0 B14R0.393 C#CCC(=O)CCCCCCCCCC 1458a_100000210375_100000184674 [0,0,0,0,0,0|1,0,2]=3 1 B14R0.393 C#CCC(=O)CCCCCCCCCC 1458a_100011220946_100000210319 [0,0,0,0,0,0|1,0,2]=3 2 B14R0.393 C#CCC(=O)CCCCCCCCCF 1458a_200009909015_100000184674 [0,0,0,0,0,0|2,0,2]=4 3 B14R0.393 C#CCC(=O)CCCCCCCCCO 1458a_100011220946_100009813782 [0,0,0,0,0,0|2,0,2]=4 4 B14R0.393 C#CCC(=O)COCCCCCCCC 1458a_100000759886_100000184674 [0,0,0,0,0,0|2,0,2]=4 5 B14R0.393 C#CCC(=O)NCCCCCCCCC 1626a_100000212291_100011220946 [0,0,0,0,0,0|2,0,2]=4 6 B14R0.393 C#CCC(=O)NCCCCCCCCC 527a_100000212291_100011220946 [0,0,0,0,0,0|2,0,2]=4 7 B14R0.393 C#CCCCCCCCCC(=O)CCC 1458a_100000029693_100000210303 [0,0,0,0,0,0|1,0,2]=3 8 B14R0.393 C#CCCCCCCCCC(=O)CCF 1458a_100000029693_100011217306 [0,0,0,0,0,0|2,0,2]=4 9 B14R0.393 C#CCCCCCCCCC(=O)CCO 1458a_100000029693_100000211926 [0,0,0,0,0,0|2,0,2]=4 10 B14R0.393 C#CCCCCCCCCC(=O)NCC 11a_100015525214_100000029693 [0,0,0,0,0,0|1,0,2]=3 11 B14R0.393 C#CCCCCCCCCC(=O)NCC 240690a_100015525214_100000029693 [0,0,0,0,0,0|1,0,2]=3 12 B14R0.393 C#CCCCCCCCCC(=O)NCC 527a_100015525214_100000029693 [0,0,0,0,0,0|1,0,2]=3 13 B14R0.393 C#CCCCCCCCCC(=O)NNC 22a_100016993582_100000029693 [0,0,0,0,0,0|2,0,2]=4 14 B14R0.393 C#CCCCCCCNCC(=O)NCC 2230a_100016988866_100012276617 [0,0,0,0,0,0|2,0,2]=4 15 B14R0.393 C#CCCCCCCOCC(=O)CCC 7a_100011217361_100000747444 [0,0,0,0,0,0|2,0,2]=4 16 B14R0.393 C#CCCCCCCOCC(=O)NCC 34a_100011217361_100000183381 [0,0,0,0,0,0|2,0,2]=4 17 B14R0.393 C#CCCCCCCOCC(=O)NCC 7a_100011217361_100000183381 [0,0,0,0,0,0|2,0,2]=4 18 B14R0.393 C#CCCCCCCOCC(=O)OCC 34a_100011217361_100000188475 [0,0,0,0,0,0|1,0,2]=3 19 B14R0.393 C#CCCCCCCOCC(=O)OCC 7a_100011217361_100000188475 [0,0,0,0,0,0|1,0,2]=3 20 B14R0.393 C#CCCCCCCSCC(=O)CCC 62a_100000747444_100012276617 [0,0,0,0,0,0|2,0,2]=4 21 B14R0.393 C#CCCCCCCSCC(=O)CCC 62a_100012276617_100000747444 [0,0,0,0,0,0|2,0,2]=4 22 B14R0.393 C#CCCCCCCSCC(=O)NCC 62a_100000183381_100012276617 [0,0,0,0,0,0|2,0,2]=4 23 B14R0.393 C#CCCCCCCSCC(=O)NCC 62a_100012276617_100000183381 [0,0,0,0,0,0|2,0,2]=4 24 B14R0.393 C#CCCCCCCSCC(=O)OCC 62a_100000188475_100012276617 [0,0,0,0,0,0|1,0,2]=3 25 B14R0.393 C#CCCCCCCSCC(=O)OCC 62a_100012276617_100000188475 [0,0,0,0,0,0|1,0,2]=3 26 B14R0.393 C#CCCCCCNCCC(=O)NCC 34a_100025743525_100012094781 [0,0,0,0,0,0|2,0,2]=4 27 B14R0.393 C#CCCCCCOCCC(=O)NCC 7a_100000766912_100000737597 [0,0,0,0,0,0|2,0,2]=4 28 B14R0.393 C#CCCCCCOCCC(=O)OCC 34a_100000766912_100000765890 [0,0,0,0,0,0|1,0,2]=3 29 B14R0.393 C#CCCCCCOCCC(=O)OCC 7a_100000766912_100011206558 [0,0,0,0,0,0|1,0,2]=3 30 B14R0.393 C#CCCCCCSCCC(=O)NCC 62a_100000737597_100012094781 [0,0,0,0,0,0|2,0,2]=4 31 B14R0.393 C#CCCCCCSCCC(=O)NCC 62a_100012094781_100000737597 [0,0,0,0,0,0|2,0,2]=4 32 B14R0.393 C#CCCCCCSCCC(=O)OCC 62a_100000765890_100012094781 [0,0,0,0,0,0|1,0,2]=3 33 B14R0.393 C#CCCCCCSCCC(=O)OCC 62a_100012094781_100000765890 [0,0,0,0,0,0|1,0,2]=3 34 B14R0.393 C#CCCCCCSCOC(=O)OCC 62a_100012094781_100000075025 [0,0,0,0,0,0|2,0,2]=4 35 B14R0.393 C#CCCCCNCCCC(=O)OCC 2230a_100000706060_100009991533 [0,0,0,0,0,0|1,0,2]=3 36 B14R0.393 C#CCCCCNCCCC(=O)OCC 34a_100000706060_100009991533 [0,0,0,0,0,0|1,0,2]=3 37 B14R0.393 C#CCCCCOCCCC(=O)OCC 34a_100000766709_100009991533 [0,0,0,0,0,0|1,0,2]=3 38 B14R0.393 C#CCCCCOCCCC(=O)OCC 7a_100000766709_100011215271 [0,0,0,0,0,0|1,0,2]=3 39 B14R0.393 C#CCCCCOCCCC(=O)OCC 7a_100012001163_100010269958 [0,0,0,0,0,0|1,0,2]=3 40 B14R0.393 C#CCCCCOCCNC(=O)OCC 34a_100000158857_100010269958 [0,0,0,0,0,0|2,0,2]=4 41 B14R0.393 C#CCCCCOCCNC(=O)OCC 7a_100000766709_200011445536 [0,0,0,0,0,0|2,0,2]=4 42 B14R0.393 C#CCCCCSCCCC(=O)OCC 62a_100009991533_100010269958 [0,0,0,0,0,0|1,0,2]=3 43 B14R0.393 C#CCCCCSCCCC(=O)OCC 62a_100010269958_100009991533 [0,0,0,0,0,0|1,0,2]=3 44 B14R0.393 C#CCCCCSCCNC(=O)OCC 62a_100010269958_200011445536 [0,0,0,0,0,0|2,0,2]=4 45 B14R0.393 C#CCCCNCCCCC(=O)OCC 34a_100000718082_100000750268 [0,0,0,0,0,0|1,0,2]=3 46 B14R0.393 C#CCCCNCCOCC(=O)OCC 34a_100000718082_100000088970 [0,0,0,0,0,0|2,0,2]=4 47 B14R0.393 C#CCCCOCCCCC(=O)OCC 34a_100000215630_100000750268 [0,0,0,0,0,0|1,0,2]=3 48 B14R0.393 C#CCCCOCCCCC(=O)OCC 7a_100000215630_100000750268 [0,0,0,0,0,0|1,0,2]=3 49 B14R0.393 C#CCCCOCCOCC(=O)OCC 34a_100000215630_100000088970 [0,0,0,0,0,0|2,0,2]=4 50 B14R0.393 C#CCCCOCCOCC(=O)OCC 7a_100000215630_100000088970 [0,0,0,0,0,0|2,0,2]=4 51 B14R0.393 C#CCCCOCCSCC(=O)OCC 7a_200000230590_100011215417 [0,0,0,0,0,0|2,0,2]=4 52 B14R0.393 C#CCCCSCCCCC(=O)OCC 62a_100000750268_100011215417 [0,0,0,0,0,0|1,0,2]=3 53 B14R0.393 C#CCCCSCCCCC(=O)OCC 62a_100011215417_100000750268 [0,0,0,0,0,0|1,0,2]=3 54 B14R0.393 C#CCCCSCCOCC(=O)OCC 62a_100000088970_100011215417 [0,0,0,0,0,0|2,0,2]=4 55 B14R0.393 C#CCCCSCCOCC(=O)OCC 62a_100011215417_100000088970 [0,0,0,0,0,0|2,0,2]=4 56 B14R0.393 C#CCCNCCCCCC(=O)OCC 34a_100000755551_100000755133 [0,0,0,0,0,0|1,0,2]=3 57 B14R0.393 C#CCCNCCCOCC(=O)OCC 34a_100000755551_100009893628 [0,0,0,0,0,0|2,0,2]=4 58 B14R0.393 C#CCCOCCCCCC(=O)OCC 34a_100011215631_100000755133 [0,0,0,0,0,0|1,0,2]=3 59 B14R0.393 C#CCCOCCCCCC(=O)OCC 7a_100011214988_100000688953 [0,0,0,0,0,0|1,0,2]=3 60 B14R0.393 C#CCCOCCCOCC(=O)OCC 34a_100011215631_100009893628 [0,0,0,0,0,0|2,0,2]=4 61 B14R0.393 C#CCCSCCCCCC(=O)OCC 62a_100000688953_100000755133 [0,0,0,0,0,0|1,0,2]=3 62 B14R0.393 C#CCCSCCCCCC(=O)OCC 62a_100000755133_100000688953 [0,0,0,0,0,0|1,0,2]=3 63 B14R0.393 C#CCCSCCCOCC(=O)OCC 62a_100000688953_100009893628 [0,0,0,0,0,0|2,0,2]=4 64 B14R0.393 C#CCCSCCCOCC(=O)OCC 62a_100009893628_100000688953 [0,0,0,0,0,0|2,0,2]=4 65 B14R0.393 C#CCNCCCCCCC(=O)OCC 34a_100000212058_100009814379 [0,0,0,0,0,0|1,0,2]=3 66 B14R0.393 C#CCOCCCCCCC(=O)OCC 34a_100000210247_100009814379 [0,0,0,0,0,0|1,0,2]=3 67 B14R0.393 C#CCOCCNCCCC(=O)OCC 2230a_100000700922_100009991533 [0,0,0,0,0,0|2,0,2]=4 68 B14R0.393 C#CCOCCNCCCC(=O)OCC 34a_100000700922_100009991533 [0,0,0,0,0,0|2,0,2]=4 69 B14R0.393 C#CCOCCOCCCC(=O)OCC 34a_100000054580_100009991533 [0,0,0,0,0,0|2,0,2]=4 70 B14R0.393 C#CCOCCOCCCC(=O)OCC 7a_100000054580_100011215271 [0,0,0,0,0,0|2,0,2]=4 71 B14R0.393 C#CCOCCOCCCC(=O)OCC 7a_100012001163_100010402529 [0,0,0,0,0,0|2,0,2]=4 72 B14R0.393 C#CCOCCSCCCC(=O)OCC 62a_100009991533_100010402529 [0,0,0,0,0,0|2,0,2]=4 73 B14R0.393 C#CCOCCSCCCC(=O)OCC 62a_100010402529_100009991533 [0,0,0,0,0,0|2,0,2]=4 74 B14R0.393 C#CCSCCCCCCC(=O)OCC 62a_100000038162_100009814379 [0,0,0,0,0,0|1,0,2]=3 75 B14R0.393 C/C=C/CCOCCCCC(=O)OCC 34a_100016278192_100000750268 [0,0,0,0,0,0|1,0,2]=3 76 B14R0.393 C/C=C/CCOCCOCC(=O)OCC 34a_100016278192_100000088970 [0,0,0,0,0,0|2,0,2]=4 77 B14R0.393 C/C=C/COCCCCCC(=O)OCC 34a_100016270725_100000755133 [0,0,0,0,0,0|1,0,2]=3 78 B14R0.393 C/C=C/COCCCCCC(=O)OCC 7a_100011214988_100102629194 [0,0,0,0,0,0|1,0,2]=3 79 B14R0.393 C/C=C/COCCCOCC(=O)OCC 34a_100016270725_100009893628 [0,0,0,0,0,0|2,0,2]=4 80 B14R0.393 C/C=C/CSCCCCCC(=O)OCC 62a_100000755133_100102629194 [0,0,0,0,0,0|1,0,2]=3 81 B14R0.393 C/C=C/CSCCCCCC(=O)OCC 62a_100102629194_100000755133 [0,0,0,0,0,0|1,0,2]=3 82 B14R0.393 C/C=C/CSCCCOCC(=O)OCC 62a_100009893628_100102629194 [0,0,0,0,0,0|2,0,2]=4 83 B14R0.393 C/C=C/CSCCCOCC(=O)OCC 62a_100102629194_100009893628 [0,0,0,0,0,0|2,0,2]=4 84 B14R0.393 C=CCC(=O)CCCCCCCCCC 1458a_100000210193_100000210319 [0,0,0,0,0,0|1,0,2]=3 85 B14R0.393 C=CCC(=O)CCCCCCCCCC 1458a_100000210375_100000210623 [0,0,0,0,0,0|1,0,2]=3 86 B14R0.393 C=CCC(=O)CCCCCCCCCF 1458a_200009909015_100000210623 [0,0,0,0,0,0|2,0,2]=4 87 B14R0.393 C=CCC(=O)CCCCCCCCCO 1458a_100000210193_100009813782 [0,0,0,0,0,0|2,0,2]=4 88 B14R0.393 C=CCC(=O)COCCCCCCCC 1458a_100000759886_100000210623 [0,0,0,0,0,0|2,0,2]=4 89 B14R0.393 C=CCC(=O)NCCCCCCCCC 11a_100000212291_100000210193 [0,0,0,0,0,0|2,0,2]=4 90 B14R0.393 C=CCC(=O)NCCCCCCCCC 1626a_100000212291_100000210193 [0,0,0,0,0,0|2,0,2]=4 91 B14R0.393 C=CCC(=O)NCCCCCCCCC 240690a_100000212291_100000210193 [0,0,0,0,0,0|2,0,2]=4 92 B14R0.393 C=CCC(=O)NCCCCCCCCC 527a_100000212291_100000210193 [0,0,0,0,0,0|2,0,2]=4 93 B14R0.393 C=CCCCCCCCCC(=O)C#CC 1458a_100000763181_100011933949 [0,0,0,0,0,0|1,0,3]=4 94 B14R0.393 C=CCCCCCCCCC(=O)C=CC 1458a_100000210699_100011933949 [0,0,0,0,0,0|1,0,3]=4 95 B14R0.393 C=CCCCCCCCCC(=O)CCC 1458a_100000211349_100000210303 [0,0,0,0,0,0|1,0,2]=3 96 B14R0.393 C=CCCCCCCCCC(=O)CCC 1458a_100000211992_100011933949 [0,0,0,0,0,0|1,0,2]=3 97 B14R0.393 C=CCCCCCCCCC(=O)CCF 1458a_100000211349_100011217306 [0,0,0,0,0,0|2,0,2]=4 98 B14R0.393 C=CCCCCCCCCC(=O)CCO 1458a_100000211349_100000211926 [0,0,0,0,0,0|2,0,2]=4 99 B14R0.393 C=CCCCCCCCCC(=O)CCO 1458a_100011216618_100011933949 [0,0,0,0,0,0|2,0,2]=4 100 B14R0.393 C=CCCCCCCCCC(=O)COC 1458a_100000210968_100011933949 [0,0,0,0,0,0|2,0,2]=4 101 B14R0.393 C=CCCCCCCCCC(=O)CSC 1458a_100000184570_100011933949 [0,0,0,0,0,0|2,0,2]=4 102 B14R0.393 C=CCCCCCCCCC(=O)NCC 11a_100015525214_100000211349 [0,0,0,0,0,0|1,0,2]=3 103 B14R0.393 C=CCCCCCCCCC(=O)NCC 240690a_100015525214_100000211349 [0,0,0,0,0,0|1,0,2]=3 104 B14R0.393 C=CCCCCCCCCC(=O)NCC 527a_100015525214_100000211349 [0,0,0,0,0,0|1,0,2]=3 105 B14R0.393 C=CCCCCCCCCC(=O)NNC 22a_100016993582_100000211349 [0,0,0,0,0,0|2,0,2]=4 106 B14R0.393 C=CCCCCCCNCC(=O)NCC 2230a_100016988866_100011215473 [0,0,0,0,0,0|2,0,2]=4 107 B14R0.393 C=CCCCCCCOCC(=O)CCC 7a_200011216477_100000747444 [0,0,0,0,0,0|2,0,2]=4 108 B14R0.393 C=CCCCCCCOCC(=O)NCC 34a_200011216477_100000183381 [0,0,0,0,0,0|2,0,2]=4 109 B14R0.393 C=CCCCCCCOCC(=O)NCC 7a_200011216477_100000183381 [0,0,0,0,0,0|2,0,2]=4 110 B14R0.393 C=CCCCCCCOCC(=O)OCC 34a_200011216477_100000188475 [0,0,0,0,0,0|1,0,2]=3 111 B14R0.393 C=CCCCCCCOCC(=O)OCC 7a_200011216477_100000188475 [0,0,0,0,0,0|1,0,2]=3 112 B14R0.393 C=CCCCCCCSCC(=O)CCC 62a_100000747444_100011215473 [0,0,0,0,0,0|2,0,2]=4 113 B14R0.393 C=CCCCCCCSCC(=O)CCC 62a_100011215473_100000747444 [0,0,0,0,0,0|2,0,2]=4 114 B14R0.393 C=CCCCCCCSCC(=O)NCC 62a_100000183381_100011215473 [0,0,0,0,0,0|2,0,2]=4 115 B14R0.393 C=CCCCCCCSCC(=O)NCC 62a_100011215473_100000183381 [0,0,0,0,0,0|2,0,2]=4 116 B14R0.393 C=CCCCCCCSCC(=O)OCC 62a_100000188475_100011215473 [0,0,0,0,0,0|1,0,2]=3 117 B14R0.393 C=CCCCCCCSCC(=O)OCC 62a_100011215473_100000188475 [0,0,0,0,0,0|1,0,2]=3 118 B14R0.393 C=CCCCCCNCCC(=O)NCC 34a_100025743525_100000700193 [0,0,0,0,0,0|2,0,2]=4 119 B14R0.393 C=CCCCCCOCCC(=O)NCC 7a_100011216702_100000737597 [0,0,0,0,0,0|2,0,2]=4 120 B14R0.393 C=CCCCCCOCCC(=O)OCC 34a_100011216702_100000765890 [0,0,0,0,0,0|1,0,2]=3 121 B14R0.393 C=CCCCCCOCCC(=O)OCC 7a_100011216702_100011206558 [0,0,0,0,0,0|1,0,2]=3 122 B14R0.393 C=CCCCCCSCCC(=O)NCC 62a_100000700193_100000737597 [0,0,0,0,0,0|2,0,2]=4 123 B14R0.393 C=CCCCCCSCCC(=O)NCC 62a_100000737597_100000700193 [0,0,0,0,0,0|2,0,2]=4 124 B14R0.393 C=CCCCCCSCCC(=O)OCC 62a_100000700193_100000765890 [0,0,0,0,0,0|1,0,2]=3 125 B14R0.393 C=CCCCCCSCCC(=O)OCC 62a_100000765890_100000700193 [0,0,0,0,0,0|1,0,2]=3 126 B14R0.393 C=CCCCCCSCOC(=O)OCC 62a_100000700193_100000075025 [0,0,0,0,0,0|2,0,2]=4 127 B14R0.393 C=CCCCCNCCCC(=O)OCC 2230a_100000703577_100009991533 [0,0,0,0,0,0|1,0,2]=3 128 B14R0.393 C=CCCCCNCCCC(=O)OCC 34a_100000703577_100009991533 [0,0,0,0,0,0|1,0,2]=3 129 B14R0.393 C=CCCCCOCCCC(=O)OCC 34a_100000766645_100009991533 [0,0,0,0,0,0|1,0,2]=3 130 B14R0.393 C=CCCCCOCCCC(=O)OCC 7a_100000766645_100011215271 [0,0,0,0,0,0|1,0,2]=3 131 B14R0.393 C=CCCCCOCCCC(=O)OCC 7a_100012001163_100011215482 [0,0,0,0,0,0|1,0,2]=3 132 B14R0.393 C=CCCCCOCCNC(=O)OCC 34a_100000158857_100011215482 [0,0,0,0,0,0|2,0,2]=4 133 B14R0.393 C=CCCCCOCCNC(=O)OCC 7a_100000766645_200011445536 [0,0,0,0,0,0|2,0,2]=4 134 B14R0.393 C=CCCCCSCCCC(=O)OCC 62a_100009991533_100011215482 [0,0,0,0,0,0|1,0,2]=3 135 B14R0.393 C=CCCCCSCCCC(=O)OCC 62a_100011215482_100009991533 [0,0,0,0,0,0|1,0,2]=3 136 B14R0.393 C=CCCCCSCCNC(=O)OCC 62a_100011215482_200011445536 [0,0,0,0,0,0|2,0,2]=4 137 B14R0.393 C=CCCCNCCCCC(=O)OCC 2230a_100000700776_100000750268 [0,0,0,0,0,0|1,0,2]=3 138 B14R0.393 C=CCCCNCCCCC(=O)OCC 34a_100000700776_100000750268 [0,0,0,0,0,0|1,0,2]=3 139 B14R0.393 C=CCCCNCCOCC(=O)OCC 2230a_100000700776_100000088970 [0,0,0,0,0,0|2,0,2]=4 140 B14R0.393 C=CCCCNCCOCC(=O)OCC 34a_100000700776_100000088970 [0,0,0,0,0,0|2,0,2]=4 141 B14R0.393 C=CCCCOCCCCC(=O)OCC 34a_100000758997_100000750268 [0,0,0,0,0,0|1,0,2]=3 142 B14R0.393 C=CCCCOCCCCC(=O)OCC 7a_100000758997_100000750268 [0,0,0,0,0,0|1,0,2]=3 143 B14R0.393 C=CCCCOCCOCC(=O)OCC 34a_100000758997_100000088970 [0,0,0,0,0,0|2,0,2]=4 144 B14R0.393 C=CCCCOCCOCC(=O)OCC 7a_100000758997_100000088970 [0,0,0,0,0,0|2,0,2]=4 145 B14R0.393 C=CCCCOCCSCC(=O)OCC 7a_200000230590_100000757094 [0,0,0,0,0,0|2,0,2]=4 146 B14R0.393 C=CCCCSCCCCC(=O)OCC 62a_100000750268_100000757094 [0,0,0,0,0,0|1,0,2]=3 147 B14R0.393 C=CCCCSCCCCC(=O)OCC 62a_100011713584_100000750268 [0,0,0,0,0,0|1,0,2]=3 148 B14R0.393 C=CCCCSCCOCC(=O)OCC 62a_100000088970_100000757094 [0,0,0,0,0,0|2,0,2]=4 149 B14R0.393 C=CCCCSCCOCC(=O)OCC 62a_100011713584_100000088970 [0,0,0,0,0,0|2,0,2]=4 150 B14R0.393 C=CCCNCCCCCC(=O)OCC 2230a_100015191253_100000755133 [0,0,0,0,0,0|1,0,2]=3 151 B14R0.393 C=CCCNCCCOCC(=O)OCC 2230a_100015191253_100009893628 [0,0,0,0,0,0|2,0,2]=4 152 B14R0.393 C=CCCOCCCCCC(=O)OCC 34a_100011205117_100000755133 [0,0,0,0,0,0|1,0,2]=3 153 B14R0.393 C=CCCOCCCCCC(=O)OCC 7a_100011214988_100000754431 [0,0,0,0,0,0|1,0,2]=3 154 B14R0.393 C=CCCOCCCOCC(=O)OCC 34a_100011205117_100009893628 [0,0,0,0,0,0|2,0,2]=4 155 B14R0.393 C=CCCSCCCCCC(=O)OCC 62a_100000754431_100000755133 [0,0,0,0,0,0|1,0,2]=3 156 B14R0.393 C=CCCSCCCCCC(=O)OCC 62a_100000755133_100000754431 [0,0,0,0,0,0|1,0,2]=3 157 B14R0.393 C=CCCSCCCOCC(=O)OCC 62a_100000754431_100009893628 [0,0,0,0,0,0|2,0,2]=4 158 B14R0.393 C=CCCSCCCOCC(=O)OCC 62a_100009893628_100000754431 [0,0,0,0,0,0|2,0,2]=4 159 B14R0.393 C=CCNCCCCCCC(=O)OCC 2230a_100020586998_100009814379 [0,0,0,0,0,0|1,0,2]=3 160 B14R0.393 C=CCOCCCCCCC(=O)OCC 34a_200000210373_100009814379 [0,0,0,0,0,0|1,0,2]=3 161 B14R0.393 C=CCOCCOCCCC(=O)OCC 34a_100000037705_100009991533 [0,0,0,0,0,0|2,0,2]=4 162 B14R0.393 C=CCOCCOCCCC(=O)OCC 7a_100000037705_100011215271 [0,0,0,0,0,0|2,0,2]=4 163 B14R0.393 C=CCSCCCCCCC(=O)OCC 62a_100000210623_100009814379 [0,0,0,0,0,0|1,0,2]=3 164 B14R0.393 C=COC(=O)CNCCCCCCCC 2230a_100000229939_100000036128 [0,0,0,0,0,0|1,0,2]=3 165 B14R0.393 C=COC(=O)CNCCCCCCCC 34a_100000229939_100000036128 [0,0,0,0,0,0|1,0,2]=3 166 B14R0.393 C=COC(=O)CNCCCCCCCO 2230a_100011996573_100000036128 [0,0,0,0,0,0|2,0,2]=4 167 B14R0.393 C=COC(=O)CNCCCCCCCO 34a_100011996573_100000036128 [0,0,0,0,0,0|2,0,2]=4 168 B14R0.393 C=COC(=O)CNCCCOCCCC 2230a_200000211371_100000036128 [0,0,0,0,0,0|2,0,2]=4 169 B14R0.393 C=COC(=O)CNCCCOCCCC 34a_200000211371_100000036128 [0,0,0,0,0,0|2,0,2]=4 170 B14R0.393 C=COC(=O)COCCCCCCCBr 34a_100000760002_100000036128 [0,0,0,0,0,0|2,0,2]=4 171 B14R0.393 C=COC(=O)COCCCCCCCC 34a_100000210232_100000036128 [0,0,0,0,0,0|1,0,2]=3 172 B14R0.393 C=COC(=O)COCCCCCCCN 34a_100011996573_100000036128 [0,0,0,0,0,0|2,0,2]=4 173 B14R0.393 C=COC(=O)COCCCCCCOC 34a_200012092642_100000036128 [0,0,0,0,0,0|2,0,2]=4 174 B14R0.393 C=COC(=O)COCCCOCCCC 34a_200011215613_100000036128 [0,0,0,0,0,0|2,0,2]=4 175 B14R0.393 C=COC(=O)COCCNCCCCC 34a_100000224656_100000036128 [0,0,0,0,0,0|2,0,2]=4 176 B14R0.393 C=COC(=O)COCCOCCCCC 34a_100011215259_100000036128 [0,0,0,0,0,0|2,0,2]=4 177 B14R0.393 C=COC(=O)CSCCCCCCCC 62a_100000036128_100000210317 [0,0,0,0,0,0|1,0,2]=3 178 B14R0.393 C=COC(=O)CSCCCCCCCC 62a_100000210759_100000036128 [0,0,0,0,0,0|1,0,2]=3 179 B14R0.393 C=COC(=O)CSCCCCCCCO 62a_100000036128_100000760002 [0,0,0,0,0,0|2,0,2]=4 180 B14R0.393 C=COC(=O)CSCCCCCCCO 62a_100000760002_100000036128 [0,0,0,0,0,0|2,0,2]=4 181 B14R0.393 C=COC(=O)CSCCCCCCOC 62a_100000036128_100011998445 [0,0,0,0,0,0|2,0,2]=4 182 B14R0.393 C=COC(=O)CSCCCCCCOC 62a_100011998445_100000036128 [0,0,0,0,0,0|2,0,2]=4 183 B14R0.393 C=COCCCCOCCC(=O)OCC 34a_100000031558_100000765890 [0,0,0,0,0,0|2,0,2]=4 184 B14R0.393 C=COCCCCOCCC(=O)OCC 7a_100000031558_100011206558 [0,0,0,0,0,0|2,0,2]=4 185 B14R0.393 C=COCCCNCCCC(=O)OCC 2230a_100000210767_100009991533 [0,0,0,0,0,0|2,0,2]=4 186 B14R0.393 C=COCCCNCCCC(=O)OCC 34a_100000210767_100009991533 [0,0,0,0,0,0|2,0,2]=4 187 B14R0.393 C=COCCOCCCCC(=O)OCC 34a_100000033082_100000750268 [0,0,0,0,0,0|2,0,2]=4 188 B14R0.393 C=COCCSCCCCC(=O)OCC 62a_100000039644_100000750268 [0,0,0,0,0,0|2,0,2]=4 189 B14R0.393 C=COCCSCCCCC(=O)OCC 62a_100000750268_100000039644 [0,0,0,0,0,0|2,0,2]=4 190 B14R0.393 CC#CC(=O)CCCCCCC#CCC 1458a_100000763181_200000036426 [0,0,0,0,0,0|1,0,3]=4 191 B14R0.393 CC#CC(=O)CCCCCCCCCC 1458a_100000763181_100000210319 [0,0,0,0,0,0|1,0,1]=2 192 B14R0.393 CC#CC(=O)CCCCCCCCCO 1458a_100000763181_100009813782 [0,0,0,0,0,0|2,0,1]=3 193 B14R0.393 CC#CCCCCCCCC(=O)CCC 1458a_100000066323_100000210303 [0,0,0,0,0,0|1,0,2]=3 194 B14R0.393 CC#CCCCCCCCC(=O)CCF 1458a_100000066323_100011217306 [0,0,0,0,0,0|2,0,2]=4 195 B14R0.393 CC#CCCCCCCCC(=O)CCO 1458a_100000066323_100000211926 [0,0,0,0,0,0|2,0,2]=4 196 B14R0.393 CC#CCCCCCCCC(=O)NCC 11a_100015525214_100000066323 [0,0,0,0,0,0|1,0,2]=3 197 B14R0.393 CC#CCCCCCCCC(=O)NCC 240690a_100015525214_100000066323 [0,0,0,0,0,0|1,0,2]=3 198 B14R0.393 CC#CCCCCCCCC(=O)NCC 527a_100015525214_100000066323 [0,0,0,0,0,0|1,0,2]=3 199 B14R0.393 CC#CCCOCCCCC(=O)OCC 34a_100000750427_100000750268 [0,0,0,0,0,0|1,0,2]=3 200 B14R0.393 CC#CCCOCCOCC(=O)OCC 34a_100000750427_100000088970 [0,0,0,0,0,0|2,0,2]=4 201 B14R0.393 CC#CCNCCCCCC(=O)OCC 2230a_100000685387_100000755133 [0,0,0,0,0,0|1,0,2]=3 202 B14R0.393 CC#CCNCCCCCC(=O)OCC 34a_100000685387_100000755133 [0,0,0,0,0,0|1,0,2]=3 203 B14R0.393 CC#CCNCCCOCC(=O)OCC 2230a_100000685387_100009893628 [0,0,0,0,0,0|2,0,2]=4 204 B14R0.393 CC#CCNCCCOCC(=O)OCC 34a_100000685387_100009893628 [0,0,0,0,0,0|2,0,2]=4 205 B14R0.393 CC#CCOCCCCCC(=O)OCC 34a_100000761923_100000755133 [0,0,0,0,0,0|1,0,2]=3 206 B14R0.393 CC#CCOCCCCCC(=O)OCC 7a_100011214988_100000748600 [0,0,0,0,0,0|1,0,2]=3 207 B14R0.393 CC#CCOCCCOCC(=O)OCC 34a_100000761923_100009893628 [0,0,0,0,0,0|2,0,2]=4 208 B14R0.393 CC#CCSCCCCCC(=O)OCC 62a_100000748600_100000755133 [0,0,0,0,0,0|1,0,2]=3 209 B14R0.393 CC#CCSCCCCCC(=O)OCC 62a_100000755133_100000748600 [0,0,0,0,0,0|1,0,2]=3 210 B14R0.393 CC#CCSCCCOCC(=O)OCC 62a_100000748600_100009893628 [0,0,0,0,0,0|2,0,2]=4 211 B14R0.393 CC#CCSCCCOCC(=O)OCC 62a_100009893628_100000748600 [0,0,0,0,0,0|2,0,2]=4 212 B14R0.393 CC/C=C/CCCOCCC(=O)NCC 7a_100016287902_100000737597 [0,0,0,0,0,0|2,0,2]=4 213 B14R0.393 CC/C=C/CCCOCCC(=O)OCC 34a_100016287902_100000765890 [0,0,0,0,0,0|1,0,2]=3 214 B14R0.393 CC/C=C/CCCOCCC(=O)OCC 7a_100016287902_100011206558 [0,0,0,0,0,0|1,0,2]=3 215 B14R0.393 CC/C=C\CCCCOCC(=O)CCC 7a_100016287862_100000747444 [0,0,0,0,0,0|2,0,2]=4 216 B14R0.393 CC/C=C\CCCCOCC(=O)NCC 34a_100016287862_100000183381 [0,0,0,0,0,0|2,0,2]=4 217 B14R0.393 CC/C=C\CCCCOCC(=O)NCC 7a_100016287862_100000183381 [0,0,0,0,0,0|2,0,2]=4 218 B14R0.393 CC/C=C\CCCCOCC(=O)OCC 34a_100016287862_100000188475 [0,0,0,0,0,0|1,0,2]=3 219 B14R0.393 CC/C=C\CCCCOCC(=O)OCC 7a_100016287862_100000188475 [0,0,0,0,0,0|1,0,2]=3 220 B14R0.393 CC/C=C\CCOCCCC(=O)OCC 34a_100016288707_100009991533 [0,0,0,0,0,0|1,0,2]=3 221 B14R0.393 CC/C=C\CCOCCCC(=O)OCC 7a_100012001163_100015370543 [0,0,0,0,0,0|1,0,2]=3 222 B14R0.393 CC/C=C\CCOCCCC(=O)OCC 7a_100016288707_100011215271 [0,0,0,0,0,0|1,0,2]=3 223 B14R0.393 CC/C=C\CCOCCNC(=O)OCC 34a_100000158857_100015370543 [0,0,0,0,0,0|2,0,2]=4 224 B14R0.393 CC/C=C\CCOCCNC(=O)OCC 7a_100016288707_200011445536 [0,0,0,0,0,0|2,0,2]=4 225 B14R0.393 CC/C=C\CCSCCCC(=O)OCC 62a_100009991533_100015370543 [0,0,0,0,0,0|1,0,2]=3 226 B14R0.393 CC/C=C\CCSCCCC(=O)OCC 62a_100015370543_100009991533 [0,0,0,0,0,0|1,0,2]=3 227 B14R0.393 CC/C=C\CCSCCNC(=O)OCC 62a_100015370543_200011445536 [0,0,0,0,0,0|2,0,2]=4 228 B14R0.393 CC/C=C\COCCCCC(=O)OCC 34a_100016268518_100000750268 [0,0,0,0,0,0|1,0,2]=3 229 B14R0.393 CC/C=C\COCCOCC(=O)OCC 34a_100016268518_100000088970 [0,0,0,0,0,0|2,0,2]=4 230 B14R0.393 CC/C=C\COCCSCC(=O)OCC 7a_200000230590_100103147603 [0,0,0,0,0,0|2,0,2]=4 231 B14R0.393 CC/C=C\CSCCCCC(=O)OCC 62a_100000750268_100103147603 [0,0,0,0,0,0|1,0,2]=3 232 B14R0.393 CC/C=C\CSCCCCC(=O)OCC 62a_100103147603_100000750268 [0,0,0,0,0,0|1,0,2]=3 233 B14R0.393 CC/C=C\CSCCOCC(=O)OCC 62a_100000088970_100103147603 [0,0,0,0,0,0|2,0,2]=4 234 B14R0.393 CC/C=C\CSCCOCC(=O)OCC 62a_100103147603_100000088970 [0,0,0,0,0,0|2,0,2]=4 235 B14R0.393 CC=C=CCCOCCCC(=O)OCC 34a_100011020354_100009991533 [0,0,0,0,0,0|1,0,3]=4 236 B14R0.393 CC=CC(=O)CCCCCCC#CCC 1458a_100000210699_200000036426 [0,0,0,0,0,0|1,0,3]=4 237 B14R0.393 CC=CC(=O)CCCCCCCCCC 1458a_100000210699_100000210319 [0,0,0,0,0,0|1,0,1]=2 238 B14R0.393 CC=CC(=O)CCCCCCCCCO 1458a_100000210699_100009813782 [0,0,0,0,0,0|2,0,1]=3 239 B14R0.393 CC=CC(=O)NCCCCCCCCC 11a_100000212291_100000210699 [0,0,0,0,0,0|2,0,1]=3 240 B14R0.393 CC=CC(=O)NCCCCCCCCC 1626a_100000212291_100000210699 [0,0,0,0,0,0|2,0,1]=3 241 B14R0.393 CC=CC(=O)NCCCCCCCCC 240690a_100000212291_100000210699 [0,0,0,0,0,0|2,0,1]=3 242 B14R0.393 CC=CC(=O)NCCCCCCCCO 240690a_102515433106_100000210699 [0,0,0,0,0,0|3,0,1]=4 243 B14R0.393 CC=CCCCOCCCC(=O)OCC 34a_100020645299_100009991533 [0,0,0,0,0,0|1,0,2]=3 244 B14R0.393 CC=CCOCCCCCC(=O)OCC 7a_100011214988_100000070051 [0,0,0,0,0,0|1,0,2]=3 245 B14R0.393 CC=CCSCCCCCC(=O)OCC 62a_100000070051_100000755133 [0,0,0,0,0,0|1,0,2]=3 246 B14R0.393 CC=CCSCCCCCC(=O)OCC 62a_100000755133_100000070051 [0,0,0,0,0,0|1,0,2]=3 247 B14R0.393 CC=CCSCCCOCC(=O)OCC 62a_100000070051_100009893628 [0,0,0,0,0,0|2,0,2]=4 248 B14R0.393 CC=CCSCCCOCC(=O)OCC 62a_100009893628_100000070051 [0,0,0,0,0,0|2,0,2]=4 249 B14R0.393 CCC#CCCCCCCC(=O)CCC 1458a_100000211992_200000036426 [0,0,0,0,0,0|1,0,2]=3 250 B14R0.393 CCC#CCCCCCCC(=O)CCO 1458a_100011216618_200000036426 [0,0,0,0,0,0|2,0,2]=4 251 B14R0.393 CCC#CCCCCCCC(=O)COC 1458a_100000210968_200000036426 [0,0,0,0,0,0|2,0,2]=4 252 B14R0.393 CCC#CCCCCCCC(=O)CSC 1458a_100000184570_200000036426 [0,0,0,0,0,0|2,0,2]=4 253 B14R0.393 CCC#CCCOCCCC(=O)OCC 34a_100000036655_100009991533 [0,0,0,0,0,0|1,0,2]=3 254 B14R0.393 CCC#CCCOCCCC(=O)OCC 7a_100000036655_100011215271 [0,0,0,0,0,0|1,0,2]=3 255 B14R0.393 CCC#CCCOCCNC(=O)OCC 7a_100000036655_200011445536 [0,0,0,0,0,0|2,0,2]=4 256 B14R0.393 CCC#CCOCCCCC(=O)OCC 34a_100000032950_100000750268 [0,0,0,0,0,0|1,0,2]=3 257 B14R0.393 CCC#CCOCCOCC(=O)OCC 34a_100000032950_100000088970 [0,0,0,0,0,0|2,0,2]=4 258 B14R0.393 CCC#CCOCCSCC(=O)OCC 7a_200000230590_100009813939 [0,0,0,0,0,0|2,0,2]=4 259 B14R0.393 CCC#CCSCCCCC(=O)OCC 62a_100000750268_100009813939 [0,0,0,0,0,0|1,0,2]=3 260 B14R0.393 CCC#CCSCCCCC(=O)OCC 62a_100009813939_100000750268 [0,0,0,0,0,0|1,0,2]=3 261 B14R0.393 CCC#CCSCCOCC(=O)OCC 62a_100000088970_100009813939 [0,0,0,0,0,0|2,0,2]=4 262 B14R0.393 CCC#CCSCCOCC(=O)OCC 62a_100009813939_100000088970 [0,0,0,0,0,0|2,0,2]=4 263 B14R0.393 CCC/C=C/COCCCC(=O)OCC 34a_100016278788_100009991533 [0,0,0,0,0,0|1,0,2]=3 264 B14R0.393 CCC/C=C/COCCCC(=O)OCC 7a_100016278788_100011215271 [0,0,0,0,0,0|1,0,2]=3 265 B14R0.393 CCC/C=C/COCCNC(=O)OCC 7a_100016278788_200011445536 [0,0,0,0,0,0|2,0,2]=4 266 B14R0.393 CCCC#CCCOCCC(=O)NCC 7a_100000042726_100000737597 [0,0,0,0,0,0|2,0,2]=4 267 B14R0.393 CCCC#CCCOCCC(=O)OCC 34a_100000042726_100000765890 [0,0,0,0,0,0|1,0,2]=3 268 B14R0.393 CCCC#CCCOCCC(=O)OCC 7a_100000042726_100011206558 [0,0,0,0,0,0|1,0,2]=3 269 B14R0.393 CCCC#CCOCCCC(=O)OCC 34a_100000034806_100009991533 [0,0,0,0,0,0|1,0,2]=3 270 B14R0.393 CCCC#CCOCCCC(=O)OCC 7a_100000034806_100011215271 [0,0,0,0,0,0|1,0,2]=3 271 B14R0.393 CCCC#CCOCCNC(=O)OCC 7a_100000034806_200011445536 [0,0,0,0,0,0|2,0,2]=4 272 B14R0.393 CCCC(=O)CCCCCCCCCF 1458a_200009909015_100000210303 [0,0,0,0,0,0|2,0,0]=2 273 B14R0.393 CCCC(=O)CCCCCCCCCO 1458a_100000211992_100009813782 [0,0,0,0,0,0|2,0,0]=2 274 B14R0.393 CCCC(=O)CCOCCOCCOC 1458a_100000211992_100013367474 [0,0,0,0,0,0|4,0,0]=4 275 B14R0.393 CCCC(=O)CCOCCOCCOC 1458a_100012278103_100000210303 [0,0,0,0,0,0|4,0,0]=4 276 B14R0.393 CCCC(=O)CNCCCCCCCO 2230a_100011996573_100000747444 [0,0,0,0,0,0|3,0,0]=3 277 B14R0.393 CCCC(=O)CNCCCOCCCO 2230a_100011310245_100000747444 [0,0,0,0,0,0|4,0,0]=4 278 B14R0.393 CCCC(=O)CNCCCOCCOC 2230a_100000206027_100000747444 [0,0,0,0,0,0|4,0,0]=4 279 B14R0.393 CCCC(=O)CNCCOCCOCC 2230a_100102712874_100000747444 [0,0,0,0,0,0|4,0,0]=4 280 B14R0.393 CCCC(=O)COCCCCCCCBr 7a_100000760002_100000747444 [0,0,0,0,0,0|3,0,0]=3 281 B14R0.393 CCCC(=O)COCCCCCCOC 7a_200012092642_100000747444 [0,0,0,0,0,0|3,0,0]=3 282 B14R0.393 CCCC(=O)COCCOCCOCC 7a_100000210240_100000747444 [0,0,0,0,0,0|4,0,0]=4 283 B14R0.393 CCCC(=O)CSCCCCCCC#N 62a_100000747444_100009813337 [0,0,0,0,0,0|3,0,1]=4 284 B14R0.393 CCCC(=O)CSCCCCCCC#N 62a_100009813337_100000747444 [0,0,0,0,0,0|3,0,1]=4 285 B14R0.393 CCCC(=O)CSCCCCCCCO 62a_100000747444_100000760002 [0,0,0,0,0,0|3,0,0]=3 286 B14R0.393 CCCC(=O)CSCCCCCCCO 62a_100000760002_100000747444 [0,0,0,0,0,0|3,0,0]=3 287 B14R0.393 CCCC(=O)CSCCCCCCOC 62a_100000747444_100011998445 [0,0,0,0,0,0|3,0,0]=3 288 B14R0.393 CCCC(=O)CSCCCCCCOC 62a_100011998445_100000747444 [0,0,0,0,0,0|3,0,0]=3 289 B14R0.393 CCCC(=O)CSCCCOCCOC 62a_100000747444_100011216529 [0,0,0,0,0,0|4,0,0]=4 290 B14R0.393 CCCC(=O)CSCCCOCCOC 62a_100011216529_100000747444 [0,0,0,0,0,0|4,0,0]=4 291 B14R0.393 CCCC(=O)CSCCOCCOCC 62a_100000747444_100011211534 [0,0,0,0,0,0|4,0,0]=4 292 B14R0.393 CCCC(=O)CSCCOCCOCC 62a_100011211534_100000747444 [0,0,0,0,0,0|4,0,0]=4 293 B14R0.393 CCCC(=O)NCCCCCCCCO 240690a_102515433106_100000211992 [0,0,0,0,0,0|3,0,0]=3 294 B14R0.393 CCCC(=O)OCNCCCCCCO 2230a_100000686447_100000034017 [0,0,0,0,0,0|4,0,0]=4 295 B14R0.393 CCCC(=O)OCNCCCCCCO 34a_100000686447_100000034017 [0,0,0,0,0,0|4,0,0]=4 296 B14R0.393 CCCC(=O)OCNCCCCCOC 2230a_100000747528_100000034017 [0,0,0,0,0,0|4,0,0]=4 297 B14R0.393 CCCC(=O)OCNCCCCCOC 34a_100000747528_100000034017 [0,0,0,0,0,0|4,0,0]=4 298 B14R0.393 CCCC(=O)OCOCCCCCCBr 34a_100011215345_100000034017 [0,0,0,0,0,0|4,0,0]=4 299 B14R0.393 CCCC(=O)OCOCCCCCCCl 34a_100000766143_100000034017 [0,0,0,0,0,0|4,0,0]=4 300 B14R0.393 CCCC(=O)OCOCCCCCCF 34a_100000732779_100000034017 [0,0,0,0,0,0|4,0,0]=4 301 B14R0.393 CCCC(=O)OCOCCCCCCN 34a_100000686447_100000034017 [0,0,0,0,0,0|4,0,0]=4 302 B14R0.393 CCCC(=O)OCOCCCCCNC 34a_100000722520_100000034017 [0,0,0,0,0,0|4,0,0]=4 303 B14R0.393 CCCC(=O)OCSCCCCCCF 62a_100015922095_100000034017 [0,0,0,0,0,0|4,0,0]=4 304 B14R0.393 CCCC(=O)OCSCCCCCCO 62a_100000766143_100000034017 [0,0,0,0,0,0|4,0,0]=4 305 B14R0.393 CCCC/C=C/COCCC(=O)NCC 7a_200016272032_100000737597 [0,0,0,0,0,0|2,0,2]=4 306 B14R0.393 CCCC/C=C/COCCC(=O)OCC 34a_200016272032_100000765890 [0,0,0,0,0,0|1,0,2]=3 307 B14R0.393 CCCC/C=C/COCCC(=O)OCC 7a_200016272032_100011206558 [0,0,0,0,0,0|1,0,2]=3 308 B14R0.393 CCCC/C=C\CCOCC(=O)CCC 7a_200016286491_100000747444 [0,0,0,0,0,0|2,0,2]=4 309 B14R0.393 CCCC/C=C\CCOCC(=O)NCC 34a_200016286491_100000183381 [0,0,0,0,0,0|2,0,2]=4 310 B14R0.393 CCCC/C=C\CCOCC(=O)NCC 7a_200016286491_100000183381 [0,0,0,0,0,0|2,0,2]=4 311 B14R0.393 CCCC/C=C\CCOCC(=O)OCC 34a_200016286491_100000188475 [0,0,0,0,0,0|1,0,2]=3 312 B14R0.393 CCCC/C=C\CCOCC(=O)OCC 7a_200016286491_100000188475 [0,0,0,0,0,0|1,0,2]=3 313 B14R0.393 CCCCC#CCCOCC(=O)CCC 7a_100000037610_100000747444 [0,0,0,0,0,0|2,0,2]=4 314 B14R0.393 CCCCC#CCCOCC(=O)NCC 34a_100000037610_100000183381 [0,0,0,0,0,0|2,0,2]=4 315 B14R0.393 CCCCC#CCCOCC(=O)NCC 7a_100000037610_100000183381 [0,0,0,0,0,0|2,0,2]=4 316 B14R0.393 CCCCC#CCCOCC(=O)OCC 34a_100000037610_100000188475 [0,0,0,0,0,0|1,0,2]=3 317 B14R0.393 CCCCC#CCCOCC(=O)OCC 7a_100000037610_100000188475 [0,0,0,0,0,0|1,0,2]=3 318 B14R0.393 CCCCC#CCOCCC(=O)NCC 7a_200000034558_100000737597 [0,0,0,0,0,0|2,0,2]=4 319 B14R0.393 CCCCC#CCOCCC(=O)OCC 34a_200000034558_100000765890 [0,0,0,0,0,0|1,0,2]=3 320 B14R0.393 CCCCC#CCOCCC(=O)OCC 7a_200000034558_100011206558 [0,0,0,0,0,0|1,0,2]=3 321 B14R0.393 CCCCC/C=C/COCC(=O)CCC 7a_100016258190_100000747444 [0,0,0,0,0,0|2,0,2]=4 322 B14R0.393 CCCCC/C=C/COCC(=O)NCC 34a_100016258190_100000183381 [0,0,0,0,0,0|2,0,2]=4 323 B14R0.393 CCCCC/C=C/COCC(=O)NCC 7a_100016258190_100000183381 [0,0,0,0,0,0|2,0,2]=4 324 B14R0.393 CCCCC/C=C/COCC(=O)OCC 34a_100016258190_100000188475 [0,0,0,0,0,0|1,0,2]=3 325 B14R0.393 CCCCC/C=C/COCC(=O)OCC 7a_100016258190_100000188475 [0,0,0,0,0,0|1,0,2]=3 326 B14R0.393 CCCCCC#CCNCC(=O)NCC 2230a_100016988866_100009816472 [0,0,0,0,0,0|2,0,2]=4 327 B14R0.393 CCCCCC#CCOCC(=O)CCC 7a_200000033628_100000747444 [0,0,0,0,0,0|2,0,2]=4 328 B14R0.393 CCCCCC#CCOCC(=O)NCC 34a_200000033628_100000183381 [0,0,0,0,0,0|2,0,2]=4 329 B14R0.393 CCCCCC#CCOCC(=O)NCC 7a_200000033628_100000183381 [0,0,0,0,0,0|2,0,2]=4 330 B14R0.393 CCCCCC#CCOCC(=O)OCC 34a_200000033628_100000188475 [0,0,0,0,0,0|1,0,2]=3 331 B14R0.393 CCCCCC#CCOCC(=O)OCC 7a_200000033628_100000188475 [0,0,0,0,0,0|1,0,2]=3 332 B14R0.393 CCCCCC#CCSCC(=O)CCC 62a_100000747444_100009816472 [0,0,0,0,0,0|2,0,2]=4 333 B14R0.393 CCCCCC#CCSCC(=O)CCC 62a_100009816472_100000747444 [0,0,0,0,0,0|2,0,2]=4 334 B14R0.393 CCCCCC#CCSCC(=O)NCC 62a_100000183381_100009816472 [0,0,0,0,0,0|2,0,2]=4 335 B14R0.393 CCCCCC#CCSCC(=O)NCC 62a_100009816472_100000183381 [0,0,0,0,0,0|2,0,2]=4 336 B14R0.393 CCCCCC#CCSCC(=O)OCC 62a_100000188475_100009816472 [0,0,0,0,0,0|1,0,2]=3 337 B14R0.393 CCCCCC#CCSCC(=O)OCC 62a_100009816472_100000188475 [0,0,0,0,0,0|1,0,2]=3 338 B14R0.393 CCCCCCCC=NNC(=O)CCC 4a_100000189770_100000210592 [0,0,0,0,0,0|3,0,1]=4 339 B14R0.393 CCCCCCCCC=CC(=O)CCC 1458a_100015345288_100000210303 [0,0,0,0,0,0|1,0,2]=3 340 B14R0.393 CCCCCCCCC=CC(=O)CCF 1458a_100015345288_100011217306 [0,0,0,0,0,0|2,0,2]=4 341 B14R0.393 CCCCCCCCC=CC(=O)CCO 1458a_100015345288_100000211926 [0,0,0,0,0,0|2,0,2]=4 342 B14R0.393 