1,0,0|2,0,0]=4 14155 B17R1.1242 C=COCCCCOCCCC1CCCCC1 7a_100000031558_100011713725 [0,0,1,1,0,0|2,0,0]=4 14156 B17R1.1242 O=CCCCCCNCCCC1CCCCC1 2230a_100011211642_100000139337 [0,0,1,1,0,0|2,0,0]=4 14157 B17R1.1242 O=CCCCCCOCCCC1CCCCC1 7a_100000198086_100000139337 [0,0,1,1,0,0|2,0,0]=4 14158 B17R1.1242 O=CCCCCCOCCOC1CCCCO1 7a_100000034223_100000139337 [0,0,1,1,0,0|2,0,0]=4 14159 B17R1.1242 O=CCCCCCSCCCC1CCCCC1 62a_100000139337_100011713725 [0,0,1,1,0,0|2,0,0]=4 14160 B17R1.1242 O=CCCCCCSCCCC1CCCCC1 62a_100011713725_100000139337 [0,0,1,1,0,0|2,0,0]=4 14161 B17R1.1242 O=CCCCCCSCCOC1CCCCO1 62a_100000139337_100000744793 [0,0,1,1,0,0|2,0,0]=4 14162 B17R1.1242 O=CCCCCCSCCOC1CCCCO1 62a_100000744793_100000139337 [0,0,1,1,0,0|2,0,0]=4 14163 B17R1.1242 O=CCCCCOCCCCC1CCCCC1 7a_100011215267_100000139335 [0,0,1,1,0,0|2,0,0]=4 14164 B17R1.1242 O=CCCCCSCCCOC1CCCCO1 62a_100000139335_100000700653 [0,0,1,1,0,0|2,0,0]=4 14165 B17R1.1242 O=CCCCCSCCCOC1CCCCO1 62a_100000700653_100000139335 [0,0,1,1,0,0|2,0,0]=4 14166 B17R1.1242 O=CCCCSCCCCOC1CCCCO1 62a_100000031530_200011292268 [0,0,1,1,0,0|2,0,0]=4 14167 B17R1.1242 O=CCCCSCCCCOC1CCCCO1 62a_200011292268_100000031530 [0,0,1,1,0,0|2,0,0]=4 14168 B17R1.1242 O=CCSCCCCCCOC1CCCCO1 62a_100000033462_200015260668 [0,0,1,1,0,0|2,0,0]=4 14169 B17R1.1242 O=CCSCCCCCCOC1CCCCO1 62a_200015260668_100000033462 [0,0,1,1,0,0|2,0,0]=4 14170 B17R1.1242 OCCCCCCCCCNC1C=CCCC1 2230a_100000078944_100000751183 [0,0,1,1,0,0|2,0,0]=4 14171 B17R1.1242 OCCCCCCCCCOC1C=CCCC1 34a_100011215024_100009813782 [0,0,1,1,0,0|2,0,0]=4 14172 B17R1.1242 OCCCCCCCCCSC1C=CCCC1 62a_100000751183_100009813782 [0,0,1,1,0,0|2,0,0]=4 14173 B17R1.1242 OCCCCCCCCCSC1C=CCCC1 62a_100009813782_100000751183 [0,0,1,1,0,0|2,0,0]=4 14174 B17R1.1450 C=CCCCCCCCOC1CCCCC1O 34a_100000730831_100000038908 [0,0,1,1,0,0|2,0,0]=4 14175 B17R1.1450 C=CCCCCCCCSC1CCCCC1O 62a_100000038908_100012355270 [0,0,1,1,0,0|2,0,0]=4 14176 B17R1.1450 C=CCCCCCCCSC1CCCCC1O 62a_100012355270_100000038908 [0,0,1,1,0,0|2,0,0]=4 14177 B17R1.1450 C=CCCCCCCNCC1CCCCC1O 34a_100011216029_100011215473 [0,0,1,1,0,0|2,0,0]=4 14178 B17R1.1450 CCCCCCCCCNC1CCCCC1=O 34a_100000212291_100000754470 [0,0,1,1,0,0|2,0,0]=4 14179 B17R1.1450 CCCCCCCCCNC1CCCNC1=O 2230a_100000212291_100000687798 [0,0,1,1,0,0|2,0,0]=4 14180 B17R1.1450 CCCCCCCCCNC1CCCNC1=O 2230a_100000747585_100011214924 [0,0,1,1,0,0|2,0,0]=4 14181 B17R1.1450 CCCCCCCCCNC1CCCNC1=O 34a_100000212291_100000687798 [0,0,1,1,0,0|2,0,0]=4 14182 B17R1.1450 CCCCCCCCCNC1CCCNC1=O 34a_100000747585_100011214924 [0,0,1,1,0,0|2,0,0]=4 14183 B17R1.1450 CCCCCCCCCOC1CCCCC1=O 34a_100000210712_100000754470 [0,0,1,1,0,0|2,0,0]=4 14184 B17R1.1450 CCCCCCCCCOC1CCCCC1=O 34a_100011214950_100011214924 [0,0,1,1,0,0|2,0,0]=4 14185 B17R1.1450 CCCCCCCCCOC1CCCCC1=O 7a_100000210712_100000204591 [0,0,1,1,0,0|2,0,0]=4 14186 B17R1.1450 CCCCCCCCCOC1CCCNC1=O 34a_100000073722_100011214924 [0,0,1,1,0,0|2,0,0]=4 14187 B17R1.1450 CCCCCCCCCOC1CCCNC1=O 34a_100000210712_100000687798 [0,0,1,1,0,0|2,0,0]=4 14188 B17R1.1450 CCCCCCCCCOC1CCCNC1=O 7a_100000210712_100000687798 [0,0,1,1,0,0|2,0,0]=4 14189 B17R1.1450 CCCCCCCCCSC1CCCCC1=O 62a_100000204591_100000210670 [0,0,1,1,0,0|2,0,0]=4 14190 B17R1.1450 CCCCCCCCCSC1CCCNC1=O 62a_100000687798_100000210670 [0,0,1,1,0,0|2,0,0]=4 14191 B17R1.1450 CCCCCCCCOCC1CCCCC1=O 34a_100009861125_100000210759 [0,0,1,1,0,0|2,0,0]=4 14192 B17R1.1450 CCCCCCCCOCC1CCCCC1=O 7a_100009861125_100000210759 [0,0,1,1,0,0|2,0,0]=4 14193 B17R1.1450 NCCCCCCCCOC1CCCCC1=O 34a_102515433106_100000754470 [0,0,1,1,0,0|2,0,0]=4 14194 B17R1.1450 O=C1CCCCC1COCCCCCCCO 34a_100009861125_100000760002 [0,0,1,1,0,0|1,0,0]=3 14195 B17R1.1450 O=C1CCCCC1COCCCCCCCO 7a_100009861125_100000760002 [0,0,1,1,0,0|1,0,0]=3 14196 B17R1.1450 O=C1CCCCC1NCCCCCCCCO 34a_102515433106_100000754470 [0,0,1,1,0,0|1,0,0]=3 14197 B17R1.1450 O=C1CCCCC1OCCCCCCCCBr 34a_100009813846_100000754470 [0,0,1,1,0,0|2,0,0]=4 14198 B17R1.1450 O=C1CCCCC1OCCCCCCCCBr 7a_100009813846_100000204591 [0,0,1,1,0,0|2,0,0]=4 14199 B17R1.1450 O=C1CCCCC1OCCCCCCCCCl 34a_100000033203_100000754470 [0,0,1,1,0,0|2,0,0]=4 14200 B17R1.1450 O=C1CCCCC1OCCCCCCCCCl 7a_100000033203_100000204591 [0,0,1,1,0,0|2,0,0]=4 14201 B17R1.1450 O=C1CCCCC1OCCCCCCCCO 34a_100011214950_100000033203 [0,0,1,1,0,0|1,0,0]=3 14202 B17R1.1450 O=C1CCCCC1SCCCCCCCCO 62a_100000033203_100000204591 [0,0,1,1,0,0|1,0,0]=3 14203 B17R1.1450 O=C1CCCCC1SCCCCCCCCO 62a_100000204591_100000033203 [0,0,1,1,0,0|1,0,0]=3 14204 B17R1.1450 O=C1CCCCN1CCNCCCCCCO 2230a_100160573077_100000766143 [0,0,1,1,0,0|2,0,0]=4 14205 B17R1.1450 O=C1CCCCN1CCNCCCCCCO 34a_100160573077_100000766143 [0,0,1,1,0,0|2,0,0]=4 14206 B17R1.1450 O=C1CCOCC1NCCCCCCCCO 34a_102515433106_100012180262 [0,0,1,1,0,0|2,0,0]=4 14207 B17R1.1450 O=C1CCOCC1SCCCCCCCCO 62a_100000033203_100012180262 [0,0,1,1,0,0|2,0,0]=4 14208 B17R1.1450 O=C1CCOCC1SCCCCCCCCO 62a_100012180262_100000033203 [0,0,1,1,0,0|2,0,0]=4 14209 B17R1.1450 O=C1NCCCC1NCCCCCCCCO 2230a_100000747585_100000033203 [0,0,1,1,0,0|2,0,0]=4 14210 B17R1.1450 O=C1NCCCC1NCCCCCCCCO 2230a_102515433106_100000687798 [0,0,1,1,0,0|2,0,0]=4 14211 B17R1.1450 O=C1NCCCC1NCCCCCCCCO 34a_100000747585_100000033203 [0,0,1,1,0,0|2,0,0]=4 14212 B17R1.1450 O=C1NCCCC1NCCCCCCCCO 34a_102515433106_100000687798 [0,0,1,1,0,0|2,0,0]=4 14213 B17R1.1450 O=C1NCCCC1OCCCCCCCCO 34a_100000073722_100000033203 [0,0,1,1,0,0|2,0,0]=4 14214 B17R1.1450 O=C1NCCCC1SCCCCCCCCO 62a_100000033203_100000687798 [0,0,1,1,0,0|2,0,0]=4 14215 B17R1.1450 O=C1NCCCC1SCCCCCCCCO 62a_100000687798_100000033203 [0,0,1,1,0,0|2,0,0]=4 14216 B17R1.1451 C=CCCCCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100011933949 [0,0,1,1,0,0|2,0,0]=4 14217 B17R1.1451 C=CCCCCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100011933949 [0,0,1,1,0,0|2,0,0]=4 14218 B17R1.1451 C=CCCCCCCCCN1CCC[C@@H]1CO 34a_100000745186_100011933949 [0,0,1,1,0,0|2,0,0]=4 14219 B17R1.4155 C=CCCCCCN1CCCCC1CCCO 2230a_100011934581_100000700193 [0,0,1,1,0,0|2,0,0]=4 14220 B17R1.4155 C=CCCCCCN1CCCCC1CCCO 269982a_100011934581_100000700193 [0,0,1,1,0,0|2,0,0]=4 14221 B17R1.4155 C=CCCCCCN1CCCCC1CCCO 34a_100011934581_100000700193 [0,0,1,1,0,0|2,0,0]=4 14222 B17R1.4155 O=CCCCCCN1CCCCC1CCCO 2230a_100011934581_100000139337 [0,0,1,1,0,0|1,0,0]=3 14223 B17R1.4155 O=CCCCCCN1CCCCC1CCCO 269982a_100011934581_100000139337 [0,0,1,1,0,0|1,0,0]=3 14224 B17R1.4166 C=COCCCNC1CCCC1CCCCC 269862a_100000210767_200000198059 [0,0,1,1,0,0|2,0,0]=4 14225 B17R1.4166 C=COCCCNC1CCCC1CCCCC 270004a_100000210767_200000198059 [0,0,1,1,0,0|2,0,0]=4 14226 B17R1.10640 C=CCC1CCCCC1NCCCCCCO 269862a_100000686447_100011214939 [0,0,1,1,0,0|2,0,0]=4 14227 B17R1.10640 C=CCC1CCCCC1NCCCCCCO 270004a_100000686447_100011214939 [0,0,1,1,0,0|2,0,0]=4 14228 B17R1.10640 C=CCCCCCCN1CCCCC1CCO 2230a_100000211664_100011215473 [0,0,1,1,0,0|2,0,0]=4 14229 B17R1.10640 C=CCCCCCCN1CCCCC1CCO 269982a_100000211664_100011215473 [0,0,1,1,0,0|2,0,0]=4 14230 B17R1.10640 C=CCCCCCCN1CCCCC1CCO 34a_100000211664_100011215473 [0,0,1,1,0,0|2,0,0]=4 14231 B17R1.10640 CCCC1CCCCC1OCCCCCC=O 7a_100011217265_100000139337 [0,0,1,1,0,0|2,0,0]=4 14232 B17R1.25275 O=CCCCCCOCC1CCCCCCC1 7a_100011216312_100000139337 [0,0,1,1,0,0|2,0,0]=4 14233 B17R1.25275 O=CCCCCNCCC1CCCCCCC1 2230a_100011532352_100000139335 [0,0,1,1,0,0|2,0,0]=4 14234 B17R1.25275 OCCCCCCCOC1C=CCCCCC1 34a_100000688657_100000760002 [0,0,1,1,0,0|2,0,0]=4 14235 B17R1.1515 CCCCC(=O)NCCCN1CCCCC1C 240690a_100000212276_100000210183 [0,0,1,1,0,0|2,0,0]=4 14236 B17R1.1515 CCCCC(=O)NCCCN1CCCCC1C 527a_100000212276_100000210183 [0,0,1,1,0,0|2,0,0]=4 14237 B17R1.1515 CCCNC(=O)CCCNC1CCCCC1C 2230a_100000211402_100011194427 [0,0,1,1,0,0|2,0,0]=4 14238 B17R1.1515 CCCNC(=O)CCCOC1CCCCC1C 7a_100000211207_100011194427 [0,0,1,1,0,0|2,0,0]=4 14239 B17R1.1515 CCCOC(=O)CNCCN1CCCCC1C 2230a_100000739827_200011215008 [0,0,1,1,0,0|2,0,0]=4 14240 B17R1.1515 CCCOC(=O)CNCCN1CCCCC1C 34a_100000739827_200011215008 [0,0,1,1,0,0|2,0,0]=4 14241 B17R1.1515 CCCOC(=O)COCCN1CCCCC1C 34a_100011305533_200011215008 [0,0,1,1,0,0|2,0,0]=4 14242 B17R1.1515 CCCOC(=O)CSCCC1CCCCN1C 62a_100000211948_200011215008 [0,0,1,1,0,0|2,0,0]=4 14243 B17R1.1515 CCCOC(=O)CSCCC1CCCCN1C 62a_200011215008_100000211948 [0,0,1,1,0,0|2,0,0]=4 14244 B17R1.1559 CCCCC(=O)CCCCCN1CCCCC1 1458a_100012051570_100000210211 [0,0,1,1,0,0|2,0,0]=4 14245 B17R1.1559 CCCCC(=O)NCCCCN1CCCCC1 240690a_200011207366_100000210183 [0,0,1,1,0,0|2,0,0]=4 14246 B17R1.1559 CCCCC(=O)NCCCOC1CCCCC1 11a_100000205933_100000210183 [0,0,1,1,0,0|2,0,0]=4 14247 B17R1.1559 CCCCC(=O)NCCCOC1CCCCC1 1626a_100000205933_100000210183 [0,0,1,1,0,0|2,0,0]=4 14248 B17R1.1559 CCCCC(=O)NCCCOC1CCCCC1 240690a_100000205933_100000210183 [0,0,1,1,0,0|2,0,0]=4 14249 B17R1.1559 CCCCC(=O)NCCCOC1CCCCC1 527a_100000205933_100000210183 [0,0,1,1,0,0|2,0,0]=4 14250 B17R1.1559 CCCCC(C)OCCCCC1CCCCC1 34a_100011215267_200011215066 [0,0,1,1,0,0|1,0,1]=4 14251 B17R1.1559 CCCCC(C)OCCCCC1CCCCC1 7a_100011215267_200011215066 [0,0,1,1,0,0|1,0,1]=4 14252 B17R1.1559 CCCNC(=O)CCCCCN1CCCCC1 11a_100020643023_100012051570 [0,0,1,1,0,0|2,0,0]=4 14253 B17R1.1559 CCCNC(=O)CCCCCN1CCCCC1 240690a_100020643023_100012051570 [0,0,1,1,0,0|2,0,0]=4 14254 B17R1.1559 CCCNC(=O)CCCNCC1CCCCC1 2230a_100000210473_100011194427 [0,0,1,1,0,0|2,0,0]=4 14255 B17R1.1559 CCCNC(=O)CCCOCC1CCCCC1 7a_100000212181_100011194427 [0,0,1,1,0,0|2,0,0]=4 14256 B17R1.1559 CCCNC(=O)CCCSCC1CCCCC1 62a_100000211423_100011194427 [0,0,1,1,0,0|2,0,0]=4 14257 B17R1.1559 CCCNC(=O)CCCSCC1CCCCC1 62a_100011194427_100000211423 [0,0,1,1,0,0|2,0,0]=4 14258 B17R1.1559 CCCNC(=O)CNCCCC1CCCCC1 2230a_100000174927_100011713725 [0,0,1,1,0,0|2,0,0]=4 14259 B17R1.1559 