CCCCCCCCC=CC(=O)NCC 11a_100015525214_100015345288 [0,0,0,0,0,0|1,0,2]=3 343 B14R0.393 CCCCCCCCC=CC(=O)NCC 240690a_100015525214_100015345288 [0,0,0,0,0,0|1,0,2]=3 344 B14R0.393 CCCCCCCCC=CC(=O)NNC 22a_100016993582_100015345288 [0,0,0,0,0,0|2,0,2]=4 345 B14R0.393 CCCCCCCCCCC(=O)C=CBr 1458a_100016273825_100000210319 [0,0,0,0,0,0|2,0,1]=3 346 B14R0.393 CCCCCCCCCCC(=O)C=CCl 1458a_200016279998_100000210319 [0,0,0,0,0,0|2,0,1]=3 347 B14R0.393 CCCCCCCCCCC(=O)CC#N 1458a_100000210375_100011214920 [0,0,0,0,0,0|2,0,1]=3 348 B14R0.393 CCCCCCCCCCC(=O)CC#N 1458a_100051588842_100000210319 [0,0,0,0,0,0|2,0,1]=3 349 B14R0.393 CCCCCCCCCCC(=O)CCC 1458a_100000210375_100000210303 [0,0,0,0,0,0|1,0,0]=1 350 B14R0.393 CCCCCCCCCCC(=O)CCC 1458a_100000211992_100000210319 [0,0,0,0,0,0|1,0,0]=1 351 B14R0.393 CCCCCCCCCCC(=O)CCF 1458a_100000210375_100011217306 [0,0,0,0,0,0|2,0,0]=2 352 B14R0.393 CCCCCCCCCCC(=O)CCO 1458a_100000210375_100000211926 [0,0,0,0,0,0|2,0,0]=2 353 B14R0.393 CCCCCCCCCCC(=O)CCO 1458a_100011216618_100000210319 [0,0,0,0,0,0|2,0,0]=2 354 B14R0.393 CCCCCCCCCCC(=O)COC 1458a_100000210968_100000210319 [0,0,0,0,0,0|2,0,0]=2 355 B14R0.393 CCCCCCCCCCC(=O)CSC 1458a_100000184570_100000210319 [0,0,0,0,0,0|2,0,0]=2 356 B14R0.393 CCCCCCCCCCC(=O)NCC 11a_100015525214_100000210375 [0,0,0,0,0,0|1,0,0]=1 357 B14R0.393 CCCCCCCCCCC(=O)NCC 240690a_100015525214_100000210375 [0,0,0,0,0,0|1,0,0]=1 358 B14R0.393 CCCCCCCCCCC(=O)NNC 22a_100016993582_100000210375 [0,0,0,0,0,0|2,0,0]=2 359 B14R0.393 CCCCCCCCCCC(C)NCC 270004a_100015525214_200011219864 [0,0,0,0,0,0|2,0,1]=3 360 B14R0.393 CCCCCCCCCCC(C)OCC 34a_100011215000_100000210202 [0,0,0,0,0,0|1,0,1]=2 361 B14R0.393 CCCCCCCCCCC(C)OCC 7a_100011215000_100000210202 [0,0,0,0,0,0|1,0,1]=2 362 B14R0.393 CCCCCCCCCCC(C)OCF 34a_100011215000_100015361967 [0,0,0,0,0,0|2,0,1]=3 363 B14R0.393 CCCCCCCCCCC(C)OCF 7a_100011215000_100015361967 [0,0,0,0,0,0|2,0,1]=3 364 B14R0.393 CCCCCCCCCCN(C)CCC 2230a_100000207566_100000210303 [0,0,0,0,0,0|3,0,0]=3 365 B14R0.393 CCCCCCCCCCN(C)CCC 2230a_100000747261_100000210320 [0,0,0,0,0,0|3,0,0]=3 366 B14R0.393 CCCCCCCCCCN(C)CCC 269982a_100000207566_100000210303 [0,0,0,0,0,0|3,0,0]=3 367 B14R0.393 CCCCCCCCCCN(C)CCC 269982a_100000747261_100000210320 [0,0,0,0,0,0|3,0,0]=3 368 B14R0.393 CCCCCCCCCCN(C)CCF 2230a_100000207566_100011217306 [0,0,0,0,0,0|4,0,0]=4 369 B14R0.393 CCCCCCCCCCN(C)CCF 269982a_100000207566_100011217306 [0,0,0,0,0,0|4,0,0]=4 370 B14R0.393 CCCCCCCCCCN(C)CCO 2230a_100000207566_100000211926 [0,0,0,0,0,0|4,0,0]=4 371 B14R0.393 CCCCCCCCCCN(C)CCO 2230a_100000210263_100000210320 [0,0,0,0,0,0|4,0,0]=4 372 B14R0.393 CCCCCCCCCCN(C)CCO 269982a_100000207566_100000211926 [0,0,0,0,0,0|4,0,0]=4 373 B14R0.393 CCCCCCCCCCN(C)CCO 269982a_100000210263_100000210320 [0,0,0,0,0,0|4,0,0]=4 374 B14R0.393 CCCCCCCCCCN(C)COC 2230a_100000207566_100000766300 [0,0,0,0,0,0|4,0,0]=4 375 B14R0.393 CCCCCCCCCCN(C)COC 269982a_100000207566_100000766300 [0,0,0,0,0,0|4,0,0]=4 376 B14R0.393 CCCCCCCCCCN(C)CSC 2230a_100000207566_100011218213 [0,0,0,0,0,0|4,0,0]=4 377 B14R0.393 CCCCCCCCCCN(C)CSC 269982a_100000207566_100011218213 [0,0,0,0,0,0|4,0,0]=4 378 B14R0.393 CCCCCCCCCNC(=O)C=CBr 1626a_100000212291_100016273825 [0,0,0,0,0,0|3,0,1]=4 379 B14R0.393 CCCCCCCCCNC(=O)C=CBr 240690a_100000212291_100016273825 [0,0,0,0,0,0|3,0,1]=4 380 B14R0.393 CCCCCCCCCNC(=O)C=CCl 11a_100000212291_200016279998 [0,0,0,0,0,0|3,0,1]=4 381 B14R0.393 CCCCCCCCCNC(=O)C=CCl 1626a_100000212291_200016279998 [0,0,0,0,0,0|3,0,1]=4 382 B14R0.393 CCCCCCCCCNC(=O)C=CCl 240690a_100000212291_200016279998 [0,0,0,0,0,0|3,0,1]=4 383 B14R0.393 CCCCCCCCCNC(=O)C=CI 1626a_100000212291_100016256311 [0,0,0,0,0,0|3,0,1]=4 384 B14R0.393 CCCCCCCCCNC(=O)CC#N 1626a_100000212291_100051588842 [0,0,0,0,0,0|3,0,1]=4 385 B14R0.393 CCCCCCCCCNC(=O)CC#N 240690a_100000212291_100051588842 [0,0,0,0,0,0|3,0,1]=4 386 B14R0.393 CCCCCCCCCNC(=O)CCC 11a_100000212291_100000211992 [0,0,0,0,0,0|2,0,0]=2 387 B14R0.393 CCCCCCCCCNC(=O)CCC 1626a_100000212291_100000211992 [0,0,0,0,0,0|2,0,0]=2 388 B14R0.393 CCCCCCCCCNC(=O)CCC 240690a_100000212291_100000211992 [0,0,0,0,0,0|2,0,0]=2 389 B14R0.393 CCCCCCCCCNC(=O)CCC 527a_100000212291_100000211992 [0,0,0,0,0,0|2,0,0]=2 390 B14R0.393 CCCCCCCCCNC(=O)CCO 240690a_100000212291_100011216618 [0,0,0,0,0,0|3,0,0]=3 391 B14R0.393 CCCCCCCCCNC(=O)COC 11a_100000212291_100000210968 [0,0,0,0,0,0|3,0,0]=3 392 B14R0.393 CCCCCCCCCNC(=O)COC 1626a_100000212291_100000210968 [0,0,0,0,0,0|3,0,0]=3 393 B14R0.393 CCCCCCCCCNC(=O)COC 240690a_100000212291_100000210968 [0,0,0,0,0,0|3,0,0]=3 394 B14R0.393 CCCCCCCCCNC(=O)COC 527a_100000212291_100000210968 [0,0,0,0,0,0|3,0,0]=3 395 B14R0.393 CCCCCCCCCNC(=O)CSC 11a_100000212291_100000184570 [0,0,0,0,0,0|3,0,0]=3 396 B14R0.393 CCCCCCCCCNC(=O)CSC 1626a_100000212291_100000184570 [0,0,0,0,0,0|3,0,0]=3 397 B14R0.393 CCCCCCCCCNC(=O)CSC 240690a_100000212291_100000184570 [0,0,0,0,0,0|3,0,0]=3 398 B14R0.393 CCCCCCCCCNC(=O)CSC 527a_100000212291_100000184570 [0,0,0,0,0,0|3,0,0]=3 399 B14R0.393 CCCCCCCCCNC(=O)NCC 2708a_100000212291_100015525214 [0,0,0,0,0,0|2,0,0]=2 400 B14R0.393 CCCCCCCCCNC(=O)NCC 2708a_100015525214_100000212291 [0,0,0,0,0,0|2,0,0]=2 401 B14R0.393 CCCCCCCCCNC(=O)NCC 273464a_100000212291_100015525214 [0,0,0,0,0,0|2,0,0]=2 402 B14R0.393 CCCCCCCCCNC(=O)NCC 273464a_100015525214_100000212291 [0,0,0,0,0,0|2,0,0]=2 403 B14R0.393 CCCCCCCCCNC(=O)NCC 512a_100000212291_100015525214 [0,0,0,0,0,0|2,0,0]=2 404 B14R0.393 CCCCCCCCCNC(=O)NCC 512a_100015525214_100000212291 [0,0,0,0,0,0|2,0,0]=2 405 B14R0.393 CCCCCCCCCNC(=O)NNC 273464a_100000212291_100016993582 [0,0,0,0,0,0|3,0,0]=3 406 B14R0.393 CCCCCCCCCNC(=O)NNC 512a_100000212291_100016993582 [0,0,0,0,0,0|3,0,0]=3 407 B14R0.393 CCCCCCCCCNC(=O)NNC 512a_100016993582_100000212291 [0,0,0,0,0,0|3,0,0]=3 408 B14R0.393 CCCCCCCCCNC(C)CCC 2230a_100000212291_100000766640 [0,0,0,0,0,0|3,0,1]=4 409 B14R0.393 CCCCCCCCCNC(C)CCC 2230a_100000741246_100011214924 [0,0,0,0,0,0|3,0,1]=4 410 B14R0.393 CCCCCCCCCNC(C)CCC 270004a_100000212291_100000211909 [0,0,0,0,0,0|3,0,1]=4 411 B14R0.393 CCCCCCCCCNC(C)CCC 34a_100000212291_100000766640 [0,0,0,0,0,0|3,0,1]=4 412 B14R0.393 CCCCCCCCCOC(C)CCC 34a_100000210712_100000766640 [0,0,0,0,0,0|3,0,1]=4 413 B14R0.393 CCCCCCCCCOC(C)CCC 34a_100000764384_100011214924 [0,0,0,0,0,0|3,0,1]=4 414 B14R0.393 CCCCCCCCCOC(C)CCC 7a_100000210712_100000766640 [0,0,0,0,0,0|3,0,1]=4 415 B14R0.393 CCCCCCCCCOC(C)CCC 7a_100000764384_100000210328 [0,0,0,0,0,0|3,0,1]=4 416 B14R0.393 CCCCCCCCNCC(=O)CCC 2230a_100000229939_100000747444 [0,0,0,0,0,0|2,0,0]=2 417 B14R0.393 CCCCCCCCNCC(=O)NCC 2230a_100000229939_100000183381 [0,0,0,0,0,0|2,0,0]=2 418 B14R0.393 CCCCCCCCNCC(=O)NCC 2230a_100016988866_100000210759 [0,0,0,0,0,0|2,0,0]=2 419 B14R0.393 CCCCCCCCNCC(=O)NCC 34a_100000229939_100000183381 [0,0,0,0,0,0|2,0,0]=2 420 B14R0.393 CCCCCCCCNCC(=O)NCO 2230a_100000229939_100000185155 [0,0,0,0,0,0|3,0,0]=3 421 B14R0.393 CCCCCCCCNCC(=O)NCO 34a_100000229939_100000185155 [0,0,0,0,0,0|3,0,0]=3 422 B14R0.393 CCCCCCCCNCC(=O)OCC 2230a_100000229939_100000188475 [0,0,0,0,0,0|1,0,0]=1 423 B14R0.393 CCCCCCCCNCC(=O)OCC 34a_100000229939_100000188475 [0,0,0,0,0,0|1,0,0]=1 424 B14R0.393 CCCCCCCCNCC(C)CCC 2230a_100000229939_100011216630 [0,0,0,0,0,0|3,0,1]=4 425 B14R0.393 CCCCCCCCNCC(C)CCC 270004a_100000229939_100000243154 [0,0,0,0,0,0|3,0,1]=4 426 B14R0.393 CCCCCCCCNCC(C)CCC 34a_100000229939_100011216630 [0,0,0,0,0,0|3,0,1]=4 427 B14R0.393 CCCCCCCCOCC(=O)CC#N 1458a_100000759886_100011214920 [0,0,0,0,0,0|3,0,1]=4 428 B14R0.393 CCCCCCCCOCC(=O)CCC 1458a_100000759886_100000210303 [0,0,0,0,0,0|2,0,0]=2 429 B14R0.393 CCCCCCCCOCC(=O)CCC 7a_100000210232_100000747444 [0,0,0,0,0,0|2,0,0]=2 430 B14R0.393 CCCCCCCCOCC(=O)CCF 1458a_100000759886_100011217306 [0,0,0,0,0,0|3,0,0]=3 431 B14R0.393 CCCCCCCCOCC(=O)CCO 1458a_100000759886_100000211926 [0,0,0,0,0,0|3,0,0]=3 432 B14R0.393 CCCCCCCCOCC(=O)NCC 11a_100015525214_100000759886 [0,0,0,0,0,0|2,0,0]=2 433 B14R0.393 CCCCCCCCOCC(=O)NCC 240690a_100015525214_100000759886 [0,0,0,0,0,0|2,0,0]=2 434 B14R0.393 CCCCCCCCOCC(=O)NCC 34a_100000210232_100000183381 [0,0,0,0,0,0|2,0,0]=2 435 B14R0.393 CCCCCCCCOCC(=O)NCC 527a_100015525214_100000759886 [0,0,0,0,0,0|2,0,0]=2 436 B14R0.393 CCCCCCCCOCC(=O)NCC 7a_100000210232_100000183381 [0,0,0,0,0,0|2,0,0]=2 437 B14R0.393 CCCCCCCCOCC(=O)NCO 34a_100000210232_100000185155 [0,0,0,0,0,0|3,0,0]=3 438 B14R0.393 CCCCCCCCOCC(=O)NCO 7a_100000210232_100000185155 [0,0,0,0,0,0|3,0,0]=3 439 B14R0.393 CCCCCCCCOCC(=O)NNC 22a_100016993582_100000759886 [0,0,0,0,0,0|3,0,0]=3 440 B14R0.393 CCCCCCCCOCC(=O)OCC 34a_100000210232_100000188475 [0,0,0,0,0,0|1,0,0]=1 441 B14R0.393 CCCCCCCCOCC(=O)OCC 7a_100000210232_100000188475 [0,0,0,0,0,0|1,0,0]=1 442 B14R0.393 CCCCCCCCOCC(C)CCC 34a_100000210232_100011216630 [0,0,0,0,0,0|3,0,1]=4 443 B14R0.393 CCCCCCCCOCC(C)CCC 34a_100000688023_100000210759 [0,0,0,0,0,0|3,0,1]=4 444 B14R0.393 CCCCCCCCOCC(C)CCC 7a_100000210232_100011216630 [0,0,0,0,0,0|3,0,1]=4 445 B14R0.393 CCCCCCCCOCC(C)CCC 7a_100000688023_100000210759 [0,0,0,0,0,0|3,0,1]=4 446 B14R0.393 CCCCCCCCOC[C@@H](N)CCC 34a_100000732646_100000210759 [0,0,0,0,0,0|3,0,1]=4 447 B14R0.393 CCCCCCCCSCC(=O)CCC 62a_100000210759_100000747444 [0,0,0,0,0,0|2,0,0]=2 448 B14R0.393 CCCCCCCCSCC(=O)CCC 62a_100000747444_100000210317 [0,0,0,0,0,0|2,0,0]=2 449 B14R0.393 CCCCCCCCSCC(=O)NCC 62a_100000183381_100000210317 [0,0,0,0,0,0|2,0,0]=2 450 B14R0.393 CCCCCCCCSCC(=O)NCC 62a_100000210759_100000183381 [0,0,0,0,0,0|2,0,0]=2 451 B14R0.393 CCCCCCCCSCC(=O)NCO 62a_100000185155_100000210317 [0,0,0,0,0,0|3,0,0]=3 452 B14R0.393 CCCCCCCCSCC(=O)NCO 62a_100000210759_100000185155 [0,0,0,0,0,0|3,0,0]=3 453 B14R0.393 CCCCCCCCSCC(=O)OCC 62a_100000188475_100000210317 [0,0,0,0,0,0|1,0,0]=1 454 B14R0.393 CCCCCCCCSCC(=O)OCC 62a_100000210759_100000188475 [0,0,0,0,0,0|1,0,0]=1 455 B14R0.393 CCCCCCCNCCC(=O)NCC 2230a_100000229938_100000737597 [0,0,0,0,0,0|2,0,0]=2 456 B14R0.393 CCCCCCCNCCC(=O)NCC 34a_100025743525_100000210614 [0,0,0,0,0,0|2,0,0]=2 457 B14R0.393 CCCCCCCNCCC(=O)OCC 2230a_100000229938_100011206558 [0,0,0,0,0,0|1,0,0]=1 458 B14R0.393 CCCCCCCNCOC(=O)CCC 2230a_100000229938_100000034017 [0,0,0,0,0,0|3,0,0]=3 459 B14R0.393 CCCCCCCOCCC(=O)NCC 7a_100000210272_100000737597 [0,0,0,0,0,0|2,0,0]=2 460 B14R0.393 CCCCCCCOCCC(=O)OCC 34a_100000210272_100000765890 [0,0,0,0,0,0|1,0,0]=1 461 B14R0.393 CCCCCCCOCCC(=O)OCC 7a_100000210272_100011206558 [0,0,0,0,0,0|1,0,0]=1 462 B14R0.393 CCCCCCCOCCC(C)CCC 34a_100011217855_100000210614 [0,0,0,0,0,0|3,0,1]=4 463 B14R0.393 CCCCCCCOCCC(C)CCC 7a_100011217855_100000210614 [0,0,0,0,0,0|3,0,1]=4 464 B14R0.393 CCCCCCCOCC[C@@H](N)CCC 34a_100015193777_100000210614 [0,0,0,0,0,0|3,0,1]=4 465 B14R0.393 CCCCCCCOCOC(=O)CCC 34a_100000210272_100000034017 [0,0,0,0,0,0|3,0,0]=3 466 B14R0.393 CCCCCCCSCCC(=O)NCC 62a_100000210614_100000737597 [0,0,0,0,0,0|2,0,0]=2 467 B14R0.393 CCCCCCCSCCC(=O)NCC 62a_100000737597_100000210316 [0,0,0,0,0,0|2,0,0]=2 468 B14R0.393 CCCCCCCSCCC(=O)OCC 62a_100000210614_100000765890 [0,0,0,0,0,0|1,0,0]=1 469 B14R0.393 CCCCCCCSCCC(=O)OCC 62a_100000765890_100000210316 [0,0,0,0,0,0|1,0,0]=1 470 B14R0.393 CCCCCCCSCOC(=O)CCC 62a_100000210614_100000034017 [0,0,0,0,0,0|3,0,0]=3 471 B14R0.393 CCCCCCCSCOC(=O)OCC 62a_100000210614_100000075025 [0,0,0,0,0,0|2,0,0]=2 472 B14R0.393 CCCCCCNC/C=C/C(=O)OCC 2230a_100000210581_100016267167 [0,0,0,0,0,0|1,0,2]=3 473 B14R0.393 CCCCCCNCCCC(=O)OCC 2230a_100000210581_100009991533 [0,0,0,0,0,0|1,0,0]=1 474 B14R0.393 CCCCCCOC/C=C/C(=O)OCC 34a_100000210259_100016267167 [0,0,0,0,0,0|1,0,2]=3 475 B14R0.393 CCCCCCOC/C=C/C(=O)OCC 7a_100000210259_100016267167 [0,0,0,0,0,0|1,0,2]=3 476 B14R0.393 CCCCCCOCCCC(=O)OCC 34a_100000210259_100009991533 [0,0,0,0,0,0|1,0,0]=1 477 B14R0.393 CCCCCCOCCCC(=O)OCC 7a_100000210259_100011215271 [0,0,0,0,0,0|1,0,0]=1 478 B14R0.393 CCCCCCOCCCC(=O)OCC 7a_100012001163_100000210314 [0,0,0,0,0,0|1,0,0]=1 479 B14R0.393 CCCCCCOCCCC(C)CCC 34a_100011713154_100000210314 [0,0,0,0,0,0|3,0,1]=4 480 B14R0.393 CCCCCCOCCCC(C)CCC 7a_100011713154_100000210314 [0,0,0,0,0,0|3,0,1]=4 481 B14R0.393 CCCCCCOCCNC(=O)OCC 34a_100000158857_100000210314 [0,0,0,0,0,0|2,0,0]=2 482 B14R0.393 CCCCCCOCCNC(=O)OCC 7a_100000210259_200011445536 [0,0,0,0,0,0|2,0,0]=2 483 B14R0.393 CCCCCCSC/C=C/C(=O)OCC 62a_100000210314_100016267167 [0,0,0,0,0,0|1,0,2]=3 484 B14R0.393 CCCCCCSC/C=C/C(=O)OCC 62a_100016267167_100000210757 [0,0,0,0,0,0|1,0,2]=3 485 B14R0.393 CCCCCCSCCCC(=O)OCC 62a_100000210314_100009991533 [0,0,0,0,0,0|1,0,0]=1 486 B14R0.393 CCCCCCSCCCC(=O)OCC 62a_100009991533_100000210757 [0,0,0,0,0,0|1,0,0]=1 487 B14R0.393 CCCCCCSCCNC(=O)OCC 62a_100000210314_200011445536 [0,0,0,0,0,0|2,0,0]=2 488 B14R0.393 CCCCCNCCCCC(=O)OCC 2230a_100000209983_100000750268 [0,0,0,0,0,0|1,0,0]=1 489 B14R0.393 CCCCCNCCOCC(=O)NCC 34a_100000224656_100000183381 [0,0,0,0,0,0|3,0,0]=3 490 B14R0.393 CCCCCNCCOCC(=O)NCO 34a_100000224656_100000185155 [0,0,0,0,0,0|4,0,0]=4 491 B14R0.393 CCCCCNCCOCC(=O)OCC 2230a_100000209983_100000088970 [0,0,0,0,0,0|2,0,0]=2 492 B14R0.393 CCCCCNCCOCC(=O)OCC 34a_100000224656_100000188475 [0,0,0,0,0,0|2,0,0]=2 493 B14R0.393 CCCCCOCCCCC(=O)OCC 34a_100000210253_100000750268 [0,0,0,0,0,0|1,0,0]=1 494 B14R0.393 CCCCCOCCCCC(=O)OCC 7a_100000210253_100000750268 [0,0,0,0,0,0|1,0,0]=1 495 B14R0.393 CCCCCOCCOCC(=O)CCC 7a_100011215259_100000747444 [0,0,0,0,0,0|3,0,0]=3 496 B14R0.393 CCCCCOCCOCC(=O)NCC 34a_100011215259_100000183381 [0,0,0,0,0,0|3,0,0]=3 497 B14R0.393 CCCCCOCCOCC(=O)NCC 7a_100011215259_100000183381 [0,0,0,0,0,0|3,0,0]=3 498 B14R0.393 CCCCCOCCOCC(=O)NCO 34a_100011215259_100000185155 [0,0,0,0,0,0|4,0,0]=4 499 B14R0.393 CCCCCOCCOCC(=O)NCO 7a_100011215259_100000185155 [0,0,0,0,0,0|4,0,0]=4 500 B14R0.393 CCCCCOCCOCC(=O)OCC 34a_100000210253_100000088970 [0,0,0,0,0,0|2,0,0]=2 501 B14R0.393 CCCCCOCCOCC(=O)OCC 34a_100011215259_100000188475 [0,0,0,0,0,0|2,0,0]=2 502 B14R0.393 CCCCCOCCOCC(=O)OCC 7a_100000210253_100000088970 [0,0,0,0,0,0|2,0,0]=2 503 B14R0.393 CCCCCOCCOCC(=O)OCC 7a_100011215259_100000188475 [0,0,0,0,0,0|2,0,0]=2 504 B14R0.393 CCCCCOCCSCC(=O)OCC 7a_200000230590_100000210326 [0,0,0,0,0,0|2,0,0]=2 505 B14R0.393 CCCCCSCC=NNC(=O)OCC 62a_100000210326_100015372823 [0,0,0,0,0,0|3,0,1]=4 506 B14R0.393 CCCCCSCCCCC(=O)OCC 62a_100000210326_100000750268 [0,0,0,0,0,0|1,0,0]=1 507 B14R0.393 CCCCCSCCCCC(=O)OCC 62a_100000750268_100000210326 [0,0,0,0,0,0|1,0,0]=1 508 B14R0.393 CCCCCSCCOCC(=O)OCC 62a_100000088970_100000210326 [0,0,0,0,0,0|2,0,0]=2 509 B14R0.393 CCCCCSCCOCC(=O)OCC 62a_100000210326_100000088970 [0,0,0,0,0,0|2,0,0]=2 510 B14R0.393 CCCCNCCCCCC(=O)OCC 2230a_100000102301_100000755133 [0,0,0,0,0,0|1,0,0]=1 511 B14R0.393 CCCCNCCCCCC(=O)OCC 7a_106832991798_100000755133 [0,0,0,0,0,0|1,0,0]=1 512 B14R0.393 CCCCNCCCOCC(=O)OCC 2230a_100000102301_100009893628 [0,0,0,0,0,0|2,0,0]=2 513 B14R0.393 CCCCNCCCOCC(=O)OCC 7a_106832991798_100009893628 [0,0,0,0,0,0|2,0,0]=2 514 B14R0.393 CCCCOCCCCCC(=O)OCC 34a_100000210227_100000755133 [0,0,0,0,0,0|1,0,0]=1 515 B14R0.393 CCCCOCCCCCC(=O)OCC 7a_100000210227_100000755133 [0,0,0,0,0,0|1,0,0]=1 516 B14R0.393 CCCCOCCCCCC(=O)OCC 7a_100011214988_100000210211 [0,0,0,0,0,0|1,0,0]=1 517 B14R0.393 CCCCOCCCNCC(=O)CCC 2230a_200000211371_100000747444 [0,0,0,0,0,0|3,0,0]=3 518 B14R0.393 CCCCOCCCNCC(=O)NCC 2230a_200000211371_100000183381 [0,0,0,0,0,0|3,0,0]=3 519 B14R0.393 CCCCOCCCNCC(=O)NCC 34a_200000211371_100000183381 [0,0,0,0,0,0|3,0,0]=3 520 B14R0.393 CCCCOCCCNCC(=O)NCO 2230a_200000211371_100000185155 [0,0,0,0,0,0|4,0,0]=4 521 B14R0.393 CCCCOCCCNCC(=O)NCO 34a_200000211371_100000185155 [0,0,0,0,0,0|4,0,0]=4 522 B14R0.393 CCCCOCCCNCC(=O)OCC 2230a_200000211371_100000188475 [0,0,0,0,0,0|2,0,0]=2 523 B14R0.393 CCCCOCCCNCC(=O)OCC 34a_200000211371_100000188475 [0,0,0,0,0,0|2,0,0]=2 524 B14R0.393 CCCCOCCCOCC(=O)CCC 7a_200011215613_100000747444 [0,0,0,0,0,0|3,0,0]=3 525 B14R0.393 CCCCOCCCOCC(=O)NCC 34a_200011215613_100000183381 [0,0,0,0,0,0|3,0,0]=3 526 B14R0.393 CCCCOCCCOCC(=O)NCC 7a_200011215613_100000183381 [0,0,0,0,0,0|3,0,0]=3 527 B14R0.393 CCCCOCCCOCC(=O)NCO 34a_200011215613_100000185155 [0,0,0,0,0,0|4,0,0]=4 528 B14R0.393 CCCCOCCCOCC(=O)NCO 7a_200011215613_100000185155 [0,0,0,0,0,0|4,0,0]=4 529 B14R0.393 CCCCOCCCOCC(=O)OCC 34a_100000210227_100009893628 [0,0,0,0,0,0|2,0,0]=2 530 B14R0.393 CCCCOCCCOCC(=O)OCC 34a_200011215613_100000188475 [0,0,0,0,0,0|2,0,0]=2 531 B14R0.393 CCCCOCCCOCC(=O)OCC 7a_100000210227_100009893628 [0,0,0,0,0,0|2,0,0]=2 532 B14R0.393 CCCCOCCCOCC(=O)OCC 7a_200011215613_100000188475 [0,0,0,0,0,0|2,0,0]=2 533 B14R0.393 CCCCOCCNCCC(=O)NCC 34a_100025743525_100000743108 [0,0,0,0,0,0|3,0,0]=3 534 B14R0.393 CCCCOCCOCCC(=O)NCC 7a_100000210238_100000737597 [0,0,0,0,0,0|3,0,0]=3 535 B14R0.393 CCCCOCCOCCC(=O)OCC 34a_100000210238_100000765890 [0,0,0,0,0,0|2,0,0]=2 536 B14R0.393 CCCCOCCOCCC(=O)OCC 7a_100000210238_100011206558 [0,0,0,0,0,0|2,0,0]=2 537 B14R0.393 CCCCOCCOCOC(=O)CCC 34a_100000210238_100000034017 [0,0,0,0,0,0|4,0,0]=4 538 B14R0.393 CCCCOCCSCCC(=O)NCC 62a_100000737597_100000743108 [0,0,0,0,0,0|3,0,0]=3 539 B14R0.393 CCCCOCCSCCC(=O)NCC 62a_100000743108_100000737597 [0,0,0,0,0,0|3,0,0]=3 540 B14R0.393 CCCCOCCSCCC(=O)OCC 62a_100000743108_100000765890 [0,0,0,0,0,0|2,0,0]=2 541 B14R0.393 CCCCOCCSCCC(=O)OCC 62a_100000765890_100000743108 [0,0,0,0,0,0|2,0,0]=2 542 B14R0.393 CCCCOCCSCOC(=O)CCC 62a_100000743108_100000034017 [0,0,0,0,0,0|4,0,0]=4 543 B14R0.393 CCCCOCCSCOC(=O)OCC 62a_100000743108_100000075025 [0,0,0,0,0,0|3,0,0]=3 544 B14R0.393 CCCCOCOCCNC(=O)OCC 34a_100000158857_100011995733 [0,0,0,0,0,0|3,0,0]=3 545 B14R0.393 CCCCOCSC/C=C/C(=O)OCC 62a_100011995733_100016267167 [0,0,0,0,0,0|2,0,2]=4 546 B14R0.393 CCCCOCSC/C=C/C(=O)OCC 62a_100016267167_100011995733 [0,0,0,0,0,0|2,0,2]=4 547 B14R0.393 CCCCOCSCCCC(=O)OCC 62a_100009991533_100011995733 [0,0,0,0,0,0|2,0,0]=2 548 B14R0.393 CCCCOCSCCCC(=O)OCC 62a_100011995733_100009991533 [0,0,0,0,0,0|2,0,0]=2 549 B14R0.393 CCCCOCSCCNC(=O)OCC 62a_100011995733_200011445536 [0,0,0,0,0,0|3,0,0]=3 550 B14R0.393 CCCCSCCCCCC(=O)OCC 62a_100000210211_100000755133 [0,0,0,0,0,0|1,0,0]=1 551 B14R0.393 CCCCSCCCCCC(=O)OCC 62a_100000755133_100000210210 [0,0,0,0,0,0|1,0,0]=1 552 B14R0.393 CCCCSCCCOCC(=O)OCC 62a_100000210211_100009893628 [0,0,0,0,0,0|2,0,0]=2 553 B14R0.393 CCCCSCCCOCC(=O)OCC 62a_100009893628_100000210210 [0,0,0,0,0,0|2,0,0]=2 554 B14R0.393 CCCCSCCNCCC(=O)NCC 2230a_100025743550_100000737597 [0,0,0,0,0,0|3,0,0]=3 555 B14R0.393 CCCCSCCNCCC(=O)OCC 2230a_100025743550_100011206558 [0,0,0,0,0,0|2,0,0]=2 556 B14R0.393 CCCCSCCNCOC(=O)CCC 2230a_100025743550_100000034017 [0,0,0,0,0,0|4,0,0]=4 557 B14R0.393 CCCCSCCOCCC(=O)NCC 7a_200000230436_100000737597 [0,0,0,0,0,0|3,0,0]=3 558 B14R0.393 CCCCSCCOCCC(=O)OCC 34a_200000230436_100000765890 [0,0,0,0,0,0|2,0,0]=2 559 B14R0.393 CCCCSCCOCCC(=O)OCC 7a_200000230436_100011206558 [0,0,0,0,0,0|2,0,0]=2 560 B14R0.393 CCCCSCCOCOC(=O)CCC 34a_200000230436_100000034017 [0,0,0,0,0,0|4,0,0]=4 561 B14R0.393 CCCN(C)CCCCCCCCCO 2230a_100000747261_100009813782 [0,0,0,0,0,0|4,0,0]=4 562 B14R0.393 CCCN(C)CCCCCCCCCO 269982a_100000747261_100009813782 [0,0,0,0,0,0|4,0,0]=4 563 B14R0.393 CCCNN=CCCCCC(=O)OCC 4a_100000740057_100012182868 [0,0,0,0,0,0|2,0,1]=3 564 B14R0.393 CCCOCCCCCCC(=O)OCC 34a_100000210258_100009814379 [0,0,0,0,0,0|1,0,0]=1 565 B14R0.393 CCCOCCCNCCC(=O)NCC 2230a_100011217757_100000737597 [0,0,0,0,0,0|3,0,0]=3 566 B14R0.393 CCCOCCCNCCC(=O)OCC 2230a_100011217757_100011206558 [0,0,0,0,0,0|2,0,0]=2 567 B14R0.393 CCCOCCCNCCC(=O)OCC 34a_100011217757_100000765890 [0,0,0,0,0,0|2,0,0]=2 568 B14R0.393 CCCOCCCNCOC(=O)CCC 2230a_100011217757_100000034017 [0,0,0,0,0,0|4,0,0]=4 569 B14R0.393 CCCOCCCNCOC(=O)CCC 34a_100011217757_100000034017 [0,0,0,0,0,0|4,0,0]=4 570 B14R0.393 CCCOCCNC/C=C/C(=O)OCC 2230a_100161115042_100016267167 [0,0,0,0,0,0|2,0,2]=4 571 B14R0.393 CCCOCCNC/C=C/C(=O)OCC 34a_100161115042_100016267167 [0,0,0,0,0,0|2,0,2]=4 572 B14R0.393 CCCOCCNCCCC(=O)OCC 2230a_100161115042_100009991533 [0,0,0,0,0,0|2,0,0]=2 573 B14R0.393 CCCOCCNCCCC(=O)OCC 34a_100161115042_100009991533 [0,0,0,0,0,0|2,0,0]=2 574 B14R0.393 CCCOCCOC/C=C/C(=O)OCC 34a_100000752267_100016267167 [0,0,0,0,0,0|2,0,2]=4 575 B14R0.393 CCCOCCOC/C=C/C(=O)OCC 7a_100000752267_100016267167 [0,0,0,0,0,0|2,0,2]=4 576 B14R0.393 CCCOCCOCCCC(=O)OCC 34a_100000752267_100009991533 [0,0,0,0,0,0|2,0,0]=2 577 B14R0.393 CCCOCCOCCCC(=O)OCC 7a_100000752267_100011215271 [0,0,0,0,0,0|2,0,0]=2 578 B14R0.393 CCCOCCOCCCC(=O)OCC 7a_100012001163_100011215938 [0,0,0,0,0,0|2,0,0]=2 579 B14R0.393 CCCOCCOCCNC(=O)CCC 11a_200011904461_100000211992 [0,0,0,0,0,0|4,0,0]=4 580 B14R0.393 CCCOCCOCCNC(=O)CCC 1626a_200011904461_100000211992 [0,0,0,0,0,0|4,0,0]=4 581 B14R0.393 CCCOCCOCCNC(=O)CCC 240690a_200011904461_100000211992 [0,0,0,0,0,0|4,0,0]=4 582 B14R0.393 CCCOCCOCCNC(=O)NCC 2708a_100015525214_200011904461 [0,0,0,0,0,0|4,0,0]=4 583 B14R0.393 CCCOCCOCCNC(=O)NCC 2708a_200011904461_100015525214 [0,0,0,0,0,0|4,0,0]=4 584 B14R0.393 CCCOCCOCCNC(=O)NCC 273464a_100015525214_200011904461 [0,0,0,0,0,0|4,0,0]=4 585 B14R0.393 CCCOCCOCCNC(=O)NCC 273464a_200011904461_100015525214 [0,0,0,0,0,0|4,0,0]=4 586 B14R0.393 CCCOCCOCCNC(=O)NCC 512a_200011904461_100015525214 [0,0,0,0,0,0|4,0,0]=4 587 B14R0.393 CCCOCCOCCNC(=O)OCC 34a_100000158857_100011215938 [0,0,0,0,0,0|3,0,0]=3 588 B14R0.393 CCCOCCOCCNC(=O)OCC 7a_100000752267_200011445536 [0,0,0,0,0,0|3,0,0]=3 589 B14R0.393 CCCOCCSC/C=C/C(=O)OCC 62a_100011215938_100016267167 [0,0,0,0,0,0|2,0,2]=4 590 B14R0.393 CCCOCCSC/C=C/C(=O)OCC 62a_100016267167_100011215938 [0,0,0,0,0,0|2,0,2]=4 591 B14R0.393 CCCOCCSCCCC(=O)OCC 62a_100009991533_100011215938 [0,0,0,0,0,0|2,0,0]=2 592 B14R0.393 CCCOCCSCCCC(=O)OCC 62a_100011215938_100009991533 [0,0,0,0,0,0|2,0,0]=2 593 B14R0.393 CCCOCCSCCNC(=O)OCC 62a_100011215938_200011445536 [0,0,0,0,0,0|3,0,0]=3 594 B14R0.393 CCCSCCCCCCC(=O)OCC 62a_100000210303_100009814379 [0,0,0,0,0,0|1,0,0]=1 595 B14R0.393 CCCSCCNC/C=C/C(=O)OCC 2230a_100020603323_100016267167 [0,0,0,0,0,0|2,0,2]=4 596 B14R0.393 CCCSCCNCCCC(=O)OCC 2230a_100020603323_100009991533 [0,0,0,0,0,0|2,0,0]=2 597 B14R0.393 CCCSCCOC/C=C/C(=O)OCC 34a_200000230433_100016267167 [0,0,0,0,0,0|2,0,2]=4 598 B14R0.393 CCCSCCOC/C=C/C(=O)OCC 7a_200000230433_100016267167 [0,0,0,0,0,0|2,0,2]=4 599 B14R0.393 CCCSCCOCCCC(=O)OCC 34a_200000230433_100009991533 [0,0,0,0,0,0|2,0,0]=2 600 B14R0.393 CCCSCCOCCCC(=O)OCC 7a_200000230433_100011215271 [0,0,0,0,0,0|2,0,0]=2 601 B14R0.393 CCCSCCOCCNC(=O)OCC 7a_200000230433_200011445536 [0,0,0,0,0,0|3,0,0]=3 602 B14R0.393 CCNC(=O)C=CCCCCCCCO 240690a_100015525214_100016988705 [0,0,0,0,0,0|2,0,2]=4 603 B14R0.393 CCNC(=O)CCCCCCCCCF 11a_100015525214_200009909015 [0,0,0,0,0,0|2,0,0]=2 604 B14R0.393 CCNC(=O)CCCCCCCCCF 240690a_100015525214_200009909015 [0,0,0,0,0,0|2,0,0]=2 605 B14R0.393 CCNC(=O)CCCCCCCCCF 527a_100015525214_200009909015 [0,0,0,0,0,0|2,0,0]=2 606 B14R0.393 CCNC(=O)CCCCCCCCCO 240690a_100015525214_100000032657 [0,0,0,0,0,0|2,0,0]=2 607 B14R0.393 CCNC(=O)CCNCCCCCCF 34a_100025743525_100015922095 [0,0,0,0,0,0|3,0,0]=3 608 B14R0.393 CCNC(=O)CCNCCCCCCO 2230a_100000686447_100000737597 [0,0,0,0,0,0|3,0,0]=3 609 B14R0.393 CCNC(=O)CCNCCCCCCO 34a_100025743525_100000766143 [0,0,0,0,0,0|3,0,0]=3 610 B14R0.393 CCNC(=O)CCNCCCCCOC 2230a_100000747528_100000737597 [0,0,0,0,0,0|3,0,0]=3 611 B14R0.393 CCNC(=O)CCNCCOCCOC 2230a_100000745349_100000737597 [0,0,0,0,0,0|4,0,0]=4 612 B14R0.393 CCNC(=O)CCNCCOCCOC 34a_100025743525_100000695917 [0,0,0,0,0,0|4,0,0]=4 613 B14R0.393 CCNC(=O)CCOCCCCCCBr 7a_100011215345_100000737597 [0,0,0,0,0,0|3,0,0]=3 614 B14R0.393 CCNC(=O)CCOCCCCCCCl 7a_100000766143_100000737597 [0,0,0,0,0,0|3,0,0]=3 615 B14R0.393 CCNC(=O)CCOCCCCCCF 7a_100000732779_100000737597 [0,0,0,0,0,0|3,0,0]=3 616 B14R0.393 CCNC(=O)CCOCCOCCOC 11a_100015525214_100012278103 [0,0,0,0,0,0|4,0,0]=4 617 B14R0.393 CCNC(=O)CCOCCOCCOC 240690a_100015525214_100012278103 [0,0,0,0,0,0|4,0,0]=4 618 B14R0.393 CCNC(=O)CCOCCOCCOC 527a_100015525214_100012278103 [0,0,0,0,0,0|4,0,0]=4 619 B14R0.393 CCNC(=O)CCOCCOCCOC 7a_100011215163_100000737597 [0,0,0,0,0,0|4,0,0]=4 620 B14R0.393 CCNC(=O)CCSCCCCCC#N 62a_100000737597_100009813376 [0,0,0,0,0,0|3,0,1]=4 621 B14R0.393 CCNC(=O)CCSCCCCCC#N 62a_100009813376_100000737597 [0,0,0,0,0,0|3,0,1]=4 622 B14R0.393 CCNC(=O)CCSCCCCCC=O 62a_100000139337_100000737597 [0,0,0,0,0,0|3,0,1]=4 623 B14R0.393 CCNC(=O)CCSCCCCCC=O 62a_100000737597_100000139337 [0,0,0,0,0,0|3,0,1]=4 624 B14R0.393 CCNC(=O)CCSCCCCCCF 62a_100000737597_100015922095 [0,0,0,0,0,0|3,0,0]=3 625 B14R0.393 CCNC(=O)CCSCCCCCCF 62a_100015922095_100000737597 [0,0,0,0,0,0|3,0,0]=3 626 B14R0.393 CCNC(=O)CCSCCCCCCO 62a_100000737597_100000766143 [0,0,0,0,0,0|3,0,0]=3 627 B14R0.393 CCNC(=O)CCSCCCCCCO 62a_100000766143_100000737597 [0,0,0,0,0,0|3,0,0]=3 628 B14R0.393 CCNC(=O)CCSCCOCCOC 62a_100000695917_100000737597 [0,0,0,0,0,0|4,0,0]=4 629 B14R0.393 CCNC(=O)CCSCCOCCOC 62a_100000737597_100000695917 [0,0,0,0,0,0|4,0,0]=4 630 B14R0.393 CCNC(=O)CNCCCCCCC#N 2230a_100016988866_100009813337 [0,0,0,0,0,0|3,0,1]=4 631 B14R0.393 CCNC(=O)CNCCCCCCCO 2230a_100011996573_100000183381 [0,0,0,0,0,0|3,0,0]=3 632 B14R0.393 CCNC(=O)CNCCCCCCCO 2230a_100016988866_100000760002 [0,0,0,0,0,0|3,0,0]=3 633 B14R0.393 CCNC(=O)CNCCCCCCCO 34a_100011996573_100000183381 [0,0,0,0,0,0|3,0,0]=3 634 B14R0.393 CCNC(=O)CNCCCCCCOC 2230a_100016988866_100011998445 [0,0,0,0,0,0|3,0,0]=3 635 B14R0.393 CCNC(=O)CNCCCOCCCO 2230a_100011310245_100000183381 [0,0,0,0,0,0|4,0,0]=4 636 B14R0.393 CCNC(=O)CNCCCOCCCO 34a_100011310245_100000183381 [0,0,0,0,0,0|4,0,0]=4 637 B14R0.393 CCNC(=O)CNCCCOCCOC 2230a_100000206027_100000183381 [0,0,0,0,0,0|4,0,0]=4 638 B14R0.393 CCNC(=O)CNCCCOCCOC 2230a_100016988866_100011216529 [0,0,0,0,0,0|4,0,0]=4 639 B14R0.393 CCNC(=O)CNCCCOCCOC 34a_100000206027_100000183381 [0,0,0,0,0,0|4,0,0]=4 640 B14R0.393 CCNC(=O)CNCCOCCOCC 2230a_100016988866_100011211534 [0,0,0,0,0,0|4,0,0]=4 641 B14R0.393 CCNC(=O)CNCCOCCOCC 2230a_100102712874_100000183381 [0,0,0,0,0,0|4,0,0]=4 642 B14R0.393 CCNC(=O)CNCCOCCOCC 34a_100102712874_100000183381 [0,0,0,0,0,0|4,0,0]=4 643 B14R0.393 CCNC(=O)COCCCCCCCBr 34a_100000760002_100000183381 [0,0,0,0,0,0|3,0,0]=3 644 B14R0.393 CCNC(=O)COCCCCCCCBr 7a_100000760002_100000183381 [0,0,0,0,0,0|3,0,0]=3 645 B14R0.393 CCNC(=O)COCCCCCCCN 34a_100011996573_100000183381 [0,0,0,0,0,0|3,0,0]=3 646 B14R0.393 CCNC(=O)COCCCCCCOC 34a_200012092642_100000183381 [0,0,0,0,0,0|3,0,0]=3 647 B14R0.393 CCNC(=O)COCCCCCCOC 7a_200012092642_100000183381 [0,0,0,0,0,0|3,0,0]=3 648 B14R0.393 CCNC(=O)COCCCOCCCN 34a_100011310245_100000183381 [0,0,0,0,0,0|4,0,0]=4 649 B14R0.393 CCNC(=O)COCCOCCOCC 34a_100000210240_100000183381 [0,0,0,0,0,0|4,0,0]=4 650 B14R0.393 CCNC(=O)COCCOCCOCC 7a_100000210240_100000183381 [0,0,0,0,0,0|4,0,0]=4 651 B14R0.393 CCNC(=O)CSCCCCCCC#N 62a_100000183381_100009813337 [0,0,0,0,0,0|3,0,1]=4 652 B14R0.393 CCNC(=O)CSCCCCCCC#N 62a_100009813337_100000183381 [0,0,0,0,0,0|3,0,1]=4 653 B14R0.393 CCNC(=O)CSCCCCCCCO 62a_100000183381_100000760002 [0,0,0,0,0,0|3,0,0]=3 654 B14R0.393 CCNC(=O)CSCCCCCCCO 62a_100000760002_100000183381 [0,0,0,0,0,0|3,0,0]=3 655 B14R0.393 CCNC(=O)CSCCCCCCOC 62a_100000183381_100011998445 [0,0,0,0,0,0|3,0,0]=3 656 B14R0.393 CCNC(=O)CSCCCCCCOC 62a_100011998445_100000183381 [0,0,0,0,0,0|3,0,0]=3 657 B14R0.393 CCNC(=O)CSCCCOCCOC 62a_100000183381_100011216529 [0,0,0,0,0,0|4,0,0]=4 658 B14R0.393 CCNC(=O)CSCCCOCCOC 62a_100011216529_100000183381 [0,0,0,0,0,0|4,0,0]=4 659 B14R0.393 CCNC(=O)CSCCOCCOCC 62a_100000183381_100011211534 [0,0,0,0,0,0|4,0,0]=4 660 B14R0.393 CCNC(=O)CSCCOCCOCC 62a_100011211534_100000183381 [0,0,0,0,0,0|4,0,0]=4 661 B14R0.393 CCNC(=O)NCCCCCCCCO 2708a_100015525214_102515433106 [0,0,0,0,0,0|3,0,0]=3 662 B14R0.393 CCNC(=O)NCCCCCCCCO 2708a_102515433106_100015525214 [0,0,0,0,0,0|3,0,0]=3 663 B14R0.393 CCNC(=O)NCCCCCCCCO 273464a_100015525214_102515433106 [0,0,0,0,0,0|3,0,0]=3 664 B14R0.393 CCNC(=O)NCCCCCCCCO 273464a_102515433106_100015525214 [0,0,0,0,0,0|3,0,0]=3 665 B14R0.393 CCNC(=O)NCCCCCCCCO 512a_100015525214_102515433106 [0,0,0,0,0,0|3,0,0]=3 666 B14R0.393 CCNC(=O)NCCCCCCCCO 512a_102515433106_100015525214 [0,0,0,0,0,0|3,0,0]=3 667 B14R0.393 CCNCCCCCCCC(=O)OCC 2230a_100015525214_100009991516 [0,0,0,0,0,0|1,0,0]=1 668 B14R0.393 CCNN=CCCCCCC(=O)OCC 4a_100000756455_100000085164 [0,0,0,0,0,0|2,0,1]=3 669 B14R0.393 CCOC(=O)/C=C/CNCCCCCO 2230a_100000762737_100016267167 [0,0,0,0,0,0|2,0,2]=4 670 B14R0.393 CCOC(=O)/C=C/CNCCCCCO 34a_100000762737_100016267167 [0,0,0,0,0,0|2,0,2]=4 671 B14R0.393 CCOC(=O)/C=C/COCCCCCBr 34a_100000746331_100016267167 [0,0,0,0,0,0|2,0,2]=4 672 B14R0.393 CCOC(=O)/C=C/COCCCCCBr 7a_100000746331_100016267167 [0,0,0,0,0,0|2,0,2]=4 673 B14R0.393 CCOC(=O)/C=C/COCCCCCCl 34a_100000746330_100016267167 [0,0,0,0,0,0|2,0,2]=4 674 B14R0.393 CCOC(=O)/C=C/COCCCCCCl 7a_100000746330_100016267167 [0,0,0,0,0,0|2,0,2]=4 675 B14R0.393 CCOC(=O)/C=C/COCCCCCI 34a_200012148887_100016267167 [0,0,0,0,0,0|2,0,2]=4 676 B14R0.393 CCOC(=O)/C=C/COCCCCCI 7a_200012148887_100016267167 [0,0,0,0,0,0|2,0,2]=4 677 B14R0.393 CCOC(=O)/C=C/COCCCCCN 34a_100000762737_100016267167 [0,0,0,0,0,0|2,0,2]=4 678 B14R0.393 CCOC(=O)/C=C/COCCCCOC 34a_100000740925_100016267167 [0,0,0,0,0,0|2,0,2]=4 679 B14R0.393 CCOC(=O)/C=C/COCCCCSC 34a_100011217163_100016267167 [0,0,0,0,0,0|2,0,2]=4 680 B14R0.393 CCOC(=O)/C=C/COCCCCSC 7a_100011217163_100016267167 [0,0,0,0,0,0|2,0,2]=4 681 B14R0.393 CCOC(=O)/C=C/COCCCSCC 34a_100011216438_100016267167 [0,0,0,0,0,0|2,0,2]=4 682 B14R0.393 CCOC(=O)/C=C/COCCCSCC 7a_100011216438_100016267167 [0,0,0,0,0,0|2,0,2]=4 683 B14R0.393 CCOC(=O)/C=C/CSCCCCCF 62a_100000729378_100016267167 [0,0,0,0,0,0|2,0,2]=4 684 B14R0.393 CCOC(=O)/C=C/CSCCCCCF 62a_100016267167_100000729378 [0,0,0,0,0,0|2,0,2]=4 685 B14R0.393 CCOC(=O)/C=C/CSCCCCCO 62a_100000746330_100016267167 [0,0,0,0,0,0|2,0,2]=4 686 B14R0.393 CCOC(=O)/C=C/CSCCCCCO 62a_100016267167_100000746330 [0,0,0,0,0,0|2,0,2]=4 687 B14R0.393 CCOC(=O)/C=C/CSCCCCOC 62a_100000730899_100016267167 [0,0,0,0,0,0|2,0,2]=4 688 B14R0.393 CCOC(=O)/C=C/CSCCCCOC 62a_100016267167_100000730899 [0,0,0,0,0,0|2,0,2]=4 689 B14R0.393 CCOC(=O)CCCCC=NNCCO 4a_100000210001_100012182868 [0,0,0,0,0,0|3,0,1]=4 690 B14R0.393 CCOC(=O)CCCCCCCCNC 2230a_106832991635_100010175975 [0,0,0,0,0,0|1,0,0]=1 691 B14R0.393 CCOC(=O)CCCCCCCCNC 34a_100102657272_100010175975 [0,0,0,0,0,0|1,0,0]=1 692 B14R0.393 CCOC(=O)CCCCCCCCNC 7a_106832991635_100010175975 [0,0,0,0,0,0|1,0,0]=1 693 B14R0.393 CCOC(=O)CCCCCCCCOC 34a_100138415774_100010175975 [0,0,0,0,0,0|1,0,0]=1 694 B14R0.393 CCOC(=O)CCCCCCCCSC 62a_200000210301_100010175975 [0,0,0,0,0,0|1,0,0]=1 695 B14R0.393 CCOC(=O)CCCCCCCCS[13CH3] 62a_200025704644_100010175975 [0,0,0,0,0,0|1,0,0]=1 696 B14R0.393 CCOC(=O)CCCCCCCSCC 62a_100000210202_100009991516 [0,0,0,0,0,0|1,0,0]=1 697 B14R0.393 CCOC(=O)CCCCCCCSCF 62a_100015361967_100009991516 [0,0,0,0,0,0|2,0,0]=2 698 B14R0.393 CCOC(=O)CCCCCCNCCF 34a_100000724931_100009814379 [0,0,0,0,0,0|2,0,0]=2 699 B14R0.393 CCOC(=O)CCCCCCNCCO 2230a_100016997473_100009814379 [0,0,0,0,0,0|2,0,0]=2 700 B14R0.393 CCOC(=O)CCCCCCNCCO 34a_100016990907_100009814379 [0,0,0,0,0,0|2,0,0]=2 701 B14R0.393 CCOC(=O)CCCCCCOCCBr 34a_100000211926_100009814379 [0,0,0,0,0,0|2,0,0]=2 702 B14R0.393 CCOC(=O)CCCCCCOCCN 34a_100000210304_100009814379 [0,0,0,0,0,0|2,0,0]=2 703 B14R0.393 CCOC(=O)CCCCCCSCC#N 62a_100011215382_100009814379 [0,0,0,0,0,0|2,0,1]=3 704 B14R0.393 CCOC(=O)CCCCCCSCC=O 62a_200015260668_100009814379 [0,0,0,0,0,0|2,0,1]=3 705 B14R0.393 CCOC(=O)CCCCCCSCCF 62a_100011217306_100009814379 [0,0,0,0,0,0|2,0,0]=2 706 B14R0.393 CCOC(=O)CCCCCCSCCO 62a_100000211926_100009814379 [0,0,0,0,0,0|2,0,0]=2 707 B14R0.393 CCOC(=O)CCCCCCSCOC 62a_100000766300_100009814379 [0,0,0,0,0,0|2,0,0]=2 708 B14R0.393 CCOC(=O)CCCCCCSCSC 62a_100011218213_100009814379 [0,0,0,0,0,0|2,0,0]=2 709 B14R0.393 CCOC(=O)CCCCCNCCCF 2230a_100015189416_100000755133 [0,0,0,0,0,0|2,0,0]=2 710 B14R0.393 CCOC(=O)CCCCCNCCCF 34a_100015189416_100000755133 [0,0,0,0,0,0|2,0,0]=2 711 B14R0.393 CCOC(=O)CCCCCNCCOC 2230a_100000209980_100000755133 [0,0,0,0,0,0|2,0,0]=2 712 B14R0.393 CCOC(=O)CCCCCNCCSC 2230a_100020590264_100000755133 [0,0,0,0,0,0|2,0,0]=2 713 B14R0.393 CCOC(=O)CCCCCOCCC#N 7a_100011214988_100000184422 [0,0,0,0,0,0|2,0,1]=3 714 B14R0.393 CCOC(=O)CCCCCOCCCBr 34a_100011217188_100000755133 [0,0,0,0,0,0|2,0,0]=2 715 B14R0.393 CCOC(=O)CCCCCOCCCCl 34a_100000230001_100000755133 [0,0,0,0,0,0|2,0,0]=2 716 B14R0.393 CCOC(=O)CCCCCOCCCF 34a_100000759539_100000755133 [0,0,0,0,0,0|2,0,0]=2 717 B14R0.393 CCOC(=O)CCCCCOCCCF 7a_100011214988_100011934791 [0,0,0,0,0,0|2,0,0]=2 718 B14R0.393 CCOC(=O)CCCCCOCCCN 34a_100000182051_100000755133 [0,0,0,0,0,0|2,0,0]=2 719 B14R0.393 CCOC(=O)CCCCCOCCCO 7a_100011214988_100011215043 [0,0,0,0,0,0|2,0,0]=2 720 B14R0.393 CCOC(=O)CCCCCOCCOC 34a_100000210237_100000755133 [0,0,0,0,0,0|2,0,0]=2 721 B14R0.393 CCOC(=O)CCCCCOCCOC 7a_100011214988_100000233755 [0,0,0,0,0,0|2,0,0]=2 722 B14R0.393 CCOC(=O)CCCCCOCCON 34a_100000700252_100000755133 [0,0,0,0,0,0|3,0,0]=3 723 B14R0.393 CCOC(=O)CCCCCOCCSC 34a_100000230434_100000755133 [0,0,0,0,0,0|2,0,0]=2 724 B14R0.393 CCOC(=O)CCCCCOCCSC 7a_100000230434_100000755133 [0,0,0,0,0,0|2,0,0]=2 725 B14R0.393 CCOC(=O)CCCCCOCCSC 7a_100011214988_100000212216 [0,0,0,0,0,0|2,0,0]=2 726 B14R0.393 CCOC(=O)CCCCCSCCC#N 62a_100000755133_100011215226 [0,0,0,0,0,0|2,0,1]=3 727 B14R0.393 CCOC(=O)CCCCCSCCC#N 62a_100011215226_100000755133 [0,0,0,0,0,0|2,0,1]=3 728 B14R0.393 CCOC(=O)CCCCCSCCCF 62a_100000755133_100011934791 [0,0,0,0,0,0|2,0,0]=2 729 B14R0.393 CCOC(=O)CCCCCSCCCF 62a_100011934791_100000755133 [0,0,0,0,0,0|2,0,0]=2 730 B14R0.393 CCOC(=O)CCCCCSCCCO 62a_100000755133_100011215043 [0,0,0,0,0,0|2,0,0]=2 731 B14R0.393 CCOC(=O)CCCCCSCCCO 62a_100011215043_100000755133 [0,0,0,0,0,0|2,0,0]=2 732 B14R0.393 CCOC(=O)CCCCCSCCOC 62a_100000233755_100000755133 [0,0,0,0,0,0|2,0,0]=2 733 B14R0.393 CCOC(=O)CCCCCSCCOC 62a_100000755133_100000233755 [0,0,0,0,0,0|2,0,0]=2 734 B14R0.393 CCOC(=O)CCCCCSCCSC 62a_100000212216_100000755133 [0,0,0,0,0,0|2,0,0]=2 735 B14R0.393 CCOC(=O)CCCCCSCCSC 62a_100000755133_100000751147 [0,0,0,0,0,0|2,0,0]=2 736 B14R0.393 CCOC(=O)CCCCCSCSC#N 62a_100000211825_100000755133 [0,0,0,0,0,0|3,0,1]=4 737 B14R0.393 CCOC(=O)CCCCCSCSC#N 62a_100000755133_100000211825 [0,0,0,0,0,0|3,0,1]=4 738 B14R0.393 CCOC(=O)CCCCNCCCCO 2230a_100000750430_100000750268 [0,0,0,0,0,0|2,0,0]=2 739 B14R0.393 CCOC(=O)CCCCNCCCCO 34a_100000750430_100000750268 [0,0,0,0,0,0|2,0,0]=2 740 B14R0.393 CCOC(=O)CCCCNCCCOC 34a_100150723488_100000750268 [0,0,0,0,0,0|2,0,0]=2 741 B14R0.393 CCOC(=O)CCCCNCCCSC 2230a_100000749238_100000750268 [0,0,0,0,0,0|2,0,0]=2 742 B14R0.393 CCOC(=O)CCCCNCCSCC 2230a_100000106463_100000750268 [0,0,0,0,0,0|2,0,0]=2 743 B14R0.393 CCOC(=O)CCCCOCC#CCCl 34a_200000047223_100000750268 [0,0,0,0,0,0|2,0,2]=4 744 B14R0.393 CCOC(=O)CCCCOCCCCBr 34a_100011216708_100000750268 [0,0,0,0,0,0|2,0,0]=2 745 B14R0.393 CCOC(=O)CCCCOCCCCCl 34a_100000210776_100000750268 [0,0,0,0,0,0|2,0,0]=2 746 B14R0.393 CCOC(=O)CCCCOCCCCCl 7a_100000210776_100000750268 [0,0,0,0,0,0|2,0,0]=2 747 B14R0.393 CCOC(=O)CCCCOCCCCF 34a_100011995726_100000750268 [0,0,0,0,0,0|2,0,0]=2 748 B14R0.393 CCOC(=O)CCCCOCCCCF 7a_100011995726_100000750268 [0,0,0,0,0,0|2,0,0]=2 749 B14R0.393 CCOC(=O)CCCCOCCCCI 34a_200012148704_100000750268 [0,0,0,0,0,0|2,0,0]=2 750 B14R0.393 CCOC(=O)CCCCOCCCCN 34a_100000750430_100000750268 [0,0,0,0,0,0|2,0,0]=2 751 B14R0.393 CCOC(=O)CCCCOCCCNC 34a_100000213112_100000750268 [0,0,0,0,0,0|2,0,0]=2 752 B14R0.393 CCOC(=O)CCCCOCCCOC 34a_100000740835_100000750268 [0,0,0,0,0,0|2,0,0]=2 753 B14R0.393 CCOC(=O)CCCCOCCCSC 34a_100000690336_100000750268 [0,0,0,0,0,0|2,0,0]=2 754 B14R0.393 CCOC(=O)CCCCOCCCSC 7a_100000690336_100000750268 [0,0,0,0,0,0|2,0,0]=2 755 B14R0.393 CCOC(=O)CCCCOCCSCC 34a_100000212035_100000750268 [0,0,0,0,0,0|2,0,0]=2 756 B14R0.393 CCOC(=O)CCCCOCCSCC 7a_100000212035_100000750268 [0,0,0,0,0,0|2,0,0]=2 757 B14R0.393 CCOC(=O)CCCCSCC#CCO 62a_100000750268_200000047223 [0,0,0,0,0,0|2,0,2]=4 758 B14R0.393 CCOC(=O)CCCCSCC#CCO 62a_200000047223_100000750268 [0,0,0,0,0,0|2,0,2]=4 759 B14R0.393 CCOC(=O)CCCCSCCCC#N 62a_100000687738_100000750268 [0,0,0,0,0,0|2,0,1]=3 760 B14R0.393 CCOC(=O)CCCCSCCCC#N 62a_100000750268_100000687738 [0,0,0,0,0,0|2,0,1]=3 761 B14R0.393 CCOC(=O)CCCCSCCCC=O 62a_100000750268_200011292268 [0,0,0,0,0,0|2,0,1]=3 762 B14R0.393 CCOC(=O)CCCCSCCCC=O 62a_200011292268_100000750268 [0,0,0,0,0,0|2,0,1]=3 763 B14R0.393 CCOC(=O)CCCCSCCCCF 62a_100000729493_100000750268 [0,0,0,0,0,0|2,0,0]=2 764 B14R0.393 CCOC(=O)CCCCSCCCCF 62a_100000750268_100000729493 [0,0,0,0,0,0|2,0,0]=2 765 B14R0.393 CCOC(=O)CCCCSCCCCO 62a_100000210776_100000750268 [0,0,0,0,0,0|2,0,0]=2 766 B14R0.393 CCOC(=O)CCCCSCCCCO 62a_100000750268_100000210776 [0,0,0,0,0,0|2,0,0]=2 767 B14R0.393 CCOC(=O)CCCCSCCCOC 62a_100000709357_100000750268 [0,0,0,0,0,0|2,0,0]=2 768 B14R0.393 CCOC(=O)CCCCSCCCOC 62a_100000750268_100000709357 [0,0,0,0,0,0|2,0,0]=2 769 B14R0.393 CCOC(=O)CCCCSCCSC#N 62a_100000034367_100000750268 [0,0,0,0,0,0|3,0,1]=4 770 B14R0.393 CCOC(=O)CCCCSCCSC#N 62a_100000750268_100000034367 [0,0,0,0,0,0|3,0,1]=4 771 B14R0.393 CCOC(=O)CCCCSCCSCC 62a_100000750268_100000757381 [0,0,0,0,0,0|2,0,0]=2 772 B14R0.393 CCOC(=O)CCCCSCCSCC 62a_100000757381_100000750268 [0,0,0,0,0,0|2,0,0]=2 773 B14R0.393 CCOC(=O)CCCNCCCCCO 2230a_100000762737_100009991533 [0,0,0,0,0,0|2,0,0]=2 774 B14R0.393 CCOC(=O)CCCNCCCCCO 34a_100000762737_100009991533 [0,0,0,0,0,0|2,0,0]=2 775 B14R0.393 CCOC(=O)CCCNCCCN=[N+]=[N-] 2230a_100000744732_100009991533 [0,0,0,0,0,0|4,0,0]=4 776 B14R0.393 CCOC(=O)CCCNCCOCCO 2230a_100000211614_100009991533 [0,0,0,0,0,0|3,0,0]=3 777 B14R0.393 CCOC(=O)CCCNCCOCCO 34a_100000211614_100009991533 [0,0,0,0,0,0|3,0,0]=3 778 B14R0.393 CCOC(=O)CCCNCCSCCO 2230a_100011219999_100009991533 [0,0,0,0,0,0|3,0,0]=3 779 B14R0.393 CCOC(=O)CCCOCCCCC#N 7a_100012001163_100000211819 [0,0,0,0,0,0|2,0,1]=3 780 B14R0.393 CCOC(=O)CCCOCCCCC=O 7a_100012001163_100000139335 [0,0,0,0,0,0|2,0,1]=3 781 B14R0.393 CCOC(=O)CCCOCCCCCBr 34a_100000746331_100009991533 [0,0,0,0,0,0|2,0,0]=2 782 B14R0.393 CCOC(=O)CCCOCCCCCBr 7a_100000746331_100011215271 [0,0,0,0,0,0|2,0,0]=2 783 B14R0.393 CCOC(=O)CCCOCCCCCCl 34a_100000746330_100009991533 [0,0,0,0,0,0|2,0,0]=2 784 B14R0.393 CCOC(=O)CCCOCCCCCCl 7a_100000746330_100011215271 [0,0,0,0,0,0|2,0,0]=2 785 B14R0.393 CCOC(=O)CCCOCCCCCF 7a_100012001163_100000729378 [0,0,0,0,0,0|2,0,0]=2 786 B14R0.393 CCOC(=O)CCCOCCCCCI 34a_200012148887_100009991533 [0,0,0,0,0,0|2,0,0]=2 787 B14R0.393 CCOC(=O)CCCOCCCCCI 7a_200012148887_100011215271 [0,0,0,0,0,0|2,0,0]=2 788 B14R0.393 CCOC(=O)CCCOCCCCCN 34a_100000762737_100009991533 [0,0,0,0,0,0|2,0,0]=2 789 B14R0.393 CCOC(=O)CCCOCCCCCO 7a_100012001163_100000746330 [0,0,0,0,0,0|2,0,0]=2 790 B14R0.393 CCOC(=O)CCCOCCCCOC 34a_100000740925_100009991533 [0,0,0,0,0,0|2,0,0]=2 791 B14R0.393 CCOC(=O)CCCOCCCCOC 7a_100012001163_100000730899 [0,0,0,0,0,0|2,0,0]=2 792 B14R0.393 CCOC(=O)CCCOCCCCSC 34a_100011217163_100009991533 [0,0,0,0,0,0|2,0,0]=2 793 B14R0.393 CCOC(=O)CCCOCCCCSC 7a_100011217163_100011215271 [0,0,0,0,0,0|2,0,0]=2 794 B14R0.393 CCOC(=O)CCCOCCCSCC 34a_100011216438_100009991533 [0,0,0,0,0,0|2,0,0]=2 795 B14R0.393 CCOC(=O)CCCOCCCSCC 7a_100011216438_100011215271 [0,0,0,0,0,0|2,0,0]=2 796 B14R0.393 CCOC(=O)CCCOCCOCC#N 7a_100012001163_200000047693 [0,0,0,0,0,0|3,0,1]=4 797 B14R0.393 CCOC(=O)CCCOCCOCCBr 34a_100000692535_100009991533 [0,0,0,0,0,0|3,0,0]=3 798 B14R0.393 CCOC(=O)CCCOCCOCCBr 7a_100000692535_100011215271 [0,0,0,0,0,0|3,0,0]=3 799 B14R0.393 CCOC(=O)CCCOCCOCCCl 34a_100011215305_100009991533 [0,0,0,0,0,0|3,0,0]=3 800 B14R0.393 CCOC(=O)CCCOCCOCCCl 7a_100011215305_100011215271 [0,0,0,0,0,0|3,0,0]=3 801 B14R0.393 CCOC(=O)CCCOCCOCCF 34a_200015357709_100009991533 [0,0,0,0,0,0|3,0,0]=3 802 B14R0.393 CCOC(=O)CCCOCCOCCF 7a_200015357709_100011215271 [0,0,0,0,0,0|3,0,0]=3 803 B14R0.393 CCOC(=O)CCCOCCOCCI 34a_100012149058_100009991533 [0,0,0,0,0,0|3,0,0]=3 804 B14R0.393 CCOC(=O)CCCOCCOCCI 7a_100012149058_100011215271 [0,0,0,0,0,0|3,0,0]=3 805 B14R0.393 CCOC(=O)CCCOCCOCCN 34a_100000211614_100009991533 [0,0,0,0,0,0|3,0,0]=3 806 B14R0.393 CCOC(=O)CCCOCCOCCO 7a_100012001163_100011215305 [0,0,0,0,0,0|3,0,0]=3 807 B14R0.393 CCOC(=O)CCCSCCCCC#N 62a_100009991533_100000211819 [0,0,0,0,0,0|2,0,1]=3 808 B14R0.393 CCOC(=O)CCCSCCCCC#N 62a_100011219923_100009991533 [0,0,0,0,0,0|2,0,1]=3 809 B14R0.393 CCOC(=O)CCCSCCCCC=O 62a_100000139335_100009991533 [0,0,0,0,0,0|2,0,1]=3 810 B14R0.393 CCOC(=O)CCCSCCCCC=O 62a_100009991533_100000139335 [0,0,0,0,0,0|2,0,1]=3 811 B14R0.393 CCOC(=O)CCCSCCCCCF 62a_100000729378_100009991533 [0,0,0,0,0,0|2,0,0]=2 812 B14R0.393 CCOC(=O)CCCSCCCCCF 62a_100009991533_100000729378 [0,0,0,0,0,0|2,0,0]=2 813 B14R0.393 CCOC(=O)CCCSCCCCCO 62a_100000746330_100009991533 [0,0,0,0,0,0|2,0,0]=2 814 B14R0.393 CCOC(=O)CCCSCCCCCO 62a_100009991533_100000746330 [0,0,0,0,0,0|2,0,0]=2 815 B14R0.393 CCOC(=O)CCCSCCCCOC 62a_100000730899_100009991533 [0,0,0,0,0,0|2,0,0]=2 816 B14R0.393 CCOC(=O)CCCSCCCCOC 62a_100009991533_100000730899 [0,0,0,0,0,0|2,0,0]=2 817 B14R0.393 CCOC(=O)CCCSCCOCC#N 62a_100009991533_200000047693 [0,0,0,0,0,0|3,0,1]=4 818 B14R0.393 CCOC(=O)CCCSCCOCC#N 62a_200000047693_100009991533 [0,0,0,0,0,0|3,0,1]=4 819 B14R0.393 CCOC(=O)CCCSCCOCCO 62a_100009991533_100011215305 [0,0,0,0,0,0|3,0,0]=3 820 B14R0.393 CCOC(=O)CCCSCCOCCO 62a_100011215305_100009991533 [0,0,0,0,0,0|3,0,0]=3 821 B14R0.393 CCOC(=O)CCCSCOCCOC 62a_100000231047_100009991533 [0,0,0,0,0,0|3,0,0]=3 822 B14R0.393 CCOC(=O)CCCSCOCCOC 62a_100009991533_100000231047 [0,0,0,0,0,0|3,0,0]=3 823 B14R0.393 CCOC(=O)CCNCCCCCCO 2230a_100000686447_100011206558 [0,0,0,0,0,0|2,0,0]=2 824 B14R0.393 CCOC(=O)CCNCCCCCCO 34a_100000686447_100000765890 [0,0,0,0,0,0|2,0,0]=2 825 B14R0.393 CCOC(=O)CCNCCCCCOC 2230a_100000747528_100011206558 [0,0,0,0,0,0|2,0,0]=2 826 B14R0.393 CCOC(=O)CCNCCCCCOC 34a_100000747528_100000765890 [0,0,0,0,0,0|2,0,0]=2 827 B14R0.393 CCOC(=O)CCNCCCCN=[N+]=[N-] 2230a_100000101370_100011206558 [0,0,0,0,0,0|4,0,0]=4 828 B14R0.393 CCOC(=O)CCNCCOCCOC 2230a_100000745349_100011206558 [0,0,0,0,0,0|3,0,0]=3 829 B14R0.393 CCOC(=O)CCNCCOCCOC 34a_100000745349_100000765890 [0,0,0,0,0,0|3,0,0]=3 830 B14R0.393 CCOC(=O)CCOCCCCCCBr 34a_100011215345_100000765890 [0,0,0,0,0,0|2,0,0]=2 831 B14R0.393 CCOC(=O)CCOCCCCCCBr 7a_100011215345_100011206558 [0,0,0,0,0,0|2,0,0]=2 832 B14R0.393 CCOC(=O)CCOCCCCCCCl 34a_100000766143_100000765890 [0,0,0,0,0,0|2,0,0]=2 833 B14R0.393 CCOC(=O)CCOCCCCCCCl 7a_100000766143_100011206558 [0,0,0,0,0,0|2,0,0]=2 834 B14R0.393 CCOC(=O)CCOCCCCCCF 34a_100000732779_100000765890 [0,0,0,0,0,0|2,0,0]=2 835 B14R0.393 CCOC(=O)CCOCCCCCCF 7a_100000732779_100011206558 [0,0,0,0,0,0|2,0,0]=2 836 B14R0.393 CCOC(=O)CCOCCCCCCN 34a_100000686447_100000765890 [0,0,0,0,0,0|2,0,0]=2 837 B14R0.393 CCOC(=O)CCOCCCCCNC 34a_100000722520_100000765890 [0,0,0,0,0,0|2,0,0]=2 838 B14R0.393 CCOC(=O)CCOCCOCCNC 34a_100000228057_100000765890 [0,0,0,0,0,0|3,0,0]=3 839 B14R0.393 CCOC(=O)CCOCCOCCOC 34a_100010737887_200000210301 [0,0,0,0,0,0|3,0,0]=3 840 B14R0.393 CCOC(=O)CCOCCOCCOC 34a_100011215163_100000765890 [0,0,0,0,0,0|3,0,0]=3 841 B14R0.393 CCOC(=O)CCOCCOCCOC 7a_100010737887_200000210301 [0,0,0,0,0,0|3,0,0]=3 842 B14R0.393 CCOC(=O)CCOCCOCCOC 7a_100011215163_100011206558 [0,0,0,0,0,0|3,0,0]=3 843 B14R0.393 CCOC(=O)CCOCCOCCO[13CH3] 34a_100010737887_200025704644 [0,0,0,0,0,0|3,0,0]=3 844 B14R0.393 CCOC(=O)CCOCCOCCO[13CH3] 7a_100010737887_200025704644 [0,0,0,0,0,0|3,0,0]=3 845 B14R0.393 CCOC(=O)CCSCCCCCC#N 62a_100000765890_100009813376 [0,0,0,0,0,0|2,0,1]=3 846 B14R0.393 CCOC(=O)CCSCCCCCC#N 62a_100009813376_100000765890 [0,0,0,0,0,0|2,0,1]=3 847 B14R0.393 CCOC(=O)CCSCCCCCC=O 62a_100000139337_100000765890 [0,0,0,0,0,0|2,0,1]=3 848 B14R0.393 CCOC(=O)CCSCCCCCC=O 62a_100000765890_100000139337 [0,0,0,0,0,0|2,0,1]=3 849 B14R0.393 CCOC(=O)CCSCCCCCCF 62a_100000765890_100015922095 [0,0,0,0,0,0|2,0,0]=2 850 B14R0.393 CCOC(=O)CCSCCCCCCF 62a_100015922095_100000765890 [0,0,0,0,0,0|2,0,0]=2 851 B14R0.393 CCOC(=O)CCSCCCCCCO 62a_100000765890_100000766143 [0,0,0,0,0,0|2,0,0]=2 852 B14R0.393 CCOC(=O)CCSCCCCCCO 62a_100000766143_100000765890 [0,0,0,0,0,0|2,0,0]=2 853 B14R0.393 CCOC(=O)CCSCCOCCOC 62a_100000695917_100000765890 [0,0,0,0,0,0|3,0,0]=3 854 B14R0.393 CCOC(=O)CCSCCOCCOC 62a_100000765890_100000695917 [0,0,0,0,0,0|3,0,0]=3 855 B14R0.393 CCOC(=O)CNCCCCCCCO 2230a_100011996573_100000188475 [0,0,0,0,0,0|2,0,0]=2 856 B14R0.393 CCOC(=O)CNCCCCCCCO 34a_100011996573_100000188475 [0,0,0,0,0,0|2,0,0]=2 857 B14R0.393 CCOC(=O)CNCCCOCCCO 2230a_100011310245_100000188475 [0,0,0,0,0,0|3,0,0]=3 858 B14R0.393 CCOC(=O)CNCCCOCCCO 34a_100011310245_100000188475 [0,0,0,0,0,0|3,0,0]=3 859 B14R0.393 CCOC(=O)CNCCCOCCOC 2230a_100000206027_100000188475 [0,0,0,0,0,0|3,0,0]=3 860 B14R0.393 CCOC(=O)CNCCCOCCOC 34a_100000206027_100000188475 [0,0,0,0,0,0|3,0,0]=3 861 B14R0.393 CCOC(=O)COCCCCCCCBr 34a_100000760002_100000188475 [0,0,0,0,0,0|2,0,0]=2 862 B14R0.393 CCOC(=O)COCCCCCCCBr 7a_100000760002_100000188475 [0,0,0,0,0,0|2,0,0]=2 863 B14R0.393 CCOC(=O)COCCCCCCCN 34a_100011996573_100000188475 [0,0,0,0,0,0|2,0,0]=2 864 B14R0.393 CCOC(=O)COCCCCCCOC 34a_200012092642_100000188475 [0,0,0,0,0,0|2,0,0]=2 865 B14R0.393 CCOC(=O)COCCCCCCOC 7a_200012092642_100000188475 [0,0,0,0,0,0|2,0,0]=2 866 B14R0.393 CCOC(=O)COCCCNCCCF 2230a_100015189416_100009893628 [0,0,0,0,0,0|3,0,0]=3 867 B14R0.393 CCOC(=O)COCCCNCCCF 34a_100015189416_100009893628 [0,0,0,0,0,0|3,0,0]=3 868 B14R0.393 CCOC(=O)COCCCNCCOC 2230a_100000209980_100009893628 [0,0,0,0,0,0|3,0,0]=3 869 B14R0.393 CCOC(=O)COCCCNCCSC 2230a_100020590264_100009893628 [0,0,0,0,0,0|3,0,0]=3 870 B14R0.393 CCOC(=O)COCCCOCCCBr 34a_100011217188_100009893628 [0,0,0,0,0,0|3,0,0]=3 871 B14R0.393 CCOC(=O)COCCCOCCCCl 34a_100000230001_100009893628 [0,0,0,0,0,0|3,0,0]=3 872 B14R0.393 CCOC(=O)COCCCOCCCF 34a_100000759539_100009893628 [0,0,0,0,0,0|3,0,0]=3 873 B14R0.393 CCOC(=O)COCCCOCCCN 34a_100000182051_100009893628 [0,0,0,0,0,0|3,0,0]=3 874 B14R0.393 CCOC(=O)COCCCOCCCN 34a_100011310245_100000188475 [0,0,0,0,0,0|3,0,0]=3 875 B14R0.393 CCOC(=O)COCCCOCCOC 34a_100000210237_100009893628 [0,0,0,0,0,0|3,0,0]=3 876 B14R0.393 CCOC(=O)COCCCOCCON 34a_100000700252_100009893628 [0,0,0,0,0,0|4,0,0]=4 877 B14R0.393 CCOC(=O)COCCCOCCSC 34a_100000230434_100009893628 [0,0,0,0,0,0|3,0,0]=3 878 B14R0.393 CCOC(=O)COCCCOCCSC 7a_100000230434_100009893628 [0,0,0,0,0,0|3,0,0]=3 879 B14R0.393 CCOC(=O)COCCCSCCC#N 62a_100009893628_100011215226 [0,0,0,0,0,0|3,0,1]=4 880 B14R0.393 CCOC(=O)COCCCSCCC#N 62a_100011215226_100009893628 [0,0,0,0,0,0|3,0,1]=4 881 B14R0.393 CCOC(=O)COCCCSCCCF 62a_100009893628_100011934791 [0,0,0,0,0,0|3,0,0]=3 882 B14R0.393 CCOC(=O)COCCCSCCCF 62a_100011934791_100009893628 [0,0,0,0,0,0|3,0,0]=3 883 B14R0.393 CCOC(=O)COCCCSCCCO 62a_100009893628_100011215043 [0,0,0,0,0,0|3,0,0]=3 884 B14R0.393 CCOC(=O)COCCCSCCCO 62a_100011215043_100009893628 [0,0,0,0,0,0|3,0,0]=3 885 B14R0.393 CCOC(=O)COCCCSCCOC 62a_100000233755_100009893628 [0,0,0,0,0,0|3,0,0]=3 886 B14R0.393 CCOC(=O)COCCCSCCOC 62a_100009893628_100000233755 [0,0,0,0,0,0|3,0,0]=3 887 B14R0.393 CCOC(=O)COCCCSCCSC 62a_100000212216_100009893628 [0,0,0,0,0,0|3,0,0]=3 888 B14R0.393 CCOC(=O)COCCCSCCSC 62a_100009893628_100000751147 [0,0,0,0,0,0|3,0,0]=3 889 B14R0.393 CCOC(=O)COCCNCCCCO 2230a_100000750430_100000088970 [0,0,0,0,0,0|3,0,0]=3 890 B14R0.393 CCOC(=O)COCCNCCCCO 34a_100000750430_100000088970 [0,0,0,0,0,0|3,0,0]=3 891 B14R0.393 CCOC(=O)COCCNCCCOC 34a_100150723488_100000088970 [0,0,0,0,0,0|3,0,0]=3 892 B14R0.393 CCOC(=O)COCCNCCCSC 2230a_100000749238_100000088970 [0,0,0,0,0,0|3,0,0]=3 893 B14R0.393 CCOC(=O)COCCNCCSCC 2230a_100000106463_100000088970 [0,0,0,0,0,0|3,0,0]=3 894 B14R0.393 CCOC(=O)COCCOCCCCBr 34a_100011216708_100000088970 [0,0,0,0,0,0|3,0,0]=3 895 B14R0.393 CCOC(=O)COCCOCCCCCl 34a_100000210776_100000088970 [0,0,0,0,0,0|3,0,0]=3 896 B14R0.393 CCOC(=O)COCCOCCCCCl 7a_100000210776_100000088970 [0,0,0,0,0,0|3,0,0]=3 897 B14R0.393 CCOC(=O)COCCOCCCCF 34a_100011995726_100000088970 [0,0,0,0,0,0|3,0,0]=3 898 B14R0.393 CCOC(=O)COCCOCCCCF 7a_100011995726_100000088970 [0,0,0,0,0,0|3,0,0]=3 899 B14R0.393 CCOC(=O)COCCOCCCCI 34a_200012148704_100000088970 [0,0,0,0,0,0|3,0,0]=3 900 B14R0.393 CCOC(=O)COCCOCCCCN 34a_100000750430_100000088970 [0,0,0,0,0,0|3,0,0]=3 901 B14R0.393 CCOC(=O)COCCOCCCNC 34a_100000213112_100000088970 [0,0,0,0,0,0|3,0,0]=3 902 B14R0.393 CCOC(=O)COCCOCCCOC 34a_100000740835_100000088970 [0,0,0,0,0,0|3,0,0]=3 903 B14R0.393 CCOC(=O)COCCOCCCSC 34a_100000690336_100000088970 [0,0,0,0,0,0|3,0,0]=3 904 B14R0.393 CCOC(=O)COCCOCCCSC 7a_100000690336_100000088970 [0,0,0,0,0,0|3,0,0]=3 905 B14R0.393 CCOC(=O)COCCOCCSCC 34a_100000212035_100000088970 [0,0,0,0,0,0|3,0,0]=3 906 B14R0.393 CCOC(=O)COCCOCCSCC 7a_100000212035_100000088970 [0,0,0,0,0,0|3,0,0]=3 907 B14R0.393 CCOC(=O)COCCSCCCC#N 62a_100000088970_100000687738 [0,0,0,0,0,0|3,0,1]=4 908 B14R0.393 CCOC(=O)COCCSCCCC#N 62a_100000687738_100000088970 [0,0,0,0,0,0|3,0,1]=4 909 B14R0.393 CCOC(=O)COCCSCCCC=O 62a_100000088970_200011292268 [0,0,0,0,0,0|3,0,1]=4 910 B14R0.393 CCOC(=O)COCCSCCCC=O 62a_200011292268_100000088970 [0,0,0,0,0,0|3,0,1]=4 911 B14R0.393 CCOC(=O)COCCSCCCCF 62a_100000088970_100000729493 [0,0,0,0,0,0|3,0,0]=3 912 B14R0.393 CCOC(=O)COCCSCCCCF 62a_100000729493_100000088970 [0,0,0,0,0,0|3,0,0]=3 913 B14R0.393 CCOC(=O)COCCSCCCCO 62a_100000088970_100000210776 [0,0,0,0,0,0|3,0,0]=3 914 B14R0.393 CCOC(=O)COCCSCCCCO 62a_100000210776_100000088970 [0,0,0,0,0,0|3,0,0]=3 915 B14R0.393 CCOC(=O)COCCSCCCOC 62a_100000088970_100000709357 [0,0,0,0,0,0|3,0,0]=3 916 B14R0.393 CCOC(=O)COCCSCCCOC 62a_100000709357_100000088970 [0,0,0,0,0,0|3,0,0]=3 917 B14R0.393 CCOC(=O)COCCSCCSCC 62a_100000088970_100000757381 [0,0,0,0,0,0|3,0,0]=3 918 B14R0.393 CCOC(=O)COCCSCCSCC 62a_100000757381_100000088970 [0,0,0,0,0,0|3,0,0]=3 919 B14R0.393 CCOC(=O)CSCCCCCCC#N 62a_100000188475_100009813337 [0,0,0,0,0,0|2,0,1]=3 920 B14R0.393 CCOC(=O)CSCCCCCCC#N 62a_100009813337_100000188475 [0,0,0,0,0,0|2,0,1]=3 921 B14R0.393 CCOC(=O)CSCCCCCCCO 62a_100000188475_100000760002 [0,0,0,0,0,0|2,0,0]=2 922 B14R0.393 CCOC(=O)CSCCCCCCCO 62a_100000760002_100000188475 [0,0,0,0,0,0|2,0,0]=2 923 B14R0.393 CCOC(=O)CSCCCCCCOC 62a_100000188475_100011998445 [0,0,0,0,0,0|2,0,0]=2 924 B14R0.393 CCOC(=O)CSCCCCCCOC 62a_100011998445_100000188475 [0,0,0,0,0,0|2,0,0]=2 925 B14R0.393 CCOC(=O)CSCCCOCCOC 62a_100000188475_100011216529 [0,0,0,0,0,0|3,0,0]=3 926 B14R0.393 CCOC(=O)CSCCCOCCOC 62a_100011216529_100000188475 [0,0,0,0,0,0|3,0,0]=3 927 B14R0.393 CCOC(=O)CSCCOCCCC#N 7a_200000230590_100000687738 [0,0,0,0,0,0|3,0,1]=4 928 B14R0.393 CCOC(=O)CSCCOCCCC=O 7a_200000230590_200011292268 [0,0,0,0,0,0|3,0,1]=4 929 B14R0.393 CCOC(=O)CSCCOCCCCF 7a_200000230590_100000729493 [0,0,0,0,0,0|3,0,0]=3 930 B14R0.393 CCOC(=O)CSCCOCCCCO 7a_200000230590_100000210776 [0,0,0,0,0,0|3,0,0]=3 931 B14R0.393 CCOC(=O)CSCCOCCCOC 7a_200000230590_100000740836 [0,0,0,0,0,0|3,0,0]=3 932 B14R0.393 CCOC(=O)CSCCOCCSCC 7a_200000230590_100000757381 [0,0,0,0,0,0|3,0,0]=3 933 B14R0.393 CCOC(=O)NCCOCCCCCBr 7a_100000746331_200011445536 [0,0,0,0,0,0|3,0,0]=3 934 B14R0.393 CCOC(=O)NCCOCCCCCCl 7a_100000746330_200011445536 [0,0,0,0,0,0|3,0,0]=3 935 B14R0.393 CCOC(=O)NCCOCCCCCF 34a_100000158857_100000729378 [0,0,0,0,0,0|3,0,0]=3 936 B14R0.393 CCOC(=O)NCCOCCCCCI 7a_200012148887_200011445536 [0,0,0,0,0,0|3,0,0]=3 937 B14R0.393 CCOC(=O)NCCOCCCCCO 34a_100000158857_100000746330 [0,0,0,0,0,0|3,0,0]=3 938 B14R0.393 CCOC(=O)NCCOCCCCOC 34a_100000158857_100000755781 [0,0,0,0,0,0|3,0,0]=3 939 B14R0.393 CCOC(=O)NCCOCCCCSC 7a_100011217163_200011445536 [0,0,0,0,0,0|3,0,0]=3 940 B14R0.393 CCOC(=O)NCCOCCCSCC 7a_100011216438_200011445536 [0,0,0,0,0,0|3,0,0]=3 941 B14R0.393 CCOC(=O)NCCOCCOCCBr 7a_100000692535_200011445536 [0,0,0,0,0,0|4,0,0]=4 942 B14R0.393 CCOC(=O)NCCOCCOCCCl 7a_100011215305_200011445536 [0,0,0,0,0,0|4,0,0]=4 943 B14R0.393 CCOC(=O)NCCOCCOCCF 7a_200015357709_200011445536 [0,0,0,0,0,0|4,0,0]=4 944 B14R0.393 CCOC(=O)NCCOCCOCCI 7a_100012149058_200011445536 [0,0,0,0,0,0|4,0,0]=4 945 B14R0.393 CCOC(=O)NCCOCCOCCO 34a_100000158857_100000692535 [0,0,0,0,0,0|4,0,0]=4 946 B14R0.393 CCOC(=O)NCCSCCCCC#N 62a_100011219923_200011445536 [0,0,0,0,0,0|3,0,1]=4 947 B14R0.393 CCOC(=O)NCCSCCCCC=O 62a_100000139335_200011445536 [0,0,0,0,0,0|3,0,1]=4 948 B14R0.393 CCOC(=O)NCCSCCCCCF 62a_100000729378_200011445536 [0,0,0,0,0,0|3,0,0]=3 949 B14R0.393 CCOC(=O)NCCSCCCCCO 62a_100000746330_200011445536 [0,0,0,0,0,0|3,0,0]=3 950 B14R0.393 CCOC(=O)NCCSCCCCOC 62a_100000730899_200011445536 [0,0,0,0,0,0|3,0,0]=3 951 B14R0.393 CCOC(=O)NCCSCCOCCO 62a_100011215305_200011445536 [0,0,0,0,0,0|4,0,0]=4 952 B14R0.393 CCOC(=O)NCCSCOCCOC 62a_100000231047_200011445536 [0,0,0,0,0,0|4,0,0]=4 953 B14R0.393 CCOC(=O)OCSCCCCCC#N 62a_100009813376_100000075025 [0,0,0,0,0,0|3,0,1]=4 954 B14R0.393 CCOC(=O)OCSCCCCCC=O 62a_100000139337_100000075025 [0,0,0,0,0,0|3,0,1]=4 955 B14R0.393 CCOC(=O)OCSCCCCCCF 62a_100015922095_100000075025 [0,0,0,0,0,0|3,0,0]=3 956 B14R0.393 CCOC(=O)OCSCCCCCCO 62a_100000766143_100000075025 [0,0,0,0,0,0|3,0,0]=3 957 B14R0.393 CCOC(=O)OCSCCOCCOC 62a_100000695917_100000075025 [0,0,0,0,0,0|4,0,0]=4 958 B14R0.393 CCOCCCCCCCC(=O)OCC 34a_100121572206_100009991516 [0,0,0,0,0,0|1,0,0]=1 959 B14R0.393 CCOCCCNC/C=C/C(=O)OCC 2230a_100000210961_100016267167 [0,0,0,0,0,0|2,0,2]=4 960 B14R0.393 CCOCCCNC/C=C/C(=O)OCC 34a_100000210961_100016267167 [0,0,0,0,0,0|2,0,2]=4 961 B14R0.393 CCOCCCNCCCC(=O)OCC 2230a_100000210961_100009991533 [0,0,0,0,0,0|2,0,0]=2 962 B14R0.393 CCOCCCNCCCC(=O)OCC 34a_100000210961_100009991533 [0,0,0,0,0,0|2,0,0]=2 963 B14R0.393 CCOCCCOC/C=C/C(=O)OCC 34a_100000757476_100016267167 [0,0,0,0,0,0|2,0,2]=4 964 B14R0.393 CCOCCCOC/C=C/C(=O)OCC 7a_100000757476_100016267167 [0,0,0,0,0,0|2,0,2]=4 965 B14R0.393 CCOCCCOCCCC(=O)OCC 34a_100000757476_100009991533 [0,0,0,0,0,0|2,0,0]=2 966 B14R0.393 CCOCCCOCCCC(=O)OCC 7a_100000757476_100011215271 [0,0,0,0,0,0|2,0,0]=2 967 B14R0.393 CCOCCCOCCCC(=O)OCC 7a_100012001163_100012232248 [0,0,0,0,0,0|2,0,0]=2 968 B14R0.393 CCOCCCOCCNC(=O)OCC 34a_100000158857_100012232248 [0,0,0,0,0,0|3,0,0]=3 969 B14R0.393 CCOCCCOCCNC(=O)OCC 7a_100000757476_200011445536 [0,0,0,0,0,0|3,0,0]=3 970 B14R0.393 CCOCCCSC/C=C/C(=O)OCC 62a_100012232248_100016267167 [0,0,0,0,0,0|2,0,2]=4 971 B14R0.393 CCOCCCSC/C=C/C(=O)OCC 62a_100016267167_100012232248 [0,0,0,0,0,0|2,0,2]=4 972 B14R0.393 CCOCCCSCCCC(=O)OCC 62a_100009991533_100012232248 [0,0,0,0,0,0|2,0,0]=2 973 B14R0.393 CCOCCCSCCCC(=O)OCC 62a_100012232248_100009991533 [0,0,0,0,0,0|2,0,0]=2 974 B14R0.393 CCOCCCSCCNC(=O)OCC 62a_100012232248_200011445536 [0,0,0,0,0,0|3,0,0]=3 975 B14R0.393 CCOCCNCCCCC(=O)OCC 2230a_102516460346_100000750268 [0,0,0,0,0,0|2,0,0]=2 976 B14R0.393 CCOCCNCCCCC(=O)OCC 34a_102516460346_100000750268 [0,0,0,0,0,0|2,0,0]=2 977 B14R0.393 CCOCCNCCOCC(=O)OCC 2230a_102516460346_100000088970 [0,0,0,0,0,0|3,0,0]=3 978 B14R0.393 CCOCCNCCOCC(=O)OCC 34a_102516460346_100000088970 [0,0,0,0,0,0|3,0,0]=3 979 B14R0.393 CCOCCOCCCCC(=O)OCC 34a_100000210136_100000750268 [0,0,0,0,0,0|2,0,0]=2 980 B14R0.393 CCOCCOCCCCC(=O)OCC 7a_100000210136_100000750268 [0,0,0,0,0,0|2,0,0]=2 981 B14R0.393 CCOCCOCCNCC(=O)OCC 2230a_100102712874_100000188475 [0,0,0,0,0,0|3,0,0]=3 982 B14R0.393 CCOCCOCCNCC(=O)OCC 34a_100102712874_100000188475 [0,0,0,0,0,0|3,0,0]=3 983 B14R0.393 CCOCCOCCOCC(=O)OCC 34a_100000210136_100000088970 [0,0,0,0,0,0|3,0,0]=3 984 B14R0.393 CCOCCOCCOCC(=O)OCC 34a_100000210240_100000188475 [0,0,0,0,0,0|3,0,0]=3 985 B14R0.393 CCOCCOCCOCC(=O)OCC 7a_100000210136_100000088970 [0,0,0,0,0,0|3,0,0]=3 986 B14R0.393 CCOCCOCCOCC(=O)OCC 7a_100000210240_100000188475 [0,0,0,0,0,0|3,0,0]=3 987 B14R0.393 CCOCCOCCSCC(=O)OCC 62a_100000188475_100011211534 [0,0,0,0,0,0|3,0,0]=3 988 B14R0.393 CCOCCOCCSCC(=O)OCC 62a_100011211534_100000188475 [0,0,0,0,0,0|3,0,0]=3 989 B14R0.393 CCOCCOCCSCC(=O)OCC 7a_200000230590_100011215890 [0,0,0,0,0,0|3,0,0]=3 990 B14R0.393 CCOCCSCCCCC(=O)OCC 62a_100000210147_100000750268 [0,0,0,0,0,0|2,0,0]=2 991 B14R0.393 CCOCCSCCCCC(=O)OCC 62a_100000750268_100011215890 [0,0,0,0,0,0|2,0,0]=2 992 B14R0.393 CCOCCSCCOCC(=O)OCC 62a_100000088970_100011215890 [0,0,0,0,0,0|3,0,0]=3 993 B14R0.393 CCOCCSCCOCC(=O)OCC 62a_100000210147_100000088970 [0,0,0,0,0,0|3,0,0]=3 994 B14R0.393 CCOCSCCCCCC(=O)OCC 62a_100000739092_100000755133 [0,0,0,0,0,0|2,0,0]=2 995 B14R0.393 CCOCSCCCCCC(=O)OCC 62a_100000755133_100000739092 [0,0,0,0,0,0|2,0,0]=2 996 B14R0.393 CCOCSCCCOCC(=O)OCC 62a_100000739092_100009893628 [0,0,0,0,0,0|3,0,0]=3 997 B14R0.393 CCOCSCCCOCC(=O)OCC 62a_100009893628_100000739092 [0,0,0,0,0,0|3,0,0]=3 998 B14R0.393 CNNC(=O)CCCCCCCCCF 22a_100016993582_200009909015 [0,0,0,0,0,0|3,0,0]=3 999 B14R0.393 CNNC(=O)CCCCCCCCCO 22a_100016993582_100000032657 [0,0,0,0,0,0|3,0,0]=3 1000 B14R0.393 CNNC(=O)NCCCCCCCCO 273464a_102515433106_100016993582 [0,0,0,0,0,0|4,0,0]=4 1001 B14R0.393 CNNC(=O)NCCCCCCCCO 512a_100016993582_102515433106 [0,0,0,0,0,0|4,0,0]=4 1002 B14R0.393 CNNC(=O)NCCCCCCCCO 512a_102515433106_100016993582 [0,0,0,0,0,0|4,0,0]=4 1003 B14R0.393 COCC(=O)CCCCCCCCCO 1458a_100000210968_100009813782 [0,0,0,0,0,0|3,0,0]=3 1004 B14R0.393 COCC(=O)NCCCCCCCCO 240690a_102515433106_100000210968 [0,0,0,0,0,0|4,0,0]=4 1005 B14R0.393 COCCCCCCOCC(=O)NCO 34a_200012092642_100000185155 [0,0,0,0,0,0|4,0,0]=4 1006 B14R0.393 COCCCCCCOCC(=O)NCO 7a_200012092642_100000185155 [0,0,0,0,0,0|4,0,0]=4 1007 B14R0.393 COCCCCCCSCC(=O)NCO 62a_100000185155_100011998445 [0,0,0,0,0,0|4,0,0]=4 1008 B14R0.393 COCCCCCCSCC(=O)NCO 62a_100011998445_100000185155 [0,0,0,0,0,0|4,0,0]=4 1009 B14R0.393 CSCC(=O)CCCCCCCCCO 1458a_100000184570_100009813782 [0,0,0,0,0,0|3,0,0]=3 1010 B14R0.393 CSCC(=O)NCCCCCCCCO 240690a_102515433106_100000184570 [0,0,0,0,0,0|4,0,0]=4 1011 B14R0.393 N#CCC(=O)CCCCCCCCCF 1458a_200009909015_100011214920 [0,0,0,0,0,0|3,0,1]=4 1012 B14R0.393 N#CCC(=O)CCCCCCCCCO 1458a_100051588842_100009813782 [0,0,0,0,0,0|3,0,1]=4 1013 B14R0.393 NCCCCCCCOCC(=O)NCO 34a_100011996573_100000185155 [0,0,0,0,0,0|4,0,0]=4 1014 B14R0.393 O=C(C=CBr)CCCCCCCCCO 1458a_100016273825_100009813782 [0,0,0,0,0,0|3,0,1]=4 1015 B14R0.393 O=C(C=CCl)CCCCCCCCCO 1458a_200016279998_100009813782 [0,0,0,0,0,0|3,0,1]=4 1016 B14R0.393 O=C(C=CI)CCCCCCCCCO 1458a_100016256311_100009813782 [0,0,0,0,0,0|3,0,1]=4 1017 B14R0.393 O=C(CCF)CCCCCCCCCF 1458a_200009909015_100011217306 [0,0,0,0,0,0|3,0,0]=3 1018 B14R0.393 O=C(CCO)CCCCCCCCCF 1458a_200009909015_100000211926 [0,0,0,0,0,0|3,0,0]=3 1019 B14R0.393 O=C(CCO)CCCCCCCCCO 1458a_100011216618_100009813782 [0,0,0,0,0,0|3,0,0]=3 1020 B14R0.393 O=C(CCO)NCCCCCCCCO 240690a_102515433106_100011216618 [0,0,0,0,0,0|4,0,0]=4 1021 B14R0.393 O=C(CNCCCCCCCO)NCO 2230a_100011996573_100000185155 [0,0,0,0,0,0|4,0,0]=4 1022 B14R0.393 O=C(CNCCCCCCCO)NCO 34a_100011996573_100000185155 [0,0,0,0,0,0|4,0,0]=4 1023 B14R0.393 O=C(COCCCCCCCBr)NCO 34a_100000760002_100000185155 [0,0,0,0,0,0|4,0,0]=4 1024 B14R0.393 O=C(COCCCCCCCBr)NCO 7a_100000760002_100000185155 [0,0,0,0,0,0|4,0,0]=4 1025 B14R0.393 O=C(CSCCCCCCCO)NCO 62a_100000185155_100000760002 [0,0,0,0,0,0|4,0,0]=4 1026 B14R0.393 O=C(CSCCCCCCCO)NCO 62a_100000760002_100000185155 [0,0,0,0,0,0|4,0,0]=4 1027 B13R0.2 C#CCC(=O)CCCCCCCCC 1458a_100000210558_100000184674 [1,0,0,0,0,0|1,0,2]=4 1028 B13R0.2 C#CCC(=O)CCCCCCCCC 1458a_100011220946_100000210670 [1,0,0,0,0,0|1,0,2]=4 1029 B13R0.2 C#CCCCCCCCC(=O)CCC 1458a_100000087357_100000210303 [1,0,0,0,0,0|1,0,2]=4 1030 B13R0.2 C#CCCCCCCCC(=O)CCC 1458a_100000211992_100153394163 [1,0,0,0,0,0|1,0,2]=4 1031 B13R0.2 C#CCCCCCCCC(=O)NCC 11a_100015525214_100000087357 [1,0,0,0,0,0|1,0,2]=4 1032 B13R0.2 C#CCCCCCCCC(=O)NCC 240690a_100015525214_100000087357 [1,0,0,0,0,0|1,0,2]=4 1033 B13R0.2 C#CCCCCCCCC(=O)NCC 527a_100015525214_100000087357 [1,0,0,0,0,0|1,0,2]=4 1034 B13R0.2 C#CCCCCCOCC(=O)OCC 34a_100000766912_100000188475 [1,0,0,0,0,0|1,0,2]=4 1035 B13R0.2 C#CCCCCCOCC(=O)OCC 7a_100000766912_100000188475 [1,0,0,0,0,0|1,0,2]=4 1036 B13R0.2 C#CCCCCCSCC(=O)OCC 62a_100000188475_100012094781 [1,0,0,0,0,0|1,0,2]=4 1037 B13R0.2 C#CCCCCCSCC(=O)OCC 62a_100012094781_100000188475 [1,0,0,0,0,0|1,0,2]=4 1038 B13R0.2 C#CCCCCNCCC(=O)OCC 2230a_100000706060_100011206558 [1,0,0,0,0,0|1,0,2]=4 1039 B13R0.2 C#CCCCCNCCC(=O)OCC 34a_100000706060_100000765890 [1,0,0,0,0,0|1,0,2]=4 1040 B13R0.2 C#CCCCCOCCC(=O)OCC 34a_100000766709_100000765890 [1,0,0,0,0,0|1,0,2]=4 1041 B13R0.2 C#CCCCCOCCC(=O)OCC 7a_100000766709_100011206558 [1,0,0,0,0,0|1,0,2]=4 1042 B13R0.2 C#CCCCCSCCC(=O)OCC 62a_100000765890_100010269958 [1,0,0,0,0,0|1,0,2]=4 1043 B13R0.2 C#CCCCCSCCC(=O)OCC 62a_100010269958_100000765890 [1,0,0,0,0,0|1,0,2]=4 1044 B13R0.2 C#CCCCNCCCC(=O)OCC 34a_100000718082_100009991533 [1,0,0,0,0,0|1,0,2]=4 1045 B13R0.2 C#CCCCOCCCC(=O)OCC 34a_100000215630_100009991533 [1,0,0,0,0,0|1,0,2]=4 1046 B13R0.2 C#CCCCOCCCC(=O)OCC 7a_100000215630_100011215271 [1,0,0,0,0,0|1,0,2]=4 1047 B13R0.2 C#CCCCOCCCC(=O)OCC 7a_100012001163_100011215417 [1,0,0,0,0,0|1,0,2]=4 1048 B13R0.2 C#CCCCSCCCC(=O)OCC 62a_100009991533_100011215417 [1,0,0,0,0,0|1,0,2]=4 1049 B13R0.2 C#CCCCSCCCC(=O)OCC 62a_100011215417_100009991533 [1,0,0,0,0,0|1,0,2]=4 1050 B13R0.2 C#CCCNCCCCC(=O)OCC 34a_100000755551_100000750268 [1,0,0,0,0,0|1,0,2]=4 1051 B13R0.2 C#CCCOCCCCC(=O)OCC 34a_100011215631_100000750268 [1,0,0,0,0,0|1,0,2]=4 1052 B13R0.2 C#CCCSCCCCC(=O)OCC 62a_100000688953_100000750268 [1,0,0,0,0,0|1,0,2]=4 1053 B13R0.2 C#CCCSCCCCC(=O)OCC 62a_100000750268_100000688953 [1,0,0,0,0,0|1,0,2]=4 1054 B13R0.2 C#CCNCCCCCC(=O)OCC 34a_100000212058_100000755133 [1,0,0,0,0,0|1,0,2]=4 1055 B13R0.2 C#CCOCCCCCC(=O)OCC 34a_100000210247_100000755133 [1,0,0,0,0,0|1,0,2]=4 1056 B13R0.2 C#CCOCCCCCC(=O)OCC 7a_100011214988_100000038162 [1,0,0,0,0,0|1,0,2]=4 1057 B13R0.2 C#CCSCCCCCC(=O)OCC 62a_100000038162_100000755133 [1,0,0,0,0,0|1,0,2]=4 1058 B13R0.2 C/C=C/CCOCCCC(=O)OCC 34a_100016278192_100009991533 [1,0,0,0,0,0|1,0,2]=4 1059 B13R0.2 C/C=C/COCCCCC(=O)OCC 34a_100016270725_100000750268 [1,0,0,0,0,0|1,0,2]=4 1060 B13R0.2 C/C=C/CSCCCCC(=O)OCC 62a_100000750268_100102629194 [1,0,0,0,0,0|1,0,2]=4 1061 B13R0.2 C/C=C/CSCCCCC(=O)OCC 62a_100102629194_100000750268 [1,0,0,0,0,0|1,0,2]=4 1062 B13R0.2 C=CCC(=O)CCCCCCCCC 1458a_100000210193_100000210670 [1,0,0,0,0,0|1,0,2]=4 1063 B13R0.2 C=CCC(=O)CCCCCCCCC 1458a_100000210558_100000210623 [1,0,0,0,0,0|1,0,2]=4 1064 B13R0.2 C=CCCCCCCCC(=O)CCC 1458a_100000211992_100012355270 [1,0,0,0,0,0|1,0,2]=4 1065 B13R0.2 C=CCCCCCCCC(=O)CCC 1458a_100011216160_100000210303 [1,0,0,0,0,0|1,0,2]=4 1066 B13R0.2 C=CCCCCCCCC(=O)NCC 11a_100015525214_100011216160 [1,0,0,0,0,0|1,0,2]=4 1067 B13R0.2 C=CCCCCCCCC(=O)NCC 240690a_100015525214_100011216160 [1,0,0,0,0,0|1,0,2]=4 1068 B13R0.2 C=CCCCCCCCC(=O)NCC 527a_100015525214_100011216160 [1,0,0,0,0,0|1,0,2]=4 1069 B13R0.2 C=CCCCCCOCC(=O)OCC 34a_100011216702_100000188475 [1,0,0,0,0,0|1,0,2]=4 1070 B13R0.2 C=CCCCCCOCC(=O)OCC 7a_100011216702_100000188475 [1,0,0,0,0,0|1,0,2]=4 1071 B13R0.2 C=CCCCCCSCC(=O)OCC 62a_100000188475_100000700193 [1,0,0,0,0,0|1,0,2]=4 1072 B13R0.2 C=CCCCCCSCC(=O)OCC 62a_100000700193_100000188475 [1,0,0,0,0,0|1,0,2]=4 1073 B13R0.2 C=CCCCCNCCC(=O)OCC 2230a_100000703577_100011206558 [1,0,0,0,0,0|1,0,2]=4 1074 B13R0.2 C=CCCCCNCCC(=O)OCC 34a_100000703577_100000765890 [1,0,0,0,0,0|1,0,2]=4 1075 B13R0.2 C=CCCCCOCCC(=O)OCC 34a_100000766645_100000765890 [1,0,0,0,0,0|1,0,2]=4 1076 B13R0.2 C=CCCCCOCCC(=O)OCC 7a_100000766645_100011206558 [1,0,0,0,0,0|1,0,2]=4 1077 B13R0.2 C=CCCCCSCCC(=O)OCC 62a_100000765890_100011215482 [1,0,0,0,0,0|1,0,2]=4 1078 B13R0.2 C=CCCCCSCCC(=O)OCC 62a_100011215482_100000765890 [1,0,0,0,0,0|1,0,2]=4 1079 B13R0.2 C=CCCCNCCCC(=O)OCC 2230a_100000700776_100009991533 [1,0,0,0,0,0|1,0,2]=4 1080 B13R0.2 C=CCCCNCCCC(=O)OCC 34a_100000700776_100009991533 [1,0,0,0,0,0|1,0,2]=4 1081 B13R0.2 C=CCCCOCCCC(=O)OCC 34a_100000758997_100009991533 [1,0,0,0,0,0|1,0,2]=4 1082 B13R0.2 C=CCCCOCCCC(=O)OCC 7a_100000758997_100011215271 [1,0,0,0,0,0|1,0,2]=4 1083 B13R0.2 C=CCCCOCCCC(=O)OCC 7a_100012001163_100000757094 [1,0,0,0,0,0|1,0,2]=4 1084 B13R0.2 C=CCCCSCCCC(=O)OCC 62a_100009991533_100000757094 [1,0,0,0,0,0|1,0,2]=4 1085 B13R0.2 C=CCCCSCCCC(=O)OCC 62a_100011713584_100009991533 [1,0,0,0,0,0|1,0,2]=4 1086 B13R0.2 C=CCCNCCCCC(=O)OCC 2230a_100015191253_100000750268 [1,0,0,0,0,0|1,0,2]=4 1087 B13R0.2 C=CCCOCCCCC(=O)OCC 34a_100011205117_100000750268 [1,0,0,0,0,0|1,0,2]=4 1088 B13R0.2 C=CCCSCCCCC(=O)OCC 62a_100000750268_100000754431 [1,0,0,0,0,0|1,0,2]=4 1089 B13R0.2 C=CCCSCCCCC(=O)OCC 62a_100000754431_100000750268 [1,0,0,0,0,0|1,0,2]=4 1090 B13R0.2 C=CCNCCCCCC(=O)OCC 2230a_100020586998_100000755133 [1,0,0,0,0,0|1,0,2]=4 1091 B13R0.2 C=CCOCCCCCC(=O)OCC 34a_200000210373_100000755133 [1,0,0,0,0,0|1,0,2]=4 1092 B13R0.2 C=CCOCCCCCC(=O)OCC 7a_100011214988_100015514636 [1,0,0,0,0,0|1,0,2]=4 1093 B13R0.2 C=CCSCCCCCC(=O)OCC 62a_100000210623_100000755133 [1,0,0,0,0,0|1,0,2]=4 1094 B13R0.2 C=CCSCCCCCC(=O)OCC 62a_100000755133_100000210623 [1,0,0,0,0,0|1,0,2]=4 1095 B13R0.2 C=COC(=O)CNCCCCCCC 2230a_100000229938_100000036128 [1,0,0,0,0,0|1,0,2]=4 1096 B13R0.2 C=COC(=O)COCCCCCCC 34a_100000210272_100000036128 [1,0,0,0,0,0|1,0,2]=4 1097 B13R0.2 C=COC(=O)CSCCCCCCC 62a_100000036128_100000210316 [1,0,0,0,0,0|1,0,2]=4 1098 B13R0.2 C=COC(=O)CSCCCCCCC 62a_100000210614_100000036128 [1,0,0,0,0,0|1,0,2]=4 1099 B13R0.2 CC#CC(=O)CCCCCCCCC 1458a_100000763181_100000210670 [1,0,0,0,0,0|1,0,1]=3 1100 B13R0.2 CC#CC(=O)CCCCCCCCO 1458a_100000763181_100000033203 [1,0,0,0,0,0|2,0,1]=4 1101 B13R0.2 CC#CCCOCCCC(=O)OCC 34a_100000750427_100009991533 [1,0,0,0,0,0|1,0,2]=4 1102 B13R0.2 CC#CCNCCCCC(=O)OCC 2230a_100000685387_100000750268 [1,0,0,0,0,0|1,0,2]=4 1103 B13R0.2 CC#CCNCCCCC(=O)OCC 34a_100000685387_100000750268 [1,0,0,0,0,0|1,0,2]=4 1104 B13R0.2 CC#CCOCCCCC(=O)OCC 34a_100000761923_100000750268 [1,0,0,0,0,0|1,0,2]=4 1105 B13R0.2 CC#CCSCCCCC(=O)OCC 62a_100000748600_100000750268 [1,0,0,0,0,0|1,0,2]=4 1106 B13R0.2 CC#CCSCCCCC(=O)OCC 62a_100000750268_100000748600 [1,0,0,0,0,0|1,0,2]=4 1107 B13R0.2 CC/C=C/CCCOCC(=O)OCC 34a_100016287902_100000188475 [1,0,0,0,0,0|1,0,2]=4 1108 B13R0.2 CC/C=C/CCCOCC(=O)OCC 7a_100016287902_100000188475 [1,0,0,0,0,0|1,0,2]=4 1109 B13R0.2 CC/C=C\CCOCCC(=O)OCC 34a_100016288707_100000765890 [1,0,0,0,0,0|1,0,2]=4 1110 B13R0.2 CC/C=C\CCOCCC(=O)OCC 7a_100016288707_100011206558 [1,0,0,0,0,0|1,0,2]=4 1111 B13R0.2 CC/C=C\CCSCCC(=O)OCC 62a_100000765890_100015370543 [1,0,0,0,0,0|1,0,2]=4 1112 B13R0.2 CC/C=C\CCSCCC(=O)OCC 62a_100015370543_100000765890 [1,0,0,0,0,0|1,0,2]=4 1113 B13R0.2 CC/C=C\COCCCC(=O)OCC 34a_100016268518_100009991533 [1,0,0,0,0,0|1,0,2]=4 1114 B13R0.2 CC/C=C\COCCCC(=O)OCC 7a_100012001163_100103147603 [1,0,0,0,0,0|1,0,2]=4 1115 B13R0.2 CC/C=C\CSCCCC(=O)OCC 62a_100009991533_100103147603 [1,0,0,0,0,0|1,0,2]=4 1116 B13R0.2 CC/C=C\CSCCCC(=O)OCC 62a_100103147603_100009991533 [1,0,0,0,0,0|1,0,2]=4 1117 B13R0.2 CC=CC(=O)CCCCCCCCC 1458a_100000210699_100000210670 [1,0,0,0,0,0|1,0,1]=3 1118 B13R0.2 CC=CC(=O)CCCCCCCCO 1458a_100000210699_100000033203 [1,0,0,0,0,0|2,0,1]=4 1119 B13R0.2 CC=CC(=O)NCCCCCCCC 11a_100000229939_100000210699 [1,0,0,0,0,0|2,0,1]=4 1120 B13R0.2 CC=CC(=O)NCCCCCCCC 1626a_100000229939_100000210699 [1,0,0,0,0,0|2,0,1]=4 1121 B13R0.2 CC=CC(=O)NCCCCCCCC 240690a_100000229939_100000210699 [1,0,0,0,0,0|2,0,1]=4 1122 B13R0.2 CC=CCCCOCCC(=O)OCC 34a_100020645299_100000765890 [1,0,0,0,0,0|1,0,2]=4 1123 B13R0.2 CC=CCSCCCCC(=O)OCC 62a_100000070051_100000750268 [1,0,0,0,0,0|1,0,2]=4 1124 B13R0.2 CC=CCSCCCCC(=O)OCC 62a_100000750268_100000070051 [1,0,0,0,0,0|1,0,2]=4 1125 B13R0.2 CCC#CCCOCCC(=O)OCC 34a_100000036655_100000765890 [1,0,0,0,0,0|1,0,2]=4 1126 B13R0.2 CCC#CCCOCCC(=O)OCC 7a_100000036655_100011206558 [1,0,0,0,0,0|1,0,2]=4 1127 B13R0.2 CCC#CCOCCCC(=O)OCC 34a_100000032950_100009991533 [1,0,0,0,0,0|1,0,2]=4 1128 B13R0.2 CCC#CCOCCCC(=O)OCC 7a_100012001163_100009813939 [1,0,0,0,0,0|1,0,2]=4 1129 B13R0.2 CCC#CCSCCCC(=O)OCC 62a_100009813939_100009991533 [1,0,0,0,0,0|1,0,2]=4 1130 B13R0.2 CCC#CCSCCCC(=O)OCC 62a_100009991533_100009813939 [1,0,0,0,0,0|1,0,2]=4 1131 B13R0.2 CCC/C=C/COCCC(=O)OCC 34a_100016278788_100000765890 [1,0,0,0,0,0|1,0,2]=4 1132 B13R0.2 CCC/C=C/COCCC(=O)OCC 7a_100016278788_100011206558 [1,0,0,0,0,0|1,0,2]=4 1133 B13R0.2 CCCC#CCCOCC(=O)OCC 34a_100000042726_100000188475 [1,0,0,0,0,0|1,0,2]=4 1134 B13R0.2 CCCC#CCCOCC(=O)OCC 7a_100000042726_100000188475 [1,0,0,0,0,0|1,0,2]=4 1135 B13R0.2 CCCC#CCOCCC(=O)OCC 34a_100000034806_100000765890 [1,0,0,0,0,0|1,0,2]=4 1136 B13R0.2 CCCC#CCOCCC(=O)OCC 7a_100000034806_100011206558 [1,0,0,0,0,0|1,0,2]=4 1137 B13R0.2 CCCC(=O)CCCCCCCCO 1458a_100000211992_100000033203 [1,0,0,0,0,0|2,0,0]=3 1138 B13R0.2 CCCC(=O)CNCCCCCCO 2230a_100000686447_100000747444 [1,0,0,0,0,0|3,0,0]=4 1139 B13R0.2 CCCC(=O)CNCCCCCOC 2230a_100000747528_100000747444 [1,0,0,0,0,0|3,0,0]=4 1140 B13R0.2 CCCC(=O)COCCCCCCBr 7a_100011215345_100000747444 [1,0,0,0,0,0|3,0,0]=4 1141 B13R0.2 CCCC(=O)COCCCCCCCl 7a_100000766143_100000747444 [1,0,0,0,0,0|3,0,0]=4 1142 B13R0.2 CCCC(=O)COCCCCCCF 7a_100000732779_100000747444 [1,0,0,0,0,0|3,0,0]=4 1143 B13R0.2 CCCC(=O)CSCCCCCCF 62a_100000747444_100015922095 [1,0,0,0,0,0|3,0,0]=4 1144 B13R0.2 CCCC(=O)CSCCCCCCF 62a_100015922095_100000747444 [1,0,0,0,0,0|3,0,0]=4 1145 B13R0.2 CCCC(=O)CSCCCCCCO 62a_100000747444_100000766143 [1,0,0,0,0,0|3,0,0]=4 1146 B13R0.2 CCCC(=O)CSCCCCCCO 62a_100000766143_100000747444 [1,0,0,0,0,0|3,0,0]=4 1147 B13R0.2 CCCC(=O)NCCCCCCCO 240690a_100011996573_100000211992 [1,0,0,0,0,0|3,0,0]=4 1148 B13R0.2 CCCC/C=C/COCC(=O)OCC 34a_200016272032_100000188475 [1,0,0,0,0,0|1,0,2]=4 1149 B13R0.2 CCCC/C=C/COCC(=O)OCC 7a_200016272032_100000188475 [1,0,0,0,0,0|1,0,2]=4 1150 B13R0.2 CCCCC#CCCCC(=O)CCC 1458a_100000211992_200000047210 [1,0,0,0,0,0|1,0,2]=4 1151 B13R0.2 CCCCC#CCOCC(=O)OCC 34a_200000034558_100000188475 [1,0,0,0,0,0|1,0,2]=4 1152 B13R0.2 CCCCC#CCOCC(=O)OCC 7a_200000034558_100000188475 [1,0,0,0,0,0|1,0,2]=4 1153 B13R0.2 CCCCC/C=C/CCC(=O)CCC 1458a_200015255902_100000210303 [1,0,0,0,0,0|1,0,2]=4 1154 B13R0.2 CCCCC/C=C/CCC(=O)NCC 11a_100015525214_200015255902 [1,0,0,0,0,0|1,0,2]=4 1155 B13R0.2 CCCCC/C=C/CCC(=O)NCC 240690a_100015525214_200015255902 [1,0,0,0,0,0|1,0,2]=4 1156 B13R0.2 CCCCC/C=C/CCC(=O)NCC 527a_100015525214_200015255902 [1,0,0,0,0,0|1,0,2]=4 1157 B13R0.2 CCCCCC/C=C/CC(=O)CCC 1458a_100020681715_100000210303 [1,0,0,0,0,0|1,0,2]=4 1158 B13R0.2 CCCCCC/C=C/CC(=O)NCC 11a_100015525214_100020681715 [1,0,0,0,0,0|1,0,2]=4 1159 B13R0.2 CCCCCC/C=C/CC(=O)NCC 240690a_100015525214_100020681715 [1,0,0,0,0,0|1,0,2]=4 1160 B13R0.2 CCCCCCCC=CC(=O)CCC 1458a_200015332781_100000210303 [1,0,0,0,0,0|1,0,2]=4 1161 B13R0.2 CCCCCCCC=CC(=O)NCC 11a_100015525214_200015332781 [1,0,0,0,0,0|1,0,2]=4 1162 B13R0.2 CCCCCCCC=CC(=O)NCC 240690a_100015525214_200015332781 [1,0,0,0,0,0|1,0,2]=4 1163 B13R0.2 CCCCCCCCCC(=O)C=CBr 1458a_100016273825_100000210670 [1,0,0,0,0,0|2,0,1]=4 1164 B13R0.2 CCCCCCCCCC(=O)C=CCl 1458a_200016279998_100000210670 [1,0,0,0,0,0|2,0,1]=4 1165 B13R0.2 CCCCCCCCCC(=O)C=CI 1458a_100016256311_100000210670 [1,0,0,0,0,0|2,0,1]=4 1166 B13R0.2 CCCCCCCCCC(=O)CC#N 1458a_100000210558_100011214920 [1,0,0,0,0,0|2,0,1]=4 1167 B13R0.2 CCCCCCCCCC(=O)CC#N 1458a_100051588842_100000210670 [1,0,0,0,0,0|2,0,1]=4 1168 B13R0.2 CCCCCCCCCC(=O)CCC 1458a_100000210558_100000210303 [1,0,0,0,0,0|1,0,0]=2 1169 B13R0.2 CCCCCCCCCC(=O)CCC 1458a_100000211992_100000210670 [1,0,0,0,0,0|1,0,0]=2 1170 B13R0.2 CCCCCCCCCC(=O)CCF 1458a_100000210558_100011217306 [1,0,0,0,0,0|2,0,0]=3 1171 B13R0.2 CCCCCCCCCC(=O)CCO 1458a_100000210558_100000211926 [1,0,0,0,0,0|2,0,0]=3 1172 B13R0.2 CCCCCCCCCC(=O)CCO 1458a_100011216618_100000210670 [1,0,0,0,0,0|2,0,0]=3 1173 B13R0.2 CCCCCCCCCC(=O)COC 1458a_100000210968_100000210670 [1,0,0,0,0,0|2,0,0]=3 1174 B13R0.2 CCCCCCCCCC(=O)CSC 1458a_100000184570_100000210670 [1,0,0,0,0,0|2,0,0]=3 1175 B13R0.2 CCCCCCCCCC(=O)NCC 11a_100015525214_100000210558 [1,0,0,0,0,0|1,0,0]=2 1176 B13R0.2 CCCCCCCCCC(=O)NCC 240690a_100015525214_100000210558 [1,0,0,0,0,0|1,0,0]=2 1177 B13R0.2 CCCCCCCCCC(=O)NCC 527a_100015525214_100000210558 [1,0,0,0,0,0|1,0,0]=2 1178 B13R0.2 CCCCCCCCCC(=O)NNC 22a_100016993582_100000210558 [1,0,0,0,0,0|2,0,0]=3 1179 B13R0.2 CCCCCCCCCC(C)NCC 270004a_100015525214_100011215753 [1,0,0,0,0,0|2,0,1]=4 1180 B13R0.2 CCCCCCCCCC(C)OCC 34a_100011218016_100000210202 [1,0,0,0,0,0|1,0,1]=3 1181 B13R0.2 CCCCCCCCCC(C)OCC 7a_100011218016_100000210202 [1,0,0,0,0,0|1,0,1]=3 1182 B13R0.2 CCCCCCCCCC(C)OCF 34a_100011218016_100015361967 [1,0,0,0,0,0|2,0,1]=4 1183 B13R0.2 CCCCCCCCCC(C)OCF 7a_100011218016_100015361967 [1,0,0,0,0,0|2,0,1]=4 1184 B13R0.2 CCCCCCCCCN(C)CCC 2230a_100000232482_100000210303 [1,0,0,0,0,0|3,0,0]=4 1185 B13R0.2 CCCCCCCCCN(C)CCC 2230a_100000747261_100011214924 [1,0,0,0,0,0|3,0,0]=4 1186 B13R0.2 CCCCCCCCCN(C)CCC 269982a_100000232482_100000210303 [1,0,0,0,0,0|3,0,0]=4 1187 B13R0.2 CCCCCCCCCN(C)CCC 269982a_100000747261_100000210670 [1,0,0,0,0,0|3,0,0]=4 1188 B13R0.2 CCCCCCCCNC(=O)CCC 11a_100000229939_100000211992 [1,0,0,0,0,0|2,0,0]=3 1189 B13R0.2 CCCCCCCCNC(=O)CCC 1626a_100000229939_100000211992 [1,0,0,0,0,0|2,0,0]=3 1190 B13R0.2 CCCCCCCCNC(=O)CCC 240690a_100000229939_100000211992 [1,0,0,0,0,0|2,0,0]=3 1191 B13R0.2 CCCCCCCCNC(=O)CCC 527a_100000229939_100000211992 [1,0,0,0,0,0|2,0,0]=3 1192 B13R0.2 CCCCCCCCNC(=O)CCO 240690a_100000229939_100011216618 [1,0,0,0,0,0|3,0,0]=4 1193 B13R0.2 CCCCCCCCNC(=O)COC 11a_100000229939_100000210968 [1,0,0,0,0,0|3,0,0]=4 1194 B13R0.2 CCCCCCCCNC(=O)COC 1626a_100000229939_100000210968 [1,0,0,0,0,0|3,0,0]=4 1195 B13R0.2 CCCCCCCCNC(=O)COC 240690a_100000229939_100000210968 [1,0,0,0,0,0|3,0,0]=4 1196 B13R0.2 CCCCCCCCNC(=O)COC 527a_100000229939_100000210968 [1,0,0,0,0,0|3,0,0]=4 1197 B13R0.2 CCCCCCCCNC(=O)CSC 11a_100000229939_100000184570 [1,0,0,0,0,0|3,0,0]=4 1198 B13R0.2 CCCCCCCCNC(=O)CSC 1626a_100000229939_100000184570 [1,0,0,0,0,0|3,0,0]=4 1199 B13R0.2 CCCCCCCCNC(=O)CSC 240690a_100000229939_100000184570 [1,0,0,0,0,0|3,0,0]=4 1200 B13R0.2 CCCCCCCCNC(=O)CSC 527a_100000229939_100000184570 [1,0,0,0,0,0|3,0,0]=4 1201 B13R0.2 CCCCCCCCNC(=O)NCC 2708a_100000229939_100015525214 [1,0,0,0,0,0|2,0,0]=3 1202 B13R0.2 CCCCCCCCNC(=O)NCC 2708a_100015525214_100000229939 [1,0,0,0,0,0|2,0,0]=3 1203 B13R0.2 CCCCCCCCNC(=O)NCC 273464a_100000229939_100015525214 [1,0,0,0,0,0|2,0,0]=3 1204 B13R0.2 CCCCCCCCNC(=O)NCC 273464a_100015525214_100000229939 [1,0,0,0,0,0|2,0,0]=3 1205 B13R0.2 CCCCCCCCNC(=O)NCC 512a_100000229939_100015525214 [1,0,0,0,0,0|2,0,0]=3 1206 B13R0.2 CCCCCCCCNC(=O)NCC 512a_100015525214_100000229939 [1,0,0,0,0,0|2,0,0]=3 1207 B13R0.2 CCCCCCCCNC(=O)NNC 273464a_100000229939_100016993582 [1,0,0,0,0,0|3,0,0]=4 1208 B13R0.2 CCCCCCCCNC(=O)NNC 512a_100000229939_100016993582 [1,0,0,0,0,0|3,0,0]=4 1209 B13R0.2 CCCCCCCCNC(=O)NNC 512a_100016993582_100000229939 [1,0,0,0,0,0|3,0,0]=4 1210 B13R0.2 CCCCCCCNCC(=O)CCC 2230a_100000229938_100000747444 [1,0,0,0,0,0|2,0,0]=3 1211 B13R0.2 CCCCCCCNCC(=O)NCC 2230a_100000229938_100000183381 [1,0,0,0,0,0|2,0,0]=3 1212 B13R0.2 CCCCCCCNCC(=O)NCC 2230a_100016988866_100000210681 [1,0,0,0,0,0|2,0,0]=3 1213 B13R0.2 CCCCCCCNCC(=O)NCO 2230a_100000229938_100000185155 [1,0,0,0,0,0|3,0,0]=4 1214 B13R0.2 CCCCCCCNCC(=O)OCC 2230a_100000229938_100000188475 [1,0,0,0,0,0|1,0,0]=2 1215 B13R0.2 CCCCCCCOCC(=O)CCC 7a_100000210272_100000747444 [1,0,0,0,0,0|2,0,0]=3 1216 B13R0.2 CCCCCCCOCC(=O)NCC 34a_100000210272_100000183381 [1,0,0,0,0,0|2,0,0]=3 1217 B13R0.2 CCCCCCCOCC(=O)NCC 7a_100000210272_100000183381 [1,0,0,0,0,0|2,0,0]=3 1218 B13R0.2 CCCCCCCOCC(=O)NCO 34a_100000210272_100000185155 [1,0,0,0,0,0|3,0,0]=4 1219 B13R0.2 CCCCCCCOCC(=O)NCO 7a_100000210272_100000185155 [1,0,0,0,0,0|3,0,0]=4 1220 B13R0.2 CCCCCCCOCC(=O)OCC 34a_100000210272_100000188475 [1,0,0,0,0,0|1,0,0]=2 1221 B13R0.2 CCCCCCCOCC(=O)OCC 7a_100000210272_100000188475 [1,0,0,0,0,0|1,0,0]=2 1222 B13R0.2 CCCCCCCSCC(=O)CCC 62a_100000210614_100000747444 [1,0,0,0,0,0|2,0,0]=3 1223 B13R0.2 CCCCCCCSCC(=O)CCC 62a_100000747444_100000210316 [1,0,0,0,0,0|2,0,0]=3 1224 B13R0.2 CCCCCCCSCC(=O)NCC 62a_100000183381_100000210316 [1,0,0,0,0,0|2,0,0]=3 1225 B13R0.2 CCCCCCCSCC(=O)NCC 62a_100000210614_100000183381 [1,0,0,0,0,0|2,0,0]=3 1226 B13R0.2 CCCCCCCSCC(=O)NCO 62a_100000185155_100000210316 [1,0,0,0,0,0|3,0,0]=4 1227 B13R0.2 CCCCCCCSCC(=O)NCO 62a_100000210614_100000185155 [1,0,0,0,0,0|3,0,0]=4 1228 B13R0.2 CCCCCCCSCC(=O)OCC 62a_100000188475_100000210316 [1,0,0,0,0,0|1,0,0]=2 1229 B13R0.2 CCCCCCCSCC(=O)OCC 62a_100000210614_100000188475 [1,0,0,0,0,0|1,0,0]=2 1230 B13R0.2 CCCCCCNCCC(=O)NCC 2230a_100000210581_100000737597 [1,0,0,0,0,0|2,0,0]=3 1231 B13R0.2 CCCCCCNCCC(=O)NCC 34a_100025743525_100000210314 [1,0,0,0,0,0|2,0,0]=3 1232 B13R0.2 CCCCCCNCCC(=O)OCC 2230a_100000210581_100011206558 [1,0,0,0,0,0|1,0,0]=2 1233 B13R0.2 CCCCCCNCOC(=O)CCC 2230a_100000210581_100000034017 [1,0,0,0,0,0|3,0,0]=4 1234 B13R0.2 CCCCCCOCCC(=O)NCC 7a_100000210259_100000737597 [1,0,0,0,0,0|2,0,0]=3 1235 B13R0.2 CCCCCCOCCC(=O)OCC 34a_100000210259_100000765890 [1,0,0,0,0,0|1,0,0]=2 1236 B13R0.2 CCCCCCOCCC(=O)OCC 7a_100000210259_100011206558 [1,0,0,0,0,0|1,0,0]=2 1237 B13R0.2 CCCCCCOCOC(=O)CCC 34a_100000210259_100000034017 [1,0,0,0,0,0|3,0,0]=4 1238 B13R0.2 CCCCCCSCCC(=O)NCC 62a_100000210314_100000737597 [1,0,0,0,0,0|2,0,0]=3 1239 B13R0.2 CCCCCCSCCC(=O)NCC 62a_100000737597_100000210757 [1,0,0,0,0,0|2,0,0]=3 1240 B13R0.2 CCCCCCSCCC(=O)OCC 62a_100000210314_100000765890 [1,0,0,0,0,0|1,0,0]=2 1241 B13R0.2 CCCCCCSCCC(=O)OCC 62a_100000765890_100000210757 [1,0,0,0,0,0|1,0,0]=2 1242 B13R0.2 CCCCCCSCOC(=O)CCC 62a_100000210314_100000034017 [1,0,0,0,0,0|3,0,0]=4 1243 B13R0.2 CCCCCCSCOC(=O)OCC 62a_100000210314_100000075025 [1,0,0,0,0,0|2,0,0]=3 1244 B13R0.2 CCCCCNC/C=C/C(=O)OCC 2230a_100000209983_100016267167 [1,0,0,0,0,0|1,0,2]=4 1245 B13R0.2 CCCCCNCCCC(=O)OCC 2230a_100000209983_100009991533 [1,0,0,0,0,0|1,0,0]=2 1246 B13R0.2 CCCCCOC/C=C/C(=O)OCC 34a_100000210253_100016267167 [1,0,0,0,0,0|1,0,2]=4 1247 B13R0.2 CCCCCOC/C=C/C(=O)OCC 7a_100000210253_100016267167 [1,0,0,0,0,0|1,0,2]=4 1248 B13R0.2 CCCCCOCCCC(=O)OCC 34a_100000210253_100009991533 [1,0,0,0,0,0|1,0,0]=2 1249 B13R0.2 CCCCCOCCCC(=O)OCC 7a_100000210253_100011215271 [1,0,0,0,0,0|1,0,0]=2 1250 B13R0.2 CCCCCOCCCC(=O)OCC 7a_100012001163_100000210326 [1,0,0,0,0,0|1,0,0]=2 1251 B13R0.2 CCCCCOCCNC(=O)OCC 34a_100000158857_100000718602 [1,0,0,0,0,0|2,0,0]=3 1252 B13R0.2 CCCCCOCCNC(=O)OCC 7a_100000210253_200011445536 [1,0,0,0,0,0|2,0,0]=3 1253 B13R0.2 CCCCCSC/C=C/C(=O)OCC 62a_100000210326_100016267167 [1,0,0,0,0,0|1,0,2]=4 1254 B13R0.2 CCCCCSC/C=C/C(=O)OCC 62a_100016267167_100000210326 [1,0,0,0,0,0|1,0,2]=4 1255 B13R0.2 CCCCCSCCCC(=O)OCC 62a_100000210326_100009991533 [1,0,0,0,0,0|1,0,0]=2 1256 B13R0.2 CCCCCSCCCC(=O)OCC 62a_100009991533_100000210326 [1,0,0,0,0,0|1,0,0]=2 1257 B13R0.2 CCCCCSCCNC(=O)OCC 62a_100000210326_200011445536 [1,0,0,0,0,0|2,0,0]=3 1258 B13R0.2 CCCCNCCCCC(=O)OCC 2230a_100000102301_100000750268 [1,0,0,0,0,0|1,0,0]=2 1259 B13R0.2 CCCCNCCCCC(=O)OCC 7a_106832991798_100000750268 [1,0,0,0,0,0|1,0,0]=2 1260 B13R0.2 CCCCNCCOCC(=O)OCC 2230a_100000102301_100000088970 [1,0,0,0,0,0|2,0,0]=3 1261 B13R0.2 CCCCNCCOCC(=O)OCC 7a_106832991798_100000088970 [1,0,0,0,0,0|2,0,0]=3 1262 B13R0.2 CCCCOCCCCC(=O)OCC 34a_100000210227_100000750268 [1,0,0,0,0,0|1,0,0]=2 1263 B13R0.2 CCCCOCCCCC(=O)OCC 7a_100000210227_100000750268 [1,0,0,0,0,0|1,0,0]=2 1264 B13R0.2 CCCCOCCCNC(=O)CCC 1626a_200000211371_100000211992 [1,0,0,0,0,0|3,0,0]=4 1265 B13R0.2 CCCCOCCCNC(=O)CCC 240690a_200000211371_100000211992 [1,0,0,0,0,0|3,0,0]=4 1266 B13R0.2 CCCCOCCCNC(=O)CCC 527a_200000211371_100000211992 [1,0,0,0,0,0|3,0,0]=4 1267 B13R0.2 CCCCOCCCNC(=O)NCC 2708a_100015525214_200000211371 [1,0,0,0,0,0|3,0,0]=4 1268 B13R0.2 CCCCOCCCNC(=O)NCC 2708a_200000211371_100015525214 [1,0,0,0,0,0|3,0,0]=4 1269 B13R0.2 CCCCOCCCNC(=O)NCC 273464a_100015525214_200000211371 [1,0,0,0,0,0|3,0,0]=4 1270 B13R0.2 CCCCOCCCNC(=O)NCC 273464a_200000211371_100015525214 [1,0,0,0,0,0|3,0,0]=4 1271 B13R0.2 CCCCOCCCNC(=O)NCC 512a_100015525214_200000211371 [1,0,0,0,0,0|3,0,0]=4 1272 B13R0.2 CCCCOCCCNC(=O)NCC 512a_200000211371_100015525214 [1,0,0,0,0,0|3,0,0]=4 1273 B13R0.2 CCCCOCCNCC(=O)NCC 2230a_100016988866_100000743108 [1,0,0,0,0,0|3,0,0]=4 1274 B13R0.2 CCCCOCCOCC(=O)CCC 1458a_100011216887_100000210303 [1,0,0,0,0,0|3,0,0]=4 1275 B13R0.2 CCCCOCCOCC(=O)CCC 7a_100000210238_100000747444 [1,0,0,0,0,0|3,0,0]=4 1276 B13R0.2 CCCCOCCOCC(=O)NCC 11a_100015525214_100011216887 [1,0,0,0,0,0|3,0,0]=4 1277 B13R0.2 CCCCOCCOCC(=O)NCC 240690a_100015525214_100011216887 [1,0,0,0,0,0|3,0,0]=4 1278 B13R0.2 CCCCOCCOCC(=O)NCC 34a_100000210238_100000183381 [1,0,0,0,0,0|3,0,0]=4 1279 B13R0.2 CCCCOCCOCC(=O)NCC 527a_100015525214_100011216887 [1,0,0,0,0,0|3,0,0]=4 1280 B13R0.2 CCCCOCCOCC(=O)NCC 7a_100000210238_100000183381 [1,0,0,0,0,0|3,0,0]=4 1281 B13R0.2 CCCCOCCOCC(=O)OCC 34a_100000210227_100000088970 [1,0,0,0,0,0|2,0,0]=3 1282 B13R0.2 CCCCOCCOCC(=O)OCC 34a_100000210238_100000188475 [1,0,0,0,0,0|2,0,0]=3 1283 B13R0.2 CCCCOCCOCC(=O)OCC 7a_100000210227_100000088970 [1,0,0,0,0,0|2,0,0]=3 1284 B13R0.2 CCCCOCCOCC(=O)OCC 7a_100000210238_100000188475 [1,0,0,0,0,0|2,0,0]=3 1285 B13R0.2 CCCCOCCSCC(=O)CCC 62a_100000743108_100000747444 [1,0,0,0,0,0|3,0,0]=4 1286 B13R0.2 CCCCOCCSCC(=O)CCC 62a_100000747444_100000743108 [1,0,0,0,0,0|3,0,0]=4 1287 B13R0.2 CCCCOCCSCC(=O)NCC 62a_100000183381_100000743108 [1,0,0,0,0,0|3,0,0]=4 1288 B13R0.2 CCCCOCCSCC(=O)NCC 62a_100000743108_100000183381 [1,0,0,0,0,0|3,0,0]=4 1289 B13R0.2 CCCCOCCSCC(=O)OCC 62a_100000188475_100000743108 [1,0,0,0,0,0|2,0,0]=3 1290 B13R0.2 CCCCOCCSCC(=O)OCC 62a_100000743108_100000188475 [1,0,0,0,0,0|2,0,0]=3 1291 B13R0.2 CCCCOCCSCC(=O)OCC 7a_200000230590_100000210211 [1,0,0,0,0,0|2,0,0]=3 1292 B13R0.2 CCCCOCNCCC(=O)NCC 34a_100025743525_100011995733 [1,0,0,0,0,0|3,0,0]=4 1293 B13R0.2 CCCCOCSCCC(=O)NCC 62a_100000737597_100011995733 [1,0,0,0,0,0|3,0,0]=4 1294 B13R0.2 CCCCOCSCCC(=O)NCC 62a_100011995733_100000737597 [1,0,0,0,0,0|3,0,0]=4 1295 B13R0.2 CCCCOCSCCC(=O)OCC 62a_100000765890_100011995733 [1,0,0,0,0,0|2,0,0]=3 1296 B13R0.2 CCCCOCSCCC(=O)OCC 62a_100011995733_100000765890 [1,0,0,0,0,0|2,0,0]=3 1297 B13R0.2 CCCCOCSCOC(=O)OCC 62a_100011995733_100000075025 [1,0,0,0,0,0|3,0,0]=4 1298 B13R0.2 CCCCSCCCCC(=O)OCC 62a_100000210211_100000750268 [1,0,0,0,0,0|1,0,0]=2 1299 B13R0.2 CCCCSCCCCC(=O)OCC 62a_100000750268_100000210210 [1,0,0,0,0,0|1,0,0]=2 1300 B13R0.2 CCCCSCCNCC(=O)CCC 2230a_100025743550_100000747444 [1,0,0,0,0,0|3,0,0]=4 1301 B13R0.2 CCCCSCCNCC(=O)NCC 2230a_100025743550_100000183381 [1,0,0,0,0,0|3,0,0]=4 1302 B13R0.2 CCCCSCCNCC(=O)OCC 2230a_100025743550_100000188475 [1,0,0,0,0,0|2,0,0]=3 1303 B13R0.2 CCCCSCCOCC(=O)CCC 7a_200000230436_100000747444 [1,0,0,0,0,0|3,0,0]=4 1304 B13R0.2 CCCCSCCOCC(=O)NCC 34a_200000230436_100000183381 [1,0,0,0,0,0|3,0,0]=4 1305 B13R0.2 CCCCSCCOCC(=O)NCC 7a_200000230436_100000183381 [1,0,0,0,0,0|3,0,0]=4 1306 B13R0.2 CCCCSCCOCC(=O)OCC 34a_200000230436_100000188475 [1,0,0,0,0,0|2,0,0]=3 1307 B13R0.2 CCCCSCCOCC(=O)OCC 62a_100000088970_100000210210 [1,0,0,0,0,0|2,0,0]=3 1308 B13R0.2 CCCCSCCOCC(=O)OCC 62a_100000210211_100000088970 [1,0,0,0,0,0|2,0,0]=3 1309 B13R0.2 CCCCSCCOCC(=O)OCC 7a_200000230436_100000188475 [1,0,0,0,0,0|2,0,0]=3 1310 B13R0.2 CCCOCCCCCC(=O)OCC 34a_100000210258_100000755133 [1,0,0,0,0,0|1,0,0]=2 1311 B13R0.2 CCCOCCCCCC(=O)OCC 7a_100011214988_100000210303 [1,0,0,0,0,0|1,0,0]=2 1312 B13R0.2 CCCOCCCNCC(=O)CCC 2230a_100011217757_100000747444 [1,0,0,0,0,0|3,0,0]=4 1313 B13R0.2 CCCOCCCNCC(=O)NCC 2230a_100011217757_100000183381 [1,0,0,0,0,0|3,0,0]=4 1314 B13R0.2 CCCOCCCNCC(=O)NCC 34a_100011217757_100000183381 [1,0,0,0,0,0|3,0,0]=4 1315 B13R0.2 CCCOCCCNCC(=O)OCC 2230a_100011217757_100000188475 [1,0,0,0,0,0|2,0,0]=3 1316 B13R0.2 CCCOCCCNCC(=O)OCC 34a_100011217757_100000188475 [1,0,0,0,0,0|2,0,0]=3 1317 B13R0.2 CCCOCCCOCC(=O)OCC 34a_100000210258_100009893628 [1,0,0,0,0,0|2,0,0]=3 1318 B13R0.2 CCCOCCNCCC(=O)NCC 2230a_100161115042_100000737597 [1,0,0,0,0,0|3,0,0]=4 1319 B13R0.2 CCCOCCNCCC(=O)NCC 34a_100025743525_100011215938 [1,0,0,0,0,0|3,0,0]=4 1320 B13R0.2 CCCOCCNCCC(=O)OCC 2230a_100161115042_100011206558 [1,0,0,0,0,0|2,0,0]=3 1321 B13R0.2 CCCOCCNCCC(=O)OCC 34a_100161115042_100000765890 [1,0,0,0,0,0|2,0,0]=3 1322 B13R0.2 CCCOCCOCCC(=O)NCC 7a_100000752267_100000737597 [1,0,0,0,0,0|3,0,0]=4 1323 B13R0.2 CCCOCCOCCC(=O)OCC 34a_100000752267_100000765890 [1,0,0,0,0,0|2,0,0]=3 1324 B13R0.2 CCCOCCOCCC(=O)OCC 7a_100000752267_100011206558 [1,0,0,0,0,0|2,0,0]=3 1325 B13R0.2 CCCOCCSCCC(=O)NCC 62a_100000737597_100011215938 [1,0,0,0,0,0|3,0,0]=4 1326 B13R0.2 CCCOCCSCCC(=O)NCC 62a_100011215938_100000737597 [1,0,0,0,0,0|3,0,0]=4 1327 B13R0.2 CCCOCCSCCC(=O)OCC 62a_100000765890_100011215938 [1,0,0,0,0,0|2,0,0]=3 1328 B13R0.2 CCCOCCSCCC(=O)OCC 62a_100011215938_100000765890 [1,0,0,0,0,0|2,0,0]=3 1329 B13R0.2 CCCOCCSCOC(=O)OCC 62a_100011215938_100000075025 [1,0,0,0,0,0|3,0,0]=4 1330 B13R0.2 CCCSCCCCCC(=O)OCC 62a_100000210303_100000755133 [1,0,0,0,0,0|1,0,0]=2 1331 B13R0.2 CCCSCCCCCC(=O)OCC 62a_100000755133_100000210303 [1,0,0,0,0,0|1,0,0]=2 1332 B13R0.2 CCCSCCCOCC(=O)OCC 62a_100000210303_100009893628 [1,0,0,0,0,0|2,0,0]=3 1333 B13R0.2 CCCSCCCOCC(=O)OCC 62a_100009893628_100000210303 [1,0,0,0,0,0|2,0,0]=3 1334 B13R0.2 CCCSCCNCCC(=O)NCC 2230a_100020603323_100000737597 [1,0,0,0,0,0|3,0,0]=4 1335 B13R0.2 CCCSCCNCCC(=O)OCC 2230a_100020603323_100011206558 [1,0,0,0,0,0|2,0,0]=3 1336 B13R0.2 CCCSCCOCCC(=O)NCC 7a_200000230433_100000737597 [1,0,0,0,0,0|3,0,0]=4 1337 B13R0.2 CCCSCCOCCC(=O)OCC 34a_200000230433_100000765890 [1,0,0,0,0,0|2,0,0]=3 1338 B13R0.2 CCCSCCOCCC(=O)OCC 7a_200000230433_100011206558 [1,0,0,0,0,0|2,0,0]=3 1339 B13R0.2 CCNC(=O)CCCCCCCCO 240690a_100015525214_100000015970 [1,0,0,0,0,0|2,0,0]=3 1340 B13R0.2 CCNC(=O)CCNCCCCCF 34a_100025743525_100000729378 [1,0,0,0,0,0|3,0,0]=4 1341 B13R0.2 CCNC(=O)CCNCCCCCO 2230a_100000762737_100000737597 [1,0,0,0,0,0|3,0,0]=4 1342 B13R0.2 CCNC(=O)CCNCCCCCO 34a_100025743525_100000746330 [1,0,0,0,0,0|3,0,0]=4 1343 B13R0.2 CCNC(=O)CCNCCCCOC 34a_100025743525_100000755781 [1,0,0,0,0,0|3,0,0]=4 1344 B13R0.2 CCNC(=O)CCNCCCOCC 2230a_100000210961_100000737597 [1,0,0,0,0,0|3,0,0]=4 1345 B13R0.2 CCNC(=O)CCNCCCOCC 34a_100025743525_100012232248 [1,0,0,0,0,0|3,0,0]=4 1346 B13R0.2 CCNC(=O)CCOCCCCCBr 7a_100000746331_100000737597 [1,0,0,0,0,0|3,0,0]=4 1347 B13R0.2 CCNC(=O)CCOCCCCCCl 7a_100000746330_100000737597 [1,0,0,0,0,0|3,0,0]=4 1348 B13R0.2 CCNC(=O)CCOCCCCCI 7a_200012148887_100000737597 [1,0,0,0,0,0|3,0,0]=4 1349 B13R0.2 CCNC(=O)CCOCCCCSC 7a_100011217163_100000737597 [1,0,0,0,0,0|3,0,0]=4 1350 B13R0.2 CCNC(=O)CCOCCCOCC 7a_100000757476_100000737597 [1,0,0,0,0,0|3,0,0]=4 1351 B13R0.2 CCNC(=O)CCOCCCSCC 7a_100011216438_100000737597 [1,0,0,0,0,0|3,0,0]=4 1352 B13R0.2 CCNC(=O)CCSCCCCCF 62a_100000729378_100000737597 [1,0,0,0,0,0|3,0,0]=4 1353 B13R0.2 CCNC(=O)CCSCCCCCF 62a_100000737597_100000729378 [1,0,0,0,0,0|3,0,0]=4 1354 B13R0.2 CCNC(=O)CCSCCCCCO 62a_100000737597_100000746330 [1,0,0,0,0,0|3,0,0]=4 1355 B13R0.2 CCNC(=O)CCSCCCCCO 62a_100000746330_100000737597 [1,0,0,0,0,0|3,0,0]=4 1356 B13R0.2 CCNC(=O)CCSCCCCOC 62a_100000730899_100000737597 [1,0,0,0,0,0|3,0,0]=4 1357 B13R0.2 CCNC(=O)CCSCCCCOC 62a_100000737597_100000730899 [1,0,0,0,0,0|3,0,0]=4 1358 B13R0.2 CCNC(=O)CCSCCCOCC 62a_100000737597_100012232248 [1,0,0,0,0,0|3,0,0]=4 1359 B13R0.2 CCNC(=O)CCSCCCOCC 62a_100012232248_100000737597 [1,0,0,0,0,0|3,0,0]=4 1360 B13R0.2 CCNC(=O)CNCCCCCCF 2230a_100016988866_100015922095 [1,0,0,0,0,0|3,0,0]=4 1361 B13R0.2 CCNC(=O)CNCCCCCCO 2230a_100000686447_100000183381 [1,0,0,0,0,0|3,0,0]=4 1362 B13R0.2 CCNC(=O)CNCCCCCCO 2230a_100016988866_100000766143 [1,0,0,0,0,0|3,0,0]=4 1363 B13R0.2 CCNC(=O)CNCCCCCCO 34a_100000686447_100000183381 [1,0,0,0,0,0|3,0,0]=4 1364 B13R0.2 CCNC(=O)CNCCCCCOC 2230a_100000747528_100000183381 [1,0,0,0,0,0|3,0,0]=4 1365 B13R0.2 CCNC(=O)CNCCCCCOC 34a_100000747528_100000183381 [1,0,0,0,0,0|3,0,0]=4 1366 B13R0.2 CCNC(=O)COCCCCCCBr 34a_100011215345_100000183381 [1,0,0,0,0,0|3,0,0]=4 1367 B13R0.2 CCNC(=O)COCCCCCCBr 7a_100011215345_100000183381 [1,0,0,0,0,0|3,0,0]=4 1368 B13R0.2 CCNC(=O)COCCCCCCCl 34a_100000766143_100000183381 [1,0,0,0,0,0|3,0,0]=4 1369 B13R0.2 CCNC(=O)COCCCCCCCl 7a_100000766143_100000183381 [1,0,0,0,0,0|3,0,0]=4 1370 B13R0.2 CCNC(=O)COCCCCCCF 34a_100000732779_100000183381 [1,0,0,0,0,0|3,0,0]=4 1371 B13R0.2 CCNC(=O)COCCCCCCF 7a_100000732779_100000183381 [1,0,0,0,0,0|3,0,0]=4 1372 B13R0.2 CCNC(=O)COCCCCCCN 34a_100000686447_100000183381 [1,0,0,0,0,0|3,0,0]=4 1373 B13R0.2 CCNC(=O)COCCCCCNC 34a_100000722520_100000183381 [1,0,0,0,0,0|3,0,0]=4 1374 B13R0.2 CCNC(=O)CSCCCCCCF 62a_100000183381_100015922095 [1,0,0,0,0,0|3,0,0]=4 1375 B13R0.2 CCNC(=O)CSCCCCCCF 62a_100015922095_100000183381 [1,0,0,0,0,0|3,0,0]=4 1376 B13R0.2 CCNC(=O)CSCCCCCCO 62a_100000183381_100000766143 [1,0,0,0,0,0|3,0,0]=4 1377 B13R0.2 CCNC(=O)CSCCCCCCO 62a_100000766143_100000183381 [1,0,0,0,0,0|3,0,0]=4 1378 B13R0.2 CCNC(=O)NCCCCCCCO 2708a_100011996573_100015525214 [1,0,0,0,0,0|3,0,0]=4 1379 B13R0.2 CCNC(=O)NCCCCCCCO 2708a_100015525214_100011996573 [1,0,0,0,0,0|3,0,0]=4 1380 B13R0.2 CCNC(=O)NCCCCCCCO 