CCCNC(=O)CNCCCC1CCCCC1 2230a_100011211642_100000183358 [0,0,1,1,0,0|2,0,0]=4 14260 B17R1.1559 CCCNC(=O)CNCCCC1CCCCC1 34a_100011211642_100000183358 [0,0,1,1,0,0|2,0,0]=4 14261 B17R1.1559 CCCNC(=O)COCCCC1CCCCC1 34a_100000198086_100000183358 [0,0,1,1,0,0|2,0,0]=4 14262 B17R1.1559 CCCNC(=O)COCCCC1CCCCC1 7a_100000198086_100000183358 [0,0,1,1,0,0|2,0,0]=4 14263 B17R1.1559 CCCNC(=O)CSCCCC1CCCCC1 62a_100000183358_100011713725 [0,0,1,1,0,0|2,0,0]=4 14264 B17R1.1559 CCCNC(=O)CSCCCC1CCCCC1 62a_100011713725_100000183358 [0,0,1,1,0,0|2,0,0]=4 14265 B17R1.1559 CCCOC(=O)CNCCCC1CCCCC1 2230a_100011211642_200011215008 [0,0,1,1,0,0|1,0,0]=3 14266 B17R1.1559 CCCOC(=O)CNCCCC1CCCCC1 34a_100011211642_200011215008 [0,0,1,1,0,0|1,0,0]=3 14267 B17R1.1559 CCCOC(=O)CNCCOC1CCCCC1 34a_100015206981_200011215008 [0,0,1,1,0,0|2,0,0]=4 14268 B17R1.1559 CCCOC(=O)COCCCC1CCCCC1 34a_100000198086_200011215008 [0,0,1,1,0,0|1,0,0]=3 14269 B17R1.1559 CCCOC(=O)COCCCC1CCCCC1 7a_100000198086_200011215008 [0,0,1,1,0,0|1,0,0]=3 14270 B17R1.1559 CCCOC(=O)COCCCC1CCCCN1 34a_100011934581_200011215008 [0,0,1,1,0,0|2,0,0]=4 14271 B17R1.1559 CCCOC(=O)COCCCC1CCCNC1 34a_100150707839_200011215008 [0,0,1,1,0,0|2,0,0]=4 14272 B17R1.1559 CCCOC(=O)COCCCC1CCNCC1 34a_100016988962_200011215008 [0,0,1,1,0,0|2,0,0]=4 14273 B17R1.1559 CCCOC(=O)COCCCN1CCCCC1 34a_100000212458_200011215008 [0,0,1,1,0,0|2,0,0]=4 14274 B17R1.1559 CCCOC(=O)COCCNC1CCCCC1 34a_100000200466_200011215008 [0,0,1,1,0,0|2,0,0]=4 14275 B17R1.1559 CCCOC(=O)COCCOC1CCCCC1 34a_100011249652_200011215008 [0,0,1,1,0,0|2,0,0]=4 14276 B17R1.1559 CCCOC(=O)COCCOC1CCCCC1 7a_100011249652_200011215008 [0,0,1,1,0,0|2,0,0]=4 14277 B17R1.1559 CCCOC(=O)CSCCCC1CCCCC1 62a_100011713725_200011215008 [0,0,1,1,0,0|1,0,0]=3 14278 B17R1.1559 CCCOC(=O)CSCCCC1CCCCC1 62a_200011215008_100011713725 [0,0,1,1,0,0|1,0,0]=3 14279 B17R1.1559 CCCOC(=O)CSCCCN1CCCCC1 62a_100132302099_200011215008 [0,0,1,1,0,0|2,0,0]=4 14280 B17R1.1559 CCCOC(=O)CSCCCN1CCCCC1 62a_200011215008_100000007876 [0,0,1,1,0,0|2,0,0]=4 14281 B17R1.1559 CCCOC(=O)CSCCOC1CCCCC1 62a_100011211530_200011215008 [0,0,1,1,0,0|2,0,0]=4 14282 B17R1.1559 CCCOC(=O)CSCCOC1CCCCC1 62a_200011215008_100011211530 [0,0,1,1,0,0|2,0,0]=4 14283 B17R1.1559 CCCOC(=O)OCNCCC1CCCCC1 34a_100000738074_200000139673 [0,0,1,1,0,0|2,0,0]=4 14284 B17R1.1559 CCCOC(=O)OCOCCC1CCCCC1 34a_100011217863_200000139673 [0,0,1,1,0,0|2,0,0]=4 14285 B17R1.1559 CCCOC(=O)OCOCCC1CCCCC1 7a_100011217863_200000139673 [0,0,1,1,0,0|2,0,0]=4 14286 B17R1.1559 CCCOC(=O)OCSCCC1CCCCC1 62a_100012355289_200000139673 [0,0,1,1,0,0|2,0,0]=4 14287 B17R1.1575 CCCCC(=O)NCCN1CCCCC1CC 11a_100000755458_100000210183 [0,0,1,1,0,0|2,0,0]=4 14288 B17R1.1575 CCCCC(=O)NCCN1CCCCC1CC 1626a_100000755458_100000210183 [0,0,1,1,0,0|2,0,0]=4 14289 B17R1.1575 CCCCC(=O)NCCN1CCCCC1CC 240690a_100000755458_100000210183 [0,0,1,1,0,0|2,0,0]=4 14290 B17R1.1575 CCCCC(=O)NCCN1CCCCC1CC 527a_100000755458_100000210183 [0,0,1,1,0,0|2,0,0]=4 14291 B17R1.1575 CCCNC(=O)CCCN1CCCCC1CC 2230a_100000210034_100011194427 [0,0,1,1,0,0|2,0,0]=4 14292 B17R1.1575 CCCNC(=O)CCCN1CCCCC1CC 269982a_100000210034_100011194427 [0,0,1,1,0,0|2,0,0]=4 14293 B17R1.1575 CCCOC(=O)CNCC1CCCCN1CC 2230a_100000754393_200011215008 [0,0,1,1,0,0|2,0,0]=4 14294 B17R1.1575 CCCOC(=O)CNCC1CCCCN1CC 34a_100000754393_200011215008 [0,0,1,1,0,0|2,0,0]=4 14295 B17R1.1575 CCCOC(=O)COCC1CCCCN1CC 34a_100000225091_200011215008 [0,0,1,1,0,0|2,0,0]=4 14296 B17R1.1575 CCCOC(=O)COCC1CCCCN1CC 7a_100000225091_200011215008 [0,0,1,1,0,0|2,0,0]=4 14297 B17R1.1575 CCCOC(=O)OCOC1CCCCC1CC 34a_100000210738_200000139673 [0,0,1,1,0,0|2,0,0]=4 14298 B17R1.1575 CCCOC(=O)OCOC1CCCCC1CC 7a_100000210738_200000139673 [0,0,1,1,0,0|2,0,0]=4 14299 B17R1.1576 CCCCC(=O)NCCCCCN1CCCC1 1626a_100011491779_100000210183 [0,0,1,1,0,0|2,0,0]=4 14300 B17R1.1576 CCCCC(=O)NCCCCCN1CCCC1 240690a_100011491779_100000210183 [0,0,1,1,0,0|2,0,0]=4 14301 B17R1.1576 CCCNC(=O)CCCNCCC1CCCC1 2230a_100000739158_100011194427 [0,0,1,1,0,0|2,0,0]=4 14302 B17R1.1576 CCCNC(=O)CCCOCCC1CCCC1 7a_100000749090_100011194427 [0,0,1,1,0,0|2,0,0]=4 14303 B17R1.1576 CCCNC(=O)CCCSCCC1CCCC1 62a_100000760354_100011194427 [0,0,1,1,0,0|2,0,0]=4 14304 B17R1.1576 CCCNC(=O)CCCSCCC1CCCC1 62a_100011194427_100000760354 [0,0,1,1,0,0|2,0,0]=4 14305 B17R1.1576 CCCOC(=O)CNCCCOC1CCCC1 34a_100000747560_200011215008 [0,0,1,1,0,0|2,0,0]=4 14306 B17R1.1576 CCCOC(=O)OCNCCCC1CCCC1 34a_100000736752_200000139673 [0,0,1,1,0,0|2,0,0]=4 14307 B17R1.1576 CCCOC(=O)OCOCCCC1CCCC1 34a_100011215328_200000139673 [0,0,1,1,0,0|2,0,0]=4 14308 B17R1.1576 CCCOC(=O)OCOCCCC1CCCC1 7a_100011215328_200000139673 [0,0,1,1,0,0|2,0,0]=4 14309 B17R1.1576 CCCOC(=O)OCSCCCC1CCCC1 62a_100011713738_200000139673 [0,0,1,1,0,0|2,0,0]=4 14310 B17R1.6358 CCCCC(=O)N1CCCCC1CCCOC 11a_100011804088_100000210183 [0,0,1,1,0,0|2,0,0]=4 14311 B17R1.6358 CCCCC(=O)N1CCCCC1CCCOC 1626a_100011804088_100000210183 [0,0,1,1,0,0|2,0,0]=4 14312 B17R1.6358 CCCCC(=O)N1CCCCC1CCCOC 240690a_100011804088_100000210183 [0,0,1,1,0,0|2,0,0]=4 14313 B17R1.6358 CCCCC(=O)N1CCCCC1CCCOC 527a_100011804088_100000210183 [0,0,1,1,0,0|2,0,0]=4 14314 B17R1.22112 CCCCC1CCCC1NCC(=O)NCCC 269862a_100000174927_100000750825 [0,0,1,1,0,0|2,0,0]=4 14315 B17R1.22112 CCCCC1CCCC1NCC(=O)NCCC 270004a_100000174927_100000750825 [0,0,1,1,0,0|2,0,0]=4 14316 B17R1.22462 CCCOC(=O)CN1CCCCC1CCCO 2230a_100011934581_200011215008 [0,0,1,1,0,0|2,0,0]=4 14317 B17R1.22462 CCCOC(=O)CN1CCCCC1CCCO 269982a_100011934581_200011215008 [0,0,1,1,0,0|2,0,0]=4 14318 B17R1.22462 CCCOC(=O)CN1CCCCC1CCCO 34a_100011934581_200011215008 [0,0,1,1,0,0|2,0,0]=4 14319 B17R1.22462 CCCOC(=O)CN1CCCCC1CCOC 2230a_100015186528_200011215008 [0,0,1,1,0,0|2,0,0]=4 14320 B17R1.22462 CCCOC(=O)CN1CCCCC1CCOC 269982a_100015186528_200011215008 [0,0,1,1,0,0|2,0,0]=4 14321 B17R1.22462 CCCOC(=O)CN1CCCCC1CCOC 34a_100015186528_200011215008 [0,0,1,1,0,0|2,0,0]=4 14322 B17R1.29773 CCCCCCCCCC=CC(=O)C1CCC1 1458a_200015352897_100000749161 [0,0,1,1,0,0|1,0,1]=4 14323 B17R1.29773 CCCCCCCCCCCC(=O)C1CCC1 1458a_100000209988_100011215454 [0,0,1,1,0,0|1,0,0]=3 14324 B17R1.29773 CCCCCCCCCCCC(=O)C1CCC1 1458a_100000210736_100000749161 [0,0,1,1,0,0|1,0,0]=3 14325 B17R1.29773 CCCCCCCCCCCC(=O)C1CCO1 1458a_100000089072_100011215454 [0,0,1,1,0,0|2,0,0]=4 14326 B17R1.29773 CCCCCCCCCCCC(=O)C1COC1 1458a_100000210736_100000687716 [0,0,1,1,0,0|2,0,0]=4 14327 B17R1.29773 CCCCCCCCCCCC(=O)C1COC1 1458a_100000758290_100011215454 [0,0,1,1,0,0|2,0,0]=4 14328 B17R1.29773 CCCCCCCCCCCC(=O)N1CCC1 11a_100000754969_100000210736 [0,0,1,1,0,0|1,0,0]=3 14329 B17R1.29773 CCCCCCCCCCCC(=O)N1CCC1 240690a_100000754969_100000210736 [0,0,1,1,0,0|1,0,0]=3 14330 B17R1.29773 CCCCCCCCCCNC(=O)C1CCC1 11a_100000684558_100000209988 [0,0,1,1,0,0|1,0,0]=3 14331 B17R1.29773 CCCCCCCCCCNC(=O)C1CCC1 1626a_100000684558_100000209988 [0,0,1,1,0,0|1,0,0]=3 14332 B17R1.29773 CCCCCCCCCCNC(=O)C1CCC1 240690a_100000684558_100000209988 [0,0,1,1,0,0|1,0,0]=3 14333 B17R1.29773 CCCCCCCCCCNC(=O)C1CCC1 527a_100000684558_100000209988 [0,0,1,1,0,0|1,0,0]=3 14334 B17R1.29773 CCCCCCCCCCNC(=O)C1CCO1 11a_100000684558_100000089072 [0,0,1,1,0,0|2,0,0]=4 14335 B17R1.29773 CCCCCCCCCCNC(=O)C1CCO1 1626a_100000684558_100000089072 [0,0,1,1,0,0|2,0,0]=4 14336 B17R1.29773 CCCCCCCCCCNC(=O)C1CCO1 240690a_100000684558_100000089072 [0,0,1,1,0,0|2,0,0]=4 14337 B17R1.29773 CCCCCCCCCCNC(=O)C1CCO1 527a_100000684558_100000089072 [0,0,1,1,0,0|2,0,0]=4 14338 B17R1.29773 CCCCCCCCCCNC(=O)C1COC1 11a_100000684558_100000758290 [0,0,1,1,0,0|2,0,0]=4 14339 B17R1.29773 CCCCCCCCCCNC(=O)C1COC1 1626a_100000684558_100000758290 [0,0,1,1,0,0|2,0,0]=4 14340 B17R1.29773 CCCCCCCCCCNC(=O)C1COC1 240690a_100000684558_100000758290 [0,0,1,1,0,0|2,0,0]=4 14341 B17R1.29773 CCCCCCCCCCNC(=O)C1COC1 527a_100000684558_100000758290 [0,0,1,1,0,0|2,0,0]=4 14342 B17R1.29773 CCCCCCCCCCNC(=O)N1CCC1 2708a_100000684558_100000754969 [0,0,1,1,0,0|2,0,0]=4 14343 B17R1.29773 CCCCCCCCCCNC(=O)N1CCC1 273464a_100000684558_100000754969 [0,0,1,1,0,0|2,0,0]=4 14344 B17R1.29773 CCCCCCCCCCOC(C)C1CCC1 34a_100000766398_100000210320 [0,0,1,1,0,0|1,0,1]=4 14345 B17R1.29773 CCCCCCCCCCOC(C)C1CCC1 7a_100000766398_100000210320 [0,0,1,1,0,0|1,0,1]=4 14346 B17R1.29773 CCCCCCCCCNCC(=O)C1CCC1 2230a_100000212291_100000686122 [0,0,1,1,0,0|2,0,0]=4 14347 B17R1.29773 CCCCCCCCCNCC(=O)C1CCC1 34a_100000212291_100000686122 [0,0,1,1,0,0|2,0,0]=4 14348 B17R1.29773 CCCCCCCCCNCC(=O)N1CCC1 2230a_100000212291_100000185095 [0,0,1,1,0,0|2,0,0]=4 14349 B17R1.29773 CCCCCCCCCNCC(=O)N1CCC1 34a_100000212291_100000185095 [0,0,1,1,0,0|2,0,0]=4 14350 B17R1.29773 CCCCCCCCCOCC(=O)C1CCC1 34a_100000210712_100000686122 [0,0,1,1,0,0|2,0,0]=4 14351 B17R1.29773 CCCCCCCCCOCC(=O)C1CCC1 7a_100000210712_100000686122 [0,0,1,1,0,0|2,0,0]=4 14352 B17R1.29773 CCCCCCCCCOCC(=O)N1CCC1 34a_100000210712_100000185095 [0,0,1,1,0,0|2,0,0]=4 14353 B17R1.29773 CCCCCCCCCOCC(=O)N1CCC1 7a_100000210712_100000185095 [0,0,1,1,0,0|2,0,0]=4 14354 B17R1.29773 CCCCCCCCCSCC(=O)C1CCC1 62a_100000686122_100000210670 [0,0,1,1,0,0|2,0,0]=4 14355 B17R1.29773 CCCCCCCCCSCC(=O)N1CCC1 62a_100000185095_100000210670 [0,0,1,1,0,0|2,0,0]=4 14356 B17R1.29773 CCCCCCCNCCNC(=O)C1CCC1 2230a_100000723847_100000210681 [0,0,1,1,0,0|2,0,0]=4 14357 B17R1.29773 CCCCCCCNCCNC(=O)C1CCC1 34a_100000723847_100000210614 [0,0,1,1,0,0|2,0,0]=4 14358 B17R1.29773 O=C(CCCCCCCCCCO)C1CCC1 1458a_100000209988_100009813290 [0,0,1,1,0,0|2,0,0]=4 14359 B17R1.29773 O=C(CCCCCCCCCCO)N1CCC1 240690a_100000754969_200000016029 [0,0,1,1,0,0|2,0,0]=4 14360 B17R1.29773 O=C(NCCCCCCCCCO)C1CCC1 240690a_100000078944_100000209988 [0,0,1,1,0,0|2,0,0]=4 14361 B17R1.29775 CCCCCCCCCC=CC(=O)CC1CC1 