273464a_100011996573_100015525214 [1,0,0,0,0,0|3,0,0]=4 1381 B13R0.2 CCNC(=O)NCCCCCCCO 273464a_100015525214_100011996573 [1,0,0,0,0,0|3,0,0]=4 1382 B13R0.2 CCNC(=O)NCCCCCCCO 512a_100011996573_100015525214 [1,0,0,0,0,0|3,0,0]=4 1383 B13R0.2 CCNC(=O)NCCCCCCCO 512a_100015525214_100011996573 [1,0,0,0,0,0|3,0,0]=4 1384 B13R0.2 CCNCCCCCCC(=O)OCC 2230a_100015525214_100009814379 [1,0,0,0,0,0|1,0,0]=2 1385 B13R0.2 CCNN=CCCCCC(=O)OCC 4a_100000756455_100012182868 [1,0,0,0,0,0|2,0,1]=4 1386 B13R0.2 CCOC(=O)CCCCCCCNC 2230a_106832991635_100009991516 [1,0,0,0,0,0|1,0,0]=2 1387 B13R0.2 CCOC(=O)CCCCCCCNC 34a_100102657272_100009991516 [1,0,0,0,0,0|1,0,0]=2 1388 B13R0.2 CCOC(=O)CCCCCCCNC 7a_106832991635_100009991516 [1,0,0,0,0,0|1,0,0]=2 1389 B13R0.2 CCOC(=O)CCCCCCCOC 34a_100138415774_100009991516 [1,0,0,0,0,0|1,0,0]=2 1390 B13R0.2 CCOC(=O)CCCCCCCSC 62a_200000210301_100009991516 [1,0,0,0,0,0|1,0,0]=2 1391 B13R0.2 CCOC(=O)CCCCCCCS[13CH3] 62a_200025704644_100009991516 [1,0,0,0,0,0|1,0,0]=2 1392 B13R0.2 CCOC(=O)CCCCCCSCC 62a_100000210202_100009814379 [1,0,0,0,0,0|1,0,0]=2 1393 B13R0.2 CCOC(=O)CCCCCCSCF 62a_100015361967_100009814379 [1,0,0,0,0,0|2,0,0]=3 1394 B13R0.2 CCOC(=O)CCCCCNCCF 34a_100000724931_100000755133 [1,0,0,0,0,0|2,0,0]=3 1395 B13R0.2 CCOC(=O)CCCCCNCCO 2230a_100016997473_100000755133 [1,0,0,0,0,0|2,0,0]=3 1396 B13R0.2 CCOC(=O)CCCCCNCCO 34a_100016990907_100000755133 [1,0,0,0,0,0|2,0,0]=3 1397 B13R0.2 CCOC(=O)CCCCCOCC#N 7a_100011214988_100011215382 [1,0,0,0,0,0|2,0,1]=4 1398 B13R0.2 CCOC(=O)CCCCCOCC=O 7a_100011214988_200015260668 [1,0,0,0,0,0|2,0,1]=4 1399 B13R0.2 CCOC(=O)CCCCCOCCBr 34a_100000211926_100000755133 [1,0,0,0,0,0|2,0,0]=3 1400 B13R0.2 CCOC(=O)CCCCCOCCF 7a_100011214988_100011217306 [1,0,0,0,0,0|2,0,0]=3 1401 B13R0.2 CCOC(=O)CCCCCOCCN 34a_100000210304_100000755133 [1,0,0,0,0,0|2,0,0]=3 1402 B13R0.2 CCOC(=O)CCCCCOCCO 7a_100011214988_100000211926 [1,0,0,0,0,0|2,0,0]=3 1403 B13R0.2 CCOC(=O)CCCCCSCC#N 62a_100000755133_100011215382 [1,0,0,0,0,0|2,0,1]=4 1404 B13R0.2 CCOC(=O)CCCCCSCC#N 62a_100011215382_100000755133 [1,0,0,0,0,0|2,0,1]=4 1405 B13R0.2 CCOC(=O)CCCCCSCC=O 62a_100000755133_200015260668 [1,0,0,0,0,0|2,0,1]=4 1406 B13R0.2 CCOC(=O)CCCCCSCC=O 62a_200015260668_100000755133 [1,0,0,0,0,0|2,0,1]=4 1407 B13R0.2 CCOC(=O)CCCCCSCCF 62a_100000755133_100011217306 [1,0,0,0,0,0|2,0,0]=3 1408 B13R0.2 CCOC(=O)CCCCCSCCF 62a_100011217306_100000755133 [1,0,0,0,0,0|2,0,0]=3 1409 B13R0.2 CCOC(=O)CCCCCSCCO 62a_100000211926_100000755133 [1,0,0,0,0,0|2,0,0]=3 1410 B13R0.2 CCOC(=O)CCCCCSCCO 62a_100000755133_100000211926 [1,0,0,0,0,0|2,0,0]=3 1411 B13R0.2 CCOC(=O)CCCCCSCOC 62a_100000755133_100000766300 [1,0,0,0,0,0|2,0,0]=3 1412 B13R0.2 CCOC(=O)CCCCCSCOC 62a_100000766300_100000755133 [1,0,0,0,0,0|2,0,0]=3 1413 B13R0.2 CCOC(=O)CCCCCSCSC 62a_100000755133_100011218213 [1,0,0,0,0,0|2,0,0]=3 1414 B13R0.2 CCOC(=O)CCCCCSCSC 62a_100011218213_100000755133 [1,0,0,0,0,0|2,0,0]=3 1415 B13R0.2 CCOC(=O)CCCCNCCCF 2230a_100015189416_100000750268 [1,0,0,0,0,0|2,0,0]=3 1416 B13R0.2 CCOC(=O)CCCCNCCCF 34a_100015189416_100000750268 [1,0,0,0,0,0|2,0,0]=3 1417 B13R0.2 CCOC(=O)CCCCNCCOC 2230a_100000209980_100000750268 [1,0,0,0,0,0|2,0,0]=3 1418 B13R0.2 CCOC(=O)CCCCNCCSC 2230a_100020590264_100000750268 [1,0,0,0,0,0|2,0,0]=3 1419 B13R0.2 CCOC(=O)CCCCOCCCBr 34a_100011217188_100000750268 [1,0,0,0,0,0|2,0,0]=3 1420 B13R0.2 CCOC(=O)CCCCOCCCCl 34a_100000230001_100000750268 [1,0,0,0,0,0|2,0,0]=3 1421 B13R0.2 CCOC(=O)CCCCOCCCF 34a_100000759539_100000750268 [1,0,0,0,0,0|2,0,0]=3 1422 B13R0.2 CCOC(=O)CCCCOCCCN 34a_100000182051_100000750268 [1,0,0,0,0,0|2,0,0]=3 1423 B13R0.2 CCOC(=O)CCCCOCCOC 34a_100000210237_100000750268 [1,0,0,0,0,0|2,0,0]=3 1424 B13R0.2 CCOC(=O)CCCCOCCON 34a_100000700252_100000750268 [1,0,0,0,0,0|3,0,0]=4 1425 B13R0.2 CCOC(=O)CCCCOCCSC 34a_100000230434_100000750268 [1,0,0,0,0,0|2,0,0]=3 1426 B13R0.2 CCOC(=O)CCCCOCCSC 7a_100000230434_100000750268 [1,0,0,0,0,0|2,0,0]=3 1427 B13R0.2 CCOC(=O)CCCCSCCC#N 62a_100000750268_100011215226 [1,0,0,0,0,0|2,0,1]=4 1428 B13R0.2 CCOC(=O)CCCCSCCC#N 62a_100011215226_100000750268 [1,0,0,0,0,0|2,0,1]=4 1429 B13R0.2 CCOC(=O)CCCCSCCCF 62a_100000750268_100011934791 [1,0,0,0,0,0|2,0,0]=3 1430 B13R0.2 CCOC(=O)CCCCSCCCF 62a_100011934791_100000750268 [1,0,0,0,0,0|2,0,0]=3 1431 B13R0.2 CCOC(=O)CCCCSCCCO 62a_100000750268_100011215043 [1,0,0,0,0,0|2,0,0]=3 1432 B13R0.2 CCOC(=O)CCCCSCCCO 62a_100011215043_100000750268 [1,0,0,0,0,0|2,0,0]=3 1433 B13R0.2 CCOC(=O)CCCCSCCOC 62a_100000233755_100000750268 [1,0,0,0,0,0|2,0,0]=3 1434 B13R0.2 CCOC(=O)CCCCSCCOC 62a_100000750268_100000233755 [1,0,0,0,0,0|2,0,0]=3 1435 B13R0.2 CCOC(=O)CCCCSCCSC 62a_100000212216_100000750268 [1,0,0,0,0,0|2,0,0]=3 1436 B13R0.2 CCOC(=O)CCCCSCCSC 62a_100000750268_100000751147 [1,0,0,0,0,0|2,0,0]=3 1437 B13R0.2 CCOC(=O)CCCNCCCCO 2230a_100000750430_100009991533 [1,0,0,0,0,0|2,0,0]=3 1438 B13R0.2 CCOC(=O)CCCNCCCCO 34a_100000750430_100009991533 [1,0,0,0,0,0|2,0,0]=3 1439 B13R0.2 CCOC(=O)CCCNCCCOC 34a_100150723488_100009991533 [1,0,0,0,0,0|2,0,0]=3 1440 B13R0.2 CCOC(=O)CCCNCCCSC 2230a_100000749238_100009991533 [1,0,0,0,0,0|2,0,0]=3 1441 B13R0.2 CCOC(=O)CCCNCCSCC 2230a_100000106463_100009991533 [1,0,0,0,0,0|2,0,0]=3 1442 B13R0.2 CCOC(=O)CCCOCCCC#N 7a_100012001163_100000687738 [1,0,0,0,0,0|2,0,1]=4 1443 B13R0.2 CCOC(=O)CCCOCCCC=O 7a_100012001163_200011292268 [1,0,0,0,0,0|2,0,1]=4 1444 B13R0.2 CCOC(=O)CCCOCCCCBr 34a_100011216708_100009991533 [1,0,0,0,0,0|2,0,0]=3 1445 B13R0.2 CCOC(=O)CCCOCCCCCl 34a_100000210776_100009991533 [1,0,0,0,0,0|2,0,0]=3 1446 B13R0.2 CCOC(=O)CCCOCCCCCl 7a_100000210776_100011215271 [1,0,0,0,0,0|2,0,0]=3 1447 B13R0.2 CCOC(=O)CCCOCCCCF 34a_100011995726_100009991533 [1,0,0,0,0,0|2,0,0]=3 1448 B13R0.2 CCOC(=O)CCCOCCCCF 7a_100011995726_100011215271 [1,0,0,0,0,0|2,0,0]=3 1449 B13R0.2 CCOC(=O)CCCOCCCCF 7a_100012001163_100000729493 [1,0,0,0,0,0|2,0,0]=3 1450 B13R0.2 CCOC(=O)CCCOCCCCI 34a_200012148704_100009991533 [1,0,0,0,0,0|2,0,0]=3 1451 B13R0.2 CCOC(=O)CCCOCCCCN 34a_100000750430_100009991533 [1,0,0,0,0,0|2,0,0]=3 1452 B13R0.2 CCOC(=O)CCCOCCCCO 7a_100012001163_100000210776 [1,0,0,0,0,0|2,0,0]=3 1453 B13R0.2 CCOC(=O)CCCOCCCNC 34a_100000213112_100009991533 [1,0,0,0,0,0|2,0,0]=3 1454 B13R0.2 CCOC(=O)CCCOCCCOC 34a_100000740835_100009991533 [1,0,0,0,0,0|2,0,0]=3 1455 B13R0.2 CCOC(=O)CCCOCCCOC 7a_100012001163_100000740836 [1,0,0,0,0,0|2,0,0]=3 1456 B13R0.2 CCOC(=O)CCCOCCCSC 34a_100000690336_100009991533 [1,0,0,0,0,0|2,0,0]=3 1457 B13R0.2 CCOC(=O)CCCOCCCSC 7a_100000690336_100011215271 [1,0,0,0,0,0|2,0,0]=3 1458 B13R0.2 CCOC(=O)CCCOCCSCC 34a_100000212035_100009991533 [1,0,0,0,0,0|2,0,0]=3 1459 B13R0.2 CCOC(=O)CCCOCCSCC 7a_100000212035_100011215271 [1,0,0,0,0,0|2,0,0]=3 1460 B13R0.2 CCOC(=O)CCCOCCSCC 7a_100012001163_100000757381 [1,0,0,0,0,0|2,0,0]=3 1461 B13R0.2 CCOC(=O)CCCSCCCC#N 62a_100000687738_100009991533 [1,0,0,0,0,0|2,0,1]=4 1462 B13R0.2 CCOC(=O)CCCSCCCC#N 62a_100009991533_100000687738 [1,0,0,0,0,0|2,0,1]=4 1463 B13R0.2 CCOC(=O)CCCSCCCC=O 62a_100009991533_200011292268 [1,0,0,0,0,0|2,0,1]=4 1464 B13R0.2 CCOC(=O)CCCSCCCC=O 62a_200011292268_100009991533 [1,0,0,0,0,0|2,0,1]=4 1465 B13R0.2 CCOC(=O)CCCSCCCCF 62a_100000729493_100009991533 [1,0,0,0,0,0|2,0,0]=3 1466 B13R0.2 CCOC(=O)CCCSCCCCF 62a_100009991533_100000729493 [1,0,0,0,0,0|2,0,0]=3 1467 B13R0.2 CCOC(=O)CCCSCCCCO 62a_100000210776_100009991533 [1,0,0,0,0,0|2,0,0]=3 1468 B13R0.2 CCOC(=O)CCCSCCCCO 62a_100009991533_100000210776 [1,0,0,0,0,0|2,0,0]=3 1469 B13R0.2 CCOC(=O)CCCSCCCOC 62a_100000709357_100009991533 [1,0,0,0,0,0|2,0,0]=3 1470 B13R0.2 CCOC(=O)CCCSCCCOC 62a_100009991533_100000709357 [1,0,0,0,0,0|2,0,0]=3 1471 B13R0.2 CCOC(=O)CCCSCCSCC 62a_100000757381_100009991533 [1,0,0,0,0,0|2,0,0]=3 1472 B13R0.2 CCOC(=O)CCCSCCSCC 62a_100009991533_100000757381 [1,0,0,0,0,0|2,0,0]=3 1473 B13R0.2 CCOC(=O)CCNCCCCCO 2230a_100000762737_100011206558 [1,0,0,0,0,0|2,0,0]=3 1474 B13R0.2 CCOC(=O)CCNCCCCCO 34a_100000762737_100000765890 [1,0,0,0,0,0|2,0,0]=3 1475 B13R0.2 CCOC(=O)CCNCCOCCO 2230a_100000211614_100011206558 [1,0,0,0,0,0|3,0,0]=4 1476 B13R0.2 CCOC(=O)CCNCCOCCO 34a_100000211614_100000765890 [1,0,0,0,0,0|3,0,0]=4 1477 B13R0.2 CCOC(=O)CCNCCSCCO 2230a_100011219999_100011206558 [1,0,0,0,0,0|3,0,0]=4 1478 B13R0.2 CCOC(=O)CCOCCCCCBr 34a_100000746331_100000765890 [1,0,0,0,0,0|2,0,0]=3 1479 B13R0.2 CCOC(=O)CCOCCCCCBr 7a_100000746331_100011206558 [1,0,0,0,0,0|2,0,0]=3 1480 B13R0.2 CCOC(=O)CCOCCCCCCl 34a_100000746330_100000765890 [1,0,0,0,0,0|2,0,0]=3 1481 B13R0.2 CCOC(=O)CCOCCCCCCl 7a_100000746330_100011206558 [1,0,0,0,0,0|2,0,0]=3 1482 B13R0.2 CCOC(=O)CCOCCCCCI 34a_200012148887_100000765890 [1,0,0,0,0,0|2,0,0]=3 1483 B13R0.2 CCOC(=O)CCOCCCCCI 7a_200012148887_100011206558 [1,0,0,0,0,0|2,0,0]=3 1484 B13R0.2 CCOC(=O)CCOCCCCCN 34a_100000762737_100000765890 [1,0,0,0,0,0|2,0,0]=3 1485 B13R0.2 CCOC(=O)CCOCCCCOC 34a_100000740925_100000765890 [1,0,0,0,0,0|2,0,0]=3 1486 B13R0.2 CCOC(=O)CCOCCCCSC 34a_100011217163_100000765890 [1,0,0,0,0,0|2,0,0]=3 1487 B13R0.2 CCOC(=O)CCOCCCCSC 7a_100011217163_100011206558 [1,0,0,0,0,0|2,0,0]=3 1488 B13R0.2 CCOC(=O)CCOCCCSCC 34a_100011216438_100000765890 [1,0,0,0,0,0|2,0,0]=3 1489 B13R0.2 CCOC(=O)CCOCCCSCC 7a_100011216438_100011206558 [1,0,0,0,0,0|2,0,0]=3 1490 B13R0.2 CCOC(=O)CCOCCOCCBr 34a_100000692535_100000765890 [1,0,0,0,0,0|3,0,0]=4 1491 B13R0.2 CCOC(=O)CCOCCOCCBr 7a_100000692535_100011206558 [1,0,0,0,0,0|3,0,0]=4 1492 B13R0.2 CCOC(=O)CCOCCOCCCl 34a_100011215305_100000765890 [1,0,0,0,0,0|3,0,0]=4 1493 B13R0.2 CCOC(=O)CCOCCOCCCl 7a_100011215305_100011206558 [1,0,0,0,0,0|3,0,0]=4 1494 B13R0.2 CCOC(=O)CCOCCOCCF 34a_200015357709_100000765890 [1,0,0,0,0,0|3,0,0]=4 1495 B13R0.2 CCOC(=O)CCOCCOCCF 7a_200015357709_100011206558 [1,0,0,0,0,0|3,0,0]=4 1496 B13R0.2 CCOC(=O)CCOCCOCCI 34a_100012149058_100000765890 [1,0,0,0,0,0|3,0,0]=4 1497 B13R0.2 CCOC(=O)CCOCCOCCI 7a_100012149058_100011206558 [1,0,0,0,0,0|3,0,0]=4 1498 B13R0.2 CCOC(=O)CCOCCOCCN 34a_100000211614_100000765890 [1,0,0,0,0,0|3,0,0]=4 1499 B13R0.2 CCOC(=O)CCSCCCCC#N 62a_100000765890_100000211819 [1,0,0,0,0,0|2,0,1]=4 1500 B13R0.2 CCOC(=O)CCSCCCCC#N 62a_100011219923_100000765890 [1,0,0,0,0,0|2,0,1]=4 1501 B13R0.2 CCOC(=O)CCSCCCCC=O 62a_100000139335_100000765890 [1,0,0,0,0,0|2,0,1]=4 1502 B13R0.2 CCOC(=O)CCSCCCCC=O 62a_100000765890_100000139335 [1,0,0,0,0,0|2,0,1]=4 1503 B13R0.2 CCOC(=O)CCSCCCCCF 62a_100000729378_100000765890 [1,0,0,0,0,0|2,0,0]=3 1504 B13R0.2 CCOC(=O)CCSCCCCCF 62a_100000765890_100000729378 [1,0,0,0,0,0|2,0,0]=3 1505 B13R0.2 CCOC(=O)CCSCCCCCO 62a_100000746330_100000765890 [1,0,0,0,0,0|2,0,0]=3 1506 B13R0.2 CCOC(=O)CCSCCCCCO 62a_100000765890_100000746330 [1,0,0,0,0,0|2,0,0]=3 1507 B13R0.2 CCOC(=O)CCSCCCCOC 62a_100000730899_100000765890 [1,0,0,0,0,0|2,0,0]=3 1508 B13R0.2 CCOC(=O)CCSCCCCOC 62a_100000765890_100000730899 [1,0,0,0,0,0|2,0,0]=3 1509 B13R0.2 CCOC(=O)CCSCCOCCO 62a_100000765890_100011215305 [1,0,0,0,0,0|3,0,0]=4 1510 B13R0.2 CCOC(=O)CCSCCOCCO 62a_100011215305_100000765890 [1,0,0,0,0,0|3,0,0]=4 1511 B13R0.2 CCOC(=O)CCSCOCCOC 62a_100000231047_100000765890 [1,0,0,0,0,0|3,0,0]=4 1512 B13R0.2 CCOC(=O)CCSCOCCOC 62a_100000765890_100000231047 [1,0,0,0,0,0|3,0,0]=4 1513 B13R0.2 CCOC(=O)CNCCCCCCO 2230a_100000686447_100000188475 [1,0,0,0,0,0|2,0,0]=3 1514 B13R0.2 CCOC(=O)CNCCCCCCO 34a_100000686447_100000188475 [1,0,0,0,0,0|2,0,0]=3 1515 B13R0.2 CCOC(=O)CNCCCCCOC 2230a_100000747528_100000188475 [1,0,0,0,0,0|2,0,0]=3 1516 B13R0.2 CCOC(=O)CNCCCCCOC 34a_100000747528_100000188475 [1,0,0,0,0,0|2,0,0]=3 1517 B13R0.2 CCOC(=O)CNCCOCCOC 2230a_100000745349_100000188475 [1,0,0,0,0,0|3,0,0]=4 1518 B13R0.2 CCOC(=O)CNCCOCCOC 34a_100000745349_100000188475 [1,0,0,0,0,0|3,0,0]=4 1519 B13R0.2 CCOC(=O)COCCCCCCBr 34a_100011215345_100000188475 [1,0,0,0,0,0|2,0,0]=3 1520 B13R0.2 CCOC(=O)COCCCCCCBr 7a_100011215345_100000188475 [1,0,0,0,0,0|2,0,0]=3 1521 B13R0.2 CCOC(=O)COCCCCCCCl 34a_100000766143_100000188475 [1,0,0,0,0,0|2,0,0]=3 1522 B13R0.2 CCOC(=O)COCCCCCCCl 7a_100000766143_100000188475 [1,0,0,0,0,0|2,0,0]=3 1523 B13R0.2 CCOC(=O)COCCCCCCF 34a_100000732779_100000188475 [1,0,0,0,0,0|2,0,0]=3 1524 B13R0.2 CCOC(=O)COCCCCCCF 7a_100000732779_100000188475 [1,0,0,0,0,0|2,0,0]=3 1525 B13R0.2 CCOC(=O)COCCCCCCN 34a_100000686447_100000188475 [1,0,0,0,0,0|2,0,0]=3 1526 B13R0.2 CCOC(=O)COCCCCCNC 34a_100000722520_100000188475 [1,0,0,0,0,0|2,0,0]=3 1527 B13R0.2 CCOC(=O)COCCCNCCF 34a_100000724931_100009893628 [1,0,0,0,0,0|3,0,0]=4 1528 B13R0.2 CCOC(=O)COCCCNCCO 2230a_100016997473_100009893628 [1,0,0,0,0,0|3,0,0]=4 1529 B13R0.2 CCOC(=O)COCCCNCCO 34a_100016990907_100009893628 [1,0,0,0,0,0|3,0,0]=4 1530 B13R0.2 CCOC(=O)COCCCOCCBr 34a_100000211926_100009893628 [1,0,0,0,0,0|3,0,0]=4 1531 B13R0.2 CCOC(=O)COCCCOCCN 34a_100000210304_100009893628 [1,0,0,0,0,0|3,0,0]=4 1532 B13R0.2 CCOC(=O)COCCCSCCF 62a_100009893628_100011217306 [1,0,0,0,0,0|3,0,0]=4 1533 B13R0.2 CCOC(=O)COCCCSCCF 62a_100011217306_100009893628 [1,0,0,0,0,0|3,0,0]=4 1534 B13R0.2 CCOC(=O)COCCCSCCO 62a_100000211926_100009893628 [1,0,0,0,0,0|3,0,0]=4 1535 B13R0.2 CCOC(=O)COCCCSCCO 62a_100009893628_100000211926 [1,0,0,0,0,0|3,0,0]=4 1536 B13R0.2 CCOC(=O)COCCCSCOC 62a_100000766300_100009893628 [1,0,0,0,0,0|3,0,0]=4 1537 B13R0.2 CCOC(=O)COCCCSCOC 62a_100009893628_100000766300 [1,0,0,0,0,0|3,0,0]=4 1538 B13R0.2 CCOC(=O)COCCCSCSC 62a_100009893628_100011218213 [1,0,0,0,0,0|3,0,0]=4 1539 B13R0.2 CCOC(=O)COCCCSCSC 62a_100011218213_100009893628 [1,0,0,0,0,0|3,0,0]=4 1540 B13R0.2 CCOC(=O)COCCNCCCF 2230a_100015189416_100000088970 [1,0,0,0,0,0|3,0,0]=4 1541 B13R0.2 CCOC(=O)COCCNCCCF 34a_100015189416_100000088970 [1,0,0,0,0,0|3,0,0]=4 1542 B13R0.2 CCOC(=O)COCCNCCOC 2230a_100000209980_100000088970 [1,0,0,0,0,0|3,0,0]=4 1543 B13R0.2 CCOC(=O)COCCNCCSC 2230a_100020590264_100000088970 [1,0,0,0,0,0|3,0,0]=4 1544 B13R0.2 CCOC(=O)COCCOCCCBr 34a_100011217188_100000088970 [1,0,0,0,0,0|3,0,0]=4 1545 B13R0.2 CCOC(=O)COCCOCCCCl 34a_100000230001_100000088970 [1,0,0,0,0,0|3,0,0]=4 1546 B13R0.2 CCOC(=O)COCCOCCCF 34a_100000759539_100000088970 [1,0,0,0,0,0|3,0,0]=4 1547 B13R0.2 CCOC(=O)COCCOCCCN 34a_100000182051_100000088970 [1,0,0,0,0,0|3,0,0]=4 1548 B13R0.2 CCOC(=O)COCCOCCNC 34a_100000228057_100000188475 [1,0,0,0,0,0|3,0,0]=4 1549 B13R0.2 CCOC(=O)COCCOCCOC 34a_100000210237_100000088970 [1,0,0,0,0,0|3,0,0]=4 1550 B13R0.2 CCOC(=O)COCCOCCOC 34a_100011215163_100000188475 [1,0,0,0,0,0|3,0,0]=4 1551 B13R0.2 CCOC(=O)COCCOCCOC 7a_100011215163_100000188475 [1,0,0,0,0,0|3,0,0]=4 1552 B13R0.2 CCOC(=O)COCCOCCSC 34a_100000230434_100000088970 [1,0,0,0,0,0|3,0,0]=4 1553 B13R0.2 CCOC(=O)COCCOCCSC 7a_100000230434_100000088970 [1,0,0,0,0,0|3,0,0]=4 1554 B13R0.2 CCOC(=O)COCCSCCCF 62a_100000088970_100011934791 [1,0,0,0,0,0|3,0,0]=4 1555 B13R0.2 CCOC(=O)COCCSCCCF 62a_100011934791_100000088970 [1,0,0,0,0,0|3,0,0]=4 1556 B13R0.2 CCOC(=O)COCCSCCCO 62a_100000088970_100011215043 [1,0,0,0,0,0|3,0,0]=4 1557 B13R0.2 CCOC(=O)COCCSCCCO 62a_100011215043_100000088970 [1,0,0,0,0,0|3,0,0]=4 1558 B13R0.2 CCOC(=O)COCCSCCOC 62a_100000088970_100000233755 [1,0,0,0,0,0|3,0,0]=4 1559 B13R0.2 CCOC(=O)COCCSCCOC 62a_100000233755_100000088970 [1,0,0,0,0,0|3,0,0]=4 1560 B13R0.2 CCOC(=O)COCCSCCSC 62a_100000088970_100000751147 [1,0,0,0,0,0|3,0,0]=4 1561 B13R0.2 CCOC(=O)COCCSCCSC 62a_100000212216_100000088970 [1,0,0,0,0,0|3,0,0]=4 1562 B13R0.2 CCOC(=O)CSCCCCCC#N 62a_100000188475_100009813376 [1,0,0,0,0,0|2,0,1]=4 1563 B13R0.2 CCOC(=O)CSCCCCCC#N 62a_100009813376_100000188475 [1,0,0,0,0,0|2,0,1]=4 1564 B13R0.2 CCOC(=O)CSCCCCCC=O 62a_100000139337_100000188475 [1,0,0,0,0,0|2,0,1]=4 1565 B13R0.2 CCOC(=O)CSCCCCCC=O 62a_100000188475_100000139337 [1,0,0,0,0,0|2,0,1]=4 1566 B13R0.2 CCOC(=O)CSCCCCCCF 62a_100000188475_100015922095 [1,0,0,0,0,0|2,0,0]=3 1567 B13R0.2 CCOC(=O)CSCCCCCCF 62a_100015922095_100000188475 [1,0,0,0,0,0|2,0,0]=3 1568 B13R0.2 CCOC(=O)CSCCCCCCO 62a_100000188475_100000766143 [1,0,0,0,0,0|2,0,0]=3 1569 B13R0.2 CCOC(=O)CSCCCCCCO 62a_100000766143_100000188475 [1,0,0,0,0,0|2,0,0]=3 1570 B13R0.2 CCOC(=O)CSCCOCCCF 7a_200000230590_100011934791 [1,0,0,0,0,0|3,0,0]=4 1571 B13R0.2 CCOC(=O)CSCCOCCCO 7a_200000230590_100011215043 [1,0,0,0,0,0|3,0,0]=4 1572 B13R0.2 CCOC(=O)CSCCOCCOC 62a_100000188475_100000695917 [1,0,0,0,0,0|3,0,0]=4 1573 B13R0.2 CCOC(=O)CSCCOCCOC 62a_100000695917_100000188475 [1,0,0,0,0,0|3,0,0]=4 1574 B13R0.2 CCOC(=O)CSCCOCCOC 7a_200000230590_100000233755 [1,0,0,0,0,0|3,0,0]=4 1575 B13R0.2 CCOC(=O)CSCCOCCSC 7a_200000230590_100000212216 [1,0,0,0,0,0|3,0,0]=4 1576 B13R0.2 CCOC(=O)NCCOCCCCCl 7a_100000210776_200011445536 [1,0,0,0,0,0|3,0,0]=4 1577 B13R0.2 CCOC(=O)NCCOCCCCF 34a_100000158857_100000729493 [1,0,0,0,0,0|3,0,0]=4 1578 B13R0.2 CCOC(=O)NCCOCCCCF 7a_100011995726_200011445536 [1,0,0,0,0,0|3,0,0]=4 1579 B13R0.2 CCOC(=O)NCCOCCCCO 34a_100000158857_100011216708 [1,0,0,0,0,0|3,0,0]=4 1580 B13R0.2 CCOC(=O)NCCOCCCOC 34a_100000158857_100000740836 [1,0,0,0,0,0|3,0,0]=4 1581 B13R0.2 CCOC(=O)NCCOCCCSC 7a_100000690336_200011445536 [1,0,0,0,0,0|3,0,0]=4 1582 B13R0.2 CCOC(=O)NCCOCCSCC 34a_100000158857_100000757381 [1,0,0,0,0,0|3,0,0]=4 1583 B13R0.2 CCOC(=O)NCCOCCSCC 7a_100000212035_200011445536 [1,0,0,0,0,0|3,0,0]=4 1584 B13R0.2 CCOC(=O)NCCSCCCCF 62a_100000729493_200011445536 [1,0,0,0,0,0|3,0,0]=4 1585 B13R0.2 CCOC(=O)NCCSCCCCO 62a_100000210776_200011445536 [1,0,0,0,0,0|3,0,0]=4 1586 B13R0.2 CCOC(=O)NCCSCCCOC 62a_100000709357_200011445536 [1,0,0,0,0,0|3,0,0]=4 1587 B13R0.2 CCOC(=O)NCCSCCSCC 62a_100000757381_200011445536 [1,0,0,0,0,0|3,0,0]=4 1588 B13R0.2 CCOC(=O)OCSCCCCCF 62a_100000729378_100000075025 [1,0,0,0,0,0|3,0,0]=4 1589 B13R0.2 CCOC(=O)OCSCCCCCO 62a_100000746330_100000075025 [1,0,0,0,0,0|3,0,0]=4 1590 B13R0.2 CCOC(=O)OCSCCCCOC 62a_100000730899_100000075025 [1,0,0,0,0,0|3,0,0]=4 1591 B13R0.2 CCOCCCCCCC(=O)OCC 34a_100121572206_100009814379 [1,0,0,0,0,0|1,0,0]=2 1592 B13R0.2 CCOCCCNCCC(=O)OCC 2230a_100000210961_100011206558 [1,0,0,0,0,0|2,0,0]=3 1593 B13R0.2 CCOCCCNCCC(=O)OCC 34a_100000210961_100000765890 [1,0,0,0,0,0|2,0,0]=3 1594 B13R0.2 CCOCCCOCCC(=O)OCC 34a_100000757476_100000765890 [1,0,0,0,0,0|2,0,0]=3 1595 B13R0.2 CCOCCCOCCC(=O)OCC 7a_100000757476_100011206558 [1,0,0,0,0,0|2,0,0]=3 1596 B13R0.2 CCOCCCSCCC(=O)OCC 62a_100000765890_100012232248 [1,0,0,0,0,0|2,0,0]=3 1597 B13R0.2 CCOCCCSCCC(=O)OCC 62a_100012232248_100000765890 [1,0,0,0,0,0|2,0,0]=3 1598 B13R0.2 CCOCCCSCOC(=O)OCC 62a_100012232248_100000075025 [1,0,0,0,0,0|3,0,0]=4 1599 B13R0.2 CCOCCNCCCC(=O)OCC 2230a_102516460346_100009991533 [1,0,0,0,0,0|2,0,0]=3 1600 B13R0.2 CCOCCNCCCC(=O)OCC 34a_102516460346_100009991533 [1,0,0,0,0,0|2,0,0]=3 1601 B13R0.2 CCOCCOCCCC(=O)OCC 34a_100000210136_100009991533 [1,0,0,0,0,0|2,0,0]=3 1602 B13R0.2 CCOCCOCCCC(=O)OCC 7a_100000210136_100011215271 [1,0,0,0,0,0|2,0,0]=3 1603 B13R0.2 CCOCCOCCCC(=O)OCC 7a_100012001163_100011215890 [1,0,0,0,0,0|2,0,0]=3 1604 B13R0.2 CCOCCOCCNC(=O)OCC 34a_100000158857_100000210147 [1,0,0,0,0,0|3,0,0]=4 1605 B13R0.2 CCOCCOCCNC(=O)OCC 7a_100000210136_200011445536 [1,0,0,0,0,0|3,0,0]=4 1606 B13R0.2 CCOCCSCCCC(=O)OCC 62a_100000210147_100009991533 [1,0,0,0,0,0|2,0,0]=3 1607 B13R0.2 CCOCCSCCCC(=O)OCC 62a_100009991533_100011215890 [1,0,0,0,0,0|2,0,0]=3 1608 B13R0.2 CCOCCSCCNC(=O)OCC 62a_100000210147_200011445536 [1,0,0,0,0,0|3,0,0]=4 1609 B13R0.2 CCOCSCCCCC(=O)OCC 62a_100000739092_100000750268 [1,0,0,0,0,0|2,0,0]=3 1610 B13R0.2 CCOCSCCCCC(=O)OCC 62a_100000750268_100000739092 [1,0,0,0,0,0|2,0,0]=3 1611 B13R0.2 CCOCSCCOCC(=O)OCC 62a_100000088970_100000739092 [1,0,0,0,0,0|3,0,0]=4 1612 B13R0.2 CCOCSCCOCC(=O)OCC 62a_100000739092_100000088970 [1,0,0,0,0,0|3,0,0]=4 1613 B13R0.2 CNNC(=O)CCCCCCCCO 22a_100016993582_100000015970 [1,0,0,0,0,0|3,0,0]=4 1614 B13R0.2 COCC(=O)CCCCCCCCO 1458a_100000210968_100000033203 [1,0,0,0,0,0|3,0,0]=4 1615 B13R0.2 CSCC(=O)CCCCCCCCO 1458a_100000184570_100000033203 [1,0,0,0,0,0|3,0,0]=4 1616 B13R0.2 O=C(CCO)CCCCCCCCO 1458a_100011216618_100000033203 [1,0,0,0,0,0|3,0,0]=4 1617 B13R0.147 C#CC(=O)CCCCCCCCCC 1458a_100000211873_100000210319 [1,0,0,0,0,0|0,0,2]=3 1618 B13R0.147 C#CC(=O)CCCCCCCCCO 1458a_100000211873_100009813782 [1,0,0,0,0,0|1,0,2]=4 1619 B13R0.147 C#CCCCCCCCCC(=O)CC 1458a_100000029693_100000210202 [1,0,0,0,0,0|0,0,2]=3 1620 B13R0.147 C#CCCCCCCCCC(=O)CF 1458a_100000029693_100015361967 [1,0,0,0,0,0|1,0,2]=4 1621 B13R0.147 C#CCCCCCCCCC(=O)NC 11a_106832991635_100000029693 [1,0,0,0,0,0|1,0,2]=4 1622 B13R0.147 C#CCCCCCCCCC(=O)NC 1626a_100102657272_100000029693 [1,0,0,0,0,0|1,0,2]=4 1623 B13R0.147 C#CCCCCCCCCC(=O)NC 240690a_100102657272_100000029693 [1,0,0,0,0,0|1,0,2]=4 1624 B13R0.147 C#CCCCCCCCCC(=O)NC 527a_100102657272_100000029693 [1,0,0,0,0,0|1,0,2]=4 1625 B13R0.147 C#CCCCCCCOCC(=O)CC 34a_100000725409_100012276617 [1,0,0,0,0,0|1,0,2]=4 1626 B13R0.147 C#CCCCCCCOCC(=O)CC 7a_100011217361_100000747405 [1,0,0,0,0,0|1,0,2]=4 1627 B13R0.147 C#CCCCCCCOCC(=O)OC 34a_100011217361_100000747449 [1,0,0,0,0,0|1,0,2]=4 1628 B13R0.147 C#CCCCCCCOCC(=O)OC 7a_100011217361_100000747449 [1,0,0,0,0,0|1,0,2]=4 1629 B13R0.147 C#CCCCCCCSCC(=O)CC 62a_100000747405_100012276617 [1,0,0,0,0,0|1,0,2]=4 1630 B13R0.147 C#CCCCCCCSCC(=O)CC 62a_100012276617_100000747405 [1,0,0,0,0,0|1,0,2]=4 1631 B13R0.147 C#CCCCCCCSCC(=O)OC 62a_100000747449_100012276617 [1,0,0,0,0,0|1,0,2]=4 1632 B13R0.147 C#CCCCCCCSCC(=O)OC 62a_100012276617_100000747449 [1,0,0,0,0,0|1,0,2]=4 1633 B13R0.147 C#CCCCCCOCCC(=O)OC 34a_100000766912_100000742370 [1,0,0,0,0,0|1,0,2]=4 1634 B13R0.147 C#CCCCCCOCCC(=O)OC 7a_100000766912_100000204255 [1,0,0,0,0,0|1,0,2]=4 1635 B13R0.147 C#CCCCCCSCCC(=O)OC 62a_100000204255_100012094781 [1,0,0,0,0,0|1,0,2]=4 1636 B13R0.147 C#CCCCCCSCCC(=O)OC 62a_100012094781_100000204255 [1,0,0,0,0,0|1,0,2]=4 1637 B13R0.147 C#CCCCCNCCCC(=O)OC 2230a_100000706060_100011218270 [1,0,0,0,0,0|1,0,2]=4 1638 B13R0.147 C#CCCCCNCCCC(=O)OC 34a_100000706060_100000742333 [1,0,0,0,0,0|1,0,2]=4 1639 B13R0.147 C#CCCCCOCCCC(=O)OC 34a_100000766709_100000742333 [1,0,0,0,0,0|1,0,2]=4 1640 B13R0.147 C#CCCCCOCCCC(=O)OC 7a_100000766709_100011218270 [1,0,0,0,0,0|1,0,2]=4 1641 B13R0.147 C#CCCCCSCCCC(=O)OC 62a_100010269958_100011218270 [1,0,0,0,0,0|1,0,2]=4 1642 B13R0.147 C#CCCCCSCCCC(=O)OC 62a_100011218270_100010269958 [1,0,0,0,0,0|1,0,2]=4 1643 B13R0.147 C#CCCCNCCCCC(=O)OC 34a_100000718082_100000204269 [1,0,0,0,0,0|1,0,2]=4 1644 B13R0.147 C#CCCCOCCCCC(=O)OC 34a_100000059025_100000695029 [1,0,0,0,0,0|1,0,2]=4 1645 B13R0.147 C#CCCCOCCCCC(=O)OC 34a_100000215630_100000204269 [1,0,0,0,0,0|1,0,2]=4 1646 B13R0.147 C#CCCCOCCCCC(=O)OC 7a_100000059025_100011215417 [1,0,0,0,0,0|1,0,2]=4 1647 B13R0.147 C#CCCCOCCCCC(=O)OC 7a_100000215630_100000204269 [1,0,0,0,0,0|1,0,2]=4 1648 B13R0.147 C#CCCCSCCCCC(=O)OC 62a_100000204269_100011215417 [1,0,0,0,0,0|1,0,2]=4 1649 B13R0.147 C#CCCCSCCCCC(=O)OC 62a_100011215417_100000204269 [1,0,0,0,0,0|1,0,2]=4 1650 B13R0.147 C#CCCNCCCCCC(=O)OC 34a_100000755551_100009816466 [1,0,0,0,0,0|1,0,2]=4 1651 B13R0.147 C#CCCOCCCCCC(=O)OC 34a_100000074720_100000688953 [1,0,0,0,0,0|1,0,2]=4 1652 B13R0.147 C#CCCOCCCCCC(=O)OC 34a_100011215631_100009816466 [1,0,0,0,0,0|1,0,2]=4 1653 B13R0.147 C#CCCOCCCCCC(=O)OC 7a_100000074720_100000688953 [1,0,0,0,0,0|1,0,2]=4 1654 B13R0.147 C#CCCSCCCCCC(=O)OC 62a_100000688953_100009816466 [1,0,0,0,0,0|1,0,2]=4 1655 B13R0.147 C#CCCSCCCCCC(=O)OC 62a_100009816466_100000688953 [1,0,0,0,0,0|1,0,2]=4 1656 B13R0.147 C#CCNCCCCCCC(=O)OC 34a_100000212058_100009815986 [1,0,0,0,0,0|1,0,2]=4 1657 B13R0.147 C#CCOCCCCCCC(=O)OC 34a_100000210247_100009815986 [1,0,0,0,0,0|1,0,2]=4 1658 B13R0.147 C#CCOCCCCCCC(=O)OC 34a_100009863599_100000184674 [1,0,0,0,0,0|1,0,2]=4 1659 B13R0.147 C#CCOCCCCCCC(=O)OC 7a_100009863599_100000038162 [1,0,0,0,0,0|1,0,2]=4 1660 B13R0.147 C#CCSCCCCCCC(=O)OC 62a_100000038162_100009815986 [1,0,0,0,0,0|1,0,2]=4 1661 B13R0.147 C/C=C/CCOCCCCC(=O)OC 34a_100016278192_100000204269 [1,0,0,0,0,0|1,0,2]=4 1662 B13R0.147 C/C=C/COCCCCCC(=O)OC 34a_100000074720_100102629194 [1,0,0,0,0,0|1,0,2]=4 1663 B13R0.147 C/C=C/COCCCCCC(=O)OC 34a_100016270725_100009816466 [1,0,0,0,0,0|1,0,2]=4 1664 B13R0.147 C/C=C/COCCCCCC(=O)OC 7a_100000074720_100102629194 [1,0,0,0,0,0|1,0,2]=4 1665 B13R0.147 C/C=C/CSCCCCCC(=O)OC 62a_100009816466_100102629194 [1,0,0,0,0,0|1,0,2]=4 1666 B13R0.147 C/C=C/CSCCCCCC(=O)OC 62a_100102629194_100009816466 [1,0,0,0,0,0|1,0,2]=4 1667 B13R0.147 C=CC(=O)CCCCCCCCCC 1458a_100000185746_100000210319 [1,0,0,0,0,0|0,0,2]=3 1668 B13R0.147 C=CC(=O)CCCCCCCCCO 1458a_100000185746_100009813782 [1,0,0,0,0,0|1,0,2]=4 1669 B13R0.147 C=CC(=O)NCCCCCCCCC 1626a_100000212291_100000185746 [1,0,0,0,0,0|1,0,2]=4 1670 B13R0.147 C=CC(=O)NCCCCCCCCC 240690a_100000212291_200121576911 [1,0,0,0,0,0|1,0,2]=4 1671 B13R0.147 C=CCCCCCCCCC(=O)CC 1458a_100000210414_100011933949 [1,0,0,0,0,0|0,0,2]=3 1672 B13R0.147 C=CCCCCCCCCC(=O)CC 1458a_100000211349_100000210202 [1,0,0,0,0,0|0,0,2]=3 1673 B13R0.147 C=CCCCCCCCCC(=O)CF 1458a_100000211349_100015361967 [1,0,0,0,0,0|1,0,2]=4 1674 B13R0.147 C=CCCCCCCCCC(=O)CO 1458a_100000210174_100011933949 [1,0,0,0,0,0|1,0,2]=4 1675 B13R0.147 C=CCCCCCCCCC(=O)NC 11a_106832991635_100000211349 [1,0,0,0,0,0|1,0,2]=4 1676 B13R0.147 C=CCCCCCCCCC(=O)NC 1626a_100102657272_100000211349 [1,0,0,0,0,0|1,0,2]=4 1677 B13R0.147 C=CCCCCCCCCC(=O)NC 240690a_100102657272_100000211349 [1,0,0,0,0,0|1,0,2]=4 1678 B13R0.147 C=CCCCCCCCCC(=O)NC 527a_100102657272_100000211349 [1,0,0,0,0,0|1,0,2]=4 1679 B13R0.147 C=CCCCCCCOCC(=O)CC 34a_100000725409_100011215473 [1,0,0,0,0,0|1,0,2]=4 1680 B13R0.147 C=CCCCCCCOCC(=O)CC 7a_200011216477_100000747405 [1,0,0,0,0,0|1,0,2]=4 1681 B13R0.147 C=CCCCCCCOCC(=O)OC 34a_200011216477_100000747449 [1,0,0,0,0,0|1,0,2]=4 1682 B13R0.147 C=CCCCCCCOCC(=O)OC 7a_200011216477_100000747449 [1,0,0,0,0,0|1,0,2]=4 1683 B13R0.147 C=CCCCCCCSCC(=O)CC 62a_100000747405_100011215473 [1,0,0,0,0,0|1,0,2]=4 1684 B13R0.147 C=CCCCCCCSCC(=O)CC 62a_100011215473_100000747405 [1,0,0,0,0,0|1,0,2]=4 1685 B13R0.147 C=CCCCCCCSCC(=O)OC 62a_100000747449_100011215473 [1,0,0,0,0,0|1,0,2]=4 1686 B13R0.147 C=CCCCCCCSCC(=O)OC 62a_100011215473_100000747449 [1,0,0,0,0,0|1,0,2]=4 1687 B13R0.147 C=CCCCCCOCCC(=O)OC 34a_100011216702_100000742370 [1,0,0,0,0,0|1,0,2]=4 1688 B13R0.147 C=CCCCCCOCCC(=O)OC 7a_100011216702_100000204255 [1,0,0,0,0,0|1,0,2]=4 1689 B13R0.147 C=CCCCCCSCCC(=O)OC 62a_100000204255_100000700193 [1,0,0,0,0,0|1,0,2]=4 1690 B13R0.147 C=CCCCCCSCCC(=O)OC 62a_100000700193_100000204255 [1,0,0,0,0,0|1,0,2]=4 1691 B13R0.147 C=CCCCCNCCCC(=O)OC 2230a_100000703577_100011218270 [1,0,0,0,0,0|1,0,2]=4 1692 B13R0.147 C=CCCCCNCCCC(=O)OC 34a_100000703577_100000742333 [1,0,0,0,0,0|1,0,2]=4 1693 B13R0.147 C=CCCCCOCCCC(=O)OC 34a_100000766645_100000742333 [1,0,0,0,0,0|1,0,2]=4 1694 B13R0.147 C=CCCCCOCCCC(=O)OC 7a_100000766645_100011218270 [1,0,0,0,0,0|1,0,2]=4 1695 B13R0.147 C=CCCCCSCCCC(=O)OC 62a_100011215482_100011218270 [1,0,0,0,0,0|1,0,2]=4 1696 B13R0.147 C=CCCCCSCCCC(=O)OC 62a_100011218270_100011215482 [1,0,0,0,0,0|1,0,2]=4 1697 B13R0.147 C=CCCCNCCCCC(=O)OC 2230a_100000700776_100000204269 [1,0,0,0,0,0|1,0,2]=4 1698 B13R0.147 C=CCCCNCCCCC(=O)OC 34a_100000700776_100000204269 [1,0,0,0,0,0|1,0,2]=4 1699 B13R0.147 C=CCCCOCCCCC(=O)OC 34a_100000059025_100000757094 [1,0,0,0,0,0|1,0,2]=4 1700 B13R0.147 C=CCCCOCCCCC(=O)OC 34a_100000758997_100000204269 [1,0,0,0,0,0|1,0,2]=4 1701 B13R0.147 C=CCCCOCCCCC(=O)OC 7a_100000059025_100000757094 [1,0,0,0,0,0|1,0,2]=4 1702 B13R0.147 C=CCCCOCCCCC(=O)OC 7a_100000758997_100000204269 [1,0,0,0,0,0|1,0,2]=4 1703 B13R0.147 C=CCCCSCCCCC(=O)OC 62a_100000204269_100000757094 [1,0,0,0,0,0|1,0,2]=4 1704 B13R0.147 C=CCCCSCCCCC(=O)OC 62a_100011713584_100000204269 [1,0,0,0,0,0|1,0,2]=4 1705 B13R0.147 C=CCCNCCCCCC(=O)OC 2230a_100015191253_100009816466 [1,0,0,0,0,0|1,0,2]=4 1706 B13R0.147 C=CCCOCCCCCC(=O)OC 34a_100000074720_100000754431 [1,0,0,0,0,0|1,0,2]=4 1707 B13R0.147 C=CCCOCCCCCC(=O)OC 34a_100011205117_100009816466 [1,0,0,0,0,0|1,0,2]=4 1708 B13R0.147 C=CCCOCCCCCC(=O)OC 7a_100000074720_100000754431 [1,0,0,0,0,0|1,0,2]=4 1709 B13R0.147 C=CCCSCCCCCC(=O)OC 62a_100000754431_100009816466 [1,0,0,0,0,0|1,0,2]=4 1710 B13R0.147 C=CCCSCCCCCC(=O)OC 62a_100009816466_100000754431 [1,0,0,0,0,0|1,0,2]=4 1711 B13R0.147 C=CCNCCCCCCC(=O)OC 2230a_100020586998_100009815986 [1,0,0,0,0,0|1,0,2]=4 1712 B13R0.147 C=CCOCCCCCCC(=O)OC 34a_100009863599_100015514636 [1,0,0,0,0,0|1,0,2]=4 1713 B13R0.147 C=CCOCCCCCCC(=O)OC 34a_200000210373_100009815986 [1,0,0,0,0,0|1,0,2]=4 1714 B13R0.147 C=CCOCCCCCCC(=O)OC 7a_100009863599_100015514636 [1,0,0,0,0,0|1,0,2]=4 1715 B13R0.147 C=CCSCCCCCCC(=O)OC 62a_100000210623_100009815986 [1,0,0,0,0,0|1,0,2]=4 1716 B13R0.147 C=CCSCCCCCCC(=O)OC 62a_100009815986_100000210623 [1,0,0,0,0,0|1,0,2]=4 1717 B13R0.147 CC#CCCCCCCCC(=O)CC 1458a_100000066323_100000210202 [1,0,0,0,0,0|0,0,2]=3 1718 B13R0.147 CC#CCCCCCCCC(=O)CF 1458a_100000066323_100015361967 [1,0,0,0,0,0|1,0,2]=4 1719 B13R0.147 CC#CCCCCCCCC(=O)NC 11a_106832991635_100000066323 [1,0,0,0,0,0|1,0,2]=4 1720 B13R0.147 CC#CCCCCCCCC(=O)NC 1626a_100102657272_100000066323 [1,0,0,0,0,0|1,0,2]=4 1721 B13R0.147 CC#CCCCCCCCC(=O)NC 240690a_100102657272_100000066323 [1,0,0,0,0,0|1,0,2]=4 1722 B13R0.147 CC#CCCCCCCCC(=O)NC 527a_100102657272_100000066323 [1,0,0,0,0,0|1,0,2]=4 1723 B13R0.147 CC#CCCOCCCCC(=O)OC 34a_100000750427_100000204269 [1,0,0,0,0,0|1,0,2]=4 1724 B13R0.147 CC#CCNCCCCCC(=O)OC 2230a_100000685387_100009816466 [1,0,0,0,0,0|1,0,2]=4 1725 B13R0.147 CC#CCNCCCCCC(=O)OC 34a_100000685387_100009816466 [1,0,0,0,0,0|1,0,2]=4 1726 B13R0.147 CC#CCOCCCCCC(=O)OC 34a_100000074720_100000748600 [1,0,0,0,0,0|1,0,2]=4 1727 B13R0.147 CC#CCOCCCCCC(=O)OC 34a_100000761923_100009816466 [1,0,0,0,0,0|1,0,2]=4 1728 B13R0.147 CC#CCOCCCCCC(=O)OC 7a_100000074720_100000748600 [1,0,0,0,0,0|1,0,2]=4 1729 B13R0.147 CC#CCSCCCCCC(=O)OC 62a_100000748600_100009816466 [1,0,0,0,0,0|1,0,2]=4 1730 B13R0.147 CC#CCSCCCCCC(=O)OC 62a_100009816466_100000748600 [1,0,0,0,0,0|1,0,2]=4 1731 B13R0.147 CC/C=C/CCCOCCC(=O)OC 34a_100016287902_100000742370 [1,0,0,0,0,0|1,0,2]=4 1732 B13R0.147 CC/C=C/CCCOCCC(=O)OC 7a_100016287902_100000204255 [1,0,0,0,0,0|1,0,2]=4 1733 B13R0.147 CC/C=C\CCCCOCC(=O)CC 7a_100016287862_100000747405 [1,0,0,0,0,0|1,0,2]=4 1734 B13R0.147 CC/C=C\CCCCOCC(=O)OC 34a_100016287862_100000747449 [1,0,0,0,0,0|1,0,2]=4 1735 B13R0.147 CC/C=C\CCCCOCC(=O)OC 7a_100016287862_100000747449 [1,0,0,0,0,0|1,0,2]=4 1736 B13R0.147 CC/C=C\CCOCCCC(=O)OC 34a_100016288707_100000742333 [1,0,0,0,0,0|1,0,2]=4 1737 B13R0.147 CC/C=C\CCOCCCC(=O)OC 7a_100016288707_100011218270 [1,0,0,0,0,0|1,0,2]=4 1738 B13R0.147 CC/C=C\CCSCCCC(=O)OC 62a_100011218270_100015370543 [1,0,0,0,0,0|1,0,2]=4 1739 B13R0.147 CC/C=C\CCSCCCC(=O)OC 62a_100015370543_100011218270 [1,0,0,0,0,0|1,0,2]=4 1740 B13R0.147 CC/C=C\COCCCCC(=O)OC 34a_100000059025_100103147603 [1,0,0,0,0,0|1,0,2]=4 1741 B13R0.147 CC/C=C\COCCCCC(=O)OC 34a_100016268518_100000204269 [1,0,0,0,0,0|1,0,2]=4 1742 B13R0.147 CC/C=C\COCCCCC(=O)OC 7a_100000059025_100103147603 [1,0,0,0,0,0|1,0,2]=4 1743 B13R0.147 CC/C=C\CSCCCCC(=O)OC 62a_100000204269_100103147603 [1,0,0,0,0,0|1,0,2]=4 1744 B13R0.147 CC/C=C\CSCCCCC(=O)OC 62a_100103147603_100000204269 [1,0,0,0,0,0|1,0,2]=4 1745 B13R0.147 CC=CCCCOCCCC(=O)OC 34a_100020645299_100000742333 [1,0,0,0,0,0|1,0,2]=4 1746 B13R0.147 CC=CCOCCCCCC(=O)OC 34a_100000074720_100000070051 [1,0,0,0,0,0|1,0,2]=4 1747 B13R0.147 CC=CCOCCCCCC(=O)OC 7a_100000074720_100000070051 [1,0,0,0,0,0|1,0,2]=4 1748 B13R0.147 CC=CCSCCCCCC(=O)OC 62a_100000070051_100009816466 [1,0,0,0,0,0|1,0,2]=4 1749 B13R0.147 CC=CCSCCCCCC(=O)OC 62a_100009816466_100000070051 [1,0,0,0,0,0|1,0,2]=4 1750 B13R0.147 CCC#CCCCCCCC(=O)CC 1458a_100000210414_200000036426 [1,0,0,0,0,0|0,0,2]=3 1751 B13R0.147 CCC#CCCCCCCC(=O)CO 1458a_100000210174_200000036426 [1,0,0,0,0,0|1,0,2]=4 1752 B13R0.147 CCC#CCCOCCCC(=O)OC 34a_100000036655_100000742333 [1,0,0,0,0,0|1,0,2]=4 1753 B13R0.147 CCC#CCCOCCCC(=O)OC 7a_100000036655_100011218270 [1,0,0,0,0,0|1,0,2]=4 1754 B13R0.147 CCC#CCOCCCCC(=O)OC 34a_100000032950_100000204269 [1,0,0,0,0,0|1,0,2]=4 1755 B13R0.147 CCC#CCOCCCCC(=O)OC 34a_100000059025_100009813939 [1,0,0,0,0,0|1,0,2]=4 1756 B13R0.147 CCC#CCOCCCCC(=O)OC 7a_100000059025_100009813939 [1,0,0,0,0,0|1,0,2]=4 1757 B13R0.147 CCC#CCSCCCCC(=O)OC 62a_100000204269_100009813939 [1,0,0,0,0,0|1,0,2]=4 1758 B13R0.147 CCC#CCSCCCCC(=O)OC 62a_100009813939_100000204269 [1,0,0,0,0,0|1,0,2]=4 1759 B13R0.147 CCC(=O)CCCCCCCCCF 1458a_200009909015_100000210202 [1,0,0,0,0,0|1,0,0]=2 1760 B13R0.147 CCC(=O)CCCCCCCCCO 1458a_100000210414_100009813782 [1,0,0,0,0,0|1,0,0]=2 1761 B13R0.147 CCC(=O)CCOCCOCCOC 1458a_100000210414_100013367474 [1,0,0,0,0,0|3,0,0]=4 1762 B13R0.147 CCC(=O)CCOCCOCCOC 1458a_100012278103_100000210202 [1,0,0,0,0,0|3,0,0]=4 1763 B13R0.147 CCC(=O)COCCCCCCCBr 7a_100000760002_100000747405 [1,0,0,0,0,0|2,0,0]=3 1764 B13R0.147 CCC(=O)COCCCCCCCO 34a_100000725409_100000760002 [1,0,0,0,0,0|2,0,0]=3 1765 B13R0.147 CCC(=O)COCCCCCCOC 34a_100000725409_100011998445 [1,0,0,0,0,0|2,0,0]=3 1766 B13R0.147 CCC(=O)COCCCCCCOC 7a_200012092642_100000747405 [1,0,0,0,0,0|2,0,0]=3 1767 B13R0.147 CCC(=O)COCCCOCCOC 34a_100000725409_100011216529 [1,0,0,0,0,0|3,0,0]=4 1768 B13R0.147 CCC(=O)CSCCCCCCC#N 62a_100000747405_100009813337 [1,0,0,0,0,0|2,0,1]=4 1769 B13R0.147 CCC(=O)CSCCCCCCC#N 62a_100009813337_100000747405 [1,0,0,0,0,0|2,0,1]=4 1770 B13R0.147 CCC(=O)CSCCCCCCCO 62a_100000747405_100000760002 [1,0,0,0,0,0|2,0,0]=3 1771 B13R0.147 CCC(=O)CSCCCCCCCO 62a_100000760002_100000747405 [1,0,0,0,0,0|2,0,0]=3 1772 B13R0.147 CCC(=O)CSCCCCCCOC 62a_100000747405_100011998445 [1,0,0,0,0,0|2,0,0]=3 1773 B13R0.147 CCC(=O)CSCCCCCCOC 62a_100011998445_100000747405 [1,0,0,0,0,0|2,0,0]=3 1774 B13R0.147 CCC(=O)CSCCCOCCOC 62a_100000747405_100011216529 [1,0,0,0,0,0|3,0,0]=4 1775 B13R0.147 CCC(=O)CSCCCOCCOC 62a_100011216529_100000747405 [1,0,0,0,0,0|3,0,0]=4 1776 B13R0.147 CCC(=O)NCCCCCCCCO 240690a_102515433106_100000210414 [1,0,0,0,0,0|2,0,0]=3 1777 B13R0.147 CCC(=O)NCCNCCCCCF 34a_100132302217_100000729378 [1,0,0,0,0,0|3,0,0]=4 1778 B13R0.147 CCC(=O)NCCNCCCCCO 34a_100132302217_100000746330 [1,0,0,0,0,0|3,0,0]=4 1779 B13R0.147 CCC(=O)NCCNCCCCOC 34a_100132302217_100000755781 [1,0,0,0,0,0|3,0,0]=4 1780 B13R0.147 CCC(=O)NCCOCCCCCF 34a_200000158885_100000729378 [1,0,0,0,0,0|3,0,0]=4 1781 B13R0.147 CCC(=O)NCCOCCCCCF 7a_200000158885_100000729378 [1,0,0,0,0,0|3,0,0]=4 1782 B13R0.147 CCC(=O)NCCOCCCCCO 34a_200000158885_100000746330 [1,0,0,0,0,0|3,0,0]=4 1783 B13R0.147 CCC(=O)NCCOCCCCCO 7a_200000158885_100000746330 [1,0,0,0,0,0|3,0,0]=4 1784 B13R0.147 CCC(=O)NCCOCCCCOC 34a_200000158885_100000755781 [1,0,0,0,0,0|3,0,0]=4 1785 B13R0.147 CCC(=O)NCCOCCCCOC 7a_200000158885_100000730899 [1,0,0,0,0,0|3,0,0]=4 1786 B13R0.147 CCC(=O)OCCOCCCCCF 7a_200000031056_100000729378 [1,0,0,0,0,0|3,0,0]=4 1787 B13R0.147 CCC(=O)OCCOCCCCCO 7a_200000031056_100000746330 [1,0,0,0,0,0|3,0,0]=4 1788 B13R0.147 CCC(=O)OCCOCCCCOC 7a_200000031056_100000730899 [1,0,0,0,0,0|3,0,0]=4 1789 B13R0.147 CCC/C=C/COCCCC(=O)OC 34a_100016278788_100000742333 [1,0,0,0,0,0|1,0,2]=4 1790 B13R0.147 CCC/C=C/COCCCC(=O)OC 7a_100016278788_100011218270 [1,0,0,0,0,0|1,0,2]=4 1791 B13R0.147 CCCC#CCCOCCC(=O)OC 34a_100000042726_100000742370 [1,0,0,0,0,0|1,0,2]=4 1792 B13R0.147 CCCC#CCCOCCC(=O)OC 7a_100000042726_100000204255 [1,0,0,0,0,0|1,0,2]=4 1793 B13R0.147 CCCC#CCOCCCC(=O)OC 34a_100000034806_100000742333 [1,0,0,0,0,0|1,0,2]=4 1794 B13R0.147 CCCC#CCOCCCC(=O)OC 7a_100000034806_100011218270 [1,0,0,0,0,0|1,0,2]=4 1795 B13R0.147 CCCC/C=C/COCCC(=O)OC 34a_200016272032_100000742370 [1,0,0,0,0,0|1,0,2]=4 1796 B13R0.147 CCCC/C=C/COCCC(=O)OC 7a_200016272032_100000204255 [1,0,0,0,0,0|1,0,2]=4 1797 B13R0.147 CCCC/C=C\CCOCC(=O)CC 7a_200016286491_100000747405 [1,0,0,0,0,0|1,0,2]=4 1798 B13R0.147 CCCC/C=C\CCOCC(=O)OC 34a_200016286491_100000747449 [1,0,0,0,0,0|1,0,2]=4 1799 B13R0.147 CCCC/C=C\CCOCC(=O)OC 7a_200016286491_100000747449 [1,0,0,0,0,0|1,0,2]=4 1800 B13R0.147 CCCCC#CCCOCC(=O)CC 7a_100000037610_100000747405 [1,0,0,0,0,0|1,0,2]=4 1801 B13R0.147 CCCCC#CCCOCC(=O)OC 34a_100000037610_100000747449 [1,0,0,0,0,0|1,0,2]=4 1802 B13R0.147 CCCCC#CCCOCC(=O)OC 7a_100000037610_100000747449 [1,0,0,0,0,0|1,0,2]=4 1803 B13R0.147 CCCCC#CCOCCC(=O)OC 34a_200000034558_100000742370 [1,0,0,0,0,0|1,0,2]=4 1804 B13R0.147 CCCCC#CCOCCC(=O)OC 7a_200000034558_100000204255 [1,0,0,0,0,0|1,0,2]=4 1805 B13R0.147 CCCCC/C=C/COCC(=O)CC 7a_100016258190_100000747405 [1,0,0,0,0,0|1,0,2]=4 1806 B13R0.147 CCCCC/C=C/COCC(=O)OC 34a_100016258190_100000747449 [1,0,0,0,0,0|1,0,2]=4 1807 B13R0.147 CCCCC/C=C/COCC(=O)OC 7a_100016258190_100000747449 [1,0,0,0,0,0|1,0,2]=4 1808 B13R0.147 CCCCCC#CCOCC(=O)CC 34a_100000725409_100009816472 [1,0,0,0,0,0|1,0,2]=4 1809 B13R0.147 CCCCCC#CCOCC(=O)CC 7a_200000033628_100000747405 [1,0,0,0,0,0|1,0,2]=4 1810 B13R0.147 CCCCCC#CCOCC(=O)OC 34a_200000033628_100000747449 [1,0,0,0,0,0|1,0,2]=4 1811 B13R0.147 CCCCCC#CCOCC(=O)OC 7a_200000033628_100000747449 [1,0,0,0,0,0|1,0,2]=4 1812 B13R0.147 CCCCCC#CCSCC(=O)CC 62a_100000747405_100009816472 [1,0,0,0,0,0|1,0,2]=4 1813 B13R0.147 CCCCCC#CCSCC(=O)CC 62a_100009816472_100000747405 [1,0,0,0,0,0|1,0,2]=4 1814 B13R0.147 CCCCCC#CCSCC(=O)OC 62a_100000747449_100009816472 [1,0,0,0,0,0|1,0,2]=4 1815 B13R0.147 CCCCCC#CCSCC(=O)OC 62a_100009816472_100000747449 [1,0,0,0,0,0|1,0,2]=4 1816 B13R0.147 CCCCCCCC=NNC(=O)CC 4a_100000183195_100000210592 [1,0,0,0,0,0|2,0,1]=4 1817 B13R0.147 CCCCCCCCC=CC(=O)CC 1458a_100015345288_100000210202 [1,0,0,0,0,0|0,0,2]=3 1818 B13R0.147 CCCCCCCCC=CC(=O)CF 1458a_100015345288_100015361967 [1,0,0,0,0,0|1,0,2]=4 1819 B13R0.147 CCCCCCCCC=CC(=O)NC 11a_106832991635_100015345288 [1,0,0,0,0,0|1,0,2]=4 1820 B13R0.147 CCCCCCCCC=CC(=O)NC 1626a_100102657272_100015345288 [1,0,0,0,0,0|1,0,2]=4 1821 B13R0.147 CCCCCCCCC=CC(=O)NC 240690a_100102657272_100015345288 [1,0,0,0,0,0|1,0,2]=4 1822 B13R0.147 CCCCCCCCCCC(=O)CC 1458a_100000210375_100000210202 [1,0,0,0,0,0|0,0,0]=1 1823 B13R0.147 CCCCCCCCCCC(=O)CC 1458a_100000210414_100000210319 [1,0,0,0,0,0|0,0,0]=1 1824 B13R0.147 CCCCCCCCCCC(=O)CF 1458a_100000210375_100015361967 [1,0,0,0,0,0|1,0,0]=2 1825 B13R0.147 CCCCCCCCCCC(=O)CO 1458a_100000210174_100000210319 [1,0,0,0,0,0|1,0,0]=2 1826 B13R0.147 CCCCCCCCCCC(=O)NC 11a_106832991635_100000210375 [1,0,0,0,0,0|1,0,0]=2 1827 B13R0.147 CCCCCCCCCCC(=O)NC 1626a_100102657272_100000210375 [1,0,0,0,0,0|1,0,0]=2 1828 B13R0.147 CCCCCCCCCCC(=O)NC 240690a_100102657272_100000210375 [1,0,0,0,0,0|1,0,0]=2 1829 B13R0.147 CCCCCCCCCCC(C)NC 270004a_106832991635_200011219864 [1,0,0,0,0,0|2,0,1]=4 1830 B13R0.147 CCCCCCCCCCC(C)OC 34a_100011215000_200000210301 [1,0,0,0,0,0|1,0,1]=3 1831 B13R0.147 CCCCCCCCCCC(C)OC 7a_100011215000_200000210301 [1,0,0,0,0,0|1,0,1]=3 1832 B13R0.147 CCCCCCCCCCC(C)O[13CH3] 34a_100011215000_200025704644 [1,0,0,0,0,0|1,0,1]=3 1833 B13R0.147 CCCCCCCCCCC(C)O[13CH3] 7a_100011215000_200025704644 [1,0,0,0,0,0|1,0,1]=3 1834 B13R0.147 CCCCCCCCCCN(C)CC 2230a_100000207566_100000210202 [1,0,0,0,0,0|2,0,0]=3 1835 B13R0.147 CCCCCCCCCCN(C)CC 2230a_100000225621_100000210320 [1,0,0,0,0,0|2,0,0]=3 1836 B13R0.147 CCCCCCCCCCN(C)CC 269982a_100000207566_100000204670 [1,0,0,0,0,0|2,0,0]=3 1837 B13R0.147 CCCCCCCCCCN(C)CC 269982a_100000225621_100000210320 [1,0,0,0,0,0|2,0,0]=3 1838 B13R0.147 CCCCCCCCCCN(C)CF 269982a_100000207566_100015361967 [1,0,0,0,0,0|3,0,0]=4 1839 B13R0.147 CCCCCCCCCNC(=O)CC 11a_100000212291_100000210414 [1,0,0,0,0,0|1,0,0]=2 1840 B13R0.147 CCCCCCCCCNC(=O)CC 1626a_100000212291_100000210414 [1,0,0,0,0,0|1,0,0]=2 1841 B13R0.147 CCCCCCCCCNC(=O)CC 240690a_100000212291_100000210414 [1,0,0,0,0,0|1,0,0]=2 1842 B13R0.147 CCCCCCCCCNC(=O)CC 527a_100000212291_100000210414 [1,0,0,0,0,0|1,0,0]=2 1843 B13R0.147 CCCCCCCCCNC(=O)CO 240690a_100000212291_100000210174 [1,0,0,0,0,0|2,0,0]=3 1844 B13R0.147 CCCCCCCCCNC(=O)CO 527a_100000212291_100000210174 [1,0,0,0,0,0|2,0,0]=3 1845 B13R0.147 CCCCCCCCCNC(=O)NC 2708a_100000212291_106832991635 [1,0,0,0,0,0|2,0,0]=3 1846 B13R0.147 CCCCCCCCCNC(=O)NC 2708a_100102657272_100000212291 [1,0,0,0,0,0|2,0,0]=3 1847 B13R0.147 CCCCCCCCCNC(=O)NC 273464a_100000212291_100102657272 [1,0,0,0,0,0|2,0,0]=3 1848 B13R0.147 CCCCCCCCCNC(=O)NC 273464a_100102657272_100000212291 [1,0,0,0,0,0|2,0,0]=3 1849 B13R0.147 CCCCCCCCCNC(=O)NC 512a_100000212291_100102657272 [1,0,0,0,0,0|2,0,0]=3 1850 B13R0.147 CCCCCCCCCNC(=O)NC 512a_106832991638_100000212291 [1,0,0,0,0,0|2,0,0]=3 1851 B13R0.147 CCCCCCCCCNC(C)CC 2230a_100000209981_100011214924 [1,0,0,0,0,0|2,0,1]=4 1852 B13R0.147 CCCCCCCCCNC(C)CC 2230a_100000212291_100000758301 [1,0,0,0,0,0|2,0,1]=4 1853 B13R0.147 CCCCCCCCCNC(C)CC 34a_100000212291_100011215416 [1,0,0,0,0,0|2,0,1]=4 1854 B13R0.147 CCCCCCCCCOC(C)CC 34a_100000210712_100011215416 [1,0,0,0,0,0|2,0,1]=4 1855 B13R0.147 CCCCCCCCCOC(C)CC 7a_100000210228_100000210328 [1,0,0,0,0,0|2,0,1]=4 1856 B13R0.147 CCCCCCCCCOC(C)CC 7a_100000210712_100000758301 [1,0,0,0,0,0|2,0,1]=4 1857 B13R0.147 CCCCCCCCCSC(C)OC 62a_100009879195_100000210670 [1,0,0,0,0,0|2,0,1]=4 1858 B13R0.147 CCCCCCCCNCC(=O)NC 2230a_100000229939_100000183359 [1,0,0,0,0,0|2,0,0]=3 1859 B13R0.147 CCCCCCCCNCC(=O)NC 2230a_100000693194_100000210759 [1,0,0,0,0,0|2,0,0]=3 1860 B13R0.147 CCCCCCCCNCC(=O)NC 34a_100000229939_100000183359 [1,0,0,0,0,0|2,0,0]=3 1861 B13R0.147 CCCCCCCCNCC(=O)OC 2230a_100000229939_100000747449 [1,0,0,0,0,0|1,0,0]=2 1862 B13R0.147 CCCCCCCCNCC(=O)OC 34a_100000229939_100000747449 [1,0,0,0,0,0|1,0,0]=2 1863 B13R0.147 CCCCCCCCNCC(C)CC 2230a_100000229939_100000748023 [1,0,0,0,0,0|2,0,1]=4 1864 B13R0.147 CCCCCCCCNCC(C)CC 2230a_100020588543_100000210759 [1,0,0,0,0,0|2,0,1]=4 1865 B13R0.147 CCCCCCCCNCC(C)CC 270004a_100000229939_100000243153 [1,0,0,0,0,0|2,0,1]=4 1866 B13R0.147 CCCCCCCCNCC(C)CC 34a_100000229939_100000748023 [1,0,0,0,0,0|2,0,1]=4 1867 B13R0.147 CCCCCCCCNCC(O)CC 2230a_100000229939_100011218378 [1,0,0,0,0,0|1,0,2]=4 1868 B13R0.147 CCCCCCCCNCC(O)CC 2230a_100011218483_100000210759 [1,0,0,0,0,0|1,0,2]=4 1869 B13R0.147 CCCCCCCCNCC(O)CC 34a_100000229939_100011218378 [1,0,0,0,0,0|1,0,2]=4 1870 B13R0.147 CCCCCCCCNC[C@@H](C)CC 2230a_100000229939_100009816398 [1,0,0,0,0,0|2,0,1]=4 1871 B13R0.147 CCCCCCCCNC[C@@H](C)CC 34a_100000229939_100009816398 [1,0,0,0,0,0|2,0,1]=4 1872 B13R0.147 CCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100000210759 [1,0,0,0,0,0|2,0,1]=4 1873 B13R0.147 CCCCCCCCOCC(=O)CC 1458a_100000759886_100000210202 [1,0,0,0,0,0|1,0,0]=2 1874 B13R0.147 CCCCCCCCOCC(=O)CC 34a_100000725409_100000210759 [1,0,0,0,0,0|1,0,0]=2 1875 B13R0.147 CCCCCCCCOCC(=O)CC 7a_100000210232_100000747405 [1,0,0,0,0,0|1,0,0]=2 1876 B13R0.147 CCCCCCCCOCC(=O)CF 1458a_100000759886_100015361967 [1,0,0,0,0,0|2,0,0]=3 1877 B13R0.147 CCCCCCCCOCC(=O)NC 11a_106832991635_100000759886 [1,0,0,0,0,0|2,0,0]=3 1878 B13R0.147 CCCCCCCCOCC(=O)NC 1626a_100102657272_100000759886 [1,0,0,0,0,0|2,0,0]=3 1879 B13R0.147 CCCCCCCCOCC(=O)NC 240690a_100102657272_100000759886 [1,0,0,0,0,0|2,0,0]=3 1880 B13R0.147 CCCCCCCCOCC(=O)NC 34a_100000210232_100000183359 [1,0,0,0,0,0|2,0,0]=3 1881 B13R0.147 CCCCCCCCOCC(=O)NC 34a_100000750040_100000210759 [1,0,0,0,0,0|2,0,0]=3 1882 B13R0.147 CCCCCCCCOCC(=O)NC 527a_100102657272_100000759886 [1,0,0,0,0,0|2,0,0]=3 1883 B13R0.147 CCCCCCCCOCC(=O)NC 7a_100000210232_100000183359 [1,0,0,0,0,0|2,0,0]=3 1884 B13R0.147 CCCCCCCCOCC(=O)OC 34a_100000210232_100000747449 [1,0,0,0,0,0|1,0,0]=2 1885 B13R0.147 CCCCCCCCOCC(=O)OC 7a_100000210232_100000747449 [1,0,0,0,0,0|1,0,0]=2 1886 B13R0.147 CCCCCCCCOCC(C)CC 34a_100000210232_100000748023 [1,0,0,0,0,0|2,0,1]=4 1887 B13R0.147 CCCCCCCCOCC(C)CC 7a_100000210232_100000748023 [1,0,0,0,0,0|2,0,1]=4 1888 B13R0.147 CCCCCCCCOCC(C)OC 34a_100000690652_100000210759 [1,0,0,0,0,0|2,0,1]=4 1889 B13R0.147 CCCCCCCCOCC(O)CC 34a_100000210232_100011218378 [1,0,0,0,0,0|1,0,2]=4 1890 B13R0.147 CCCCCCCCOCC(O)CC 7a_100000210232_100011218378 [1,0,0,0,0,0|1,0,2]=4 1891 B13R0.147 CCCCCCCCOC[C@@H](C)CC 34a_100000210232_100009816398 [1,0,0,0,0,0|2,0,1]=4 1892 B13R0.147 CCCCCCCCOC[C@@H](C)CC 7a_100000210232_100009816398 [1,0,0,0,0,0|2,0,1]=4 1893 B13R0.147 CCCCCCCCOC[C@@H](C)CC 7a_100009816381_100000210759 [1,0,0,0,0,0|2,0,1]=4 1894 B13R0.147 CCCCCCCCSCC(=O)CC 62a_100000210759_100000747405 [1,0,0,0,0,0|1,0,0]=2 1895 B13R0.147 CCCCCCCCSCC(=O)CC 62a_100000747405_100000210317 [1,0,0,0,0,0|1,0,0]=2 1896 B13R0.147 CCCCCCCCSCC(=O)NC 62a_100000183359_100000210317 [1,0,0,0,0,0|2,0,0]=3 1897 B13R0.147 CCCCCCCCSCC(=O)NC 62a_100000210759_100000183359 [1,0,0,0,0,0|2,0,0]=3 1898 B13R0.147 CCCCCCCCSCC(=O)OC 62a_100000210759_100000747449 [1,0,0,0,0,0|1,0,0]=2 1899 B13R0.147 CCCCCCCCSCC(=O)OC 62a_100000747449_100000210317 [1,0,0,0,0,0|1,0,0]=2 1900 B13R0.147 CCCCCCCCSCC(O)CC 62a_100000210759_100011218378 [1,0,0,0,0,0|1,0,2]=4 1901 B13R0.147 CCCCCCCCSCC(O)CC 62a_100011218378_100000210317 [1,0,0,0,0,0|1,0,2]=4 1902 B13R0.147 CCCCCCCNCCC(=O)NC 2230a_100000229938_100000737683 [1,0,0,0,0,0|2,0,0]=3 1903 B13R0.147 CCCCCCCNCCC(=O)NC 2230a_100000738227_100000210681 [1,0,0,0,0,0|2,0,0]=3 1904 B13R0.147 CCCCCCCNCCC(=O)NC 34a_100000738227_100000210614 [1,0,0,0,0,0|2,0,0]=3 1905 B13R0.147 CCCCCCCNCCC(=O)OC 2230a_100000229938_100000204255 [1,0,0,0,0,0|1,0,0]=2 1906 B13R0.147 CCCCCCCNCCC(C)CC 2230a_100020591266_100000210681 [1,0,0,0,0,0|2,0,1]=4 1907 B13R0.147 CCCCCCCOCCC(=O)NC 34a_100000210272_100012179268 [1,0,0,0,0,0|2,0,0]=3 1908 B13R0.147 CCCCCCCOCCC(=O)NC 34a_100000754576_100000210614 [1,0,0,0,0,0|2,0,0]=3 1909 B13R0.147 CCCCCCCOCCC(=O)NC 7a_100000210272_100000737683 [1,0,0,0,0,0|2,0,0]=3 1910 B13R0.147 CCCCCCCOCCC(=O)OC 34a_100000210272_100000742370 [1,0,0,0,0,0|1,0,0]=2 1911 B13R0.147 CCCCCCCOCCC(=O)OC 7a_100000210272_100000204255 [1,0,0,0,0,0|1,0,0]=2 1912 B13R0.147 CCCCCCCOCCC(C)CC 7a_100011215188_100000210614 [1,0,0,0,0,0|2,0,1]=4 1913 B13R0.147 CCCCCCCOCCC(C)OC 7a_100000764861_100000210614 [1,0,0,0,0,0|2,0,1]=4 1914 B13R0.147 CCCCCCCSCCC(=O)NC 62a_100000210614_100000737683 [1,0,0,0,0,0|2,0,0]=3 1915 B13R0.147 CCCCCCCSCCC(=O)NC 62a_100000737683_100000210316 [1,0,0,0,0,0|2,0,0]=3 1916 B13R0.147 CCCCCCCSCCC(=O)OC 62a_100000204255_100000210316 [1,0,0,0,0,0|1,0,0]=2 1917 B13R0.147 CCCCCCCSCCC(=O)OC 62a_100000210614_100000204255 [1,0,0,0,0,0|1,0,0]=2 1918 B13R0.147 CCCCCCCSCOC(=O)OC 62a_100000210614_100000139417 [1,0,0,0,0,0|2,0,0]=3 1919 B13R0.147 CCCCCCNC/C=C/C(=O)OC 2230a_100000210581_100000742655 [1,0,0,0,0,0|1,0,2]=4 1920 B13R0.147 CCCCCCNCCCC(=O)NC 2230a_100000210581_100000741757 [1,0,0,0,0,0|2,0,0]=3 1921 B13R0.147 CCCCCCNCCCC(=O)NC 2230a_100000740002_100000210314 [1,0,0,0,0,0|2,0,0]=3 1922 B13R0.147 CCCCCCNCCCC(=O)NC 34a_100000740002_100000210314 [1,0,0,0,0,0|2,0,0]=3 1923 B13R0.147 CCCCCCNCCCC(=O)OC 2230a_100000210581_100011218270 [1,0,0,0,0,0|1,0,0]=2 1924 B13R0.147 CCCCCCNCCCN(C)CC 2230a_100000210581_100015186262 [1,0,0,0,0,0|3,0,0]=4 1925 B13R0.147 CCCCCCNCCNC(=O)CC 34a_100132302217_100000210314 [1,0,0,0,0,0|2,0,0]=3 1926 B13R0.147 CCCCCCNCCNC(=O)NC 34a_100015205895_100000210314 [1,0,0,0,0,0|3,0,0]=4 1927 B13R0.147 CCCCCCOC/C=C/C(=O)OC 34a_100000210259_100000742655 [1,0,0,0,0,0|1,0,2]=4 1928 B13R0.147 CCCCCCOC/C=C/C(=O)OC 7a_100000210259_100000742655 [1,0,0,0,0,0|1,0,2]=4 1929 B13R0.147 CCCCCCOCCCC(=O)NC 34a_100000210259_100000741757 [1,0,0,0,0,0|2,0,0]=3 1930 B13R0.147 CCCCCCOCCCC(=O)NC 7a_100000210259_100000741757 [1,0,0,0,0,0|2,0,0]=3 1931 B13R0.147 CCCCCCOCCCC(=O)NN 34a_100000211488_100000210314 [1,0,0,0,0,0|3,0,0]=4 1932 B13R0.147 CCCCCCOCCCC(=O)OC 34a_100000210259_100000742333 [1,0,0,0,0,0|1,0,0]=2 1933 B13R0.147 CCCCCCOCCCC(=O)OC 7a_100000210259_100011218270 [1,0,0,0,0,0|1,0,0]=2 1934 B13R0.147 CCCCCCOCCCC(C)CC 7a_100011216074_100000210314 [1,0,0,0,0,0|2,0,1]=4 1935 B13R0.147 CCCCCCOCCCN(C)CC 7a_100000210259_100015186262 [1,0,0,0,0,0|3,0,0]=4 1936 B13R0.147 CCCCCCOCCNC(=O)CC 34a_200000158885_100000210314 [1,0,0,0,0,0|2,0,0]=3 1937 B13R0.147 CCCCCCOCCNC(=O)CC 7a_200000158885_100000210314 [1,0,0,0,0,0|2,0,0]=3 1938 B13R0.147 CCCCCCOCCNC(=O)OC 34a_100000757965_100000210314 [1,0,0,0,0,0|2,0,0]=3 1939 B13R0.147 CCCCCCOCCOC(=O)CC 7a_200000031056_100000210314 [1,0,0,0,0,0|2,0,0]=3 1940 B13R0.147 CCCCCCOCCOC(=O)NC 34a_100000210259_200011997002 [1,0,0,0,0,0|3,0,0]=4 1941 B13R0.147 CCCCCCOCCOC(=O)NC 7a_100000210259_200011997002 [1,0,0,0,0,0|3,0,0]=4 1942 B13R0.147 CCCCCCOCCOC(=O)OC 34a_100010262106_100000210314 [1,0,0,0,0,0|2,0,0]=3 1943 B13R0.147 CCCCCCSC/C=C/C(=O)OC 62a_100000210314_100000742655 [1,0,0,0,0,0|1,0,2]=4 1944 B13R0.147 CCCCCCSC/C=C/C(=O)OC 62a_100000742655_100000210757 [1,0,0,0,0,0|1,0,2]=4 1945 B13R0.147 CCCCCCSCCCC(=O)NC 62a_100000210314_100000741757 [1,0,0,0,0,0|2,0,0]=3 1946 B13R0.147 CCCCCCSCCCC(=O)NC 62a_100000741757_100000210757 [1,0,0,0,0,0|2,0,0]=3 1947 B13R0.147 CCCCCCSCCCC(=O)OC 62a_100000210314_100011218270 [1,0,0,0,0,0|1,0,0]=2 1948 B13R0.147 CCCCCCSCCCC(=O)OC 62a_100011218270_100000210757 [1,0,0,0,0,0|1,0,0]=2 1949 B13R0.147 CCCCCCSCCCN(C)CC 62a_100000210314_100015186262 [1,0,0,0,0,0|3,0,0]=4 1950 B13R0.147 CCCCCCSCCOC(=O)NC 62a_100000210314_200011997002 [1,0,0,0,0,0|3,0,0]=4 1951 B13R0.147 CCCCCCSCCOC(=O)NC 62a_200011997002_100000210757 [1,0,0,0,0,0|3,0,0]=4 1952 B13R0.147 CCCCCNCCCCC(=O)OC 2230a_100000209983_100000204269 [1,0,0,0,0,0|1,0,0]=2 1953 B13R0.147 CCCCCNCCOCC(=O)NC 34a_100000224656_100000183359 [1,0,0,0,0,0|3,0,0]=4 1954 B13R0.147 CCCCCNCCOCC(=O)OC 2230a_100000209983_100000090808 [1,0,0,0,0,0|2,0,0]=3 1955 B13R0.147 CCCCCNCCOCC(=O)OC 34a_100000224656_100000747449 [1,0,0,0,0,0|2,0,0]=3 1956 B13R0.147 CCCCCNN=CCCC(=O)OC 4a_100000694160_100012047195 [1,0,0,0,0,0|2,0,1]=4 1957 B13R0.147 CCCCCOCCCCC(=O)OC 34a_100000059025_100000718602 [1,0,0,0,0,0|1,0,0]=2 1958 B13R0.147 CCCCCOCCCCC(=O)OC 34a_100000210253_100000204269 [1,0,0,0,0,0|1,0,0]=2 1959 B13R0.147 CCCCCOCCCCC(=O)OC 7a_100000059025_100000210326 [1,0,0,0,0,0|1,0,0]=2 1960 B13R0.147 CCCCCOCCCCC(=O)OC 7a_100000210253_100000204269 [1,0,0,0,0,0|1,0,0]=2 1961 B13R0.147 CCCCCOCCOCC(=O)CC 7a_100011215259_100000747405 [1,0,0,0,0,0|2,0,0]=3 1962 B13R0.147 CCCCCOCCOCC(=O)NC 34a_100011215259_100000183359 [1,0,0,0,0,0|3,0,0]=4 1963 B13R0.147 CCCCCOCCOCC(=O)NC 7a_100011215259_100000183359 [1,0,0,0,0,0|3,0,0]=4 1964 B13R0.147 CCCCCOCCOCC(=O)OC 34a_100000210253_100000090808 [1,0,0,0,0,0|2,0,0]=3 1965 B13R0.147 CCCCCOCCOCC(=O)OC 34a_100011215259_100000747449 [1,0,0,0,0,0|2,0,0]=3 1966 B13R0.147 CCCCCOCCOCC(=O)OC 7a_100000210253_100000090808 [1,0,0,0,0,0|2,0,0]=3 1967 B13R0.147 CCCCCOCCOCC(=O)OC 7a_100011215259_100000747449 [1,0,0,0,0,0|2,0,0]=3 1968 B13R0.147 CCCCCSCCCCC(=O)OC 62a_100000204269_100000210326 [1,0,0,0,0,0|1,0,0]=2 1969 B13R0.147 CCCCCSCCCCC(=O)OC 62a_100000210326_100000204269 [1,0,0,0,0,0|1,0,0]=2 1970 B13R0.147 CCCCCSCCOCC(=O)OC 62a_100000090808_100000210326 [1,0,0,0,0,0|2,0,0]=3 1971 B13R0.147 CCCCCSCCOCC(=O)OC 62a_100000210326_100000090808 [1,0,0,0,0,0|2,0,0]=3 1972 B13R0.147 CCCCNCCCCCC(=O)OC 2230a_100000102301_100009816466 [1,0,0,0,0,0|1,0,0]=2 1973 B13R0.147 CCCCNCCCCCC(=O)OC 7a_106832991798_100009816466 [1,0,0,0,0,0|1,0,0]=2 1974 B13R0.147 CCCCNN=CCCCC(=O)OC 4a_100025702795_100000094087 [1,0,0,0,0,0|2,0,1]=4 1975 B13R0.147 CCCCOCCCCCC(=O)OC 34a_100000074720_100000210210 [1,0,0,0,0,0|1,0,0]=2 1976 B13R0.147 CCCCOCCCCCC(=O)OC 34a_100000210227_100009816466 [1,0,0,0,0,0|1,0,0]=2 1977 B13R0.147 CCCCOCCCCCC(=O)OC 7a_100000074720_100000210211 [1,0,0,0,0,0|1,0,0]=2 1978 B13R0.147 CCCCOCCCCCC(=O)OC 7a_100000210227_100009816466 [1,0,0,0,0,0|1,0,0]=2 1979 B13R0.147 CCCCOCCCCCC(C)CC 7a_200000035636_100000210211 [1,0,0,0,0,0|2,0,1]=4 1980 B13R0.147 CCCCOCCCNCC(=O)NC 2230a_200000211371_100000183359 [1,0,0,0,0,0|3,0,0]=4 1981 B13R0.147 CCCCOCCCNCC(=O)NC 34a_200000211371_100000183359 [1,0,0,0,0,0|3,0,0]=4 1982 B13R0.147 CCCCOCCCNCC(=O)OC 2230a_200000211371_100000747449 [1,0,0,0,0,0|2,0,0]=3 1983 B13R0.147 CCCCOCCCNCC(=O)OC 34a_200000211371_100000747449 [1,0,0,0,0,0|2,0,0]=3 1984 B13R0.147 CCCCOCCCOCC(=O)CC 7a_200011215613_100000747405 [1,0,0,0,0,0|2,0,0]=3 1985 B13R0.147 CCCCOCCCOCC(=O)NC 34a_200011215613_100000183359 [1,0,0,0,0,0|3,0,0]=4 1986 B13R0.147 CCCCOCCCOCC(=O)NC 7a_200011215613_100000183359 [1,0,0,0,0,0|3,0,0]=4 1987 B13R0.147 CCCCOCCCOCC(=O)OC 34a_200011215613_100000747449 [1,0,0,0,0,0|2,0,0]=3 1988 B13R0.147 CCCCOCCCOCC(=O)OC 7a_200011215613_100000747449 [1,0,0,0,0,0|2,0,0]=3 1989 B13R0.147 CCCCOCCNCCC(=O)NC 2230a_100000738227_100000743108 [1,0,0,0,0,0|3,0,0]=4 1990 B13R0.147 CCCCOCCNCCC(=O)NC 34a_100000738227_100000743108 [1,0,0,0,0,0|3,0,0]=4 1991 B13R0.147 CCCCOCCOCCC(=O)NC 34a_100000210238_100012179268 [1,0,0,0,0,0|3,0,0]=4 1992 B13R0.147 CCCCOCCOCCC(=O)NC 34a_100000754576_100000743108 [1,0,0,0,0,0|3,0,0]=4 1993 B13R0.147 CCCCOCCOCCC(=O)NC 7a_100000210238_100000737683 [1,0,0,0,0,0|3,0,0]=4 1994 B13R0.147 CCCCOCCOCCC(=O)OC 34a_100000210238_100000742370 [1,0,0,0,0,0|2,0,0]=3 1995 B13R0.147 CCCCOCCOCCC(=O)OC 7a_100000210238_100000204255 [1,0,0,0,0,0|2,0,0]=3 1996 B13R0.147 CCCCOCCSCCC(=O)NC 62a_100000737683_100000743108 [1,0,0,0,0,0|3,0,0]=4 1997 B13R0.147 CCCCOCCSCCC(=O)NC 62a_100000743108_100000737683 [1,0,0,0,0,0|3,0,0]=4 1998 B13R0.147 CCCCOCCSCCC(=O)OC 62a_100000204255_100000743108 [1,0,0,0,0,0|2,0,0]=3 1999 B13R0.147 CCCCOCCSCCC(=O)OC 62a_100000743108_100000204255 [1,0,0,0,0,0|2,0,0]=3 2000 B13R0.147 CCCCOCCSCOC(=O)OC 62a_100000743108_100000139417 [1,0,0,0,0,0|3,0,0]=4 2001 B13R0.147 CCCCOCNCCCC(=O)NC 2230a_100000740002_100011995733 [1,0,0,0,0,0|3,0,0]=4 2002 B13R0.147 CCCCOCNCCCC(=O)NC 34a_100000740002_100011995733 [1,0,0,0,0,0|3,0,0]=4 2003 B13R0.147 CCCCOCNCCNC(=O)CC 34a_100132302217_100011995733 [1,0,0,0,0,0|3,0,0]=4 2004 B13R0.147 CCCCOCOCCNC(=O)CC 34a_200000158885_100011995733 [1,0,0,0,0,0|3,0,0]=4 2005 B13R0.147 CCCCOCOCCNC(=O)OC 34a_100000757965_100011995733 [1,0,0,0,0,0|3,0,0]=4 2006 B13R0.147 CCCCOCOCCOC(=O)OC 34a_100010262106_100011995733 [1,0,0,0,0,0|3,0,0]=4 2007 B13R0.147 CCCCOCSCCCC(=O)NC 62a_100000741757_100011995733 [1,0,0,0,0,0|3,0,0]=4 2008 B13R0.147 CCCCOCSCCCC(=O)NC 62a_100011995733_100000741757 [1,0,0,0,0,0|3,0,0]=4 2009 B13R0.147 CCCCOCSCCCC(=O)OC 62a_100011218270_100011995733 [1,0,0,0,0,0|2,0,0]=3 2010 B13R0.147 CCCCOCSCCCC(=O)OC 62a_100011995733_100011218270 [1,0,0,0,0,0|2,0,0]=3 2011 B13R0.147 CCCCSCCCCCC(=O)OC 62a_100000210211_100009816466 [1,0,0,0,0,0|1,0,0]=2 2012 B13R0.147 CCCCSCCCCCC(=O)OC 62a_100009816466_100000210210 [1,0,0,0,0,0|1,0,0]=2 2013 B13R0.147 CCCCSCCNCCC(=O)NC 2230a_100025743550_100000737683 [1,0,0,0,0,0|3,0,0]=4 2014 B13R0.147 CCCCSCCNCCC(=O)OC 2230a_100025743550_100000204255 [1,0,0,0,0,0|2,0,0]=3 2015 B13R0.147 CCCCSCCOCCC(=O)NC 34a_200000230436_100012179268 [1,0,0,0,0,0|3,0,0]=4 2016 B13R0.147 CCCCSCCOCCC(=O)NC 7a_200000230436_100000737683 [1,0,0,0,0,0|3,0,0]=4 2017 B13R0.147 CCCCSCCOCCC(=O)OC 34a_200000230436_100000742370 [1,0,0,0,0,0|2,0,0]=3 2018 B13R0.147 CCCCSCCOCCC(=O)OC 7a_200000230436_100000204255 [1,0,0,0,0,0|2,0,0]=3 2019 B13R0.147 CCCNN=CCCCCC(=O)OC 4a_100000740057_100000052768 [1,0,0,0,0,0|2,0,1]=4 2020 B13R0.147 CCCOCCCCCCC(=O)OC 34a_100000210258_100009815986 [1,0,0,0,0,0|1,0,0]=2 2021 B13R0.147 CCCOCCCCCCC(=O)OC 34a_100009863599_100000210303 [1,0,0,0,0,0|1,0,0]=2 2022 B13R0.147 CCCOCCCCCCC(=O)OC 7a_100009863599_100000210303 [1,0,0,0,0,0|1,0,0]=2 2023 B13R0.147 CCCOCCCNCCC(=O)NC 2230a_100011217757_100000737683 [1,0,0,0,0,0|3,0,0]=4 2024 B13R0.147 CCCOCCCNCCC(=O)NC 34a_100011217757_100012179268 [1,0,0,0,0,0|3,0,0]=4 2025 B13R0.147 CCCOCCCNCCC(=O)OC 2230a_100011217757_100000204255 [1,0,0,0,0,0|2,0,0]=3 2026 B13R0.147 CCCOCCCNCCC(=O)OC 34a_100011217757_100000742370 [1,0,0,0,0,0|2,0,0]=3 2027 B13R0.147 CCCOCCNCCCC(=O)NC 2230a_100000740002_100011215938 [1,0,0,0,0,0|3,0,0]=4 2028 B13R0.147 CCCOCCNCCCC(=O)NC 2230a_100161115042_100000741757 [1,0,0,0,0,0|3,0,0]=4 2029 B13R0.147 CCCOCCNCCCC(=O)NC 34a_100000740002_100011215938 [1,0,0,0,0,0|3,0,0]=4 2030 B13R0.147 CCCOCCNCCCC(=O)NC 34a_100161115042_100000741757 [1,0,0,0,0,0|3,0,0]=4 2031 B13R0.147 CCCOCCNCCCC(=O)OC 2230a_100161115042_100011218270 [1,0,0,0,0,0|2,0,0]=3 2032 B13R0.147 CCCOCCNCCCC(=O)OC 34a_100161115042_100000742333 [1,0,0,0,0,0|2,0,0]=3 2033 B13R0.147 CCCOCCNCCNC(=O)CC 34a_100132302217_100011215938 [1,0,0,0,0,0|3,0,0]=4 2034 B13R0.147 CCCOCCOCCCC(=O)NC 34a_100000752267_100000741757 [1,0,0,0,0,0|3,0,0]=4 2035 B13R0.147 CCCOCCOCCCC(=O)NC 7a_100000752267_100000741757 [1,0,0,0,0,0|3,0,0]=4 2036 B13R0.147 CCCOCCOCCCC(=O)OC 34a_100000752267_100000742333 [1,0,0,0,0,0|2,0,0]=3 2037 B13R0.147 CCCOCCOCCCC(=O)OC 7a_100000752267_100011218270 [1,0,0,0,0,0|2,0,0]=3 2038 B13R0.147 CCCOCCOCCNC(=O)CC 11a_200011904461_100000210414 [1,0,0,0,0,0|3,0,0]=4 2039 B13R0.147 CCCOCCOCCNC(=O)CC 1626a_200011904461_100000210414 [1,0,0,0,0,0|3,0,0]=4 2040 B13R0.147 CCCOCCOCCNC(=O)CC 240690a_200011904461_100000210414 [1,0,0,0,0,0|3,0,0]=4 2041 B13R0.147 CCCOCCOCCNC(=O)CC 34a_200000158885_100011215938 [1,0,0,0,0,0|3,0,0]=4 2042 B13R0.147 CCCOCCOCCNC(=O)CC 7a_200000158885_100011215938 [1,0,0,0,0,0|3,0,0]=4 2043 B13R0.147 CCCOCCOCCNC(=O)OC 34a_100000757965_100011215938 [1,0,0,0,0,0|3,0,0]=4 2044 B13R0.147 CCCOCCOCCOC(=O)CC 7a_200000031056_100011215938 [1,0,0,0,0,0|3,0,0]=4 2045 B13R0.147 CCCOCCOCCOC(=O)OC 34a_100010262106_100011215938 [1,0,0,0,0,0|3,0,0]=4 2046 B13R0.147 CCCOCCSCCCC(=O)NC 62a_100000741757_100011215938 [1,0,0,0,0,0|3,0,0]=4 2047 B13R0.147 CCCOCCSCCCC(=O)NC 62a_100011215938_100000741757 [1,0,0,0,0,0|3,0,0]=4 2048 B13R0.147 CCCOCCSCCCC(=O)OC 62a_100011215938_100011218270 [1,0,0,0,0,0|2,0,0]=3 2049 B13R0.147 CCCOCCSCCCC(=O)OC 62a_100011218270_100011215938 [1,0,0,0,0,0|2,0,0]=3 2050 B13R0.147 CCCSCCCCCCC(=O)OC 62a_100000210303_100009815986 [1,0,0,0,0,0|1,0,0]=2 2051 B13R0.147 CCCSCCCCCCC(=O)OC 62a_100009815986_100000210303 [1,0,0,0,0,0|1,0,0]=2 2052 B13R0.147 CCCSCCNCCCC(=O)NC 2230a_100020603323_100000741757 [1,0,0,0,0,0|3,0,0]=4 2053 B13R0.147 CCCSCCNCCCC(=O)OC 2230a_100020603323_100011218270 [1,0,0,0,0,0|2,0,0]=3 2054 B13R0.147 CCCSCCOCCCC(=O)NC 34a_200000230433_100000741757 [1,0,0,0,0,0|3,0,0]=4 2055 B13R0.147 CCCSCCOCCCC(=O)NC 7a_200000230433_100000741757 [1,0,0,0,0,0|3,0,0]=4 2056 B13R0.147 CCCSCCOCCCC(=O)OC 34a_200000230433_100000742333 [1,0,0,0,0,0|2,0,0]=3 2057 B13R0.147 CCCSCCOCCCC(=O)OC 7a_200000230433_100011218270 [1,0,0,0,0,0|2,0,0]=3 2058 B13R0.147 CCN(C)CCCCCCCCCO 2230a_100000225621_100009813782 [1,0,0,0,0,0|3,0,0]=4 2059 B13R0.147 CCN(C)CCCCCCCCCO 269982a_100000225621_100009813782 [1,0,0,0,0,0|3,0,0]=4 2060 B13R0.147 CCNCCCCCCCC(=O)OC 2230a_100015525214_100010004213 [1,0,0,0,0,0|1,0,0]=2 2061 B13R0.147 CCOCCCCCCCC(=O)OC 34a_100011022521_100000210202 [1,0,0,0,0,0|1,0,0]=2 2062 B13R0.147 CCOCCCCCCCC(=O)OC 34a_100121572206_100010004213 [1,0,0,0,0,0|1,0,0]=2 2063 B13R0.147 CCOCCCCCCCC(=O)OC 7a_100011022521_100000210202 [1,0,0,0,0,0|1,0,0]=2 2064 B13R0.147 CCOCCCNCCCC(=O)NC 2230a_100000210961_100000741757 [1,0,0,0,0,0|3,0,0]=4 2065 B13R0.147 CCOCCCNCCCC(=O)NC 2230a_100000740002_100012232248 [1,0,0,0,0,0|3,0,0]=4 2066 B13R0.147 CCOCCCNCCCC(=O)NC 34a_100000210961_100000741757 [1,0,0,0,0,0|3,0,0]=4 2067 B13R0.147 CCOCCCNCCCC(=O)NC 34a_100000740002_100012232248 [1,0,0,0,0,0|3,0,0]=4 2068 B13R0.147 CCOCCCNCCCC(=O)OC 2230a_100000210961_100011218270 [1,0,0,0,0,0|2,0,0]=3 2069 B13R0.147 CCOCCCNCCCC(=O)OC 34a_100000210961_100000742333 [1,0,0,0,0,0|2,0,0]=3 2070 B13R0.147 CCOCCCNCCNC(=O)CC 34a_100132302217_100012232248 [1,0,0,0,0,0|3,0,0]=4 2071 B13R0.147 CCOCCCOCCCC(=O)NC 34a_100000757476_100000741757 [1,0,0,0,0,0|3,0,0]=4 2072 B13R0.147 CCOCCCOCCCC(=O)NC 7a_100000757476_100000741757 [1,0,0,0,0,0|3,0,0]=4 2073 B13R0.147 CCOCCCOCCCC(=O)OC 34a_100000757476_100000742333 [1,0,0,0,0,0|2,0,0]=3 2074 B13R0.147 