1458a_200015352897_100000742324 [0,0,1,1,0,0|1,0,1]=4 14362 B17R1.29775 CCCCCCCCCCCC(=O)CC1CC1 1458a_100000210736_100000742324 [0,0,1,1,0,0|1,0,0]=3 14363 B17R1.29775 CCCCCCCCCCCC(=O)CC1CC1 1458a_100000738066_100011215454 [0,0,1,1,0,0|1,0,0]=3 14364 B17R1.29775 CCCCCCCCCCCC(=O)CC1CO1 1458a_100000210736_100011216344 [0,0,1,1,0,0|2,0,0]=4 14365 B17R1.29775 CCCCCCCCCCCC(=O)CC1CS1 1458a_100000210736_100000031435 [0,0,1,1,0,0|2,0,0]=4 14366 B17R1.29775 CCCCCCCCCCCC(=O)C[C@@H]1CO1 1458a_100000210736_100000745022 [0,0,1,1,0,0|2,0,0]=4 14367 B17R1.29775 CCCCCCCCCCCC(=O)NC1CC1 1626a_100000212008_100000210736 [0,0,1,1,0,0|1,0,0]=3 14368 B17R1.29775 CCCCCCCCCCCC(=O)NC1CC1 240690a_100000212008_100000210736 [0,0,1,1,0,0|1,0,0]=3 14369 B17R1.29775 CCCCCCCCCCCC(C)OC1CC1 34a_100011217895_100000211595 [0,0,1,1,0,0|1,0,1]=4 14370 B17R1.29775 CCCCCCCCCCNC(=O)CC1CC1 11a_100000684558_100000738066 [0,0,1,1,0,0|1,0,0]=3 14371 B17R1.29775 CCCCCCCCCCNC(=O)CC1CC1 1626a_100000684558_100000738066 [0,0,1,1,0,0|1,0,0]=3 14372 B17R1.29775 CCCCCCCCCCNC(=O)CC1CC1 240690a_100000684558_100000738066 [0,0,1,1,0,0|1,0,0]=3 14373 B17R1.29775 CCCCCCCCCCNC(=O)CC1CC1 527a_100000684558_100000738066 [0,0,1,1,0,0|1,0,0]=3 14374 B17R1.29775 CCCCCCCCCCNC(=O)NC1CC1 2708a_100000212008_100000684558 [0,0,1,1,0,0|2,0,0]=4 14375 B17R1.29775 CCCCCCCCCCNC(=O)NC1CC1 2708a_100000684558_100000212008 [0,0,1,1,0,0|2,0,0]=4 14376 B17R1.29775 CCCCCCCCCCNC(=O)NC1CC1 273464a_100000212008_100000684558 [0,0,1,1,0,0|2,0,0]=4 14377 B17R1.29775 CCCCCCCCCCNC(=O)NC1CC1 273464a_100000684558_100000212008 [0,0,1,1,0,0|2,0,0]=4 14378 B17R1.29775 CCCCCCCCCCNC(=O)NC1CC1 512a_100000212008_100000684558 [0,0,1,1,0,0|2,0,0]=4 14379 B17R1.29775 CCCCCCCCCNCC(=O)NC1CC1 2230a_100000212291_100000182950 [0,0,1,1,0,0|2,0,0]=4 14380 B17R1.29775 CCCCCCCCCNCC(=O)NC1CC1 2230a_100000702991_100011214924 [0,0,1,1,0,0|2,0,0]=4 14381 B17R1.29775 CCCCCCCCCNCC(=O)NC1CC1 34a_100000212291_100000182950 [0,0,1,1,0,0|2,0,0]=4 14382 B17R1.29775 CCCCCCCCCOCC(=O)NC1CC1 34a_100000210712_100000182950 [0,0,1,1,0,0|2,0,0]=4 14383 B17R1.29775 CCCCCCCCCOCC(=O)NC1CC1 7a_100000210712_100000182950 [0,0,1,1,0,0|2,0,0]=4 14384 B17R1.29775 CCCCCCCCCSCC(=O)NC1CC1 62a_100000182950_100000210670 [0,0,1,1,0,0|2,0,0]=4 14385 B17R1.29775 CCCCCCCCNCCC(=O)NC1CC1 2230a_100000229939_100000737409 [0,0,1,1,0,0|2,0,0]=4 14386 B17R1.29775 CCCCCCCCNCCC(=O)NC1CC1 34a_100000229939_100000737409 [0,0,1,1,0,0|2,0,0]=4 14387 B17R1.29775 CCCCCCCCOCCC(=O)NC1CC1 34a_100000210232_100000737409 [0,0,1,1,0,0|2,0,0]=4 14388 B17R1.29775 CCCCCCCCSCCC(=O)NC1CC1 62a_100000210759_100000737409 [0,0,1,1,0,0|2,0,0]=4 14389 B17R1.29775 CCCCCCCCSCCC(=O)NC1CC1 62a_100000737409_100000210317 [0,0,1,1,0,0|2,0,0]=4 14390 B17R1.29775 O=C(CC1CC1)NCCCCCCCCCO 240690a_100000078944_100000738066 [0,0,1,1,0,0|2,0,0]=4 14391 B17R1.29775 O=C(CCCCCCCCCCO)CC1CC1 1458a_100000738066_100009813290 [0,0,1,1,0,0|2,0,0]=4 14392 B17R1.29775 O=C(CCCCCCCCCCO)NC1CC1 240690a_100000212008_200000016029 [0,0,1,1,0,0|2,0,0]=4 14393 B17R1.29865 CCCNC(=O)CNC1CCCCC1CCC 269862a_100000174927_100011218038 [0,0,1,1,0,0|2,0,0]=4 14394 B17R1.29865 CCCNC(=O)CNC1CCCCC1CCC 270004a_100000174927_100011218038 [0,0,1,1,0,0|2,0,0]=4 14395 B17R1.29865 CCCNC(=O)COC1CCCCC1CCC 34a_100011217265_100000183358 [0,0,1,1,0,0|2,0,0]=4 14396 B17R1.29865 CCCNC(=O)COC1CCCCC1CCC 7a_100011217265_100000183358 [0,0,1,1,0,0|2,0,0]=4 14397 B17R1.29865 CCCOC(=O)COC1CCCCC1CCC 34a_100011217265_200011215008 [0,0,1,1,0,0|1,0,0]=3 14398 B17R1.29865 CCCOC(=O)COC1CCCCC1CCC 7a_100011217265_200011215008 [0,0,1,1,0,0|1,0,0]=3 14399 B17R1.29865 CCCOC(=O)OCN1CCCCC1CCC 269982a_100000701414_200000139673 [0,0,1,1,0,0|2,0,0]=4 14400 B17R1.29865 CCCOC(=O)OCN1CCCCC1CCC 34a_100000701414_200000139673 [0,0,1,1,0,0|2,0,0]=4 14401 B17R1.29867 CCCNC(=O)CNC1CCCCCCCC1 270004a_100000174927_100000038600 [0,0,1,1,0,0|2,0,0]=4 14402 B17R1.29867 CCCOC(=O)OCN1CCCCCCCC1 269982a_100000039187_200000139673 [0,0,1,1,0,0|2,0,0]=4 14403 B17R1.29867 CCCOC(=O)OCN1CCCCCCCC1 34a_100000039187_200000139673 [0,0,1,1,0,0|2,0,0]=4 14404 B17R1.29890 CCCCC(=O)NCCCN1CCCCCC1 11a_100000181460_100000210183 [0,0,1,1,0,0|2,0,0]=4 14405 B17R1.29890 CCCCC(=O)NCCCN1CCCCCC1 240690a_100000181460_100000210183 [0,0,1,1,0,0|2,0,0]=4 14406 B17R1.29890 CCCCC(=O)NCCCN1CCCCCC1 527a_100000181460_100000210183 [0,0,1,1,0,0|2,0,0]=4 14407 B17R1.29890 CCCNC(=O)CCCNC1CCCCCC1 2230a_100000210984_100011194427 [0,0,1,1,0,0|2,0,0]=4 14408 B17R1.29890 CCCNC(=O)CCCOC1CCCCCC1 7a_100000210887_100011194427 [0,0,1,1,0,0|2,0,0]=4 14409 B17R1.29890 CCCNC(=O)CCCSC1CCCCCC1 62a_100011194427_100011217769 [0,0,1,1,0,0|2,0,0]=4 14410 B17R1.29890 CCCNC(=O)CCCSC1CCCCCC1 62a_100011217769_100011194427 [0,0,1,1,0,0|2,0,0]=4 14411 B17R1.29890 CCCNC(=O)CNCCC1CCCCCC1 2230a_100011532351_100000183358 [0,0,1,1,0,0|2,0,0]=4 14412 B17R1.29890 CCCNC(=O)CNCCC1CCCCCC1 34a_100011532351_100000183358 [0,0,1,1,0,0|2,0,0]=4 14413 B17R1.29890 CCCOC(=O)CNCCC1CCCCCC1 2230a_100011532351_200011215008 [0,0,1,1,0,0|1,0,0]=3 14414 B17R1.29890 CCCOC(=O)CNCCC1CCCCCC1 34a_100011532351_200011215008 [0,0,1,1,0,0|1,0,0]=3 14415 B17R1.29890 CCCOC(=O)COCCN1CCCCCC1 34a_100000238007_200011215008 [0,0,1,1,0,0|2,0,0]=4 14416 B17R1.29890 CCCOC(=O)CSCCN1CCCCCC1 62a_100000722644_200011215008 [0,0,1,1,0,0|2,0,0]=4 14417 B17R1.29890 CCCOC(=O)CSCCN1CCCCCC1 62a_200011215008_100000722644 [0,0,1,1,0,0|2,0,0]=4 14418 B17R1.29890 CCCOC(=O)OCNCC1CCCCCC1 34a_100015204231_200000139673 [0,0,1,1,0,0|2,0,0]=4 14419 B17R1.29890 CCCOC(=O)OCOCC1CCCCCC1 34a_100000699130_200000139673 [0,0,1,1,0,0|2,0,0]=4 14420 B17R1.29890 CCCOC(=O)OCOCC1CCCCCC1 7a_100000699130_200000139673 [0,0,1,1,0,0|2,0,0]=4 14421 B17R1.29890 CCCOC(=O)OCSCC1CCCCCC1 62a_200000696569_200000139673 [0,0,1,1,0,0|2,0,0]=4 14422 B17R1.30208 CCCCC(=O)NCCC1CCCCCCC1 11a_100011532352_100000210183 [0,0,1,1,0,0|1,0,0]=3 14423 B17R1.30208 CCCCC(=O)NCCC1CCCCCCC1 1626a_100011532352_100000210183 [0,0,1,1,0,0|1,0,0]=3 14424 B17R1.30208 CCCCC(=O)NCCC1CCCCCCC1 240690a_100011532352_100000210183 [0,0,1,1,0,0|1,0,0]=3 14425 B17R1.30208 CCCCC(=O)NCCC1CCCCCCC1 527a_100011532352_100000210183 [0,0,1,1,0,0|1,0,0]=3 14426 B17R1.30208 CCCNC(=O)CCCN1CCCCCCC1 2230a_100000211400_100011194427 [0,0,1,1,0,0|2,0,0]=4 14427 B17R1.30208 CCCNC(=O)CCCN1CCCCCCC1 269982a_100000211400_100011194427 [0,0,1,1,0,0|2,0,0]=4 14428 B17R1.30208 CCCNC(=O)COCC1CCCCCCC1 34a_100011216312_100000183358 [0,0,1,1,0,0|2,0,0]=4 14429 B17R1.30208 CCCNC(=O)COCC1CCCCCCC1 7a_100011216312_100000183358 [0,0,1,1,0,0|2,0,0]=4 14430 B17R1.30208 CCCNC(=O)NCCC1CCCCCCC1 2708a_100011532352_100020643023 [0,0,1,1,0,0|2,0,0]=4 14431 B17R1.30208 CCCNC(=O)NCCC1CCCCCCC1 2708a_100020643023_100011532352 [0,0,1,1,0,0|2,0,0]=4 14432 B17R1.30208 CCCNC(=O)NCCC1CCCCCCC1 273464a_100011532352_100020643023 [0,0,1,1,0,0|2,0,0]=4 14433 B17R1.30208 CCCNC(=O)NCCC1CCCCCCC1 273464a_100020643023_100011532352 [0,0,1,1,0,0|2,0,0]=4 14434 B17R1.30208 CCCNC(=O)NCCC1CCCCCCC1 512a_100020643023_100011532352 [0,0,1,1,0,0|2,0,0]=4 14435 B17R1.30208 CCCOC(=O)COCC1CCCCCCC1 34a_100011216312_200011215008 [0,0,1,1,0,0|1,0,0]=3 14436 B17R1.30208 CCCOC(=O)COCC1CCCCCCC1 7a_100011216312_200011215008 [0,0,1,1,0,0|1,0,0]=3 14437 B17R1.30208 CCCOC(=O)OCNC1CCCCCCC1 34a_100000211152_200000139673 [0,0,1,1,0,0|2,0,0]=4 14438 B17R1.30208 CCCOC(=O)OCOC1CCCCCCC1 34a_100000210054_200000139673 [0,0,1,1,0,0|2,0,0]=4 14439 B17R1.30208 CCCOC(=O)OCOC1CCCCCCC1 7a_100000210054_200000139673 [0,0,1,1,0,0|2,0,0]=4 14440 B17R1.30208 CCOCC(=O)NCCC1CCCCCCC1 11a_100011532352_100000211967 [0,0,1,1,0,0|2,0,0]=4 14441 B17R1.30208 CCOCC(=O)NCCC1CCCCCCC1 1626a_100011532352_100000211967 [0,0,1,1,0,0|2,0,0]=4 14442 B17R1.30208 CCOCC(=O)NCCC1CCCCCCC1 240690a_100011532352_100000211967 [0,0,1,1,0,0|2,0,0]=4 14443 B17R1.30208 CCOCC(=O)NCCC1CCCCCCC1 527a_100011532352_100000211967 [0,0,1,1,0,0|2,0,0]=4 14444 B17R1.30208 CCSCC(=O)NCCC1CCCCCCC1 11a_100011532352_100000230394 [0,0,1,1,0,0|2,0,0]=4 14445 B17R1.30208 CCSCC(=O)NCCC1CCCCCCC1 1626a_100011532352_100000230394 [0,0,1,1,0,0|2,0,0]=4 14446 B17R1.30208 CCSCC(=O)NCCC1CCCCCCC1 240690a_100011532352_100000230394 [0,0,1,1,0,0|2,0,0]=4 14447 B17R1.30208 CCSCC(=O)NCCC1CCCCCCC1 527a_100011532352_100000230394 [0,0,1,1,0,0|2,0,0]=4 14448 B17R1.30208 COCCC(=O)NCCC1CCCCCCC1 11a_100011532352_100000749529 [0,0,1,1,0,0|2,0,0]=4 14449 B17R1.30208 COCCC(=O)NCCC1CCCCCCC1 1626a_100011532352_100000749529 [0,0,1,1,0,0|2,0,0]=4 14450 B17R1.30208 COCCC(=O)NCCC1CCCCCCC1 240690a_100011532352_100000749529 [0,0,1,1,0,0|2,0,0]=4 14451 B17R1.30208 COCCC(=O)NCCC1CCCCCCC1 527a_100011532352_100000749529 [0,0,1,1,0,0|2,0,0]=4 14452 B17R1.30208 CSCCC(=O)NCCC1CCCCCCC1 11a_100011532352_100000174002 [0,0,1,1,0,0|2,0,0]=4 14453 B17R1.30208 CSCCC(=O)NCCC1CCCCCCC1 1626a_100011532352_100000174002 [0,0,1,1,0,0|2,0,0]=4 14454 B17R1.30208 CSCCC(=O)NCCC1CCCCCCC1 240690a_100011532352_100000174002 [0,0,1,1,0,0|2,0,0]=4 14455 B17R1.30208 CSCCC(=O)NCCC1CCCCCCC1 527a_100011532352_100000174002 [0,0,1,1,0,0|2,0,0]=4 14456 B17R1.30209 CCCOC(=O)COCC1CCCN1CCC 34a_200000694710_200011215008 [0,0,1,1,0,0|2,0,0]=4 14457 B17R1.30209 CCCOC(=O)COCC1CCCN1CCC 7a_200000694710_200011215008 [0,0,1,1,0,0|2,0,0]=4 14458 B17R1.41530 CCCCCCCCCCOC1(CCCC1)C 34a_100000751722_100000210320 [0,0,1,1,0,0|1,0,1]=4 14459 B17R1.41530 CCCCCCCCCCOC1(CCCC1)C 7a_100000751722_100000210320 [0,0,1,1,0,0|1,0,1]=4 14460 B17R1.60382 CCCCCCCCN1CCC(=O)NC[C@@H]1C 2230a_102125656889_100000210759 [0,0,1,1,0,0|2,0,0]=4 14461 B17R1.60382 CCCCCCCCN1CCC(=O)NC[C@@H]1C 269982a_102125656889_100000210759 [0,0,1,1,0,0|2,0,0]=4 14462 B17R1.60382 CCCCCCCCN1CCC(=O)NC[C@@H]1C 34a_102125656889_100000210759 [0,0,1,1,0,0|2,0,0]=4 14463 B17R1.73265 CC1CC1C(=O)CCCCCCCCCCO 1458a_100000211227_100009813290 [0,0,1,1,0,0|2,0,0]=4 14464 B17R1.73265 CCCCCCCCCCCC(=O)C1CC1C 1458a_100000211227_100011215454 [0,0,1,1,0,0|1,0,0]=3 14465 B17R1.73265 CCCCCCCCCCCC(=O)[C@@H]1C[C@@H]1F 1458a_100015396687_100011215454 [0,0,1,1,0,0|2,0,0]=4 14466 B17R1.73265 CCCCCCCCCCNC(=O)C1CC1C 11a_100000684558_100000211227 [0,0,1,1,0,0|1,0,0]=3 14467 B17R1.73265 CCCCCCCCCCNC(=O)C1CC1C 1626a_100000684558_100000211227 [0,0,1,1,0,0|1,0,0]=3 14468 B17R1.73265 CCCCCCCCCCNC(=O)C1CC1C 527a_100000684558_100000211227 [0,0,1,1,0,0|1,0,0]=3 14469 B17R1.73265 CCCCCCCCCCNC(=O)[C@@H]1C[C@@H]1F 11a_100000684558_100015396687 [0,0,1,1,0,0|2,0,0]=4 14470 B17R1.73265 CCCCCCCCCCNC(=O)[C@@H]1C[C@@H]1F 240690a_100000684558_100015396687 [0,0,1,1,0,0|2,0,0]=4 14471 B17R1.73265 CCCCCCCCCCNC(=O)[C@@H]1C[C@@H]1F 527a_100000684558_100015396687 [0,0,1,1,0,0|2,0,0]=4 14472 B17R1.165670 CCCCCCCN1CCNC(=O)C1CCC 2230a_200000695202_100000210681 [0,0,1,1,0,0|2,0,0]=4 14473 B17R1.165670 CCCCCCCN1CCNC(=O)C1CCC 269982a_200000695202_100000210681 [0,0,1,1,0,0|2,0,0]=4 14474 B17R1.165670 CCCCCCCN1CCNC(=O)C1CCC 34a_200000695202_100000210614 [0,0,1,1,0,0|2,0,0]=4 14475 B17R1.754 CCCCCCCC=CC(=O)C1CCCCC1 1458a_200015332781_100000210327 [0,0,1,1,0,0|1,0,1]=4 14476 B17R1.754 CCCCCCCCCC(=O)C1=CCCCC1 1458a_100000765259_100000210670 [0,0,1,1,0,0|1,0,1]=4 14477 B17R1.754 CCCCCCCCCC(=O)C1CCCCC1 1458a_100000210558_100000210327 [0,0,1,1,0,0|1,0,0]=3 14478 B17R1.754 CCCCCCCCCC(=O)C1CCCCC1 1458a_100000210647_100000210670 [0,0,1,1,0,0|1,0,0]=3 14479 B17R1.754 CCCCCCCCCC(=O)C1CCCCO1 1458a_100000748299_100000210670 [0,0,1,1,0,0|2,0,0]=4 14480 B17R1.754 CCCCCCCCCC(=O)C1CCCOC1 1458a_100000210558_100000693364 [0,0,1,1,0,0|2,0,0]=4 14481 B17R1.754 CCCCCCCCCC(=O)C1CCCOC1 1458a_100000741522_100000210670 [0,0,1,1,0,0|2,0,0]=4 14482 B17R1.754 CCCCCCCCCC(=O)C1CCOCC1 1458a_100000195482_100000210670 [0,0,1,1,0,0|2,0,0]=4 14483 B17R1.754 CCCCCCCCCC(=O)C1CCOCC1 1458a_100000210558_100011324220 [0,0,1,1,0,0|2,0,0]=4 14484 B17R1.754 CCCCCCCCCC(=O)C1CCSCC1 1458a_100000755232_100000210670 [0,0,1,1,0,0|2,0,0]=4 14485 B17R1.754 CCCCCCCCCC(=O)N1CCCOC1 11a_100000131196_100000210558 [0,0,1,1,0,0|2,0,0]=4 14486 B17R1.754 CCCCCCCCCC(=O)N1CCCOC1 240690a_100000131196_100000210558 [0,0,1,1,0,0|2,0,0]=4 14487 B17R1.754 CCCCCCCCCC(=O)N1CCOCC1 11a_100015191051_100000210558 [0,0,1,1,0,0|2,0,0]=4 14488 B17R1.754 CCCCCCCCCC(=O)N1CCOCC1 1626a_100015191051_100000210558 [0,0,1,1,0,0|2,0,0]=4 14489 B17R1.754 CCCCCCCCCC(=O)N1CCOCC1 240690a_100015191051_100000210558 [0,0,1,1,0,0|2,0,0]=4 14490 B17R1.754 CCCCCCCCCC(=O)N1CCOCC1 527a_100015191051_100000210558 [0,0,1,1,0,0|2,0,0]=4 14491 B17R1.754 CCCCCCCCCC(=O)N1CCSCC1 11a_100000737611_100000210558 [0,0,1,1,0,0|2,0,0]=4 14492 B17R1.754 CCCCCCCCCC(=O)N1CCSCC1 240690a_100000737611_100000210558 [0,0,1,1,0,0|2,0,0]=4 14493 B17R1.754 CCCCCCCCCC(=O)N1CCSCC1 527a_100000737611_100000210558 [0,0,1,1,0,0|2,0,0]=4 14494 B17R1.754 CCCCCCCCNC(=O)C1CCCCC1 11a_100000229939_100000210647 [0,0,1,1,0,0|1,0,0]=3 14495 B17R1.754 CCCCCCCCNC(=O)C1CCCCC1 1626a_100000229939_100000210647 [0,0,1,1,0,0|1,0,0]=3 14496 B17R1.754 CCCCCCCCNC(=O)C1CCCCC1 240690a_100000229939_100000210647 [0,0,1,1,0,0|1,0,0]=3 14497 B17R1.754 CCCCCCCCNC(=O)C1CCCCC1 527a_100000229939_100000210647 [0,0,1,1,0,0|1,0,0]=3 14498 B17R1.754 CCCCCCCCNC(=O)C1CCCCO1 11a_100000229939_100000748299 [0,0,1,1,0,0|2,0,0]=4 14499 B17R1.754 CCCCCCCCNC(=O)C1CCCCO1 1626a_100000229939_100000748299 [0,0,1,1,0,0|2,0,0]=4 14500 B17R1.754 CCCCCCCCNC(=O)C1CCCCO1 240690a_100000229939_100000748299 [0,0,1,1,0,0|2,0,0]=4 14501 B17R1.754 CCCCCCCCNC(=O)C1CCCCO1 527a_100000229939_100000748299 [0,0,1,1,0,0|2,0,0]=4 14502 B17R1.754 CCCCCCCCNC(=O)C1CCCOC1 11a_100000229939_100000741522 [0,0,1,1,0,0|2,0,0]=4 14503 B17R1.754 CCCCCCCCNC(=O)C1CCCOC1 1626a_100000229939_100000741522 [0,0,1,1,0,0|2,0,0]=4 14504 B17R1.754 CCCCCCCCNC(=O)C1CCCOC1 240690a_100000229939_100000741522 [0,0,1,1,0,0|2,0,0]=4 14505 B17R1.754 CCCCCCCCNC(=O)C1CCCOC1 527a_100000229939_100000741522 [0,0,1,1,0,0|2,0,0]=4 14506 B17R1.754 CCCCCCCCNC(=O)C1CCOCC1 11a_100000229939_100000195482 [0,0,1,1,0,0|2,0,0]=4 14507 B17R1.754 CCCCCCCCNC(=O)C1CCOCC1 1626a_100000229939_100000195482 [0,0,1,1,0,0|2,0,0]=4 14508 B17R1.754 CCCCCCCCNC(=O)C1CCOCC1 240690a_100000229939_100000195482 [0,0,1,1,0,0|2,0,0]=4 14509 B17R1.754 CCCCCCCCNC(=O)C1CCOCC1 527a_100000229939_100000195482 [0,0,1,1,0,0|2,0,0]=4 14510 B17R1.754 CCCCCCCCNC(=O)C1CCSCC1 11a_100000229939_100000755232 [0,0,1,1,0,0|2,0,0]=4 14511 B17R1.754 CCCCCCCCNC(=O)C1CCSCC1 1626a_100000229939_100000755232 [0,0,1,1,0,0|2,0,0]=4 14512 B17R1.754 CCCCCCCCNC(=O)C1CCSCC1 240690a_100000229939_100000755232 [0,0,1,1,0,0|2,0,0]=4 14513 B17R1.754 CCCCCCCCNC(=O)C1CCSCC1 527a_100000229939_100000755232 [0,0,1,1,0,0|2,0,0]=4 14514 B17R1.754 CCCCCCCCOC(C)C1CCCCC1 34a_100011216961_100000210759 [0,0,1,1,0,0|1,0,1]=4 14515 B17R1.754 CCCCCCCCOC(C)C1CCCCC1 7a_100011216961_100000210759 [0,0,1,1,0,0|1,0,1]=4 14516 B17R1.754 CCCCCCCNCC(=O)C1CCCCC1 2230a_100000229938_100000241979 [0,0,1,1,0,0|2,0,0]=4 14517 B17R1.754 CCCCCCCNCC(=O)N1CCCCC1 2230a_100000229938_100000183409 [0,0,1,1,0,0|2,0,0]=4 14518 B17R1.754 CCCCCCCNCC(=O)N1CCCCC1 2230a_100000751303_100000210681 [0,0,1,1,0,0|2,0,0]=4 14519 B17R1.754 CCCCCCCOCC(=O)C1CCCCC1 34a_100000210272_100000241979 [0,0,1,1,0,0|2,0,0]=4 14520 B17R1.754 CCCCCCCOCC(=O)C1CCCCC1 7a_100000210272_100000241979 [0,0,1,1,0,0|2,0,0]=4 14521 B17R1.754 CCCCCCCOCC(=O)N1CCCCC1 34a_100000210272_100000183409 [0,0,1,1,0,0|2,0,0]=4 14522 B17R1.754 CCCCCCCOCC(=O)N1CCCCC1 7a_100000210272_100000183409 [0,0,1,1,0,0|2,0,0]=4 14523 B17R1.754 CCCCCCCOCC(=O)N1CCCCC1 7a_100011315646_100000210614 [0,0,1,1,0,0|2,0,0]=4 14524 B17R1.754 CCCCCCCSCC(=O)C1CCCCC1 62a_100000210614_100000241979 [0,0,1,1,0,0|2,0,0]=4 14525 B17R1.754 CCCCCCCSCC(=O)C1CCCCC1 62a_100000241979_100000210316 [0,0,1,1,0,0|2,0,0]=4 14526 B17R1.754 CCCCCCCSCC(=O)N1CCCCC1 62a_100000183409_100000210316 [0,0,1,1,0,0|2,0,0]=4 14527 B17R1.754 CCCCCCCSCC(=O)N1CCCCC1 62a_100000210614_100000183409 [0,0,1,1,0,0|2,0,0]=4 14528 B17R1.754 CCCCCCNCCC(=O)N1CCCCC1 2230a_100000210581_100102558178 [0,0,1,1,0,0|2,0,0]=4 14529 B17R1.754 CCCCCCNCOC(=O)C1CCCCC1 2230a_100000210581_100009893799 [0,0,1,1,0,0|1,0,0]=3 14530 B17R1.754 CCCCCCOCCC(=O)N1CCCCC1 34a_100000210259_100102558178 [0,0,1,1,0,0|2,0,0]=4 14531 B17R1.754 CCCCCCOCCC(=O)N1CCCCC1 7a_100000210259_100102558178 [0,0,1,1,0,0|2,0,0]=4 14532 B17R1.754 CCCCCCOCOC(=O)C1CCCCC1 34a_100000210259_100009893799 [0,0,1,1,0,0|1,0,0]=3 14533 B17R1.754 CCCCCCSCCC(=O)N1CCCCC1 62a_100000210314_100102558178 [0,0,1,1,0,0|2,0,0]=4 14534 B17R1.754 CCCCCCSCCC(=O)N1CCCCC1 62a_100102558178_100000210757 [0,0,1,1,0,0|2,0,0]=4 14535 B17R1.754 CCCCCCSCOC(=O)C1CCCCC1 62a_100000210314_100009893799 [0,0,1,1,0,0|1,0,0]=3 14536 B17R1.754 CCCCCCSCOC(=O)C1CCCCC1 62a_100009893799_100000210757 [0,0,1,1,0,0|1,0,0]=3 14537 B17R1.754 CCCCOCCCNC(=O)C1CCCCC1 1626a_200000211371_100000210647 [0,0,1,1,0,0|2,0,0]=4 14538 B17R1.754 CCCCOCCCNC(=O)C1CCCCC1 240690a_200000211371_100000210647 [0,0,1,1,0,0|2,0,0]=4 14539 B17R1.754 CCCCOCCCNC(=O)C1CCCCC1 527a_200000211371_100000210647 [0,0,1,1,0,0|2,0,0]=4 14540 B17R1.754 CCCCOCSCOC(=O)C1CCCCC1 62a_100009893799_100011995733 [0,0,1,1,0,0|2,0,0]=4 14541 B17R1.754 CCCCOCSCOC(=O)C1CCCCC1 62a_100011995733_100009893799 [0,0,1,1,0,0|2,0,0]=4 14542 B17R1.754 CCCOCCNCOC(=O)C1CCCCC1 2230a_100161115042_100009893799 [0,0,1,1,0,0|2,0,0]=4 14543 B17R1.754 CCCOCCNCOC(=O)C1CCCCC1 34a_100161115042_100009893799 [0,0,1,1,0,0|2,0,0]=4 14544 B17R1.754 CCCOCCOCOC(=O)C1CCCCC1 34a_100000752267_100009893799 [0,0,1,1,0,0|2,0,0]=4 14545 B17R1.754 CCCOCCSCOC(=O)C1CCCCC1 62a_100009893799_100011215938 [0,0,1,1,0,0|2,0,0]=4 14546 B17R1.754 CCCOCCSCOC(=O)C1CCCCC1 62a_100011215938_100009893799 [0,0,1,1,0,0|2,0,0]=4 14547 B17R1.754 CCCSCCNCOC(=O)C1CCCCC1 2230a_100020603323_100009893799 [0,0,1,1,0,0|2,0,0]=4 14548 B17R1.754 CCCSCCOCOC(=O)C1CCCCC1 34a_200000230433_100009893799 [0,0,1,1,0,0|2,0,0]=4 14549 B17R1.754 CCOCCCNCOC(=O)C1CCCCC1 2230a_100000210961_100009893799 [0,0,1,1,0,0|2,0,0]=4 14550 B17R1.754 CCOCCCNCOC(=O)C1CCCCC1 34a_100000210961_100009893799 [0,0,1,1,0,0|2,0,0]=4 14551 B17R1.754 CCOCCCOCOC(=O)C1CCCCC1 34a_100000757476_100009893799 [0,0,1,1,0,0|2,0,0]=4 14552 B17R1.754 CCOCCCSCOC(=O)C1CCCCC1 62a_100009893799_100012232248 [0,0,1,1,0,0|2,0,0]=4 14553 B17R1.754 CCOCCCSCOC(=O)C1CCCCC1 62a_100012232248_100009893799 [0,0,1,1,0,0|2,0,0]=4 14554 B17R1.754 CCSCCCOCOC(=O)C1CCCCC1 34a_100011216438_100009893799 [0,0,1,1,0,0|2,0,0]=4 14555 B17R1.754 COCCCCOCOC(=O)C1CCCCC1 34a_100000740925_100009893799 [0,0,1,1,0,0|2,0,0]=4 14556 B17R1.754 COCCCCSCOC(=O)C1CCCCC1 62a_100000730899_100009893799 [0,0,1,1,0,0|2,0,0]=4 14557 B17R1.754 COCCCCSCOC(=O)C1CCCCC1 62a_100009893799_100000730899 [0,0,1,1,0,0|2,0,0]=4 14558 B17R1.754 CSCCCCOCOC(=O)C1CCCCC1 34a_100011217163_100009893799 [0,0,1,1,0,0|2,0,0]=4 14559 B17R1.754 NCCCCCOCOC(=O)C1CCCCC1 34a_100000762737_100009893799 [0,0,1,1,0,0|2,0,0]=4 14560 B17R1.754 O=C(CCCCCCCCO)C1CCCCC1 1458a_100000210647_100000033203 [0,0,1,1,0,0|2,0,0]=4 14561 B17R1.754 O=C(NCCCCCCCO)C1CCCCC1 240690a_100011996573_100000210647 [0,0,1,1,0,0|2,0,0]=4 14562 B17R1.754 O=C(OCNCCCCCO)C1CCCCC1 2230a_100000762737_100009893799 [0,0,1,1,0,0|2,0,0]=4 14563 B17R1.754 O=C(OCNCCCCCO)C1CCCCC1 34a_100000762737_100009893799 [0,0,1,1,0,0|2,0,0]=4 14564 B17R1.754 O=C(OCOCCCCCBr)C1CCCCC1 34a_100000746331_100009893799 [0,0,1,1,0,0|2,0,0]=4 14565 B17R1.754 O=C(OCOCCCCCCl)C1CCCCC1 34a_100000746330_100009893799 [0,0,1,1,0,0|2,0,0]=4 14566 B17R1.754 O=C(OCOCCCCCI)C1CCCCC1 34a_200012148887_100009893799 [0,0,1,1,0,0|2,0,0]=4 14567 B17R1.754 O=C(OCSCCCCCF)C1CCCCC1 62a_100000729378_100009893799 [0,0,1,1,0,0|2,0,0]=4 14568 B17R1.754 O=C(OCSCCCCCF)C1CCCCC1 62a_100009893799_100000729378 [0,0,1,1,0,0|2,0,0]=4 14569 B17R1.754 O=C(OCSCCCCCO)C1CCCCC1 62a_100000746330_100009893799 [0,0,1,1,0,0|2,0,0]=4 14570 B17R1.754 O=C(OCSCCCCCO)C1CCCCC1 62a_100009893799_100000746330 [0,0,1,1,0,0|2,0,0]=4 14571 B17R1.1484 CCCCCCCC=CC(=O)CC1CCCC1 1458a_200015332781_100000740388 [0,0,1,1,0,0|1,0,1]=4 14572 B17R1.1484 CCCCCCCCCC(=O)C=C1CCCC1 1458a_100000743260_100000210670 [0,0,1,1,0,0|1,0,1]=4 14573 B17R1.1484 CCCCCCCCCC(=O)CC1CCCC1 1458a_100000210558_100000740388 [0,0,1,1,0,0|1,0,0]=3 14574 B17R1.1484 CCCCCCCCCC(=O)CC1CCCC1 1458a_100000210891_100000210670 [0,0,1,1,0,0|1,0,0]=3 14575 B17R1.1484 CCCCCCCCCC(=O)CC1CCCO1 1458a_100000210558_100000203698 [0,0,1,1,0,0|2,0,0]=4 14576 B17R1.1484 CCCCCCCCCC(=O)CC1CCOC1 1458a_100000210558_100000702531 [0,0,1,1,0,0|2,0,0]=4 14577 B17R1.1484 CCCCCCCCCC(=O)CC1CCOC1 1458a_100011218419_100000210670 [0,0,1,1,0,0|2,0,0]=4 14578 B17R1.1484 CCCCCCCCCC(=O)CN1CCCC1 1458a_100000740243_100000210670 [0,0,1,1,0,0|2,0,0]=4 14579 B17R1.1484 CCCCCCCCCC(=O)NC1CCCC1 11a_100000211070_100000210558 [0,0,1,1,0,0|1,0,0]=3 14580 B17R1.1484 CCCCCCCCCC(=O)NC1CCCC1 1626a_100000211070_100000210558 [0,0,1,1,0,0|1,0,0]=3 14581 B17R1.1484 CCCCCCCCCC(=O)NC1CCCC1 240690a_100000211070_100000210558 [0,0,1,1,0,0|1,0,0]=3 14582 B17R1.1484 CCCCCCCCCC(=O)NC1CCCC1 527a_100000211070_100000210558 [0,0,1,1,0,0|1,0,0]=3 14583 B17R1.1484 CCCCCCCCCC(=O)N[C@@H]1CCOC1 240690a_200015188469_100000210558 [0,0,1,1,0,0|2,0,0]=4 14584 B17R1.1484 CCCCCCCCCC(=O)N[C@@H]1CCOC1 527a_200015188469_100000210558 [0,0,1,1,0,0|2,0,0]=4 14585 B17R1.1484 CCCCCCCCCC(=O)N[C@H]1CCOC1 11a_100015188467_100000210558 [0,0,1,1,0,0|2,0,0]=4 14586 B17R1.1484 CCCCCCCCCC(=O)N[C@H]1CCOC1 1626a_100015188467_100000210558 [0,0,1,1,0,0|2,0,0]=4 14587 B17R1.1484 CCCCCCCCCC(=O)N[C@H]1CCOC1 240690a_100015188467_100000210558 [0,0,1,1,0,0|2,0,0]=4 14588 B17R1.1484 CCCCCCCCCC(=O)N[C@H]1CCOC1 527a_100015188467_100000210558 [0,0,1,1,0,0|2,0,0]=4 14589 B17R1.1484 CCCCCCCCCC(C)OC1CCCC1 34a_100011218016_100000179811 [0,0,1,1,0,0|1,0,1]=4 14590 B17R1.1484 CCCCCCCCCC(C)OC1CCCC1 7a_100011218016_100000179811 [0,0,1,1,0,0|1,0,1]=4 14591 B17R1.1484 CCCCCCCCNC(=O)CC1CCCC1 11a_100000229939_100000210891 [0,0,1,1,0,0|1,0,0]=3 14592 B17R1.1484 CCCCCCCCNC(=O)CC1CCCC1 1626a_100000229939_100000210891 [0,0,1,1,0,0|1,0,0]=3 14593 B17R1.1484 CCCCCCCCNC(=O)CC1CCCC1 240690a_100000229939_100000210891 [0,0,1,1,0,0|1,0,0]=3 14594 B17R1.1484 CCCCCCCCNC(=O)CC1CCCC1 527a_100000229939_100000210891 [0,0,1,1,0,0|1,0,0]=3 14595 B17R1.1484 CCCCCCCCNC(=O)CC1CCOC1 11a_100000229939_100011218419 [0,0,1,1,0,0|2,0,0]=4 14596 B17R1.1484 CCCCCCCCNC(=O)CC1CCOC1 1626a_100000229939_100011218419 [0,0,1,1,0,0|2,0,0]=4 14597 B17R1.1484 CCCCCCCCNC(=O)CC1CCOC1 240690a_100000229939_100011218419 [0,0,1,1,0,0|2,0,0]=4 14598 B17R1.1484 CCCCCCCCNC(=O)CC1CCOC1 527a_100000229939_100011218419 [0,0,1,1,0,0|2,0,0]=4 14599 B17R1.1484 CCCCCCCCNC(=O)CN1CCCC1 240690a_100000229939_100000740243 [0,0,1,1,0,0|2,0,0]=4 14600 B17R1.1484 CCCCCCCCNC(=O)CN1CCCC1 527a_100000229939_100000740243 [0,0,1,1,0,0|2,0,0]=4 14601 B17R1.1484 CCCCCCCCNC(=O)NC1CCCC1 2708a_100000211070_100000229939 [0,0,1,1,0,0|2,0,0]=4 14602 B17R1.1484 CCCCCCCCNC(=O)NC1CCCC1 2708a_100000229939_100000211070 [0,0,1,1,0,0|2,0,0]=4 14603 B17R1.1484 CCCCCCCCNC(=O)NC1CCCC1 273464a_100000211070_100000229939 [0,0,1,1,0,0|2,0,0]=4 14604 B17R1.1484 CCCCCCCCNC(=O)NC1CCCC1 273464a_100000229939_100000211070 [0,0,1,1,0,0|2,0,0]=4 14605 B17R1.1484 CCCCCCCCNC(=O)NC1CCCC1 512a_100000211070_100000229939 [0,0,1,1,0,0|2,0,0]=4 14606 B17R1.1484 CCCCCCCCNC(=O)NC1CCCC1 512a_100000229939_100000211070 [0,0,1,1,0,0|2,0,0]=4 14607 B17R1.1484 CCCCCCCNCC(=O)NC1CCCC1 2230a_100000229938_100000183512 [0,0,1,1,0,0|2,0,0]=4 14608 B17R1.1484 CCCCCCCNCC(=O)NC1CCCC1 2230a_100000747513_100000210681 [0,0,1,1,0,0|2,0,0]=4 14609 B17R1.1484 CCCCCCCOCC(=O)NC1CCCC1 34a_100000210272_100000183512 [0,0,1,1,0,0|2,0,0]=4 14610 B17R1.1484 CCCCCCCOCC(=O)NC1CCCC1 7a_100000210272_100000183512 [0,0,1,1,0,0|2,0,0]=4 14611 B17R1.1484 CCCCCCCSCC(=O)NC1CCCC1 62a_100000183512_100000210316 [0,0,1,1,0,0|2,0,0]=4 14612 B17R1.1484 CCCCCCCSCC(=O)NC1CCCC1 62a_100000210614_100000183512 [0,0,1,1,0,0|2,0,0]=4 14613 B17R1.1484 CCCCCCNCCC(=O)NC1CCCC1 2230a_100000210581_100000743710 [0,0,1,1,0,0|2,0,0]=4 14614 B17R1.1484 CCCCCCOCCC(=O)NC1CCCC1 7a_100000210259_100000743710 [0,0,1,1,0,0|2,0,0]=4 14615 B17R1.1484 CCCCCCSCCC(=O)NC1CCCC1 62a_100000210314_100000743710 [0,0,1,1,0,0|2,0,0]=4 14616 B17R1.1484 CCCCCCSCCC(=O)NC1CCCC1 62a_100000743710_100000210757 [0,0,1,1,0,0|2,0,0]=4 14617 B17R1.1484 CCCCOCCCNC(=O)CC1CCCC1 1626a_200000211371_100000210891 [0,0,1,1,0,0|2,0,0]=4 14618 B17R1.1484 CCCCOCCCNC(=O)CC1CCCC1 240690a_200000211371_100000210891 [0,0,1,1,0,0|2,0,0]=4 14619 B17R1.1484 CCCCOCCCNC(=O)CC1CCCC1 527a_200000211371_100000210891 [0,0,1,1,0,0|2,0,0]=4 14620 B17R1.1484 O=C(CC1CCCC1)NCCCCCCCO 240690a_100011996573_100000210891 [0,0,1,1,0,0|2,0,0]=4 14621 B17R1.1484 O=C(CCCCCCCCO)CC1CCCC1 1458a_100000210891_100000033203 [0,0,1,1,0,0|2,0,0]=4 14622 B17R1.1484 O=C(CCCCCCCCO)NC1CCCC1 240690a_100000211070_100000015970 [0,0,1,1,0,0|2,0,0]=4 14623 B17R1.5074 CCCCCCC(=O)CCC1CCCCN1C 1458a_100000718493_100000210757 [0,0,1,1,0,0|2,0,0]=4 14624 B17R1.5074 CCCCCCC(=O)CCC1CCCCN1C 1458a_100102632555_100000211948 [0,0,1,1,0,0|2,0,0]=4 14625 B17R1.5074 CCCCCCC(=O)COC1CCCCC1C 1458a_100011223357_100000210757 [0,0,1,1,0,0|2,0,0]=4 14626 B17R1.5074 CCCCCCC(=O)NCC1CCCCC1O 240690a_100011216029_100102632555 [0,0,1,1,0,0|2,0,0]=4 14627 B17R1.5074 CCCCCCC(=O)NCC1CCCCC1O 527a_100011216029_100102632555 [0,0,1,1,0,0|2,0,0]=4 14628 B17R1.5074 CCCCCCC(=O)NCC1CCCCN1C 240690a_100011228421_100102632555 [0,0,1,1,0,0|2,0,0]=4 14629 B17R1.5074 CCCCCCC(=O)NCC1CCCCN1C 527a_100011228421_100102632555 [0,0,1,1,0,0|2,0,0]=4 14630 B17R1.5074 CCCCCNC(=O)CCC1CCCCN1C 240690a_100000209983_100000718493 [0,0,1,1,0,0|2,0,0]=4 14631 B17R1.5074 CCCCCNC(=O)CCC1CCCCN1C 527a_100000209983_100000718493 [0,0,1,1,0,0|2,0,0]=4 14632 B17R1.5074 CCCCCNC(=O)CCN1CCCCC1C 240690a_100000209983_100000727554 [0,0,1,1,0,0|2,0,0]=4 14633 B17R1.5074 CCCCCNC(=O)CNC1CCCCC1C 2230a_100000211402_100000230301 [0,0,1,1,0,0|2,0,0]=4 14634 B17R1.5074 CCCCCNC(=O)CNC1CCCCC1C 34a_100000211402_100000230301 [0,0,1,1,0,0|2,0,0]=4 14635 B17R1.5074 CCCCCNC(=O)COC1CCCCC1C 11a_100000209983_100011223357 [0,0,1,1,0,0|2,0,0]=4 14636 B17R1.5074 CCCCCNC(=O)COC1CCCCC1C 1626a_100000209983_100011223357 [0,0,1,1,0,0|2,0,0]=4 14637 B17R1.5074 CCCCCNC(=O)COC1CCCCC1C 240690a_100000209983_100011223357 [0,0,1,1,0,0|2,0,0]=4 14638 B17R1.5074 CCCCCNC(=O)COC1CCCCC1C 34a_100000211207_100000230301 [0,0,1,1,0,0|2,0,0]=4 14639 B17R1.5074 CCCCCNC(=O)COC1CCCCC1C 527a_100000209983_100011223357 [0,0,1,1,0,0|2,0,0]=4 14640 B17R1.5074 CCCCCNC(=O)COC1CCCCC1C 7a_100000211207_100000230301 [0,0,1,1,0,0|2,0,0]=4 14641 B17R1.5074 CCOCCOC(=O)CNC1CCCCC1C 2230a_100000211402_200000101388 [0,0,1,1,0,0|2,0,0]=4 14642 B17R1.5074 CCOCCOC(=O)CNC1CCCCC1C 34a_100000211402_200000101388 [0,0,1,1,0,0|2,0,0]=4 14643 B17R1.5074 CCOCCOC(=O)COC1CCCCC1C 34a_100000211207_200000101388 [0,0,1,1,0,0|2,0,0]=4 14644 B17R1.5074 CCOCCOC(=O)COC1CCCCC1C 7a_100000211207_200000101388 [0,0,1,1,0,0|2,0,0]=4 14645 B17R1.5086 CCCCCCC(=O)NCCCC1CCCC1 11a_100000736752_100102632555 [0,0,1,1,0,0|1,0,0]=3 14646 B17R1.5086 CCCCCCC(=O)NCCCC1CCCC1 1626a_100000736752_100102632555 [0,0,1,1,0,0|1,0,0]=3 14647 B17R1.5086 CCCCCCC(=O)NCCCC1CCCC1 240690a_100000736752_100102632555 [0,0,1,1,0,0|1,0,0]=3 14648 B17R1.5086 CCCCCCC(=O)NCCCC1CCCC1 527a_100000736752_100102632555 [0,0,1,1,0,0|1,0,0]=3 14649 B17R1.5086 CCCCCCC(=O)NCCCN1CCCC1 240690a_100000204695_100102632555 [0,0,1,1,0,0|2,0,0]=4 14650 B17R1.5086 CCCCCCC(=O)NCCOC1CCCC1 11a_100000741755_100102632555 [0,0,1,1,0,0|2,0,0]=4 14651 B17R1.5086 CCCCCCC(=O)NCCOC1CCCC1 1626a_100000741755_100102632555 [0,0,1,1,0,0|2,0,0]=4 14652 B17R1.5086 CCCCCCC(=O)NCCOC1CCCC1 240690a_100000741755_100102632555 [0,0,1,1,0,0|2,0,0]=4 14653 B17R1.5086 CCCCCCC(=O)NCCOC1CCCC1 527a_100000741755_100102632555 [0,0,1,1,0,0|2,0,0]=4 14654 B17R1.5086 CCCCCCC(C)OCCCC1CCCC1 34a_100000210265_100011713738 [0,0,1,1,0,0|1,0,1]=4 14655 B17R1.5086 CCCCCCC(C)OCCCC1CCCC1 34a_100011215328_100011215978 [0,0,1,1,0,0|1,0,1]=4 14656 B17R1.5086 CCCCCCC(C)OCCCC1CCCC1 7a_100000210265_100011713738 [0,0,1,1,0,0|1,0,1]=4 14657 B17R1.5086 CCCCCCC(C)OCCCC1CCCC1 7a_100011215328_100011215978 [0,0,1,1,0,0|1,0,1]=4 14658 B17R1.5086 CCCCCNC(=O)CNCCC1CCCC1 2230a_100000739158_100000230301 [0,0,1,1,0,0|2,0,0]=4 14659 B17R1.5086 CCCCCNC(=O)CNCCC1CCCC1 34a_100000739158_100000230301 [0,0,1,1,0,0|2,0,0]=4 14660 B17R1.5086 CCCCCNC(=O)COCCC1CCCC1 34a_100000749090_100000230301 [0,0,1,1,0,0|2,0,0]=4 14661 B17R1.5086 CCCCCNC(=O)COCCC1CCCC1 7a_100000749090_100000230301 [0,0,1,1,0,0|2,0,0]=4 14662 B17R1.5086 CCCCCNC(=O)CSCCC1CCCC1 62a_100000230301_100000760354 [0,0,1,1,0,0|2,0,0]=4 14663 B17R1.5086 CCCCCNC(=O)CSCCC1CCCC1 62a_100000760354_100000230301 [0,0,1,1,0,0|2,0,0]=4 14664 B17R1.5086 CCCCCNC(=O)NCCCC1CCCC1 2708a_100000209983_100000736752 [0,0,1,1,0,0|2,0,0]=4 14665 B17R1.5086 CCCCCNC(=O)NCCCC1CCCC1 2708a_100000736752_100000209983 [0,0,1,1,0,0|2,0,0]=4 14666 B17R1.5086 CCCCCNC(=O)NCCCC1CCCC1 273464a_100000209983_100000736752 [0,0,1,1,0,0|2,0,0]=4 14667 B17R1.5086 CCCCCNC(=O)NCCCC1CCCC1 273464a_100000736752_100000209983 [0,0,1,1,0,0|2,0,0]=4 14668 B17R1.5086 CCCCCNC(=O)NCCCC1CCCC1 512a_100000209983_100000736752 [0,0,1,1,0,0|2,0,0]=4 14669 B17R1.5086 CCCCCNC(=O)NCCCC1CCCC1 512a_100000736752_100000209983 [0,0,1,1,0,0|2,0,0]=4 14670 B17R1.5086 CCCCOCC(=O)NCCCC1CCCC1 11a_100000736752_100000757543 [0,0,1,1,0,0|2,0,0]=4 14671 B17R1.5086 CCCCOCC(=O)NCCCC1CCCC1 1626a_100000736752_100000757543 [0,0,1,1,0,0|2,0,0]=4 14672 B17R1.5086 CCCCOCC(=O)NCCCC1CCCC1 240690a_100000736752_100000757543 [0,0,1,1,0,0|2,0,0]=4 14673 B17R1.5086 CCCCOCC(=O)NCCCC1CCCC1 527a_100000736752_100000757543 [0,0,1,1,0,0|2,0,0]=4 14674 B17R1.5086 CCCCSCC(=O)NCCCC1CCCC1 11a_100000736752_100000191162 [0,0,1,1,0,0|2,0,0]=4 14675 B17R1.5086 CCCCSCC(=O)NCCCC1CCCC1 1626a_100000736752_100000191162 [0,0,1,1,0,0|2,0,0]=4 14676 B17R1.5086 CCCCSCC(=O)NCCCC1CCCC1 240690a_100000736752_100000191162 [0,0,1,1,0,0|2,0,0]=4 14677 B17R1.5086 CCCCSCC(=O)NCCCC1CCCC1 527a_100000736752_100000191162 [0,0,1,1,0,0|2,0,0]=4 14678 B17R1.5086 CCOCCOC(=O)CNCCC1CCCC1 2230a_100000739158_200000101388 [0,0,1,1,0,0|2,0,0]=4 14679 B17R1.5086 CCOCCOC(=O)CNCCC1CCCC1 34a_100000739158_200000101388 [0,0,1,1,0,0|2,0,0]=4 14680 B17R1.5086 CCOCCOC(=O)COCCC1CCCC1 34a_100000749090_200000101388 [0,0,1,1,0,0|2,0,0]=4 14681 B17R1.5086 CCOCCOC(=O)COCCC1CCCC1 7a_100000749090_200000101388 [0,0,1,1,0,0|2,0,0]=4 14682 B17R1.5086 CCOCCOC(=O)CSCCC1CCCC1 62a_100000760354_200000101388 [0,0,1,1,0,0|2,0,0]=4 14683 B17R1.5086 CCOCCOC(=O)CSCCC1CCCC1 62a_200000101388_100000760354 [0,0,1,1,0,0|2,0,0]=4 14684 B17R1.5086 O=C(CCCCCO)NCCCC1CCCC1 240690a_100000736752_100102619762 [0,0,1,1,0,0|2,0,0]=4 14685 B17R1.5106 CCCC1CCCCN1C(=O)CCCCCO 240690a_100000701414_100102619762 [0,0,1,1,0,0|2,0,0]=4 14686 B17R1.5106 CCCCCCC(=O)C1CCCCN1CCC 1458a_100000743559_100000210757 [0,0,1,1,0,0|2,0,0]=4 14687 B17R1.5106 CCCCCCC(=O)N1CCCCC1CCC 11a_100000701414_100102632555 [0,0,1,1,0,0|1,0,0]=3 14688 B17R1.5106 CCCCCCC(=O)N1CCCCC1CCC 1626a_100000701414_100102632555 [0,0,1,1,0,0|1,0,0]=3 14689 B17R1.5106 CCCCCCC(=O)N1CCCCC1CCC 240690a_100000701414_100102632555 [0,0,1,1,0,0|1,0,0]=3 14690 B17R1.5106 CCCCCCC(=O)N1CCCCC1CCC 527a_100000701414_100102632555 [0,0,1,1,0,0|1,0,0]=3 14691 B17R1.5106 CCCCCCC(=O)N1CCCCC1CCO 240690a_100000211664_100102632555 [0,0,1,1,0,0|2,0,0]=4 14692 B17R1.5106 CCCCCCC(=O)N1CCCCC1COC 11a_100015184032_100102632555 [0,0,1,1,0,0|2,0,0]=4 14693 B17R1.5106 CCCCCCC(=O)N1CCCCC1COC 1626a_100015184032_100102632555 [0,0,1,1,0,0|2,0,0]=4 14694 B17R1.5106 CCCCCCC(=O)N1CCCCC1COC 240690a_100015184032_100102632555 [0,0,1,1,0,0|2,0,0]=4 14695 B17R1.5106 CCCCCCC(=O)N1CCCCC1COC 527a_100015184032_100102632555 [0,0,1,1,0,0|2,0,0]=4 14696 B17R1.5106 CCCCCCC(=O)N1CCOCC1CCC 11a_102495339903_100102632555 [0,0,1,1,0,0|2,0,0]=4 14697 B17R1.5106 CCCCCCC(=O)N1CCOCC1CCC 1626a_102495339903_100102632555 [0,0,1,1,0,0|2,0,0]=4 14698 B17R1.5106 CCCCCCC(=O)N1CCOCC1CCC 240690a_102495339903_100102632555 [0,0,1,1,0,0|2,0,0]=4 14699 B17R1.5106 CCCCCCC(=O)N1CCOCC1CCC 527a_102495339903_100102632555 [0,0,1,1,0,0|2,0,0]=4 14700 B17R1.5106 CCCCCNC(=O)C1CCCCN1CCC 240690a_100000209983_100000743559 [0,0,1,1,0,0|2,0,0]=4 14701 B17R1.5106 CCCCCNC(=O)N1CCCCC1CCC 2708a_100000209983_100000701414 [0,0,1,1,0,0|2,0,0]=4 14702 B17R1.5106 CCCCCNC(=O)N1CCCCC1CCC 273464a_100000209983_100000701414 [0,0,1,1,0,0|2,0,0]=4 14703 B17R1.5106 CCCCOCC(=O)N1CCCCC1CCC 11a_100000701414_100000757543 [0,0,1,1,0,0|2,0,0]=4 14704 B17R1.5106 CCCCOCC(=O)N1CCCCC1CCC 1626a_100000701414_100000757543 [0,0,1,1,0,0|2,0,0]=4 14705 B17R1.5106 CCCCOCC(=O)N1CCCCC1CCC 240690a_100000701414_100000757543 [0,0,1,1,0,0|2,0,0]=4 14706 B17R1.5106 CCCCOCC(=O)N1CCCCC1CCC 527a_100000701414_100000757543 [0,0,1,1,0,0|2,0,0]=4 14707 B17R1.5106 CCCCSCC(=O)N1CCCCC1CCC 11a_100000701414_100000191162 [0,0,1,1,0,0|2,0,0]=4 14708 B17R1.5106 CCCCSCC(=O)N1CCCCC1CCC 1626a_100000701414_100000191162 [0,0,1,1,0,0|2,0,0]=4 14709 B17R1.5106 CCCCSCC(=O)N1CCCCC1CCC 240690a_100000701414_100000191162 [0,0,1,1,0,0|2,0,0]=4 14710 B17R1.5106 CCCCSCC(=O)N1CCCCC1CCC 527a_100000701414_100000191162 [0,0,1,1,0,0|2,0,0]=4 14711 B17R1.6493 CCCCCCC(=O)NCC1CCCN1CC 11a_100000211693_100102632555 [0,0,1,1,0,0|2,0,0]=4 14712 B17R1.6493 CCCCCCC(=O)NCC1CCCN1CC 1626a_100000211693_100102632555 [0,0,1,1,0,0|2,0,0]=4 14713 B17R1.6493 CCCCCCC(=O)NCC1CCCN1CC 240690a_100000211693_100102632555 [0,0,1,1,0,0|2,0,0]=4 14714 B17R1.6493 CCCCCCC(=O)NCC1CCCN1CC 527a_100000211693_100102632555 [0,0,1,1,0,0|2,0,0]=4 14715 B17R1.6494 CCCCCCC(=O)NCCC1CCCN1C 240690a_100011219722_100102632555 [0,0,1,1,0,0|2,0,0]=4 14716 B17R1.6494 CCCCCCC(=O)NCCC1CCCN1C 527a_100011219722_100102632555 [0,0,1,1,0,0|2,0,0]=4 14717 B17R1.6511 CCCCCCC(=O)NC1CCCCC1OC 11a_100011208099_100102632555 [0,0,1,1,0,0|2,0,0]=4 14718 B17R1.6511 CCCCCCC(=O)NC1CCCCC1OC 1626a_100011208099_100102632555 [0,0,1,1,0,0|2,0,0]=4 14719 B17R1.6511 CCCCCCC(=O)NC1CCCCC1OC 240690a_100011208099_100102632555 [0,0,1,1,0,0|2,0,0]=4 14720 B17R1.6511 CCCCCCC(=O)NC1CCCCC1OC 527a_100011208099_100102632555 [0,0,1,1,0,0|2,0,0]=4 14721 B17R1.6511 CCCCCCC(C)OC1CCCCC1CC 34a_100000210738_100011215978 [0,0,1,1,0,0|1,0,1]=4 14722 B17R1.6511 CCCCCCC(C)OC1CCCCC1CC 7a_100000210738_100011215978 [0,0,1,1,0,0|1,0,1]=4 14723 B17R1.6511 CCCCCNC(=O)CN1CCCCC1CC 2230a_100000210034_100000230301 [0,0,1,1,0,0|2,0,0]=4 14724 B17R1.6511 CCCCCNC(=O)CN1CCCCC1CC 269982a_100000210034_100000230301 [0,0,1,1,0,0|2,0,0]=4 14725 B17R1.6511 CCCCCNC(=O)CN1CCCCC1CC 34a_100000210034_100000230301 [0,0,1,1,0,0|2,0,0]=4 14726 B17R1.6511 CCOCCOC(=O)CN1CCCCC1CC 2230a_100000210034_200000101388 [0,0,1,1,0,0|2,0,0]=4 14727 B17R1.6511 CCOCCOC(=O)CN1CCCCC1CC 269982a_100000210034_200000101388 [0,0,1,1,0,0|2,0,0]=4 14728 B17R1.6511 CCOCCOC(=O)CN1CCCCC1CC 34a_100000210034_200000101388 [0,0,1,1,0,0|2,0,0]=4 14729 B17R1.7823 CCCCC=CC(=O)CCCC1CCCCC1 1458a_100016266645_100011713725 [0,0,1,1,0,0|1,0,1]=4 14730 B17R1.7823 CCCCCCC(=O)CCCC1CCCCC1 1458a_100000211478_100000210757 [0,0,1,1,0,0|1,0,0]=3 14731 B17R1.7823 CCCCCCC(=O)CCCC1CCCCC1 1458a_100102632555_100011713725 [0,0,1,1,0,0|1,0,0]=3 14732 B17R1.7823 CCCCCCC(=O)CCCN1CCCCC1 1458a_100000742516_100000210757 [0,0,1,1,0,0|2,0,0]=4 14733 B17R1.7823 CCCCCCC(=O)CCCN1CCCCC1 1458a_100102632555_100000690320 [0,0,1,1,0,0|2,0,0]=4 14734 B17R1.7823 CCCCCCC(=O)CCOC1CCCCC1 1458a_100102632555_100011211530 [0,0,1,1,0,0|2,0,0]=4 14735 B17R1.7823 CCCCCCC(=O)NCCC1CCCCC1 11a_100000738074_100102632555 [0,0,1,1,0,0|1,0,0]=3 14736 B17R1.7823 CCCCCCC(=O)NCCC1CCCCC1 1626a_100000738074_100102632555 [0,0,1,1,0,0|1,0,0]=3 14737 B17R1.7823 CCCCCCC(=O)NCCC1CCCCC1 240690a_100000738074_100102632555 [0,0,1,1,0,0|1,0,0]=3 14738 B17R1.7823 CCCCCCC(=O)NCCC1CCCCC1 527a_100000738074_100102632555 [0,0,1,1,0,0|1,0,0]=3 14739 B17R1.7823 CCCCCCC(=O)NCCC1CCCCO1 11a_100015183643_100102632555 [0,0,1,1,0,0|2,0,0]=4 14740 B17R1.7823 CCCCCCC(=O)NCCC1CCCCO1 1626a_100015183643_100102632555 [0,0,1,1,0,0|2,0,0]=4 14741 B17R1.7823 CCCCCCC(=O)NCCC1CCCCO1 240690a_100015183643_100102632555 [0,0,1,1,0,0|2,0,0]=4 14742 B17R1.7823 CCCCCCC(=O)NCCC1CCCCO1 527a_100015183643_100102632555 [0,0,1,1,0,0|2,0,0]=4 14743 B17R1.7823 CCCCCCC(=O)NCCC1CCOCC1 11a_100000755988_100102632555 [0,0,1,1,0,0|2,0,0]=4 14744 B17R1.7823 CCCCCCC(=O)NCCC1CCOCC1 1626a_100000755988_100102632555 [0,0,1,1,0,0|2,0,0]=4 14745 B17R1.7823 CCCCCCC(=O)NCCC1CCOCC1 240690a_100000755988_100102632555 [0,0,1,1,0,0|2,0,0]=4 14746 B17R1.7823 CCCCCCC(=O)NCCC1CCOCC1 527a_100000755988_100102632555 [0,0,1,1,0,0|2,0,0]=4 14747 B17R1.7823 CCCCCCC(=O)NCCN1CCCCC1 240690a_100000216509_100102632555 [0,0,1,1,0,0|2,0,0]=4 14748 B17R1.7823 CCCCCCC(=O)NCCN1CCCCC1 527a_100000216509_100102632555 [0,0,1,1,0,0|2,0,0]=4 14749 B17R1.7823 CCCCCCC(=O)NNCC1CCCCC1 22a_100000740227_100102632555 [0,0,1,1,0,0|2,0,0]=4 14750 B17R1.7823 CCCCCCC(C)OCCC1CCCCC1 34a_100000210265_100011209188 [0,0,1,1,0,0|1,0,1]=4 14751 B17R1.7823 CCCCCCC(C)OCCC1CCCCC1 34a_100011217863_100011215978 [0,0,1,1,0,0|1,0,1]=4 14752 B17R1.7823 CCCCCCC(C)OCCC1CCCCC1 7a_100000210265_100011273959 [0,0,1,1,0,0|1,0,1]=4 14753 B17R1.7823 CCCCCCC(C)OCCC1CCCCC1 7a_100011217863_100011215978 [0,0,1,1,0,0|1,0,1]=4 14754 B17R1.7823 CCCCCNC(=O)CCCC1CCCCC1 11a_100000209983_100000211478 [0,0,1,1,0,0|1,0,0]=3 14755 B17R1.7823 CCCCCNC(=O)CCCC1CCCCC1 1626a_100000209983_100000211478 [0,0,1,1,0,0|1,0,0]=3 14756 B17R1.7823 CCCCCNC(=O)CCCC1CCCCC1 240690a_100000209983_100000211478 [0,0,1,1,0,0|1,0,0]=3 14757 B17R1.7823 CCCCCNC(=O)CCCC1CCCCC1 527a_100000209983_100000211478 [0,0,1,1,0,0|1,0,0]=3 14758 B17R1.7823 CCCCCNC(=O)CCCN1CCCCC1 240690a_100000209983_100000742516 [0,0,1,1,0,0|2,0,0]=4 14759 B17R1.7823 CCCCCNC(=O)CNCC1CCCCC1 2230a_100000210473_100000230301 [0,0,1,1,0,0|2,0,0]=4 14760 B17R1.7823 CCCCCNC(=O)CNCC1CCCCC1 34a_100000210473_100000230301 [0,0,1,1,0,0|2,0,0]=4 14761 B17R1.7823 CCCCCNC(=O)COCC1CCCCC1 34a_100000212181_100000230301 [0,0,1,1,0,0|2,0,0]=4 14762 B17R1.7823 CCCCCNC(=O)COCC1CCCCC1 7a_100000212181_100000230301 [0,0,1,1,0,0|2,0,0]=4 14763 B17R1.7823 CCCCCNC(=O)CSCC1CCCCC1 62a_100000211423_100000230301 [0,0,1,1,0,0|2,0,0]=4 14764 B17R1.7823 CCCCCNC(=O)CSCC1CCCCC1 62a_100000230301_100000211423 [0,0,1,1,0,0|2,0,0]=4 14765 B17R1.7823 CCCCCNC(=O)NCCC1CCCCC1 2708a_100000209983_100000738074 [0,0,1,1,0,0|2,0,0]=4 14766 B17R1.7823 CCCCCNC(=O)NCCC1CCCCC1 2708a_100000738074_100000209983 [0,0,1,1,0,0|2,0,0]=4 14767 B17R1.7823 CCCCCNC(=O)NCCC1CCCCC1 273464a_100000209983_100000738074 [0,0,1,1,0,0|2,0,0]=4 14768 B17R1.7823 CCCCCNC(=O)NCCC1CCCCC1 273464a_100000738074_100000209983 [0,0,1,1,0,0|2,0,0]=4 14769 B17R1.7823 CCCCCNC(=O)NCCC1CCCCC1 512a_100000209983_100000738074 [0,0,1,1,0,0|2,0,0]=4 14770 B17R1.7823 CCCCCNC(=O)NCCC1CCCCC1 512a_100000738074_100000209983 [0,0,1,1,0,0|2,0,0]=4 14771 B17R1.7823 CCCCNNC(=O)CCCC1CCCCC1 22a_100025702795_100000211478 [0,0,1,1,0,0|2,0,0]=4 14772 B17R1.7823 CCCCOCC(=O)CCCC1CCCCC1 1458a_100000211478_100011995733 [0,0,1,1,0,0|2,0,0]=4 14773 B17R1.7823 CCCCOCC(=O)CCCC1CCCCC1 1458a_100000757543_100011713725 [0,0,1,1,0,0|2,0,0]=4 14774 B17R1.7823 CCCCOCC(=O)NCCC1CCCCC1 11a_100000738074_100000757543 [0,0,1,1,0,0|2,0,0]=4 14775 B17R1.7823 CCCCOCC(=O)NCCC1CCCCC1 1626a_100000738074_100000757543 [0,0,1,1,0,0|2,0,0]=4 14776 B17R1.7823 CCCCOCC(=O)NCCC1CCCCC1 240690a_100000738074_100000757543 [0,0,1,1,0,0|2,0,0]=4 14777 B17R1.7823 CCCCOCC(=O)NCCC1CCCCC1 527a_100000738074_100000757543 [0,0,1,1,0,0|2,0,0]=4 14778 B17R1.7823 CCCCSCC(=O)CCCC1CCCCC1 1458a_100000191162_100011713725 [0,0,1,1,0,0|2,0,0]=4 14779 B17R1.7823 CCCCSCC(=O)NCCC1CCCCC1 11a_100000738074_100000191162 [0,0,1,1,0,0|2,0,0]=4 14780 B17R1.7823 CCCCSCC(=O)NCCC1CCCCC1 1626a_100000738074_100000191162 [0,0,1,1,0,0|2,0,0]=4 14781 B17R1.7823 CCCCSCC(=O)NCCC1CCCCC1 240690a_100000738074_100000191162 [0,0,1,1,0,0|2,0,0]=4 14782 B17R1.7823 CCCCSCC(=O)NCCC1CCCCC1 527a_100000738074_100000191162 [0,0,1,1,0,0|2,0,0]=4 14783 B17R1.7823 CCCOCCC(=O)CCCC1CCCCC1 1458a_100000211478_100011215938 [0,0,1,1,0,0|2,0,0]=4 14784 B17R1.7823 CCOCCCC(=O)CCCC1CCCCC1 1458a_100000211478_100012232248 [0,0,1,1,0,0|2,0,0]=4 14785 B17R1.7823 CCOCCNC(=O)CCCC1CCCCC1 11a_100011200944_100000211478 [0,0,1,1,0,0|2,0,0]=4 14786 B17R1.7823 CCOCCNC(=O)CCCC1CCCCC1 1626a_102516460346_100000211478 [0,0,1,1,0,0|2,0,0]=4 14787 B17R1.7823 CCOCCNC(=O)CCCC1CCCCC1 240690a_100011200944_100000211478 [0,0,1,1,0,0|2,0,0]=4 14788 B17R1.7823 CCOCCNC(=O)CCCC1CCCCC1 527a_100011200944_100000211478 [0,0,1,1,0,0|2,0,0]=4 14789 B17R1.7823 CCOCCOC(=O)CNCC1CCCCC1 2230a_100000210473_200000101388 [0,0,1,1,0,0|2,0,0]=4 14790 B17R1.7823 CCOCCOC(=O)CNCC1CCCCC1 34a_100000210473_200000101388 [0,0,1,1,0,0|2,0,0]=4 14791 B17R1.7823 CCOCCOC(=O)COCC1CCCCC1 34a_100000212181_200000101388 [0,0,1,1,0,0|2,0,0]=4 14792 B17R1.7823 CCOCCOC(=O)COCC1CCCCC1 7a_100000212181_200000101388 [0,0,1,1,0,0|2,0,0]=4 14793 B17R1.7823 CCOCCOC(=O)CSCC1CCCCC1 62a_100000211423_200000101388 [0,0,1,1,0,0|2,0,0]=4 14794 B17R1.7823 CCOCCOC(=O)CSCC1CCCCC1 62a_200000101388_100000211423 [0,0,1,1,0,0|2,0,0]=4 14795 B17R1.7823 CCSCCNC(=O)CCCC1CCCCC1 11a_100000106463_100000211478 [0,0,1,1,0,0|2,0,0]=4 14796 B17R1.7823 CCSCCNC(=O)CCCC1CCCCC1 1626a_100000106463_100000211478 [0,0,1,1,0,0|2,0,0]=4 14797 B17R1.7823 CCSCCNC(=O)CCCC1CCCCC1 240690a_100000106463_100000211478 [0,0,1,1,0,0|2,0,0]=4 14798 B17R1.7823 CCSCCNC(=O)CCCC1CCCCC1 527a_100000106463_100000211478 [0,0,1,1,0,0|2,0,0]=4 14799 B17R1.7823 COCCCCC(=O)CCCC1CCCCC1 1458a_100000211478_100000755781 [0,0,1,1,0,0|2,0,0]=4 14800 B17R1.7823 COCCCNC(=O)CCCC1CCCCC1 1626a_100150723488_100000211478 [0,0,1,1,0,0|2,0,0]=4 14801 B17R1.7823 COCCCNC(=O)CCCC1CCCCC1 240690a_100150723488_100000211478 [0,0,1,1,0,0|2,0,0]=4 14802 B17R1.7823 COCCCNC(=O)CCCC1CCCCC1 527a_100150723488_100000211478 [0,0,1,1,0,0|2,0,0]=4 14803 B17R1.7823 CSCCCNC(=O)CCCC1CCCCC1 11a_100000749238_100000211478 [0,0,1,1,0,0|2,0,0]=4 14804 B17R1.7823 CSCCCNC(=O)CCCC1CCCCC1 1626a_100000749238_100000211478 [0,0,1,1,0,0|2,0,0]=4 14805 B17R1.7823 CSCCCNC(=O)CCCC1CCCCC1 240690a_100000749238_100000211478 [0,0,1,1,0,0|2,0,0]=4 14806 B17R1.7823 CSCCCNC(=O)CCCC1CCCCC1 527a_100000749238_100000211478 [0,0,1,1,0,0|2,0,0]=4 14807 B17R1.7823 O=C(CCCC1CCCCC1)NCCCCO 240690a_100000750430_100000211478 [0,0,1,1,0,0|2,0,0]=4 14808 B17R1.7823 O=C(CCCC1CCCCC1)NCCCCO 527a_100000750430_100000211478 [0,0,1,1,0,0|2,0,0]=4 14809 B17R1.7823 O=C(CCCCCF)CCCC1CCCCC1 1458a_100000211478_100000729378 [0,0,1,1,0,0|2,0,0]=4 14810 B17R1.7823 O=C(CCCCCO)CCCC1CCCCC1 1458a_100000211478_100000746330 [0,0,1,1,0,0|2,0,0]=4 14811 B17R1.7823 O=C(CCCCCO)CCCC1CCCCC1 1458a_100102619762_100011713725 [0,0,1,1,0,0|2,0,0]=4 14812 B17R1.7823 O=C(CCCCCO)NCCC1CCCCC1 240690a_100000738074_100102619762 [0,0,1,1,0,0|2,0,0]=4 14813 B17R1.18502 CC1CCCC1C(=O)CCCCCCCCO 1458a_100000690547_100000033203 [0,0,1,1,0,0|2,0,0]=4 14814 B17R1.18502 CC1CCCC1C(=O)NCCCCCCCO 240690a_100011996573_100000690547 [0,0,1,1,0,0|2,0,0]=4 14815 B17R1.18502 CCCCCCCCCC(=O)C1CCCC1C 1458a_100000690547_100000210670 [0,0,1,1,0,0|1,0,0]=3 14816 B17R1.18502 CCCCCCCCCC(=O)N1CCC[C@@H]1C 240690a_100020605311_100000210558 [0,0,1,1,0,0|1,0,0]=3 14817 B17R1.18502 CCCCCCCCCC(=O)N1CCC[C@@H]1C 527a_100020605311_100000210558 [0,0,1,1,0,0|1,0,0]=3 14818 B17R1.18502 CCCCCCCCCC(=O)N1CCC[C@H]1C 11a_100015189458_100000210558 [0,0,1,1,0,0|1,0,0]=3 14819 B17R1.18502 CCCCCCCCCC(=O)N1CCC[C@H]1C 240690a_100015189458_100000210558 [0,0,1,1,0,0|1,0,0]=3 14820 B17R1.18502 CCCCCCCCCC(=O)N1CCC[C@H]1C 527a_100015189458_100000210558 [0,0,1,1,0,0|1,0,0]=3 14821 B17R1.18502 CCCCCCCCCC(=O)N1CCSC1C 11a_200011216479_100000210558 [0,0,1,1,0,0|2,0,0]=4 14822 B17R1.18502 CCCCCCCCCC(=O)N1CCSC1C 1626a_200011216479_100000210558 [0,0,1,1,0,0|2,0,0]=4 14823 B17R1.18502 CCCCCCCCCC(=O)N1CCSC1C 240690a_200011216479_100000210558 [0,0,1,1,0,0|2,0,0]=4 14824 B17R1.18502 CCCCCCCCCC(=O)N1CCSC1C 527a_200011216479_100000210558 [0,0,1,1,0,0|2,0,0]=4 14825 B17R1.18502 CCCCCCCCCC(=O)[C@@H]1CCCN1C 1458a_100009816429_100000210670 [0,0,1,1,0,0|2,0,0]=4 14826 B17R1.18502 CCCCCCCCNC(=O)C1CCCC1C 11a_100000229939_100000690547 [0,0,1,1,0,0|1,0,0]=3 14827 B17R1.18502 CCCCCCCCNC(=O)C1CCCC1C 1626a_100000229939_100000690547 [0,0,1,1,0,0|1,0,0]=3 14828 B17R1.18502 CCCCCCCCNC(=O)C1CCCC1C 240690a_100000229939_100000690547 [0,0,1,1,0,0|1,0,0]=3 14829 B17R1.18502 CCCCCCCCNC(=O)C1CCCC1C 527a_100000229939_100000690547 [0,0,1,1,0,0|1,0,0]=3 14830 B17R1.18502 CCCCCCCCNC(=O)N1CCC[C@@H]1C 2708a_100000229939_100020605311 [0,0,1,1,0,0|2,0,0]=4 14831 B17R1.18502 CCCCCCCCNC(=O)N1CCC[C@@H]1C 273464a_100000229939_100020605311 [0,0,1,1,0,0|2,0,0]=4 14832 B17R1.18502 CCCCCCCCNC(=O)N1CCC[C@H]1C 2708a_100000229939_100015189458 [0,0,1,1,0,0|2,0,0]=4 14833 B17R1.18502 CCCCCCCCNC(=O)N1CCC[C@H]1C 273464a_100000229939_100015189458 [0,0,1,1,0,0|2,0,0]=4 14834 B17R1.18502 CCCCCCCCNC(=O)[C@@H]1CCCN1C 11a_100000229939_100009816429 [0,0,1,1,0,0|2,0,0]=4 14835 B17R1.18502 CCCCCCCCNC(=O)[C@@H]1CCCN1C 240690a_100000229939_100009816429 [0,0,1,1,0,0|2,0,0]=4 14836 B17R1.18502 CCCCCCCCNC(=O)[C@@H]1CCCN1C 527a_100000229939_100009816429 [0,0,1,1,0,0|2,0,0]=4 14837 B17R1.18502 CCCCOCCCNC(=O)C1CCCC1C 1626a_200000211371_100000690547 [0,0,1,1,0,0|2,0,0]=4 14838 B17R1.18502 CCCCOCCCNC(=O)C1CCCC1C 240690a_200000211371_100000690547 [0,0,1,1,0,0|2,0,0]=4 14839 B17R1.18502 CCCCOCCCNC(=O)C1CCCC1C 527a_200000211371_100000690547 [0,0,1,1,0,0|2,0,0]=4 14840 B17R1.18502 C[C@@H]1CCCN1C(=O)CCCCCCCCO 240690a_100015189458_100000015970 [0,0,1,1,0,0|2,0,0]=4 14841 B17R1.18502 C[C@H]1CCCN1C(=O)CCCCCCCCO 240690a_100020605311_100000015970 [0,0,1,1,0,0|2,0,0]=4 14842 B17R1.29613 CCCCCCCCCC(=O)NCC1CCC1 11a_100000738700_100000210558 [0,0,1,1,0,0|1,0,0]=3 14843 B17R1.29613 CCCCCCCCCC(=O)NCC1CCC1 1626a_100000738700_100000210558 [0,0,1,1,0,0|1,0,0]=3 14844 B17R1.29613 CCCCCCCCCC(=O)NCC1CCC1 240690a_100000738700_100000210558 [0,0,1,1,0,0|1,0,0]=3 14845 B17R1.29613 CCCCCCCCCC(=O)NCC1CCC1 527a_100000738700_100000210558 [0,0,1,1,0,0|1,0,0]=3 14846 B17R1.29613 CCCCCCCCCC(=O)NCC1COC1 11a_100015281925_100000210558 [0,0,1,1,0,0|2,0,0]=4 14847 B17R1.29613 CCCCCCCCCC(=O)NCC1COC1 1626a_100015281925_100000210558 [0,0,1,1,0,0|2,0,0]=4 14848 B17R1.29613 CCCCCCCCCC(=O)NCC1COC1 240690a_100015281925_100000210558 [0,0,1,1,0,0|2,0,0]=4 14849 B17R1.29613 CCCCCCCCCC(=O)NCC1COC1 527a_100015281925_100000210558 [0,0,1,1,0,0|2,0,0]=4 14850 B17R1.29613 CCCCCCCCCC(=O)NC[C@@H]1CCO1 11a_100020831831_100000210558 [0,0,1,1,0,0|2,0,0]=4 14851 B17R1.29613 CCCCCCCCCC(=O)NC[C@@H]1CCO1 1626a_100020831831_100000210558 [0,0,1,1,0,0|2,0,0]=4 14852 B17R1.29613 CCCCCCCCCC(=O)NC[C@@H]1CCO1 240690a_100020831831_100000210558 [0,0,1,1,0,0|2,0,0]=4 14853 B17R1.29613 CCCCCCCCCC(=O)NC[C@@H]1CCO1 527a_100020831831_100000210558 [0,0,1,1,0,0|2,0,0]=4 14854 B17R1.29613 CCCCCCCCCC(=O)NNC1CCC1 22a_100000736358_100000210558 [0,0,1,1,0,0|2,0,0]=4 14855 B17R1.29613 CCCCCCCCCC(=O)OCN1CCC1 269982a_100000754969_200010990708 [0,0,1,1,0,0|1,0,0]=3 14856 B17R1.29613 CCCCCCCCCC(C)OCC1CCC1 34a_100011218016_100000763275 [0,0,1,1,0,0|1,0,1]=4 14857 B17R1.29613 CCCCCCCCCC(C)OCC1CCC1 7a_100011218016_100000763275 [0,0,1,1,0,0|1,0,1]=4 14858 B17R1.29613 CCCCCCCCNC(=O)NCC1CCC1 2708a_100000229939_100000738700 [0,0,1,1,0,0|2,0,0]=4 14859 B17R1.29613 CCCCCCCCNC(=O)NCC1CCC1 2708a_100000738700_100000229939 [0,0,1,1,0,0|2,0,0]=4 14860 B17R1.29613 CCCCCCCCNC(=O)NCC1CCC1 273464a_100000229939_100000738700 [0,0,1,1,0,0|2,0,0]=4 14861 B17R1.29613 CCCCCCCCNC(=O)NCC1CCC1 273464a_100000738700_100000229939 [0,0,1,1,0,0|2,0,0]=4 14862 B17R1.29613 CCCCCCCCNC(=O)NCC1CCC1 512a_100000229939_100000738700 [0,0,1,1,0,0|2,0,0]=4 14863 B17R1.29613 CCCCCCCCNC(=O)NCC1CCC1 512a_100000738700_100000229939 [0,0,1,1,0,0|2,0,0]=4 14864 B17R1.29613 O=C(CCCCCCCCO)NCC1CCC1 240690a_100000738700_100000015970 [0,0,1,1,0,0|2,0,0]=4 14865 B17R1.29614 CCCCCCCCCC(=O)CCCC1CO1 1458a_100000210558_100000733510 [0,0,1,1,0,0|2,0,0]=4 14866 B17R1.29614 CCCCCCCCCC(=O)CSCC1CC1 1458a_200011316215_100000210670 [0,0,1,1,0,0|2,0,0]=4 14867 B17R1.29614 CCCCCCCCCC(=O)NCCC1CC1 1626a_100000764129_100000210558 [0,0,1,1,0,0|1,0,0]=3 14868 B17R1.29614 CCCCCCCCCC(=O)NCCC1CC1 240690a_100000764129_100000210558 [0,0,1,1,0,0|1,0,0]=3 14869 B17R1.29614 CCCCCCCCCC(=O)NCCC1CC1 527a_100000764129_100000210558 [0,0,1,1,0,0|1,0,0]=3 14870 B17R1.29614 CCCCCCCCCC(=O)NNCC1CC1 22a_100000736359_100000210558 [0,0,1,1,0,0|2,0,0]=4 14871 B17R1.29614 CCCCCCCCCC(=O)OCNC1CC1 34a_100000212008_200010990708 [0,0,1,1,0,0|1,0,0]=3 14872 B17R1.29614 CCCCCCCCCC(C)OCCC1CC1 34a_100011218016_100000694398 [0,0,1,1,0,0|1,0,1]=4 14873 B17R1.29614 CCCCCCCCCC(C)OCCC1CC1 7a_100011218016_100000764125 [0,0,1,1,0,0|1,0,1]=4 14874 B17R1.29614 CCCCCCCCNC(=O)CSCC1CC1 11a_100000229939_200011316215 [0,0,1,1,0,0|2,0,0]=4 14875 B17R1.29614 CCCCCCCCNC(=O)CSCC1CC1 1626a_100000229939_200011316215 [0,0,1,1,0,0|2,0,0]=4 14876 B17R1.29614 CCCCCCCCNC(=O)CSCC1CC1 240690a_100000229939_200011316215 [0,0,1,1,0,0|2,0,0]=4 14877 B17R1.29614 CCCCCCCCNC(=O)CSCC1CC1 527a_100000229939_200011316215 [0,0,1,1,0,0|2,0,0]=4 14878 B17R1.29614 CCCCCCCCNC(=O)NCCC1CC1 2708a_100000229939_100000764129 [0,0,1,1,0,0|2,0,0]=4 14879 B17R1.29614 CCCCCCCCNC(=O)NCCC1CC1 2708a_100000764129_100000229939 [0,0,1,1,0,0|2,0,0]=4 14880 B17R1.29614 CCCCCCCCNC(=O)NCCC1CC1 273464a_100000229939_100000764129 [0,0,1,1,0,0|2,0,0]=4 14881 B17R1.29614 CCCCCCCCNC(=O)NCCC1CC1 273464a_100000764129_100000229939 [0,0,1,1,0,0|2,0,0]=4 14882 B17R1.29614 CCCCCCCCNC(=O)NCCC1CC1 512a_100000229939_100000764129 [0,0,1,1,0,0|2,0,0]=4 14883 B17R1.29614 CCCCCCCCNC(=O)NCCC1CC1 512a_100000764129_100000229939 [0,0,1,1,0,0|2,0,0]=4 14884 B17R1.29614 O=C(CCCCCCCCO)NCCC1CC1 240690a_100000764129_100000015970 [0,0,1,1,0,0|2,0,0]=4 14885 B17R1.40210 CCCCCCC(=O)N1CCCCCCCC1 11a_100000039187_100102632555 [0,0,1,1,0,0|1,0,0]=3 14886 B17R1.40210 CCCCCCC(=O)N1CCCCCCCC1 1626a_100000039187_100102632555 [0,0,1,1,0,0|1,0,0]=3 14887 B17R1.40210 CCCCCCC(=O)N1CCCCCCCC1 240690a_100000039187_100102632555 [0,0,1,1,0,0|1,0,0]=3 14888 B17R1.40210 CCCCCCC(=O)N1CCCCCCCC1 527a_100000039187_100102632555 [0,0,1,1,0,0|1,0,0]=3 14889 B17R1.40210 CCCCCNC(=O)N1CCCCCCCC1 2708a_100000209983_100000039187 [0,0,1,1,0,0|2,0,0]=4 14890 B17R1.40210 CCCCCNC(=O)N1CCCCCCCC1 273464a_100000209983_100000039187 [0,0,1,1,0,0|2,0,0]=4 14891 B17R1.40210 CCCCOCC(=O)N1CCCCCCCC1 11a_100000039187_100000757543 [0,0,1,1,0,0|2,0,0]=4 14892 B17R1.40210 CCCCOCC(=O)N1CCCCCCCC1 1626a_100000039187_100000757543 [0,0,1,1,0,0|2,0,0]=4 14893 B17R1.40210 CCCCOCC(=O)N1CCCCCCCC1 240690a_100000039187_100000757543 [0,0,1,1,0,0|2,0,0]=4 14894 B17R1.40210 CCCCOCC(=O)N1CCCCCCCC1 527a_100000039187_100000757543 [0,0,1,1,0,0|2,0,0]=4 14895 B17R1.40210 CCCCSCC(=O)N1CCCCCCCC1 11a_100000039187_100000191162 [0,0,1,1,0,0|2,0,0]=4 14896 B17R1.40210 CCCCSCC(=O)N1CCCCCCCC1 1626a_100000039187_100000191162 [0,0,1,1,0,0|2,0,0]=4 14897 B17R1.40210 CCCCSCC(=O)N1CCCCCCCC1 240690a_100000039187_100000191162 [0,0,1,1,0,0|2,0,0]=4 14898 B17R1.40210 CCCCSCC(=O)N1CCCCCCCC1 527a_100000039187_100000191162 [0,0,1,1,0,0|2,0,0]=4 14899 B17R1.40210 O=C(CCCCCO)N1CCCCCCCC1 240690a_100000039187_100102619762 [0,0,1,1,0,0|2,0,0]=4 14900 B17R1.40239 CCCCCCC(=O)CCN1CCCCCC1 1458a_100000740320_100000210757 [0,0,1,1,0,0|2,0,0]=4 14901 B17R1.40239 CCCCCCC(=O)CCN1CCCCCC1 1458a_100102632555_100000722644 [0,0,1,1,0,0|2,0,0]=4 14902 B17R1.40239 CCCCCCC(=O)NCC1CCCCCC1 11a_100015204231_100102632555 [0,0,1,1,0,0|1,0,0]=3 14903 B17R1.40239 CCCCCCC(=O)NCC1CCCCCC1 1626a_100015204231_100102632555 [0,0,1,1,0,0|1,0,0]=3 14904 B17R1.40239 CCCCCCC(=O)NCC1CCCCCC1 240690a_100015204231_100102632555 [0,0,1,1,0,0|1,0,0]=3 14905 B17R1.40239 CCCCCCC(=O)NCC1CCCCCC1 527a_100015204231_100102632555 [0,0,1,1,0,0|1,0,0]=3 14906 B17R1.40239 CCCCCCC(C)OCC1CCCCCC1 34a_100000210265_200000696569 [0,0,1,1,0,0|1,0,1]=4 14907 B17R1.40239 CCCCCCC(C)OCC1CCCCCC1 34a_100000699130_100011215978 [0,0,1,1,0,0|1,0,1]=4 14908 B17R1.40239 CCCCCCC(C)OCC1CCCCCC1 7a_100000210265_200000696569 [0,0,1,1,0,0|1,0,1]=4 14909 B17R1.40239 CCCCCCC(C)OCC1CCCCCC1 7a_100000699130_100011215978 [0,0,1,1,0,0|1,0,1]=4 14910 B17R1.40239 CCCCCNC(=O)CCN1CCCCCC1 240690a_100000209983_100000740320 [0,0,1,1,0,0|2,0,0]=4 14911 B17R1.40239 CCCCCNC(=O)CNC1CCCCCC1 2230a_100000210984_100000230301 [0,0,1,1,0,0|2,0,0]=4 14912 B17R1.40239 CCCCCNC(=O)CNC1CCCCCC1 34a_100000210984_100000230301 [0,0,1,1,0,0|2,0,0]=4 14913 B17R1.40239 CCCCCNC(=O)COC1CCCCCC1 34a_100000210887_100000230301 [0,0,1,1,0,0|2,0,0]=4 14914 B17R1.40239 CCCCCNC(=O)COC1CCCCCC1 7a_100000210887_100000230301 [0,0,1,1,0,0|2,0,0]=4 14915 B17R1.40239 CCCCCNC(=O)CSC1CCCCCC1 62a_100000230301_100011217769 [0,0,1,1,0,0|2,0,0]=4 14916 B17R1.40239 CCCCCNC(=O)CSC1CCCCCC1 62a_100011217769_100000230301 [0,0,1,1,0,0|2,0,0]=4 14917 B17R1.40239 CCCCCNC(=O)NCC1CCCCCC1 2708a_100000209983_100015204231 [0,0,1,1,0,0|2,0,0]=4 14918 B17R1.40239 CCCCCNC(=O)NCC1CCCCCC1 2708a_100015204231_100000209983 [0,0,1,1,0,0|2,0,0]=4 14919 B17R1.40239 CCCCCNC(=O)NCC1CCCCCC1 273464a_100000209983_100015204231 [0,0,1,1,0,0|2,0,0]=4 14920 B17R1.40239 CCCCCNC(=O)NCC1CCCCCC1 273464a_100015204231_100000209983 [0,0,1,1,0,0|2,0,0]=4 14921 B17R1.40239 CCCCCNC(=O)NCC1CCCCCC1 512a_100000209983_100015204231 [0,0,1,1,0,0|2,0,0]=4 14922 B17R1.40239 CCCCOCC(=O)NCC1CCCCCC1 11a_100015204231_100000757543 [0,0,1,1,0,0|2,0,0]=4 14923 B17R1.40239 CCCCOCC(=O)NCC1CCCCCC1 1626a_100015204231_100000757543 [0,0,1,1,0,0|2,0,0]=4 14924 B17R1.40239 CCCCOCC(=O)NCC1CCCCCC1 240690a_100015204231_100000757543 [0,0,1,1,0,0|2,0,0]=4 14925 B17R1.40239 CCCCOCC(=O)NCC1CCCCCC1 527a_100015204231_100000757543 [0,0,1,1,0,0|2,0,0]=4 14926 B17R1.40239 CCCCSCC(=O)NCC1CCCCCC1 11a_100015204231_100000191162 [0,0,1,1,0,0|2,0,0]=4 14927 B17R1.40239 CCCCSCC(=O)NCC1CCCCCC1 1626a_100015204231_100000191162 [0,0,1,1,0,0|2,0,0]=4 14928 B17R1.40239 CCCCSCC(=O)NCC1CCCCCC1 240690a_100015204231_100000191162 [0,0,1,1,0,0|2,0,0]=4 14929 B17R1.40239 CCCCSCC(=O)NCC1CCCCCC1 527a_100015204231_100000191162 [0,0,1,1,0,0|2,0,0]=4 14930 B17R1.40239 CCOCCOC(=O)CNC1CCCCCC1 2230a_100000210984_200000101388 [0,0,1,1,0,0|2,0,0]=4 14931 B17R1.40239 CCOCCOC(=O)CNC1CCCCCC1 34a_100000210984_200000101388 [0,0,1,1,0,0|2,0,0]=4 14932 B17R1.40239 CCOCCOC(=O)COC1CCCCCC1 34a_100000210887_200000101388 [0,0,1,1,0,0|2,0,0]=4 14933 B17R1.40239 CCOCCOC(=O)COC1CCCCCC1 7a_100000210887_200000101388 [0,0,1,1,0,0|2,0,0]=4 14934 B17R1.40239 CCOCCOC(=O)CSC1CCCCCC1 62a_100011217769_200000101388 [0,0,1,1,0,0|2,0,0]=4 14935 B17R1.40239 CCOCCOC(=O)CSC1CCCCCC1 62a_200000101388_100011217769 [0,0,1,1,0,0|2,0,0]=4 14936 B17R1.40239 O=C(CCCCCO)NCC1CCCCCC1 240690a_100015204231_100102619762 [0,0,1,1,0,0|2,0,0]=4 14937 B17R1.40448 CCCCCCC(=O)NC1CCCCCCC1 11a_100000211152_100102632555 [0,0,1,1,0,0|1,0,0]=3 14938 B17R1.40448 CCCCCCC(=O)NC1CCCCCCC1 1626a_100000211152_100102632555 [0,0,1,1,0,0|1,0,0]=3 14939 B17R1.40448 CCCCCCC(=O)NC1CCCCCCC1 240690a_100000211152_100102632555 [0,0,1,1,0,0|1,0,0]=3 14940 B17R1.40448 CCCCCCC(=O)NC1CCCCCCC1 527a_100000211152_100102632555 [0,0,1,1,0,0|1,0,0]=3 14941 B17R1.40448 CCCCCCC(C)OC1CCCCCCC1 34a_100000210054_100011215978 [0,0,1,1,0,0|1,0,1]=4 14942 B17R1.40448 CCCCCCC(C)OC1CCCCCCC1 7a_100000210054_100011215978 [0,0,1,1,0,0|1,0,1]=4 14943 B17R1.40448 CCCCCNC(=O)CN1CCCCCCC1 2230a_100000211400_100000230301 [0,0,1,1,0,0|2,0,0]=4 14944 B17R1.40448 CCCCCNC(=O)CN1CCCCCCC1 269982a_100000211400_100000230301 [0,0,1,1,0,0|2,0,0]=4 14945 B17R1.40448 CCCCCNC(=O)CN1CCCCCCC1 34a_100000211400_100000230301 [0,0,1,1,0,0|2,0,0]=4 14946 B17R1.40448 CCCCCNC(=O)NC1CCCCCCC1 2708a_100000209983_100000211152 [0,0,1,1,0,0|2,0,0]=4 14947 B17R1.40448 CCCCCNC(=O)NC1CCCCCCC1 2708a_100000211152_100000209983 [0,0,1,1,0,0|2,0,0]=4 14948 B17R1.40448 CCCCCNC(=O)NC1CCCCCCC1 273464a_100000209983_100000211152 [0,0,1,1,0,0|2,0,0]=4 14949 B17R1.40448 CCCCCNC(=O)NC1CCCCCCC1 273464a_100000211152_100000209983 [0,0,1,1,0,0|2,0,0]=4 14950 B17R1.40448 CCCCCNC(=O)NC1CCCCCCC1 512a_100000209983_100000211152 [0,0,1,1,0,0|2,0,0]=4 14951 B17R1.40448 CCCCCNC(=O)NC1CCCCCCC1 512a_100000211152_100000209983 [0,0,1,1,0,0|2,0,0]=4 14952 B17R1.40448 CCCCNCC(=O)NC1CCCCCCC1 2230a_100000102301_100000183010 [0,0,1,1,0,0|2,0,0]=4 14953 B17R1.40448 CCCCNCC(=O)NC1CCCCCCC1 7a_106832991798_100000183010 [0,0,1,1,0,0|2,0,0]=4 14954 B17R1.40448 CCCCOCC(=O)NC1CCCCCCC1 11a_100000211152_100000757543 [0,0,1,1,0,0|2,0,0]=4 14955 B17R1.40448 CCCCOCC(=O)NC1CCCCCCC1 1626a_100000211152_100000757543 [0,0,1,1,0,0|2,0,0]=4 14956 B17R1.40448 CCCCOCC(=O)NC1CCCCCCC1 240690a_100000211152_100000757543 [0,0,1,1,0,0|2,0,0]=4 14957 B17R1.40448 CCCCOCC(=O)NC1CCCCCCC1 34a_100000210227_100000183010 [0,0,1,1,0,0|2,0,0]=4 14958 B17R1.40448 CCCCOCC(=O)NC1CCCCCCC1 527a_100000211152_100000757543 [0,0,1,1,0,0|2,0,0]=4 14959 B17R1.40448 CCCCOCC(=O)NC1CCCCCCC1 7a_100000210227_100000183010 [0,0,1,1,0,0|2,0,0]=4 14960 B17R1.40448 CCCCSCC(=O)NC1CCCCCCC1 11a_100000211152_100000191162 [0,0,1,1,0,0|2,0,0]=4 14961 B17R1.40448 CCCCSCC(=O)NC1CCCCCCC1 1626a_100000211152_100000191162 [0,0,1,1,0,0|2,0,0]=4 14962 B17R1.40448 CCCCSCC(=O)NC1CCCCCCC1 240690a_100000211152_100000191162 [0,0,1,1,0,0|2,0,0]=4 14963 B17R1.40448 CCCCSCC(=O)NC1CCCCCCC1 527a_100000211152_100000191162 [0,0,1,1,0,0|2,0,0]=4 14964 B17R1.40448 CCCCSCC(=O)NC1CCCCCCC1 62a_100000183010_100000210210 [0,0,1,1,0,0|2,0,0]=4 14965 B17R1.40448 CCCCSCC(=O)NC1CCCCCCC1 62a_100000210211_100000183010 [0,0,1,1,0,0|2,0,0]=4 14966 B17R1.40448 CCOCCOC(=O)CN1CCCCCCC1 2230a_100000211400_200000101388 [0,0,1,1,0,0|2,0,0]=4 14967 B17R1.40448 CCOCCOC(=O)CN1CCCCCCC1 269982a_100000211400_200000101388 [0,0,1,1,0,0|2,0,0]=4 14968 B17R1.40448 CCOCCOC(=O)CN1CCCCCCC1 34a_100000211400_200000101388 [0,0,1,1,0,0|2,0,0]=4 14969 B17R1.40448 O=C(CCCCCO)NC1CCCCCCC1 240690a_100000211152_100102619762 [0,0,1,1,0,0|2,0,0]=4 14970 B17R1.41557 CCCCCCCCOC1(CCCCCC1)C 34a_100000708895_100000210759 [0,0,1,1,0,0|1,0,1]=4 14971 B17R1.41557 CCCCCCCCOC1(CCCCCC1)C 7a_100000708895_100000210759 [0,0,1,1,0,0|1,0,1]=4