CCOCCCOCCCC(=O)OC 7a_100000757476_100011218270 [1,0,0,0,0,0|2,0,0]=3 2075 B13R0.147 CCOCCCOCCNC(=O)CC 34a_200000158885_100012232248 [1,0,0,0,0,0|3,0,0]=4 2076 B13R0.147 CCOCCCOCCNC(=O)CC 7a_200000158885_100012232248 [1,0,0,0,0,0|3,0,0]=4 2077 B13R0.147 CCOCCCOCCNC(=O)OC 34a_100000757965_100012232248 [1,0,0,0,0,0|3,0,0]=4 2078 B13R0.147 CCOCCCOCCOC(=O)CC 7a_200000031056_100012232248 [1,0,0,0,0,0|3,0,0]=4 2079 B13R0.147 CCOCCCOCCOC(=O)OC 34a_100010262106_100012232248 [1,0,0,0,0,0|3,0,0]=4 2080 B13R0.147 CCOCCCSCCCC(=O)NC 62a_100000741757_100012232248 [1,0,0,0,0,0|3,0,0]=4 2081 B13R0.147 CCOCCCSCCCC(=O)NC 62a_100012232248_100000741757 [1,0,0,0,0,0|3,0,0]=4 2082 B13R0.147 CCOCCCSCCCC(=O)OC 62a_100011218270_100012232248 [1,0,0,0,0,0|2,0,0]=3 2083 B13R0.147 CCOCCCSCCCC(=O)OC 62a_100012232248_100011218270 [1,0,0,0,0,0|2,0,0]=3 2084 B13R0.147 CCOCCNCCCCC(=O)OC 2230a_102516460346_100000204269 [1,0,0,0,0,0|2,0,0]=3 2085 B13R0.147 CCOCCNCCCCC(=O)OC 34a_102516460346_100000204269 [1,0,0,0,0,0|2,0,0]=3 2086 B13R0.147 CCOCCNCCOCC(=O)OC 2230a_102516460346_100000090808 [1,0,0,0,0,0|3,0,0]=4 2087 B13R0.147 CCOCCNCCOCC(=O)OC 34a_102516460346_100000090808 [1,0,0,0,0,0|3,0,0]=4 2088 B13R0.147 CCOCCOCCCCC(=O)OC 34a_100000059025_100000210147 [1,0,0,0,0,0|2,0,0]=3 2089 B13R0.147 CCOCCOCCCCC(=O)OC 34a_100000210136_100000204269 [1,0,0,0,0,0|2,0,0]=3 2090 B13R0.147 CCOCCOCCCCC(=O)OC 7a_100000059025_100011215890 [1,0,0,0,0,0|2,0,0]=3 2091 B13R0.147 CCOCCOCCCCC(=O)OC 7a_100000210136_100000204269 [1,0,0,0,0,0|2,0,0]=3 2092 B13R0.147 CCOCCOCCNCC(=O)OC 2230a_100102712874_100000747449 [1,0,0,0,0,0|3,0,0]=4 2093 B13R0.147 CCOCCOCCNCC(=O)OC 34a_100102712874_100000747449 [1,0,0,0,0,0|3,0,0]=4 2094 B13R0.147 CCOCCOCCOCC(=O)CC 34a_100000725409_100011211534 [1,0,0,0,0,0|3,0,0]=4 2095 B13R0.147 CCOCCOCCOCC(=O)CC 7a_100000210240_100000747405 [1,0,0,0,0,0|3,0,0]=4 2096 B13R0.147 CCOCCOCCOCC(=O)OC 34a_100000210136_100000090808 [1,0,0,0,0,0|3,0,0]=4 2097 B13R0.147 CCOCCOCCOCC(=O)OC 34a_100000210240_100000747449 [1,0,0,0,0,0|3,0,0]=4 2098 B13R0.147 CCOCCOCCOCC(=O)OC 34a_100011023656_100000210202 [1,0,0,0,0,0|3,0,0]=4 2099 B13R0.147 CCOCCOCCOCC(=O)OC 7a_100000210136_100000090808 [1,0,0,0,0,0|3,0,0]=4 2100 B13R0.147 CCOCCOCCOCC(=O)OC 7a_100000210240_100000747449 [1,0,0,0,0,0|3,0,0]=4 2101 B13R0.147 CCOCCOCCOCC(=O)OC 7a_100011023656_100000210202 [1,0,0,0,0,0|3,0,0]=4 2102 B13R0.147 CCOCCOCCSCC(=O)CC 62a_100000747405_100011211534 [1,0,0,0,0,0|3,0,0]=4 2103 B13R0.147 CCOCCOCCSCC(=O)CC 62a_100011211534_100000747405 [1,0,0,0,0,0|3,0,0]=4 2104 B13R0.147 CCOCCOCCSCC(=O)OC 62a_100000747449_100011211534 [1,0,0,0,0,0|3,0,0]=4 2105 B13R0.147 CCOCCOCCSCC(=O)OC 62a_100011211534_100000747449 [1,0,0,0,0,0|3,0,0]=4 2106 B13R0.147 CCOCCSCCCCC(=O)OC 62a_100000204269_100011215890 [1,0,0,0,0,0|2,0,0]=3 2107 B13R0.147 CCOCCSCCCCC(=O)OC 62a_100000210147_100000204269 [1,0,0,0,0,0|2,0,0]=3 2108 B13R0.147 CCOCCSCCOCC(=O)OC 62a_100000090808_100011215890 [1,0,0,0,0,0|3,0,0]=4 2109 B13R0.147 CCOCCSCCOCC(=O)OC 62a_100000210147_100000090808 [1,0,0,0,0,0|3,0,0]=4 2110 B13R0.147 CCOCSCCCCCC(=O)OC 62a_100000739092_100009816466 [1,0,0,0,0,0|2,0,0]=3 2111 B13R0.147 CCOCSCCCCCC(=O)OC 62a_100009816466_100000739092 [1,0,0,0,0,0|2,0,0]=3 2112 B13R0.147 CCSCCCCCCCC(=O)OC 62a_100000210202_100010004213 [1,0,0,0,0,0|1,0,0]=2 2113 B13R0.147 CCSCCCCCCCC(=O)OC 62a_100010004213_100000210202 [1,0,0,0,0,0|1,0,0]=2 2114 B13R0.147 CCSCCCOCCCC(=O)NC 34a_100011216438_100000741757 [1,0,0,0,0,0|3,0,0]=4 2115 B13R0.147 CCSCCCOCCCC(=O)NC 7a_100011216438_100000741757 [1,0,0,0,0,0|3,0,0]=4 2116 B13R0.147 CCSCCCOCCCC(=O)OC 34a_100011216438_100000742333 [1,0,0,0,0,0|2,0,0]=3 2117 B13R0.147 CCSCCCOCCCC(=O)OC 7a_100011216438_100011218270 [1,0,0,0,0,0|2,0,0]=3 2118 B13R0.147 CCSCCNCCCCC(=O)OC 2230a_100000106463_100000204269 [1,0,0,0,0,0|2,0,0]=3 2119 B13R0.147 CCSCCNCCOCC(=O)OC 2230a_100000106463_100000090808 [1,0,0,0,0,0|3,0,0]=4 2120 B13R0.147 CCSCCOCCCCC(=O)OC 34a_100000059025_100000757381 [1,0,0,0,0,0|2,0,0]=3 2121 B13R0.147 CCSCCOCCCCC(=O)OC 34a_100000212035_100000204269 [1,0,0,0,0,0|2,0,0]=3 2122 B13R0.147 CCSCCOCCCCC(=O)OC 7a_100000059025_100000757381 [1,0,0,0,0,0|2,0,0]=3 2123 B13R0.147 CCSCCOCCCCC(=O)OC 7a_100000212035_100000204269 [1,0,0,0,0,0|2,0,0]=3 2124 B13R0.147 CCSCCOCCOCC(=O)OC 34a_100000212035_100000090808 [1,0,0,0,0,0|3,0,0]=4 2125 B13R0.147 CCSCCOCCOCC(=O)OC 7a_100000212035_100000090808 [1,0,0,0,0,0|3,0,0]=4 2126 B13R0.147 CCSCCSCCCCC(=O)OC 62a_100000204269_100000757381 [1,0,0,0,0,0|2,0,0]=3 2127 B13R0.147 CCSCCSCCCCC(=O)OC 62a_100000757381_100000204269 [1,0,0,0,0,0|2,0,0]=3 2128 B13R0.147 CCSCCSCCOCC(=O)OC 62a_100000090808_100000757381 [1,0,0,0,0,0|3,0,0]=4 2129 B13R0.147 CCSCCSCCOCC(=O)OC 62a_100000757381_100000090808 [1,0,0,0,0,0|3,0,0]=4 2130 B13R0.147 CNC(=O)CCCCCCCCCF 11a_106832991635_200009909015 [1,0,0,0,0,0|2,0,0]=3 2131 B13R0.147 CNC(=O)CCCCCCCCCF 240690a_100102657272_200009909015 [1,0,0,0,0,0|2,0,0]=3 2132 B13R0.147 CNC(=O)CCCCCCCCCF 527a_100102657272_200009909015 [1,0,0,0,0,0|2,0,0]=3 2133 B13R0.147 CNC(=O)CCCCCCCCCO 240690a_100102657272_100000032657 [1,0,0,0,0,0|2,0,0]=3 2134 B13R0.147 CNC(=O)CCCNCCCCCF 2230a_100000740002_100000729378 [1,0,0,0,0,0|3,0,0]=4 2135 B13R0.147 CNC(=O)CCCNCCCCCF 34a_100000740002_100000729378 [1,0,0,0,0,0|3,0,0]=4 2136 B13R0.147 CNC(=O)CCCNCCCCCO 2230a_100000740002_100000746330 [1,0,0,0,0,0|3,0,0]=4 2137 B13R0.147 CNC(=O)CCCNCCCCCO 2230a_100000762737_100000741757 [1,0,0,0,0,0|3,0,0]=4 2138 B13R0.147 CNC(=O)CCCNCCCCCO 34a_100000740002_100000746330 [1,0,0,0,0,0|3,0,0]=4 2139 B13R0.147 CNC(=O)CCCNCCCCCO 34a_100000762737_100000741757 [1,0,0,0,0,0|3,0,0]=4 2140 B13R0.147 CNC(=O)CCCNCCCCOC 2230a_100000740002_100000730899 [1,0,0,0,0,0|3,0,0]=4 2141 B13R0.147 CNC(=O)CCCNCCCCOC 34a_100000740002_100000755781 [1,0,0,0,0,0|3,0,0]=4 2142 B13R0.147 CNC(=O)CCCOCCCCCBr 34a_100000746331_100000741757 [1,0,0,0,0,0|3,0,0]=4 2143 B13R0.147 CNC(=O)CCCOCCCCCBr 7a_100000746331_100000741757 [1,0,0,0,0,0|3,0,0]=4 2144 B13R0.147 CNC(=O)CCCOCCCCCCl 34a_100000746330_100000741757 [1,0,0,0,0,0|3,0,0]=4 2145 B13R0.147 CNC(=O)CCCOCCCCCCl 7a_100000746330_100000741757 [1,0,0,0,0,0|3,0,0]=4 2146 B13R0.147 CNC(=O)CCCOCCCCCI 34a_200012148887_100000741757 [1,0,0,0,0,0|3,0,0]=4 2147 B13R0.147 CNC(=O)CCCOCCCCCI 7a_200012148887_100000741757 [1,0,0,0,0,0|3,0,0]=4 2148 B13R0.147 CNC(=O)CCCOCCCCCN 34a_100000762737_100000741757 [1,0,0,0,0,0|3,0,0]=4 2149 B13R0.147 CNC(=O)CCCOCCCCOC 34a_100000740925_100000741757 [1,0,0,0,0,0|3,0,0]=4 2150 B13R0.147 CNC(=O)CCCOCCCCSC 34a_100011217163_100000741757 [1,0,0,0,0,0|3,0,0]=4 2151 B13R0.147 CNC(=O)CCCOCCCCSC 7a_100011217163_100000741757 [1,0,0,0,0,0|3,0,0]=4 2152 B13R0.147 CNC(=O)CCCSCCCCCF 62a_100000729378_100000741757 [1,0,0,0,0,0|3,0,0]=4 2153 B13R0.147 CNC(=O)CCCSCCCCCF 62a_100000741757_100000729378 [1,0,0,0,0,0|3,0,0]=4 2154 B13R0.147 CNC(=O)CCCSCCCCCO 62a_100000741757_100000746330 [1,0,0,0,0,0|3,0,0]=4 2155 B13R0.147 CNC(=O)CCCSCCCCCO 62a_100000746330_100000741757 [1,0,0,0,0,0|3,0,0]=4 2156 B13R0.147 CNC(=O)CCCSCCCCOC 62a_100000730899_100000741757 [1,0,0,0,0,0|3,0,0]=4 2157 B13R0.147 CNC(=O)CCCSCCCCOC 62a_100000741757_100000730899 [1,0,0,0,0,0|3,0,0]=4 2158 B13R0.147 CNC(=O)CCNCCCCCCF 2230a_100000738227_100015922095 [1,0,0,0,0,0|3,0,0]=4 2159 B13R0.147 CNC(=O)CCNCCCCCCF 34a_100000738227_100015922095 [1,0,0,0,0,0|3,0,0]=4 2160 B13R0.147 CNC(=O)CCNCCCCCCO 2230a_100000686447_100000737683 [1,0,0,0,0,0|3,0,0]=4 2161 B13R0.147 CNC(=O)CCNCCCCCCO 2230a_100000738227_100000766143 [1,0,0,0,0,0|3,0,0]=4 2162 B13R0.147 CNC(=O)CCNCCCCCCO 34a_100000686447_100012179268 [1,0,0,0,0,0|3,0,0]=4 2163 B13R0.147 CNC(=O)CCNCCCCCCO 34a_100000738227_100000766143 [1,0,0,0,0,0|3,0,0]=4 2164 B13R0.147 CNC(=O)CCNCCCCCOC 2230a_100000747528_100000737683 [1,0,0,0,0,0|3,0,0]=4 2165 B13R0.147 CNC(=O)CCNCCCCCOC 34a_100000747528_100012179268 [1,0,0,0,0,0|3,0,0]=4 2166 B13R0.147 CNC(=O)CCOCCCCCCBr 34a_100011215345_100012179268 [1,0,0,0,0,0|3,0,0]=4 2167 B13R0.147 CNC(=O)CCOCCCCCCBr 7a_100011215345_100000737683 [1,0,0,0,0,0|3,0,0]=4 2168 B13R0.147 CNC(=O)CCOCCCCCCCl 34a_100000766143_100012179268 [1,0,0,0,0,0|3,0,0]=4 2169 B13R0.147 CNC(=O)CCOCCCCCCCl 7a_100000766143_100000737683 [1,0,0,0,0,0|3,0,0]=4 2170 B13R0.147 CNC(=O)CCOCCCCCCF 34a_100000732779_100012179268 [1,0,0,0,0,0|3,0,0]=4 2171 B13R0.147 CNC(=O)CCOCCCCCCF 34a_100000754576_100015922095 [1,0,0,0,0,0|3,0,0]=4 2172 B13R0.147 CNC(=O)CCOCCCCCCF 7a_100000732779_100000737683 [1,0,0,0,0,0|3,0,0]=4 2173 B13R0.147 CNC(=O)CCOCCCCCCN 34a_100000686447_100012179268 [1,0,0,0,0,0|3,0,0]=4 2174 B13R0.147 CNC(=O)CCOCCCCCCO 34a_100000754576_100000766143 [1,0,0,0,0,0|3,0,0]=4 2175 B13R0.147 CNC(=O)CCSCCCCCCF 62a_100000737683_100015922095 [1,0,0,0,0,0|3,0,0]=4 2176 B13R0.147 CNC(=O)CCSCCCCCCF 62a_100015922095_100000737683 [1,0,0,0,0,0|3,0,0]=4 2177 B13R0.147 CNC(=O)CCSCCCCCCO 62a_100000737683_100000766143 [1,0,0,0,0,0|3,0,0]=4 2178 B13R0.147 CNC(=O)CCSCCCCCCO 62a_100000766143_100000737683 [1,0,0,0,0,0|3,0,0]=4 2179 B13R0.147 CNC(=O)CNCCCCCCCO 2230a_100000693194_100000760002 [1,0,0,0,0,0|3,0,0]=4 2180 B13R0.147 CNC(=O)CNCCCCCCCO 2230a_100011996573_100000183359 [1,0,0,0,0,0|3,0,0]=4 2181 B13R0.147 CNC(=O)CNCCCCCCCO 34a_100011996573_100000183359 [1,0,0,0,0,0|3,0,0]=4 2182 B13R0.147 CNC(=O)CNCCCCCCOC 2230a_100000693194_100011998445 [1,0,0,0,0,0|3,0,0]=4 2183 B13R0.147 CNC(=O)COCCCCCCCBr 34a_100000760002_100000183359 [1,0,0,0,0,0|3,0,0]=4 2184 B13R0.147 CNC(=O)COCCCCCCCBr 7a_100000760002_100000183359 [1,0,0,0,0,0|3,0,0]=4 2185 B13R0.147 CNC(=O)COCCCCCCCN 34a_100011996573_100000183359 [1,0,0,0,0,0|3,0,0]=4 2186 B13R0.147 CNC(=O)COCCCCCCCO 34a_100000750040_100000760002 [1,0,0,0,0,0|3,0,0]=4 2187 B13R0.147 CNC(=O)COCCCCCCOC 34a_100000750040_100011998445 [1,0,0,0,0,0|3,0,0]=4 2188 B13R0.147 CNC(=O)COCCCCCCOC 34a_200012092642_100000183359 [1,0,0,0,0,0|3,0,0]=4 2189 B13R0.147 CNC(=O)COCCCCCCOC 7a_200012092642_100000183359 [1,0,0,0,0,0|3,0,0]=4 2190 B13R0.147 CNC(=O)CSCCCCCCCO 62a_100000183359_100000760002 [1,0,0,0,0,0|3,0,0]=4 2191 B13R0.147 CNC(=O)CSCCCCCCCO 62a_100000760002_100000183359 [1,0,0,0,0,0|3,0,0]=4 2192 B13R0.147 CNC(=O)CSCCCCCCOC 62a_100000183359_100011998445 [1,0,0,0,0,0|3,0,0]=4 2193 B13R0.147 CNC(=O)CSCCCCCCOC 62a_100011998445_100000183359 [1,0,0,0,0,0|3,0,0]=4 2194 B13R0.147 CNC(=O)NCCCCCCCCO 2708a_100102657272_102515433106 [1,0,0,0,0,0|3,0,0]=4 2195 B13R0.147 CNC(=O)NCCCCCCCCO 2708a_102515433106_106832991635 [1,0,0,0,0,0|3,0,0]=4 2196 B13R0.147 CNC(=O)NCCCCCCCCO 273464a_100102657272_102515433106 [1,0,0,0,0,0|3,0,0]=4 2197 B13R0.147 CNC(=O)NCCCCCCCCO 273464a_102515433106_100102657272 [1,0,0,0,0,0|3,0,0]=4 2198 B13R0.147 CNC(=O)NCCCCCCCCO 512a_102515433106_100102657272 [1,0,0,0,0,0|3,0,0]=4 2199 B13R0.147 CNC(=O)NCCCCCCCCO 512a_106832991638_102515433106 [1,0,0,0,0,0|3,0,0]=4 2200 B13R0.147 CNCCCCCCCCC(=O)OC 2230a_106832991635_100010282707 [1,0,0,0,0,0|1,0,0]=2 2201 B13R0.147 CNCCCCCCCCC(=O)OC 34a_100102657272_100010282707 [1,0,0,0,0,0|1,0,0]=2 2202 B13R0.147 CNCCCCCCCCC(=O)OC 7a_106832991635_100010282707 [1,0,0,0,0,0|1,0,0]=2 2203 B13R0.147 CNCCCCCOCCC(=O)NC 34a_100000722520_100012179268 [1,0,0,0,0,0|3,0,0]=4 2204 B13R0.147 CNCCCCCOCCC(=O)OC 34a_100000722520_100000742370 [1,0,0,0,0,0|2,0,0]=3 2205 B13R0.147 CNCCCOCCCCC(=O)OC 34a_100000213112_100000204269 [1,0,0,0,0,0|2,0,0]=3 2206 B13R0.147 CNCCCOCCOCC(=O)OC 34a_100000213112_100000090808 [1,0,0,0,0,0|3,0,0]=4 2207 B13R0.147 CNCCOCCOCCC(=O)OC 34a_100000228057_100000742370 [1,0,0,0,0,0|3,0,0]=4 2208 B13R0.147 COC(=O)CCCCCCCCO[13CH3] 34a_100000035544_200025704644 [1,0,0,0,0,0|1,0,0]=2 2209 B13R0.147 COC(=O)CCCCCCCCO[13CH3] 7a_100000035544_200025704644 [1,0,0,0,0,0|1,0,0]=2 2210 B13R0.147 COC(=O)CCCCCCCCSC 62a_100010282707_200000210301 [1,0,0,0,0,0|1,0,0]=2 2211 B13R0.147 COC(=O)CCCCCCCCSC 62a_200000210301_100010282707 [1,0,0,0,0,0|1,0,0]=2 2212 B13R0.147 COC(=O)CCCCCCCCS[13CH3] 62a_100010282707_200025704644 [1,0,0,0,0,0|1,0,0]=2 2213 B13R0.147 COC(=O)CCCCCCCCS[13CH3] 62a_200025704644_100010282707 [1,0,0,0,0,0|1,0,0]=2 2214 B13R0.147 COC(=O)CCCCCCCOCF 34a_100011022521_100015361967 [1,0,0,0,0,0|2,0,0]=3 2215 B13R0.147 COC(=O)CCCCCCCOCF 7a_100011022521_100015361967 [1,0,0,0,0,0|2,0,0]=3 2216 B13R0.147 COC(=O)CCCCCCCSCF 62a_100010004213_100015361967 [1,0,0,0,0,0|2,0,0]=3 2217 B13R0.147 COC(=O)CCCCCCCSCF 62a_100015361967_100010004213 [1,0,0,0,0,0|2,0,0]=3 2218 B13R0.147 COC(=O)CCCCCCNCCF 34a_100000724931_100009815986 [1,0,0,0,0,0|2,0,0]=3 2219 B13R0.147 COC(=O)CCCCCCNCCO 2230a_100016997473_100009815986 [1,0,0,0,0,0|2,0,0]=3 2220 B13R0.147 COC(=O)CCCCCCNCCO 34a_100016990907_100009815986 [1,0,0,0,0,0|2,0,0]=3 2221 B13R0.147 COC(=O)CCCCCCOCC#N 7a_100009863599_100011215382 [1,0,0,0,0,0|2,0,1]=4 2222 B13R0.147 COC(=O)CCCCCCOCC=O 34a_100009863599_200009817547 [1,0,0,0,0,0|2,0,1]=4 2223 B13R0.147 COC(=O)CCCCCCOCC=O 7a_100009863599_200015260668 [1,0,0,0,0,0|2,0,1]=4 2224 B13R0.147 COC(=O)CCCCCCOCCBr 34a_100000211926_100009815986 [1,0,0,0,0,0|2,0,0]=3 2225 B13R0.147 COC(=O)CCCCCCOCCF 34a_100009863599_100011217306 [1,0,0,0,0,0|2,0,0]=3 2226 B13R0.147 COC(=O)CCCCCCOCCF 7a_100009863599_100011217306 [1,0,0,0,0,0|2,0,0]=3 2227 B13R0.147 COC(=O)CCCCCCOCCN 34a_100000210304_100009815986 [1,0,0,0,0,0|2,0,0]=3 2228 B13R0.147 COC(=O)CCCCCCOCCO 34a_100009863599_100000211926 [1,0,0,0,0,0|2,0,0]=3 2229 B13R0.147 COC(=O)CCCCCCOCCO 7a_100009863599_100000211926 [1,0,0,0,0,0|2,0,0]=3 2230 B13R0.147 COC(=O)CCCCCCOCSC 34a_100009863599_100011218213 [1,0,0,0,0,0|2,0,0]=3 2231 B13R0.147 COC(=O)CCCCCCSCC#N 62a_100009815986_100011215382 [1,0,0,0,0,0|2,0,1]=4 2232 B13R0.147 COC(=O)CCCCCCSCC#N 62a_100011215382_100009815986 [1,0,0,0,0,0|2,0,1]=4 2233 B13R0.147 COC(=O)CCCCCCSCC=O 62a_100009815986_200015260668 [1,0,0,0,0,0|2,0,1]=4 2234 B13R0.147 COC(=O)CCCCCCSCC=O 62a_200015260668_100009815986 [1,0,0,0,0,0|2,0,1]=4 2235 B13R0.147 COC(=O)CCCCCCSCCF 62a_100009815986_100011217306 [1,0,0,0,0,0|2,0,0]=3 2236 B13R0.147 COC(=O)CCCCCCSCCF 62a_100011217306_100009815986 [1,0,0,0,0,0|2,0,0]=3 2237 B13R0.147 COC(=O)CCCCCCSCCO 62a_100000211926_100009815986 [1,0,0,0,0,0|2,0,0]=3 2238 B13R0.147 COC(=O)CCCCCCSCCO 62a_100009815986_100000211926 [1,0,0,0,0,0|2,0,0]=3 2239 B13R0.147 COC(=O)CCCCCCSCSC 62a_100009815986_100011218213 [1,0,0,0,0,0|2,0,0]=3 2240 B13R0.147 COC(=O)CCCCCCSCSC 62a_100011218213_100009815986 [1,0,0,0,0,0|2,0,0]=3 2241 B13R0.147 COC(=O)CCCCCNCCCF 2230a_100015189416_100009816466 [1,0,0,0,0,0|2,0,0]=3 2242 B13R0.147 COC(=O)CCCCCNCCCF 34a_100015189416_100009816466 [1,0,0,0,0,0|2,0,0]=3 2243 B13R0.147 COC(=O)CCCCCNCCSC 2230a_100020590264_100009816466 [1,0,0,0,0,0|2,0,0]=3 2244 B13R0.147 COC(=O)CCCCCOCCC#N 7a_100000074720_100000184422 [1,0,0,0,0,0|2,0,1]=4 2245 B13R0.147 COC(=O)CCCCCOCCCBr 34a_100011217188_100009816466 [1,0,0,0,0,0|2,0,0]=3 2246 B13R0.147 COC(=O)CCCCCOCCCCl 34a_100000230001_100009816466 [1,0,0,0,0,0|2,0,0]=3 2247 B13R0.147 COC(=O)CCCCCOCCCF 34a_100000074720_100011934791 [1,0,0,0,0,0|2,0,0]=3 2248 B13R0.147 COC(=O)CCCCCOCCCF 34a_100000759539_100009816466 [1,0,0,0,0,0|2,0,0]=3 2249 B13R0.147 COC(=O)CCCCCOCCCF 7a_100000074720_100011934791 [1,0,0,0,0,0|2,0,0]=3 2250 B13R0.147 COC(=O)CCCCCOCCCN 34a_100000182051_100009816466 [1,0,0,0,0,0|2,0,0]=3 2251 B13R0.147 COC(=O)CCCCCOCCCO 34a_100000074720_100000230001 [1,0,0,0,0,0|2,0,0]=3 2252 B13R0.147 COC(=O)CCCCCOCCCO 7a_100000074720_100011215043 [1,0,0,0,0,0|2,0,0]=3 2253 B13R0.147 COC(=O)CCCCCOCCON 34a_100000700252_100009816466 [1,0,0,0,0,0|3,0,0]=4 2254 B13R0.147 COC(=O)CCCCCOCCSC 34a_100000074720_100000212216 [1,0,0,0,0,0|2,0,0]=3 2255 B13R0.147 COC(=O)CCCCCOCCSC 34a_100000230434_100009816466 [1,0,0,0,0,0|2,0,0]=3 2256 B13R0.147 COC(=O)CCCCCOCCSC 7a_100000074720_100000212216 [1,0,0,0,0,0|2,0,0]=3 2257 B13R0.147 COC(=O)CCCCCOCCSC 7a_100000230434_100009816466 [1,0,0,0,0,0|2,0,0]=3 2258 B13R0.147 COC(=O)CCCCCSCCC#N 62a_100009816466_100011215226 [1,0,0,0,0,0|2,0,1]=4 2259 B13R0.147 COC(=O)CCCCCSCCC#N 62a_100011215226_100009816466 [1,0,0,0,0,0|2,0,1]=4 2260 B13R0.147 COC(=O)CCCCCSCCCF 62a_100009816466_100011934791 [1,0,0,0,0,0|2,0,0]=3 2261 B13R0.147 COC(=O)CCCCCSCCCF 62a_100011934791_100009816466 [1,0,0,0,0,0|2,0,0]=3 2262 B13R0.147 COC(=O)CCCCCSCCCO 62a_100009816466_100011215043 [1,0,0,0,0,0|2,0,0]=3 2263 B13R0.147 COC(=O)CCCCCSCCCO 62a_100011215043_100009816466 [1,0,0,0,0,0|2,0,0]=3 2264 B13R0.147 COC(=O)CCCCCSCCSC 62a_100000212216_100009816466 [1,0,0,0,0,0|2,0,0]=3 2265 B13R0.147 COC(=O)CCCCCSCCSC 62a_100009816466_100000751147 [1,0,0,0,0,0|2,0,0]=3 2266 B13R0.147 COC(=O)CCCCNCCCCO 2230a_100000750430_100000204269 [1,0,0,0,0,0|2,0,0]=3 2267 B13R0.147 COC(=O)CCCCNCCCCO 34a_100000750430_100000204269 [1,0,0,0,0,0|2,0,0]=3 2268 B13R0.147 COC(=O)CCCCNCCCSC 2230a_100000749238_100000204269 [1,0,0,0,0,0|2,0,0]=3 2269 B13R0.147 COC(=O)CCCCOCCCC#N 7a_100000059025_100000687738 [1,0,0,0,0,0|2,0,1]=4 2270 B13R0.147 COC(=O)CCCCOCCCC=O 7a_100000059025_200011292268 [1,0,0,0,0,0|2,0,1]=4 2271 B13R0.147 COC(=O)CCCCOCCCCBr 34a_100011216708_100000204269 [1,0,0,0,0,0|2,0,0]=3 2272 B13R0.147 COC(=O)CCCCOCCCCCl 34a_100000210776_100000204269 [1,0,0,0,0,0|2,0,0]=3 2273 B13R0.147 COC(=O)CCCCOCCCCCl 7a_100000210776_100000204269 [1,0,0,0,0,0|2,0,0]=3 2274 B13R0.147 COC(=O)CCCCOCCCCF 34a_100000059025_100000729493 [1,0,0,0,0,0|2,0,0]=3 2275 B13R0.147 COC(=O)CCCCOCCCCF 34a_100011995726_100000204269 [1,0,0,0,0,0|2,0,0]=3 2276 B13R0.147 COC(=O)CCCCOCCCCF 7a_100000059025_100000729493 [1,0,0,0,0,0|2,0,0]=3 2277 B13R0.147 COC(=O)CCCCOCCCCF 7a_100011995726_100000204269 [1,0,0,0,0,0|2,0,0]=3 2278 B13R0.147 COC(=O)CCCCOCCCCI 34a_200012148704_100000204269 [1,0,0,0,0,0|2,0,0]=3 2279 B13R0.147 COC(=O)CCCCOCCCCN 34a_100000750430_100000204269 [1,0,0,0,0,0|2,0,0]=3 2280 B13R0.147 COC(=O)CCCCOCCCCO 34a_100000059025_100011216708 [1,0,0,0,0,0|2,0,0]=3 2281 B13R0.147 COC(=O)CCCCOCCCCO 7a_100000059025_100000210776 [1,0,0,0,0,0|2,0,0]=3 2282 B13R0.147 COC(=O)CCCCOCCCSC 34a_100000690336_100000204269 [1,0,0,0,0,0|2,0,0]=3 2283 B13R0.147 COC(=O)CCCCOCCCSC 7a_100000690336_100000204269 [1,0,0,0,0,0|2,0,0]=3 2284 B13R0.147 COC(=O)CCCCSCCCC#N 62a_100000204269_100000687738 [1,0,0,0,0,0|2,0,1]=4 2285 B13R0.147 COC(=O)CCCCSCCCC#N 62a_100000687738_100000204269 [1,0,0,0,0,0|2,0,1]=4 2286 B13R0.147 COC(=O)CCCCSCCCC=O 62a_100000204269_200011292268 [1,0,0,0,0,0|2,0,1]=4 2287 B13R0.147 COC(=O)CCCCSCCCC=O 62a_200011292268_100000204269 [1,0,0,0,0,0|2,0,1]=4 2288 B13R0.147 COC(=O)CCCCSCCCCF 62a_100000204269_100000729493 [1,0,0,0,0,0|2,0,0]=3 2289 B13R0.147 COC(=O)CCCCSCCCCF 62a_100000729493_100000204269 [1,0,0,0,0,0|2,0,0]=3 2290 B13R0.147 COC(=O)CCCCSCCCCO 62a_100000204269_100000210776 [1,0,0,0,0,0|2,0,0]=3 2291 B13R0.147 COC(=O)CCCCSCCCCO 62a_100000210776_100000204269 [1,0,0,0,0,0|2,0,0]=3 2292 B13R0.147 COC(=O)CCCNCCCCCO 2230a_100000762737_100011218270 [1,0,0,0,0,0|2,0,0]=3 2293 B13R0.147 COC(=O)CCCNCCCCCO 34a_100000762737_100000742333 [1,0,0,0,0,0|2,0,0]=3 2294 B13R0.147 COC(=O)CCCNCCOCCO 2230a_100000211614_100011218270 [1,0,0,0,0,0|3,0,0]=4 2295 B13R0.147 COC(=O)CCCNCCOCCO 34a_100000211614_100000742333 [1,0,0,0,0,0|3,0,0]=4 2296 B13R0.147 COC(=O)CCCNCCSCCO 2230a_100011219999_100011218270 [1,0,0,0,0,0|3,0,0]=4 2297 B13R0.147 COC(=O)CCCOCCCCCBr 34a_100000746331_100000742333 [1,0,0,0,0,0|2,0,0]=3 2298 B13R0.147 COC(=O)CCCOCCCCCBr 7a_100000746331_100011218270 [1,0,0,0,0,0|2,0,0]=3 2299 B13R0.147 COC(=O)CCCOCCCCCCl 34a_100000746330_100000742333 [1,0,0,0,0,0|2,0,0]=3 2300 B13R0.147 COC(=O)CCCOCCCCCCl 7a_100000746330_100011218270 [1,0,0,0,0,0|2,0,0]=3 2301 B13R0.147 COC(=O)CCCOCCCCCI 34a_200012148887_100000742333 [1,0,0,0,0,0|2,0,0]=3 2302 B13R0.147 COC(=O)CCCOCCCCCI 7a_200012148887_100011218270 [1,0,0,0,0,0|2,0,0]=3 2303 B13R0.147 COC(=O)CCCOCCCCCN 34a_100000762737_100000742333 [1,0,0,0,0,0|2,0,0]=3 2304 B13R0.147 COC(=O)CCCOCCCCSC 34a_100011217163_100000742333 [1,0,0,0,0,0|2,0,0]=3 2305 B13R0.147 COC(=O)CCCOCCCCSC 7a_100011217163_100011218270 [1,0,0,0,0,0|2,0,0]=3 2306 B13R0.147 COC(=O)CCCOCCOCCBr 34a_100000692535_100000742333 [1,0,0,0,0,0|3,0,0]=4 2307 B13R0.147 COC(=O)CCCOCCOCCBr 7a_100000692535_100011218270 [1,0,0,0,0,0|3,0,0]=4 2308 B13R0.147 COC(=O)CCCOCCOCCCl 34a_100011215305_100000742333 [1,0,0,0,0,0|3,0,0]=4 2309 B13R0.147 COC(=O)CCCOCCOCCCl 7a_100011215305_100011218270 [1,0,0,0,0,0|3,0,0]=4 2310 B13R0.147 COC(=O)CCCOCCOCCF 34a_200015357709_100000742333 [1,0,0,0,0,0|3,0,0]=4 2311 B13R0.147 COC(=O)CCCOCCOCCF 7a_200015357709_100011218270 [1,0,0,0,0,0|3,0,0]=4 2312 B13R0.147 COC(=O)CCCOCCOCCI 34a_100012149058_100000742333 [1,0,0,0,0,0|3,0,0]=4 2313 B13R0.147 COC(=O)CCCOCCOCCI 7a_100012149058_100011218270 [1,0,0,0,0,0|3,0,0]=4 2314 B13R0.147 COC(=O)CCCOCCOCCN 34a_100000211614_100000742333 [1,0,0,0,0,0|3,0,0]=4 2315 B13R0.147 COC(=O)CCCSCCCCC#N 62a_100011218270_100000211819 [1,0,0,0,0,0|2,0,1]=4 2316 B13R0.147 COC(=O)CCCSCCCCC#N 62a_100011219923_100011218270 [1,0,0,0,0,0|2,0,1]=4 2317 B13R0.147 COC(=O)CCCSCCCCC=O 62a_100000139335_100011218270 [1,0,0,0,0,0|2,0,1]=4 2318 B13R0.147 COC(=O)CCCSCCCCC=O 62a_100011218270_100000139335 [1,0,0,0,0,0|2,0,1]=4 2319 B13R0.147 COC(=O)CCCSCCCCCF 62a_100000729378_100011218270 [1,0,0,0,0,0|2,0,0]=3 2320 B13R0.147 COC(=O)CCCSCCCCCF 62a_100011218270_100000729378 [1,0,0,0,0,0|2,0,0]=3 2321 B13R0.147 COC(=O)CCCSCCCCCO 62a_100000746330_100011218270 [1,0,0,0,0,0|2,0,0]=3 2322 B13R0.147 COC(=O)CCCSCCCCCO 62a_100011218270_100000746330 [1,0,0,0,0,0|2,0,0]=3 2323 B13R0.147 COC(=O)CCCSCCOCCO 62a_100011215305_100011218270 [1,0,0,0,0,0|3,0,0]=4 2324 B13R0.147 COC(=O)CCCSCCOCCO 62a_100011218270_100011215305 [1,0,0,0,0,0|3,0,0]=4 2325 B13R0.147 COC(=O)CCNCCCCCCO 2230a_100000686447_100000204255 [1,0,0,0,0,0|2,0,0]=3 2326 B13R0.147 COC(=O)CCNCCCCCCO 34a_100000686447_100000742370 [1,0,0,0,0,0|2,0,0]=3 2327 B13R0.147 COC(=O)CCOCCCCCCBr 34a_100011215345_100000742370 [1,0,0,0,0,0|2,0,0]=3 2328 B13R0.147 COC(=O)CCOCCCCCCBr 7a_100011215345_100000204255 [1,0,0,0,0,0|2,0,0]=3 2329 B13R0.147 COC(=O)CCOCCCCCCCl 34a_100000766143_100000742370 [1,0,0,0,0,0|2,0,0]=3 2330 B13R0.147 COC(=O)CCOCCCCCCCl 7a_100000766143_100000204255 [1,0,0,0,0,0|2,0,0]=3 2331 B13R0.147 COC(=O)CCOCCCCCCF 34a_100000732779_100000742370 [1,0,0,0,0,0|2,0,0]=3 2332 B13R0.147 COC(=O)CCOCCCCCCF 7a_100000732779_100000204255 [1,0,0,0,0,0|2,0,0]=3 2333 B13R0.147 COC(=O)CCOCCCCCCN 34a_100000686447_100000742370 [1,0,0,0,0,0|2,0,0]=3 2334 B13R0.147 COC(=O)CCOCCOCCO[13CH3] 34a_100010982084_200025704644 [1,0,0,0,0,0|3,0,0]=4 2335 B13R0.147 COC(=O)CCOCCOCCO[13CH3] 7a_100010982084_200025704644 [1,0,0,0,0,0|3,0,0]=4 2336 B13R0.147 COC(=O)CCSCCCCCC#N 62a_100000204255_100009813376 [1,0,0,0,0,0|2,0,1]=4 2337 B13R0.147 COC(=O)CCSCCCCCC#N 62a_100009813376_100000204255 [1,0,0,0,0,0|2,0,1]=4 2338 B13R0.147 COC(=O)CCSCCCCCC=O 62a_100000139337_100000204255 [1,0,0,0,0,0|2,0,1]=4 2339 B13R0.147 COC(=O)CCSCCCCCC=O 62a_100000204255_100000139337 [1,0,0,0,0,0|2,0,1]=4 2340 B13R0.147 COC(=O)CCSCCCCCCF 62a_100000204255_100015922095 [1,0,0,0,0,0|2,0,0]=3 2341 B13R0.147 COC(=O)CCSCCCCCCF 62a_100015922095_100000204255 [1,0,0,0,0,0|2,0,0]=3 2342 B13R0.147 COC(=O)CCSCCCCCCO 62a_100000204255_100000766143 [1,0,0,0,0,0|2,0,0]=3 2343 B13R0.147 COC(=O)CCSCCCCCCO 62a_100000766143_100000204255 [1,0,0,0,0,0|2,0,0]=3 2344 B13R0.147 COC(=O)CNCCCCCCCO 2230a_100011996573_100000747449 [1,0,0,0,0,0|2,0,0]=3 2345 B13R0.147 COC(=O)CNCCCCCCCO 34a_100011996573_100000747449 [1,0,0,0,0,0|2,0,0]=3 2346 B13R0.147 COC(=O)CNCCCOCCCO 2230a_100011310245_100000747449 [1,0,0,0,0,0|3,0,0]=4 2347 B13R0.147 COC(=O)CNCCCOCCCO 34a_100011310245_100000747449 [1,0,0,0,0,0|3,0,0]=4 2348 B13R0.147 COC(=O)COCCCCCCCBr 34a_100000760002_100000747449 [1,0,0,0,0,0|2,0,0]=3 2349 B13R0.147 COC(=O)COCCCCCCCBr 7a_100000760002_100000747449 [1,0,0,0,0,0|2,0,0]=3 2350 B13R0.147 COC(=O)COCCCCCCCN 34a_100011996573_100000747449 [1,0,0,0,0,0|2,0,0]=3 2351 B13R0.147 COC(=O)COCCCOCCCN 34a_100011310245_100000747449 [1,0,0,0,0,0|3,0,0]=4 2352 B13R0.147 COC(=O)COCCNCCCCO 2230a_100000750430_100000090808 [1,0,0,0,0,0|3,0,0]=4 2353 B13R0.147 COC(=O)COCCNCCCCO 34a_100000750430_100000090808 [1,0,0,0,0,0|3,0,0]=4 2354 B13R0.147 COC(=O)COCCNCCCSC 2230a_100000749238_100000090808 [1,0,0,0,0,0|3,0,0]=4 2355 B13R0.147 COC(=O)COCCOCCCCBr 34a_100011216708_100000090808 [1,0,0,0,0,0|3,0,0]=4 2356 B13R0.147 COC(=O)COCCOCCCCCl 34a_100000210776_100000090808 [1,0,0,0,0,0|3,0,0]=4 2357 B13R0.147 COC(=O)COCCOCCCCCl 7a_100000210776_100000090808 [1,0,0,0,0,0|3,0,0]=4 2358 B13R0.147 COC(=O)COCCOCCCCF 34a_100011995726_100000090808 [1,0,0,0,0,0|3,0,0]=4 2359 B13R0.147 COC(=O)COCCOCCCCF 7a_100011995726_100000090808 [1,0,0,0,0,0|3,0,0]=4 2360 B13R0.147 COC(=O)COCCOCCCCI 34a_200012148704_100000090808 [1,0,0,0,0,0|3,0,0]=4 2361 B13R0.147 COC(=O)COCCOCCCCN 34a_100000750430_100000090808 [1,0,0,0,0,0|3,0,0]=4 2362 B13R0.147 COC(=O)COCCOCCCSC 34a_100000690336_100000090808 [1,0,0,0,0,0|3,0,0]=4 2363 B13R0.147 COC(=O)COCCOCCCSC 7a_100000690336_100000090808 [1,0,0,0,0,0|3,0,0]=4 2364 B13R0.147 COC(=O)COCCSCCCCF 62a_100000090808_100000729493 [1,0,0,0,0,0|3,0,0]=4 2365 B13R0.147 COC(=O)COCCSCCCCF 62a_100000729493_100000090808 [1,0,0,0,0,0|3,0,0]=4 2366 B13R0.147 COC(=O)COCCSCCCCO 62a_100000090808_100000210776 [1,0,0,0,0,0|3,0,0]=4 2367 B13R0.147 COC(=O)COCCSCCCCO 62a_100000210776_100000090808 [1,0,0,0,0,0|3,0,0]=4 2368 B13R0.147 COC(=O)CSCCCCCCC#N 62a_100000747449_100009813337 [1,0,0,0,0,0|2,0,1]=4 2369 B13R0.147 COC(=O)CSCCCCCCC#N 62a_100009813337_100000747449 [1,0,0,0,0,0|2,0,1]=4 2370 B13R0.147 COC(=O)CSCCCCCCCO 62a_100000747449_100000760002 [1,0,0,0,0,0|2,0,0]=3 2371 B13R0.147 COC(=O)CSCCCCCCCO 62a_100000760002_100000747449 [1,0,0,0,0,0|2,0,0]=3 2372 B13R0.147 COC(=O)NCCOCCCCCF 34a_100000757965_100000729378 [1,0,0,0,0,0|3,0,0]=4 2373 B13R0.147 COC(=O)NCCOCCCCCO 34a_100000757965_100000746330 [1,0,0,0,0,0|3,0,0]=4 2374 B13R0.147 COC(=O)OCCOCCCCCF 34a_100010262106_100000729378 [1,0,0,0,0,0|3,0,0]=4 2375 B13R0.147 COC(=O)OCCOCCCCCO 34a_100010262106_100000746330 [1,0,0,0,0,0|3,0,0]=4 2376 B13R0.147 COC(=O)OCSCCCCCCF 62a_100015922095_100000139417 [1,0,0,0,0,0|3,0,0]=4 2377 B13R0.147 COC(=O)OCSCCCCCCO 62a_100000766143_100000139417 [1,0,0,0,0,0|3,0,0]=4 2378 B13R0.147 COCCCCCCCCC(=O)OC 34a_100000035544_200000210301 [1,0,0,0,0,0|1,0,0]=2 2379 B13R0.147 COCCCCCCCCC(=O)OC 34a_100138415774_100010282707 [1,0,0,0,0,0|1,0,0]=2 2380 B13R0.147 COCCCCCCCCC(=O)OC 7a_100000035544_200000210301 [1,0,0,0,0,0|1,0,0]=2 2381 B13R0.147 COCCCCCCOCC(=O)OC 34a_200012092642_100000747449 [1,0,0,0,0,0|2,0,0]=3 2382 B13R0.147 COCCCCCCOCC(=O)OC 7a_200012092642_100000747449 [1,0,0,0,0,0|2,0,0]=3 2383 B13R0.147 COCCCCCCSCC(=O)OC 62a_100000747449_100011998445 [1,0,0,0,0,0|2,0,0]=3 2384 B13R0.147 COCCCCCCSCC(=O)OC 62a_100011998445_100000747449 [1,0,0,0,0,0|2,0,0]=3 2385 B13R0.147 COCCCCCNCCC(=O)OC 2230a_100000747528_100000204255 [1,0,0,0,0,0|2,0,0]=3 2386 B13R0.147 COCCCCCNCCC(=O)OC 34a_100000747528_100000742370 [1,0,0,0,0,0|2,0,0]=3 2387 B13R0.147 COCCCCOCCCC(=O)OC 34a_100000740925_100000742333 [1,0,0,0,0,0|2,0,0]=3 2388 B13R0.147 COCCCCOCCNC(=O)OC 34a_100000757965_100000755781 [1,0,0,0,0,0|3,0,0]=4 2389 B13R0.147 COCCCCOCCOC(=O)OC 34a_100010262106_100000755781 [1,0,0,0,0,0|3,0,0]=4 2390 B13R0.147 COCCCCSCCCC(=O)OC 62a_100000730899_100011218270 [1,0,0,0,0,0|2,0,0]=3 2391 B13R0.147 COCCCCSCCCC(=O)OC 62a_100011218270_100000730899 [1,0,0,0,0,0|2,0,0]=3 2392 B13R0.147 COCCCNCCCCC(=O)OC 34a_100150723488_100000204269 [1,0,0,0,0,0|2,0,0]=3 2393 B13R0.147 COCCCNCCOCC(=O)OC 34a_100150723488_100000090808 [1,0,0,0,0,0|3,0,0]=4 2394 B13R0.147 COCCCOCCCCC(=O)OC 34a_100000059025_100000740836 [1,0,0,0,0,0|2,0,0]=3 2395 B13R0.147 COCCCOCCCCC(=O)OC 34a_100000740835_100000204269 [1,0,0,0,0,0|2,0,0]=3 2396 B13R0.147 COCCCOCCCCC(=O)OC 7a_100000059025_100000740836 [1,0,0,0,0,0|2,0,0]=3 2397 B13R0.147 COCCCOCCOCC(=O)OC 34a_100000740835_100000090808 [1,0,0,0,0,0|3,0,0]=4 2398 B13R0.147 COCCCSCCCCC(=O)OC 62a_100000204269_100000709357 [1,0,0,0,0,0|2,0,0]=3 2399 B13R0.147 COCCCSCCCCC(=O)OC 62a_100000709357_100000204269 [1,0,0,0,0,0|2,0,0]=3 2400 B13R0.147 COCCCSCCOCC(=O)OC 62a_100000090808_100000709357 [1,0,0,0,0,0|3,0,0]=4 2401 B13R0.147 COCCCSCCOCC(=O)OC 62a_100000709357_100000090808 [1,0,0,0,0,0|3,0,0]=4 2402 B13R0.147 COCCNCCCCCC(=O)OC 2230a_100000209980_100009816466 [1,0,0,0,0,0|2,0,0]=3 2403 B13R0.147 COCCOCCCCCC(=O)OC 34a_100000074720_100011201679 [1,0,0,0,0,0|2,0,0]=3 2404 B13R0.147 COCCOCCCCCC(=O)OC 34a_100000210237_100009816466 [1,0,0,0,0,0|2,0,0]=3 2405 B13R0.147 COCCOCCCCCC(=O)OC 7a_100000074720_100000233755 [1,0,0,0,0,0|2,0,0]=3 2406 B13R0.147 COCCOCCCNCC(=O)OC 2230a_100000206027_100000747449 [1,0,0,0,0,0|3,0,0]=4 2407 B13R0.147 COCCOCCCNCC(=O)OC 34a_100000206027_100000747449 [1,0,0,0,0,0|3,0,0]=4 2408 B13R0.147 COCCOCCCSCC(=O)OC 62a_100000747449_100011216529 [1,0,0,0,0,0|3,0,0]=4 2409 B13R0.147 COCCOCCCSCC(=O)OC 62a_100011216529_100000747449 [1,0,0,0,0,0|3,0,0]=4 2410 B13R0.147 COCCOCCNCCC(=O)OC 2230a_100000745349_100000204255 [1,0,0,0,0,0|3,0,0]=4 2411 B13R0.147 COCCOCCNCCC(=O)OC 34a_100000745349_100000742370 [1,0,0,0,0,0|3,0,0]=4 2412 B13R0.147 COCCOCCOCCC(=O)OC 34a_100010982084_200000210301 [1,0,0,0,0,0|3,0,0]=4 2413 B13R0.147 COCCOCCOCCC(=O)OC 34a_100011215163_100000742370 [1,0,0,0,0,0|3,0,0]=4 2414 B13R0.147 COCCOCCOCCC(=O)OC 7a_100010982084_200000210301 [1,0,0,0,0,0|3,0,0]=4 2415 B13R0.147 COCCOCCOCCC(=O)OC 7a_100011215163_100000204255 [1,0,0,0,0,0|3,0,0]=4 2416 B13R0.147 COCCOCCSCCC(=O)OC 62a_100000204255_100000695917 [1,0,0,0,0,0|3,0,0]=4 2417 B13R0.147 COCCOCCSCCC(=O)OC 62a_100000695917_100000204255 [1,0,0,0,0,0|3,0,0]=4 2418 B13R0.147 COCCOCSCCCC(=O)OC 62a_100000231047_100011218270 [1,0,0,0,0,0|3,0,0]=4 2419 B13R0.147 COCCOCSCCCC(=O)OC 62a_100011218270_100000231047 [1,0,0,0,0,0|3,0,0]=4 2420 B13R0.147 COCCSCCCCCC(=O)OC 62a_100000233755_100009816466 [1,0,0,0,0,0|2,0,0]=3 2421 B13R0.147 COCCSCCCCCC(=O)OC 62a_100009816466_100000233755 [1,0,0,0,0,0|2,0,0]=3 2422 B13R0.147 COCSCCCCCCC(=O)OC 62a_100000766300_100009815986 [1,0,0,0,0,0|2,0,0]=3 2423 B13R0.147 COCSCCCCCCC(=O)OC 62a_100009815986_100000766300 [1,0,0,0,0,0|2,0,0]=3 2424 B13R0.147 O=C(CF)CCCCCCCCCF 1458a_200009909015_100015361967 [1,0,0,0,0,0|2,0,0]=3 2425 B13R0.147 O=C(CO)CCCCCCCCCO 1458a_100000210174_100009813782 [1,0,0,0,0,0|2,0,0]=3 2426 B13R0.147 O=C(CO)NCCCCCCCCO 240690a_102515433106_100000210174 [1,0,0,0,0,0|3,0,0]=4 2427 B13R0.336 C#CCCCCCCCCCOCC 34a_100000034437_100000210202 [1,0,0,0,0,0|0,0,3]=4 2428 B13R0.336 C#CCCCCCCCCCOCC 7a_100000034437_100000210202 [1,0,0,0,0,0|0,0,3]=4 2429 B13R0.336 C=CCCCCCCCCCOCC 34a_100000038209_100000210202 [1,0,0,0,0,0|0,0,3]=4 2430 B13R0.336 C=CCCCCCCCCCOCC 34a_100121572206_100009814027 [1,0,0,0,0,0|0,0,3]=4 2431 B13R0.336 C=CCCCCCCCCCOCC 7a_100000038209_100000210202 [1,0,0,0,0,0|0,0,3]=4 2432 B13R0.336 CC/C=C/CCCOCCCCCC 34a_100016287902_100000210314 [1,0,0,0,0,0|2,0,0]=3 2433 B13R0.336 CC/C=C/CCCOCCCCCC 7a_100016287902_100000210314 [1,0,0,0,0,0|2,0,0]=3 2434 B13R0.336 CC/C=C/CCCOCCCCCF 34a_100016287902_100000729378 [1,0,0,0,0,0|3,0,0]=4 2435 B13R0.336 CC/C=C/CCCOCCCCCF 7a_100016287902_100000729378 [1,0,0,0,0,0|3,0,0]=4 2436 B13R0.336 CC/C=C/CCCOCCCCCO 34a_100016287902_100000746330 [1,0,0,0,0,0|3,0,0]=4 2437 B13R0.336 CC/C=C/CCCOCCCCCO 7a_100016287902_100000746330 [1,0,0,0,0,0|3,0,0]=4 2438 B13R0.336 CC/C=C/CCCOCCCCOC 34a_100016287902_100000755781 [1,0,0,0,0,0|3,0,0]=4 2439 B13R0.336 CC/C=C/CCCOCCCCOC 7a_100016287902_100000730899 [1,0,0,0,0,0|3,0,0]=4 2440 B13R0.336 CC/C=C/CCCOCCCOCC 34a_100016287902_100012232248 [1,0,0,0,0,0|3,0,0]=4 2441 B13R0.336 CC/C=C/CCCOCCCOCC 7a_100016287902_100012232248 [1,0,0,0,0,0|3,0,0]=4 2442 B13R0.336 CC/C=C/CCCOCCOCCC 34a_100016287902_100011215938 [1,0,0,0,0,0|3,0,0]=4 2443 B13R0.336 CC/C=C/CCCOCCOCCC 7a_100016287902_100011215938 [1,0,0,0,0,0|3,0,0]=4 2444 B13R0.336 CC/C=C/CCCOCOCCCC 34a_100016287902_100011995733 [1,0,0,0,0,0|3,0,0]=4 2445 B13R0.336 CC/C=C\CCCCCCCNCC 269862a_100015525214_200025770492 [1,0,0,0,0,0|2,0,0]=3 2446 B13R0.336 CC/C=C\CCCCCNCCCC 269862a_100000102301_100016288537 [1,0,0,0,0,0|2,0,0]=3 2447 B13R0.336 CC/C=C\CCCCCNCCCF 269862a_100015189416_100016288537 [1,0,0,0,0,0|3,0,0]=4 2448 B13R0.336 CC/C=C\CCCCCNCCCO 269862a_100000182051_100016288537 [1,0,0,0,0,0|3,0,0]=4 2449 B13R0.336 CC/C=C\CCCCCNCCOC 269862a_100000209980_100016288537 [1,0,0,0,0,0|3,0,0]=4 2450 B13R0.336 CC/C=C\CCCCCNCCSC 269862a_100020590264_100016288537 [1,0,0,0,0,0|3,0,0]=4 2451 B13R0.336 CC/C=C\CCCCCOCCCC 34a_100016268722_100000210210 [1,0,0,0,0,0|2,0,0]=3 2452 B13R0.336 CC/C=C\CCCCCOCCCC 7a_100016268722_100000210211 [1,0,0,0,0,0|2,0,0]=3 2453 B13R0.336 CC/C=C\CCCCCOCCCF 34a_100016268722_100011934791 [1,0,0,0,0,0|3,0,0]=4 2454 B13R0.336 CC/C=C\CCCCCOCCCF 7a_100016268722_100011934791 [1,0,0,0,0,0|3,0,0]=4 2455 B13R0.336 CC/C=C\CCCCCOCCCO 34a_100016268722_100000230001 [1,0,0,0,0,0|3,0,0]=4 2456 B13R0.336 CC/C=C\CCCCCOCCCO 7a_100016268722_100011215043 [1,0,0,0,0,0|3,0,0]=4 2457 B13R0.336 CC/C=C\CCCCCOCCOC 34a_100016268722_100011201679 [1,0,0,0,0,0|3,0,0]=4 2458 B13R0.336 CC/C=C\CCCCCOCCOC 7a_100016268722_100000233755 [1,0,0,0,0,0|3,0,0]=4 2459 B13R0.336 CC/C=C\CCCCCOCCSC 34a_100016268722_100000212216 [1,0,0,0,0,0|3,0,0]=4 2460 B13R0.336 CC/C=C\CCCCCOCCSC 7a_100016268722_100000212216 [1,0,0,0,0,0|3,0,0]=4 2461 B13R0.336 CC/C=C\CCCCOCCCCC 34a_100016287862_100000718602 [1,0,0,0,0,0|2,0,0]=3 2462 B13R0.336 CC/C=C\CCCCOCCCCC 7a_100016287862_100000210326 [1,0,0,0,0,0|2,0,0]=3 2463 B13R0.336 CC/C=C\CCCCOCCCCF 34a_100016287862_100000729493 [1,0,0,0,0,0|3,0,0]=4 2464 B13R0.336 CC/C=C\CCCCOCCCCF 7a_100016287862_100000729493 [1,0,0,0,0,0|3,0,0]=4 2465 B13R0.336 CC/C=C\CCCCOCCCCO 34a_100016287862_100011216708 [1,0,0,0,0,0|3,0,0]=4 2466 B13R0.336 CC/C=C\CCCCOCCCCO 7a_100016287862_100000210776 [1,0,0,0,0,0|3,0,0]=4 2467 B13R0.336 CC/C=C\CCCCOCCCOC 34a_100016287862_100000740836 [1,0,0,0,0,0|3,0,0]=4 2468 B13R0.336 CC/C=C\CCCCOCCCOC 7a_100016287862_100000740836 [1,0,0,0,0,0|3,0,0]=4 2469 B13R0.336 CC/C=C\CCCCOCCOCC 34a_100016287862_100000210147 [1,0,0,0,0,0|3,0,0]=4 2470 B13R0.336 CC/C=C\CCCCOCCOCC 7a_100016287862_100011215890 [1,0,0,0,0,0|3,0,0]=4 2471 B13R0.336 CC/C=C\CCCCOCCSCC 34a_100016287862_100000757381 [1,0,0,0,0,0|3,0,0]=4 2472 B13R0.336 CC/C=C\CCCCOCCSCC 7a_100016287862_100000757381 [1,0,0,0,0,0|3,0,0]=4 2473 B13R0.336 CC/C=C\CCNCCCCCCC 2230a_100000229938_100015370543 [1,0,0,0,0,0|2,0,0]=3 2474 B13R0.336 CC/C=C\CCNCCCCCCO 2230a_100000686447_100015370543 [1,0,0,0,0,0|3,0,0]=4 2475 B13R0.336 CC/C=C\CCNCCCCCCO 34a_100000686447_100015370543 [1,0,0,0,0,0|3,0,0]=4 2476 B13R0.336 CC/C=C\CCNCCCCCOC 2230a_100000747528_100015370543 [1,0,0,0,0,0|3,0,0]=4 2477 B13R0.336 CC/C=C\CCNCCCCCOC 34a_100000747528_100015370543 [1,0,0,0,0,0|3,0,0]=4 2478 B13R0.336 CC/C=C\CCNCCCOCCC 2230a_100011217757_100015370543 [1,0,0,0,0,0|3,0,0]=4 2479 B13R0.336 CC/C=C\CCNCCCOCCC 34a_100011217757_100015370543 [1,0,0,0,0,0|3,0,0]=4 2480 B13R0.336 CC/C=C\CCNCCSCCCC 2230a_100025743550_100015370543 [1,0,0,0,0,0|3,0,0]=4 2481 B13R0.336 CC/C=C\CCOCCCCCCBr 34a_100011215345_100015370543 [1,0,0,0,0,0|3,0,0]=4 2482 B13R0.336 CC/C=C\CCOCCCCCCBr 7a_100011215345_100015370543 [1,0,0,0,0,0|3,0,0]=4 2483 B13R0.336 CC/C=C\CCOCCCCCCC 34a_100000210272_100015370543 [1,0,0,0,0,0|2,0,0]=3 2484 B13R0.336 CC/C=C\CCOCCCCCCC 34a_100016288707_100000210614 [1,0,0,0,0,0|2,0,0]=3 2485 B13R0.336 CC/C=C\CCOCCCCCCC 7a_100000210272_100015370543 [1,0,0,0,0,0|2,0,0]=3 2486 B13R0.336 CC/C=C\CCOCCCCCCC 7a_100016288707_100000210614 [1,0,0,0,0,0|2,0,0]=3 2487 B13R0.336 CC/C=C\CCOCCCCCCCl 34a_100000766143_100015370543 [1,0,0,0,0,0|3,0,0]=4 2488 B13R0.336 CC/C=C\CCOCCCCCCCl 7a_100000766143_100015370543 [1,0,0,0,0,0|3,0,0]=4 2489 B13R0.336 CC/C=C\CCOCCCCCCF 34a_100000732779_100015370543 [1,0,0,0,0,0|3,0,0]=4 2490 B13R0.336 CC/C=C\CCOCCCCCCF 34a_100016288707_100015922095 [1,0,0,0,0,0|3,0,0]=4 2491 B13R0.336 CC/C=C\CCOCCCCCCF 7a_100000732779_100015370543 [1,0,0,0,0,0|3,0,0]=4 2492 B13R0.336 CC/C=C\CCOCCCCCCF 7a_100016288707_100015922095 [1,0,0,0,0,0|3,0,0]=4 2493 B13R0.336 CC/C=C\CCOCCCCCCN 34a_100000686447_100015370543 [1,0,0,0,0,0|3,0,0]=4 2494 B13R0.336 CC/C=C\CCOCCCCCCO 34a_100016288707_100000766143 [1,0,0,0,0,0|3,0,0]=4 2495 B13R0.336 CC/C=C\CCOCCCCCCO 7a_100016288707_100000766143 [1,0,0,0,0,0|3,0,0]=4 2496 B13R0.336 CC/C=C\CCOCCCCCNC 34a_100000722520_100015370543 [1,0,0,0,0,0|3,0,0]=4 2497 B13R0.336 CC/C=C\CCOCCOCCCC 34a_100000210238_100015370543 [1,0,0,0,0,0|3,0,0]=4 2498 B13R0.336 CC/C=C\CCOCCOCCCC 34a_100016288707_100000743108 [1,0,0,0,0,0|3,0,0]=4 2499 B13R0.336 CC/C=C\CCOCCOCCCC 7a_100000210238_100015370543 [1,0,0,0,0,0|3,0,0]=4 2500 B13R0.336 CC/C=C\CCOCCOCCCC 7a_100016288707_100000743108 [1,0,0,0,0,0|3,0,0]=4 2501 B13R0.336 CC/C=C\CCOCCSCCCC 34a_200000230436_100015370543 [1,0,0,0,0,0|3,0,0]=4 2502 B13R0.336 CC/C=C\CCOCCSCCCC 7a_200000230436_100015370543 [1,0,0,0,0,0|3,0,0]=4 2503 B13R0.336 CC/C=C\CCSCCCCCCF 62a_100015370543_100015922095 [1,0,0,0,0,0|3,0,0]=4 2504 B13R0.336 CC/C=C\CCSCCCCCCF 62a_100015922095_100015370543 [1,0,0,0,0,0|3,0,0]=4 2505 B13R0.336 CC/C=C\CCSCCCCCCO 62a_100000766143_100015370543 [1,0,0,0,0,0|3,0,0]=4 2506 B13R0.336 CC/C=C\CCSCCCCCCO 62a_100015370543_100000766143 [1,0,0,0,0,0|3,0,0]=4 2507 B13R0.336 CC/C=C\CCSCCOCCCC 62a_100000743108_100015370543 [1,0,0,0,0,0|3,0,0]=4 2508 B13R0.336 CC/C=C\CCSCCOCCCC 62a_100015370543_100000743108 [1,0,0,0,0,0|3,0,0]=4 2509 B13R0.336 CC/C=C\CNCCCCCCCC 2230a_100000229939_100103147603 [1,0,0,0,0,0|2,0,0]=3 2510 B13R0.336 CC/C=C\CNCCCCCCCC 34a_100000229939_100103147603 [1,0,0,0,0,0|2,0,0]=3 2511 B13R0.336 CC/C=C\CNCCCCCCCO 2230a_100011996573_100103147603 [1,0,0,0,0,0|3,0,0]=4 2512 B13R0.336 CC/C=C\CNCCCCCCCO 34a_100011996573_100103147603 [1,0,0,0,0,0|3,0,0]=4 2513 B13R0.336 CC/C=C\CNCCCOCCCC 2230a_200000211371_100103147603 [1,0,0,0,0,0|3,0,0]=4 2514 B13R0.336 CC/C=C\CNCCCOCCCC 34a_200000211371_100103147603 [1,0,0,0,0,0|3,0,0]=4 2515 B13R0.336 CC/C=C\COCCCCCCCBr 34a_100000760002_100103147603 [1,0,0,0,0,0|3,0,0]=4 2516 B13R0.336 CC/C=C\COCCCCCCCBr 7a_100000760002_100103147603 [1,0,0,0,0,0|3,0,0]=4 2517 B13R0.336 CC/C=C\COCCCCCCCC 34a_100000210232_100103147603 [1,0,0,0,0,0|2,0,0]=3 2518 B13R0.336 CC/C=C\COCCCCCCCC 34a_100016268518_100000210759 [1,0,0,0,0,0|2,0,0]=3 2519 B13R0.336 CC/C=C\COCCCCCCCC 7a_100000210232_100103147603 [1,0,0,0,0,0|2,0,0]=3 2520 B13R0.336 CC/C=C\COCCCCCCCN 34a_100011996573_100103147603 [1,0,0,0,0,0|3,0,0]=4 2521 B13R0.336 CC/C=C\COCCCCCCCO 34a_100016268518_100000760002 [1,0,0,0,0,0|3,0,0]=4 2522 B13R0.336 CC/C=C\COCCCCCCOC 34a_100016268518_100011998445 [1,0,0,0,0,0|3,0,0]=4 2523 B13R0.336 CC/C=C\COCCCCCCOC 34a_200012092642_100103147603 [1,0,0,0,0,0|3,0,0]=4 2524 B13R0.336 CC/C=C\COCCCCCCOC 7a_200012092642_100103147603 [1,0,0,0,0,0|3,0,0]=4 2525 B13R0.336 CC/C=C\COCCCOCCCC 34a_200011215613_100103147603 [1,0,0,0,0,0|3,0,0]=4 2526 B13R0.336 CC/C=C\COCCCOCCCC 7a_200011215613_100103147603 [1,0,0,0,0,0|3,0,0]=4 2527 B13R0.336 CC/C=C\COCCNCCCCC 34a_100000224656_100103147603 [1,0,0,0,0,0|3,0,0]=4 2528 B13R0.336 CC/C=C\COCCOCCCCC 34a_100011215259_100103147603 [1,0,0,0,0,0|3,0,0]=4 2529 B13R0.336 CC/C=C\COCCOCCCCC 7a_100011215259_100103147603 [1,0,0,0,0,0|3,0,0]=4 2530 B13R0.336 CC/C=C\CSCCCCCCCO 62a_100000760002_100103147603 [1,0,0,0,0,0|3,0,0]=4 2531 B13R0.336 CC/C=C\CSCCCCCCCO 62a_100103147603_100000760002 [1,0,0,0,0,0|3,0,0]=4 2532 B13R0.336 CC/C=C\CSCCCCCCOC 62a_100011998445_100103147603 [1,0,0,0,0,0|3,0,0]=4 2533 B13R0.336 CC/C=C\CSCCCCCCOC 62a_100103147603_100011998445 [1,0,0,0,0,0|3,0,0]=4 2534 B13R0.336 CC=C=CCCOCCCCCCC 34a_100011020354_100000210614 [1,0,0,0,0,0|2,0,1]=4 2535 B13R0.336 CCC#CCCCCCCCCOC 34a_200000031908_200000210301 [1,0,0,0,0,0|2,0,1]=4 2536 B13R0.336 CCC#CCCCCCCCCOC 7a_200000031908_200000210301 [1,0,0,0,0,0|2,0,1]=4 2537 B13R0.336 CCC#CCCCCCCCCO[13CH3] 34a_200000031908_200025704644 [1,0,0,0,0,0|2,0,1]=4 2538 B13R0.336 CCC#CCCCCCCCCO[13CH3] 7a_200000031908_200025704644 [1,0,0,0,0,0|2,0,1]=4 2539 B13R0.336 CCC#CCCCCCCOCCC 34a_100000210258_200000036426 [1,0,0,0,0,0|2,0,1]=4 2540 B13R0.336 CCC#CCCCCCCSCCC 62a_100000210303_200000036426 [1,0,0,0,0,0|2,0,1]=4 2541 B13R0.336 CCC#CCCCCCCSCCC 62a_200000036426_100000210303 [1,0,0,0,0,0|2,0,1]=4 2542 B13R0.336 CCC#CCCOCCCCCCC 34a_100000036655_100000210614 [1,0,0,0,0,0|2,0,1]=4 2543 B13R0.336 CCC#CCCOCCCCCCC 7a_100000036655_100000210614 [1,0,0,0,0,0|2,0,1]=4 2544 B13R0.336 CCC#CCNCCCCCCCC 2230a_100000229939_100009813939 [1,0,0,0,0,0|2,0,1]=4 2545 B13R0.336 CCC#CCNCCCCCCCC 34a_100000229939_100009813939 [1,0,0,0,0,0|2,0,1]=4 2546 B13R0.336 CCC#CCOCCCCCCCC 34a_100000032950_100000210759 [1,0,0,0,0,0|2,0,1]=4 2547 B13R0.336 CCC#CCOCCCCCCCC 34a_100000210232_100009813939 [1,0,0,0,0,0|2,0,1]=4 2548 B13R0.336 CCC#CCOCCCCCCCC 7a_100000210232_100009813939 [1,0,0,0,0,0|2,0,1]=4 2549 B13R0.336 CCC#CCSCCCCCCCC 62a_100000210759_100009813939 [1,0,0,0,0,0|2,0,1]=4 2550 B13R0.336 CCC#CCSCCCCCCCC 62a_100009813939_100000210317 [1,0,0,0,0,0|2,0,1]=4 2551 B13R0.336 CCC/C=C/COCCCCCCC 34a_100016278788_100000210614 [1,0,0,0,0,0|2,0,1]=4 2552 B13R0.336 CCC/C=C/COCCCCCCC 7a_100016278788_100000210614 [1,0,0,0,0,0|2,0,1]=4 2553 B13R0.336 CCCCCCCC/C=C/COCC 34a_200020667288_100000210202 [1,0,0,0,0,0|0,0,3]=4 2554 B13R0.336 CCCCCCCC/C=C/COCC 7a_200020667288_100000210202 [1,0,0,0,0,0|0,0,3]=4 2555 B13R0.336 CCCCCCCCC/C=C/COC 34a_100015232335_200000210301 [1,0,0,0,0,0|2,0,1]=4 2556 B13R0.336 CCCCCCCCC/C=C/COC 7a_100015232335_200000210301 [1,0,0,0,0,0|2,0,1]=4 2557 B13R0.336 CCCCCCCCC/C=C/CO[13CH3] 34a_100015232335_200025704644 [1,0,0,0,0,0|2,0,1]=4 2558 B13R0.336 CCCCCCCCC/C=C/CO[13CH3] 7a_100015232335_200025704644 [1,0,0,0,0,0|2,0,1]=4 2559 B13R0.336 CCCCCCCCCC=NNCC 4a_100000756455_100000210895 [1,0,0,0,0,0|2,0,1]=4 2560 B13R0.336 CCCCCCCCCCCCNC 2230a_100000210451_200000210301 [1,0,0,0,0,0|2,0,1]=4 2561 B13R0.336 CCCCCCCCCCCCNC 2230a_106832991635_100011215052 [1,0,0,0,0,0|2,0,1]=4 2562 B13R0.336 CCCCCCCCCCCCNC 270004a_106832991635_100011218549 [1,0,0,0,0,0|2,0,1]=4 2563 B13R0.336 CCCCCCCCCCCCNC 34a_100000210451_200000210301 [1,0,0,0,0,0|2,0,1]=4 2564 B13R0.336 CCCCCCCCCCCCNC 34a_100102657272_100000759014 [1,0,0,0,0,0|2,0,1]=4 2565 B13R0.336 CCCCCCCCCCCCNC 7a_106832991635_100000759014 [1,0,0,0,0,0|2,0,1]=4 2566 B13R0.336 CCCCCCCCCCCCN[13CH3] 2230a_100000210451_200025704644 [1,0,0,0,0,0|2,0,1]=4 2567 B13R0.336 CCCCCCCCCCCCN[13CH3] 34a_100000210451_200025704644 [1,0,0,0,0,0|2,0,1]=4 2568 B13R0.336 CCCCCCCCCCCCOC 34a_100000210810_200000210301 [1,0,0,0,0,0|2,0,1]=4 2569 B13R0.336 CCCCCCCCCCCCOC 34a_100138415774_100000759014 [1,0,0,0,0,0|2,0,1]=4 2570 B13R0.336 CCCCCCCCCCCCOC 7a_100000210810_200000210301 [1,0,0,0,0,0|2,0,1]=4 2571 B13R0.336 CCCCCCCCCCCCO[13CH3] 34a_100000210810_200025704644 [1,0,0,0,0,0|2,0,1]=4 2572 B13R0.336 CCCCCCCCCCCCO[13CH3] 7a_100000210810_200025704644 [1,0,0,0,0,0|2,0,1]=4 2573 B13R0.336 CCCCCCCCCCCNCC 2230a_100015525214_100011215454 [1,0,0,0,0,0|1,0,1]=3 2574 B13R0.336 CCCCCCCCCCCNCC 2230a_200011215754_100000210202 [1,0,0,0,0,0|1,0,1]=3 2575 B13R0.336 CCCCCCCCCCCNCC 34a_200011215754_100000210202 [1,0,0,0,0,0|1,0,1]=3 2576 B13R0.336 CCCCCCCCCCCNCF 34a_200011215754_100015361967 [1,0,0,0,0,0|2,0,1]=4 2577 B13R0.336 CCCCCCCCCCCOCC 34a_100000210809_100000210202 [1,0,0,0,0,0|0,0,1]=2 2578 B13R0.336 CCCCCCCCCCCOCC 34a_100121572206_100011215454 [1,0,0,0,0,0|0,0,1]=2 2579 B13R0.336 CCCCCCCCCCCOCC 7a_100000210809_100000210202 [1,0,0,0,0,0|0,0,1]=2 2580 B13R0.336 CCCCCCCCCCCOCF 34a_100000210809_100015361967 [1,0,0,0,0,0|1,0,1]=3 2581 B13R0.336 CCCCCCCCCCCOCF 7a_100000210809_100015361967 [1,0,0,0,0,0|1,0,1]=3 2582 B13R0.336 CCCCCCCCCCNCCC 2230a_100000684558_100000210303 [1,0,0,0,0,0|2,0,0]=3 2583 B13R0.336 CCCCCCCCCCNCCC 34a_100000684558_100000210303 [1,0,0,0,0,0|2,0,0]=3 2584 B13R0.336 CCCCCCCCCCNCCF 2230a_100000684558_100011217306 [1,0,0,0,0,0|3,0,0]=4 2585 B13R0.336 CCCCCCCCCCNCCF 34a_100000684558_100011217306 [1,0,0,0,0,0|3,0,0]=4 2586 B13R0.336 CCCCCCCCCCNCCF 34a_100000724931_100000210320 [1,0,0,0,0,0|3,0,0]=4 2587 B13R0.336 CCCCCCCCCCNCCO 2230a_100000684558_100000211926 [1,0,0,0,0,0|3,0,0]=4 2588 B13R0.336 CCCCCCCCCCNCCO 2230a_100016997473_100000210320 [1,0,0,0,0,0|3,0,0]=4 2589 B13R0.336 CCCCCCCCCCNCCO 34a_100000684558_100000211926 [1,0,0,0,0,0|3,0,0]=4 2590 B13R0.336 CCCCCCCCCCNCCO 34a_100016990907_100000210320 [1,0,0,0,0,0|3,0,0]=4 2591 B13R0.336 CCCCCCCCCCNCOC 2230a_100000684558_100000766300 [1,0,0,0,0,0|3,0,0]=4 2592 B13R0.336 CCCCCCCCCCNCSC 2230a_100000684558_100011218213 [1,0,0,0,0,0|3,0,0]=4 2593 B13R0.336 CCCCCCCCCCNCSC 34a_100000684558_100011218213 [1,0,0,0,0,0|3,0,0]=4 2594 B13R0.336 CCCCCCCCCCOCCBr 34a_100000211926_100000210320 [1,0,0,0,0,0|3,0,0]=4 2595 B13R0.336 CCCCCCCCCCOCCC 34a_100000210258_100000210320 [1,0,0,0,0,0|2,0,0]=3 2596 B13R0.336 CCCCCCCCCCOCCC 34a_100000210711_100000210303 [1,0,0,0,0,0|2,0,0]=3 2597 B13R0.336 CCCCCCCCCCOCCC 7a_100000210711_100000210303 [1,0,0,0,0,0|2,0,0]=3 2598 B13R0.336 CCCCCCCCCCOCCF 34a_100000210711_100011217306 [1,0,0,0,0,0|3,0,0]=4 2599 B13R0.336 CCCCCCCCCCOCCF 7a_100000210711_100011217306 [1,0,0,0,0,0|3,0,0]=4 2600 B13R0.336 CCCCCCCCCCOCCN 34a_100000210304_100000210320 [1,0,0,0,0,0|3,0,0]=4 2601 B13R0.336 CCCCCCCCCCOCCO 34a_100000210711_100000211926 [1,0,0,0,0,0|3,0,0]=4 2602 B13R0.336 CCCCCCCCCCOCCO 7a_100000210711_100000211926 [1,0,0,0,0,0|3,0,0]=4 2603 B13R0.336 CCCCCCCCCCOCSC 34a_100000210711_100011218213 [1,0,0,0,0,0|3,0,0]=4 2604 B13R0.336 CCCCCCCCCCSCCF 62a_100011217306_100000210320 [1,0,0,0,0,0|3,0,0]=4 2605 B13R0.336 CCCCCCCCCCSCCO 62a_100000211926_100000210320 [1,0,0,0,0,0|3,0,0]=4 2606 B13R0.336 CCCCCCCCCCSCOC 62a_100000766300_100000210320 [1,0,0,0,0,0|3,0,0]=4 2607 B13R0.336 CCCCCCCCCNCCCC 2230a_100000102301_100011214924 [1,0,0,0,0,0|2,0,1]=4 2608 B13R0.336 CCCCCCCCCNCCCC 2230a_100000212291_100000210211 [1,0,0,0,0,0|2,0,1]=4 2609 B13R0.336 CCCCCCCCCNCCCC 34a_100000212291_100000210210 [1,0,0,0,0,0|2,0,1]=4 2610 B13R0.336 CCCCCCCCCNCCCC 7a_106832991798_100000210328 [1,0,0,0,0,0|2,0,1]=4 2611 B13R0.336 CCCCCCCCCOCCCC 34a_100000210227_100011214924 [1,0,0,0,0,0|2,0,1]=4 2612 B13R0.336 CCCCCCCCCOCCCC 34a_100000210712_100000210210 [1,0,0,0,0,0|2,0,1]=4 2613 B13R0.336 CCCCCCCCCOCCCC 7a_100000210227_100000210328 [1,0,0,0,0,0|2,0,1]=4 2614 B13R0.336 CCCCCCCCCOCCCC 7a_100000210712_100000210211 [1,0,0,0,0,0|2,0,1]=4 2615 B13R0.336 CCCCCCCCCSCOCC 62a_100000739092_100000210670 [1,0,0,0,0,0|1,0,1]=3 2616 B13R0.336 CCCCCCCCNCCCCC 2230a_100000209983_100000210759 [1,0,0,0,0,0|2,0,1]=4 2617 B13R0.336 CCCCCCCCNCCCCC 2230a_100000229939_100000210326 [1,0,0,0,0,0|2,0,1]=4 2618 B13R0.336 CCCCCCCCNCCCCC 34a_100000229939_100000718602 [1,0,0,0,0,0|2,0,1]=4 2619 B13R0.336 CCCCCCCCNCCOCC 2230a_100000229939_100011215890 [1,0,0,0,0,0|1,0,1]=3 2620 B13R0.336 CCCCCCCCNCCOCC 2230a_102516460346_100000210759 [1,0,0,0,0,0|1,0,1]=3 2621 B13R0.336 CCCCCCCCNCCOCC 34a_100000229939_100000210147 [1,0,0,0,0,0|1,0,1]=3 2622 B13R0.336 CCCCCCCCNCCOCC 34a_102516460346_100000210759 [1,0,0,0,0,0|1,0,1]=3 2623 B13R0.336 CCCCCCCCNCCSCC 2230a_100000106463_100000210759 [1,0,0,0,0,0|1,1,1]=4 2624 B13R0.336 CCCCCCCCNCCSCC 2230a_100000229939_100000757381 [1,0,0,0,0,0|1,1,1]=4 2625 B13R0.336 CCCCCCCCNCCSCC 34a_100000229939_100000757381 [1,0,0,0,0,0|1,1,1]=4 2626 B13R0.336 CCCCCCCCOCCCCC 34a_100000210232_100000718602 [1,0,0,0,0,0|2,0,1]=4 2627 B13R0.336 CCCCCCCCOCCCCC 34a_100000210253_100000210759 [1,0,0,0,0,0|2,0,1]=4 2628 B13R0.336 CCCCCCCCOCCCCC 7a_100000210232_100000210326 [1,0,0,0,0,0|2,0,1]=4 2629 B13R0.336 CCCCCCCCOCCCCC 7a_100000210253_100000210759 [1,0,0,0,0,0|2,0,1]=4 2630 B13R0.336 CCCCCCCCOCCOCC 34a_100000210136_100000210759 [1,0,0,0,0,0|1,0,1]=3 2631 B13R0.336 CCCCCCCCOCCOCC 34a_100000210232_100000210147 [1,0,0,0,0,0|1,0,1]=3 2632 B13R0.336 CCCCCCCCOCCOCC 7a_100000210136_100000210759 [1,0,0,0,0,0|1,0,1]=3 2633 B13R0.336 CCCCCCCCOCCOCC 7a_100000210232_100011215890 [1,0,0,0,0,0|1,0,1]=3 2634 B13R0.336 CCCCCCCCOCCSCC 34a_100000210232_100000757381 [1,0,0,0,0,0|1,1,1]=4 2635 B13R0.336 CCCCCCCCOCCSCC 34a_100000212035_100000210759 [1,0,0,0,0,0|1,1,1]=4 2636 B13R0.336 CCCCCCCCOCCSCC 7a_100000210232_100000757381 [1,0,0,0,0,0|1,1,1]=4 2637 B13R0.336 CCCCCCCCOCCSCC 7a_100000212035_100000210759 [1,0,0,0,0,0|1,1,1]=4 2638 B13R0.336 CCCCCCCCSCCOCC 62a_100000210147_100000210317 [1,0,0,0,0,0|1,0,1]=3 2639 B13R0.336 CCCCCCCCSCCOCC 62a_100000210759_100011215890 [1,0,0,0,0,0|1,0,1]=3 2640 B13R0.336 CCCCCCCCSCCSCC 62a_100000210759_100000757381 [1,0,0,0,0,0|1,1,1]=4 2641 B13R0.336 CCCCCCCCSCCSCC 62a_100000757381_100000210317 [1,0,0,0,0,0|1,1,1]=4 2642 B13R0.336 CCCCCCCNCCCCCC 2230a_100000210581_100000210681 [1,0,0,0,0,0|2,0,1]=4 2643 B13R0.336 CCCCCCCNCCCCCC 2230a_100000229938_100000210314 [1,0,0,0,0,0|2,0,1]=4 2644 B13R0.336 CCCCCCCNCCCOCC 2230a_100000210961_100000210681 [1,0,0,0,0,0|1,0,1]=3 2645 B13R0.336 CCCCCCCNCCCOCC 2230a_100000229938_100012232248 [1,0,0,0,0,0|1,0,1]=3 2646 B13R0.336 CCCCCCCNCCCOCC 34a_100000210961_100000210614 [1,0,0,0,0,0|1,0,1]=3 2647 B13R0.336 CCCCCCCNCCOCCC 2230a_100000229938_100011215938 [1,0,0,0,0,0|3,0,0]=4 2648 B13R0.336 CCCCCCCNCCOCCC 2230a_100161115042_100000210681 [1,0,0,0,0,0|3,0,0]=4 2649 B13R0.336 CCCCCCCNCCOCCC 34a_100161115042_100000210614 [1,0,0,0,0,0|3,0,0]=4 2650 B13R0.336 CCCCCCCNCCSCCC 2230a_100020603323_100000210681 [1,0,0,0,0,0|3,0,0]=4 2651 B13R0.336 CCCCCCCOCCCCCC 34a_100000210259_100000210614 [1,0,0,0,0,0|2,0,1]=4 2652 B13R0.336 CCCCCCCOCCCCCC 34a_100000210272_100000210314 [1,0,0,0,0,0|2,0,1]=4 2653 B13R0.336 CCCCCCCOCCCCCC 7a_100000210259_100000210614 [1,0,0,0,0,0|2,0,1]=4 2654 B13R0.336 CCCCCCCOCCCCCC 7a_100000210272_100000210314 [1,0,0,0,0,0|2,0,1]=4 2655 B13R0.336 CCCCCCCOCCCOCC 34a_100000210272_100012232248 [1,0,0,0,0,0|1,0,1]=3 2656 B13R0.336 CCCCCCCOCCCOCC 34a_100000757476_100000210614 [1,0,0,0,0,0|1,0,1]=3 2657 B13R0.336 CCCCCCCOCCCOCC 7a_100000210272_100012232248 [1,0,0,0,0,0|1,0,1]=3 2658 B13R0.336 CCCCCCCOCCCOCC 7a_100000757476_100000210614 [1,0,0,0,0,0|1,0,1]=3 2659 B13R0.336 CCCCCCCOCCCSCC 34a_100011216438_100000210614 [1,0,0,0,0,0|1,1,1]=4 2660 B13R0.336 CCCCCCCOCCCSCC 7a_100011216438_100000210614 [1,0,0,0,0,0|1,1,1]=4 2661 B13R0.336 CCCCCCCOCCOCCC 34a_100000210272_100011215938 [1,0,0,0,0,0|3,0,0]=4 2662 B13R0.336 CCCCCCCOCCOCCC 34a_100000752267_100000210614 [1,0,0,0,0,0|3,0,0]=4 2663 B13R0.336 CCCCCCCOCCOCCC 7a_100000210272_100011215938 [1,0,0,0,0,0|3,0,0]=4 2664 B13R0.336 CCCCCCCOCCOCCC 7a_100000752267_100000210614 [1,0,0,0,0,0|3,0,0]=4 2665 B13R0.336 CCCCCCCOCCSCCC 34a_200000230433_100000210614 [1,0,0,0,0,0|3,0,0]=4 2666 B13R0.336 CCCCCCCOCCSCCC 7a_200000230433_100000210614 [1,0,0,0,0,0|3,0,0]=4 2667 B13R0.336 CCCCCCCSCCCOCC 62a_100000210614_100012232248 [1,0,0,0,0,0|1,0,1]=3 2668 B13R0.336 CCCCCCCSCCCOCC 62a_100012232248_100000210316 [1,0,0,0,0,0|1,0,1]=3 2669 B13R0.336 CCCCCCCSCCOCCC 62a_100000210614_100011215938 [1,0,0,0,0,0|3,0,0]=4 2670 B13R0.336 CCCCCCCSCCOCCC 62a_100011215938_100000210316 [1,0,0,0,0,0|3,0,0]=4 2671 B13R0.336 CCCCCCNCCCOCCC 2230a_100011217757_100000210314 [1,0,0,0,0,0|3,0,0]=4 2672 B13R0.336 CCCCCCNCCCOCCC 34a_100011217757_100000210314 [1,0,0,0,0,0|3,0,0]=4 2673 B13R0.336 CCCCCNCCOCCOCC 2230a_100000209983_100011211534 [1,0,0,0,0,0|2,0,1]=4 2674 B13R0.336 CCCCCNCCOCCOCC 2230a_100102712874_100000210326 [1,0,0,0,0,0|2,0,1]=4 2675 B13R0.336 CCCCCNCCOCCOCC 34a_100000224656_100000210147 [1,0,0,0,0,0|2,0,1]=4 2676 B13R0.336 CCCCCNCCOCCOCC 34a_100102712874_100000718602 [1,0,0,0,0,0|2,0,1]=4 2677 B13R0.336 CCCCCOCCOCCOCC 34a_100000210240_100000718602 [1,0,0,0,0,0|2,0,1]=4 2678 B13R0.336 CCCCCOCCOCCOCC 34a_100000210253_100011211534 [1,0,0,0,0,0|2,0,1]=4 2679 B13R0.336 CCCCCOCCOCCOCC 34a_100011215259_100000210147 [1,0,0,0,0,0|2,0,1]=4 2680 B13R0.336 CCCCCOCCOCCOCC 7a_100000210240_100000210326 [1,0,0,0,0,0|2,0,1]=4 2681 B13R0.336 CCCCCOCCOCCOCC 7a_100000210253_100011211534 [1,0,0,0,0,0|2,0,1]=4 2682 B13R0.336 CCCCCOCCOCCOCC 7a_100011215259_100011215890 [1,0,0,0,0,0|2,0,1]=4 2683 B13R0.336 CCCCCSCCOCCOCC 62a_100000210326_100011211534 [1,0,0,0,0,0|2,0,1]=4 2684 B13R0.336 CCCCCSCCOCCOCC 62a_100011211534_100000210326 [1,0,0,0,0,0|2,0,1]=4 2685 B13R0.336 CCCCOCCCNCCOCC 2230a_200000211371_100011215890 [1,0,0,0,0,0|2,0,1]=4 2686 B13R0.336 CCCCOCCCNCCOCC 34a_200000211371_100000210147 [1,0,0,0,0,0|2,0,1]=4 2687 B13R0.336 CCCCOCCCOCCOCC 34a_200011215613_100000210147 [1,0,0,0,0,0|2,0,1]=4 2688 B13R0.336 CCCCOCCCOCCOCC 7a_200011215613_100011215890 [1,0,0,0,0,0|2,0,1]=4 2689 B13R0.336 CCCCOCCNCCCOCC 2230a_100000210961_100000743108 [1,0,0,0,0,0|2,0,1]=4 2690 B13R0.336 CCCCOCCNCCCOCC 34a_100000210961_100000743108 [1,0,0,0,0,0|2,0,1]=4 2691 B13R0.336 CCCCOCCOCCCOCC 34a_100000210238_100012232248 [1,0,0,0,0,0|2,0,1]=4 2692 B13R0.336 CCCCOCCOCCCOCC 34a_100000757476_100000743108 [1,0,0,0,0,0|2,0,1]=4 2693 B13R0.336 CCCCOCCOCCCOCC 7a_100000210238_100012232248 [1,0,0,0,0,0|2,0,1]=4 2694 B13R0.336 CCCCOCCOCCCOCC 7a_100000757476_100000743108 [1,0,0,0,0,0|2,0,1]=4 2695 B13R0.336 CCCCOCCSCCCOCC 62a_100000743108_100012232248 [1,0,0,0,0,0|2,0,1]=4 2696 B13R0.336 CCCCOCCSCCCOCC 62a_100012232248_100000743108 [1,0,0,0,0,0|2,0,1]=4 2697 B13R0.336 CCCCSCCNCCCOCC 2230a_100025743550_100012232248 [1,0,0,0,0,0|2,0,1]=4 2698 B13R0.336 CCCCSCCOCCCOCC 34a_200000230436_100012232248 [1,0,0,0,0,0|2,0,1]=4 2699 B13R0.336 CCCCSCCOCCCOCC 7a_200000230436_100012232248 [1,0,0,0,0,0|2,0,1]=4 2700 B13R0.336 CCCNCCCCCCCCCO 2230a_100000078944_100000210303 [1,0,0,0,0,0|3,0,0]=4 2701 B13R0.336 CCCNCCCCCCCCCO 34a_100000078944_100000210303 [1,0,0,0,0,0|3,0,0]=4 2702 B13R0.336 CCCOCCCCCCCCCBr 34a_100009813782_100000210303 [1,0,0,0,0,0|3,0,0]=4 2703 B13R0.336 CCCOCCCCCCCCCBr 7a_100009813782_100000210303 [1,0,0,0,0,0|3,0,0]=4 2704 B13R0.336 CCCOCCCCCCCCCCl 34a_100009868337_100000210303 [1,0,0,0,0,0|3,0,0]=4 2705 B13R0.336 CCCOCCCCCCCCCCl 7a_100009868337_100000210303 [1,0,0,0,0,0|3,0,0]=4 2706 B13R0.336 CCCOCCCCCCCCCN 34a_100000078944_100000210303 [1,0,0,0,0,0|3,0,0]=4 2707 B13R0.336 CCCOCCCCCCCCCO 34a_100000210258_100009813782 [1,0,0,0,0,0|3,0,0]=4 2708 B13R0.336 CCCOCCCNCCCOCC 2230a_100011217757_100012232248 [1,0,0,0,0,0|2,0,1]=4 2709 B13R0.336 CCCOCCCNCCCOCC 34a_100011217757_100012232248 [1,0,0,0,0,0|2,0,1]=4 2710 B13R0.336 CCCSCCCCCCCCCO 62a_100000210303_100009813782 [1,0,0,0,0,0|3,0,0]=4 2711 B13R0.336 CCCSCCCCCCCCCO 62a_100009813782_100000210303 [1,0,0,0,0,0|3,0,0]=4 2712 B13R0.336 CCNCCCCCCCCCCO 2230a_100000066964_100000210202 [1,0,0,0,0,0|2,0,1]=4 2713 B13R0.336 CCNCCCCCCCCCCO 2230a_100015525214_100009813290 [1,0,0,0,0,0|2,0,1]=4 2714 B13R0.336 CCNCCCCCCCCCCO 34a_100000066964_100000210202 [1,0,0,0,0,0|2,0,1]=4 2715 B13R0.336 CCOCCCCCCCCCCBr 34a_100009813290_100000210202 [1,0,0,0,0,0|1,0,1]=3 2716 B13R0.336 CCOCCCCCCCCCCBr 7a_100009813290_100000210202 [1,0,0,0,0,0|1,0,1]=3 2717 B13R0.336 CCOCCCCCCCCCCCl 34a_200000033068_100000210202 [1,0,0,0,0,0|1,0,1]=3 2718 B13R0.336 CCOCCCCCCCCCCCl 7a_200000033068_100000210202 [1,0,0,0,0,0|1,0,1]=3 2719 B13R0.336 CCOCCCCCCCCCCN 34a_100000066964_100000210202 [1,0,0,0,0,0|1,0,1]=3 2720 B13R0.336 CCOCCCCCCCCCCO 34a_100121572206_100009813290 [1,0,0,0,0,0|1,0,1]=3 2721 B13R0.336 CCOCCCCCCCCCOC 34a_100009875440_200000210301 [1,0,0,0,0,0|1,0,1]=3 2722 B13R0.336 CCOCCCCCCCCCOC 7a_100009875440_200000210301 [1,0,0,0,0,0|1,0,1]=3 2723 B13R0.336 CCOCCCCCCCCCO[13CH3] 34a_100009875440_200025704644 [1,0,0,0,0,0|1,0,1]=3 2724 B13R0.336 CCOCCCCCCCCCO[13CH3] 7a_100009875440_200025704644 [1,0,0,0,0,0|1,0,1]=3 2725 B13R0.336 CCOCCCNCCCCCCF 2230a_100000210961_100015922095 [1,0,0,0,0,0|2,0,1]=4 2726 B13R0.336 CCOCCCNCCCCCCF 34a_100000210961_100015922095 [1,0,0,0,0,0|2,0,1]=4 2727 B13R0.336 CCOCCCNCCCCCCO 2230a_100000210961_100000766143 [1,0,0,0,0,0|2,0,1]=4 2728 B13R0.336 CCOCCCNCCCCCCO 2230a_100000686447_100012232248 [1,0,0,0,0,0|2,0,1]=4 2729 B13R0.336 CCOCCCNCCCCCCO 34a_100000210961_100000766143 [1,0,0,0,0,0|2,0,1]=4 2730 B13R0.336 CCOCCCNCCCCCCO 34a_100000686447_100012232248 [1,0,0,0,0,0|2,0,1]=4 2731 B13R0.336 CCOCCCNCCCCCOC 2230a_100000747528_100012232248 [1,0,0,0,0,0|2,0,1]=4 2732 B13R0.336 CCOCCCNCCCCCOC 34a_100000747528_100012232248 [1,0,0,0,0,0|2,0,1]=4 2733 B13R0.336 CCOCCCOCCCCCCBr 34a_100011215345_100012232248 [1,0,0,0,0,0|2,0,1]=4 2734 B13R0.336 CCOCCCOCCCCCCBr 7a_100011215345_100012232248 [1,0,0,0,0,0|2,0,1]=4 2735 B13R0.336 CCOCCCOCCCCCCCl 34a_100000766143_100012232248 [1,0,0,0,0,0|2,0,1]=4 2736 B13R0.336 CCOCCCOCCCCCCCl 7a_100000766143_100012232248 [1,0,0,0,0,0|2,0,1]=4 2737 B13R0.336 CCOCCCOCCCCCCF 34a_100000732779_100012232248 [1,0,0,0,0,0|2,0,1]=4 2738 B13R0.336 CCOCCCOCCCCCCF 34a_100000757476_100015922095 [1,0,0,0,0,0|2,0,1]=4 2739 B13R0.336 CCOCCCOCCCCCCF 7a_100000732779_100012232248 [1,0,0,0,0,0|2,0,1]=4 2740 B13R0.336 CCOCCCOCCCCCCF 7a_100000757476_100015922095 [1,0,0,0,0,0|2,0,1]=4 2741 B13R0.336 CCOCCCOCCCCCCN 34a_100000686447_100012232248 [1,0,0,0,0,0|2,0,1]=4 2742 B13R0.336 CCOCCCOCCCCCCO 34a_100000757476_100000766143 [1,0,0,0,0,0|2,0,1]=4 2743 B13R0.336 CCOCCCOCCCCCCO 7a_100000757476_100000766143 [1,0,0,0,0,0|2,0,1]=4 2744 B13R0.336 CCOCCCOCCCCCNC 34a_100000722520_100012232248 [1,0,0,0,0,0|2,0,1]=4 2745 B13R0.336 CCOCCCSCCCCCCF 62a_100012232248_100015922095 [1,0,0,0,0,0|2,0,1]=4 2746 B13R0.336 CCOCCCSCCCCCCF 62a_100015922095_100012232248 [1,0,0,0,0,0|2,0,1]=4 2747 B13R0.336 CCOCCCSCCCCCCO 62a_100000766143_100012232248 [1,0,0,0,0,0|2,0,1]=4 2748 B13R0.336 CCOCCCSCCCCCCO 62a_100012232248_100000766143 [1,0,0,0,0,0|2,0,1]=4 2749 B13R0.336 CCOCCNCCCCCCCO 2230a_100011996573_100011215890 [1,0,0,0,0,0|2,0,1]=4 2750 B13R0.336 CCOCCNCCCCCCCO 2230a_102516460346_100000760002 [1,0,0,0,0,0|2,0,1]=4 2751 B13R0.336 CCOCCNCCCCCCCO 34a_100011996573_100000210147 [1,0,0,0,0,0|2,0,1]=4 2752 B13R0.336 CCOCCNCCCCCCCO 34a_102516460346_100000760002 [1,0,0,0,0,0|2,0,1]=4 2753 B13R0.336 CCOCCNCCCCCCOC 2230a_102516460346_100011998445 [1,0,0,0,0,0|2,0,1]=4 2754 B13R0.336 CCOCCNCCCCCCOC 34a_102516460346_100011998445 [1,0,0,0,0,0|2,0,1]=4 2755 B13R0.336 CCOCCOCCCCCCCBr 34a_100000760002_100000210147 [1,0,0,0,0,0|2,0,1]=4 2756 B13R0.336 CCOCCOCCCCCCCBr 7a_100000760002_100011215890 [1,0,0,0,0,0|2,0,1]=4 2757 B13R0.336 CCOCCOCCCCCCCN 34a_100011996573_100000210147 [1,0,0,0,0,0|2,0,1]=4 2758 B13R0.336 CCOCCOCCCCCCCO 34a_100000210136_100000760002 [1,0,0,0,0,0|2,0,1]=4 2759 B13R0.336 CCOCCOCCCCCCCO 7a_100000210136_100000760002 [1,0,0,0,0,0|2,0,1]=4 2760 B13R0.336 CCOCCOCCCCCCOC 34a_100000210136_100011998445 [1,0,0,0,0,0|2,0,1]=4 2761 B13R0.336 CCOCCOCCCCCCOC 34a_200012092642_100000210147 [1,0,0,0,0,0|2,0,1]=4 2762 B13R0.336 CCOCCOCCCCCCOC 7a_100000210136_100011998445 [1,0,0,0,0,0|2,0,1]=4 2763 B13R0.336 CCOCCOCCCCCCOC 7a_200012092642_100011215890 [1,0,0,0,0,0|2,0,1]=4 2764 B13R0.336 CCOCCSCCCCCCCO 62a_100000210147_100000760002 [1,0,0,0,0,0|2,0,1]=4 2765 B13R0.336 CCOCCSCCCCCCCO 62a_100000760002_100011215890 [1,0,0,0,0,0|2,0,1]=4 2766 B13R0.336 CCOCCSCCCCCCOC 62a_100000210147_100011998445 [1,0,0,0,0,0|2,0,1]=4 2767 B13R0.336 CCOCCSCCCCCCOC 62a_100011998445_100011215890 [1,0,0,0,0,0|2,0,1]=4 2768 B13R0.336 CCOCSCCCCCCCCO 62a_100000033203_100000739092 [1,0,0,0,0,0|2,0,1]=4 2769 B13R0.336 CCOCSCCCCCCCCO 62a_100000739092_100000033203 [1,0,0,0,0,0|2,0,1]=4 2770 B13R0.336 CCSCCCCCCCCCCO 62a_100000210202_200000033068 [1,0,0,0,0,0|1,1,1]=4 2771 B13R0.336 CCSCCCCCCCCCCO 62a_100009813290_100000210202 [1,0,0,0,0,0|1,1,1]=4 2772 B13R0.336 FCOCCCCCCCCCCBr 34a_100009813290_100015361967 [1,0,0,0,0,0|2,0,1]=4 2773 B13R0.336 FCOCCCCCCCCCCBr 7a_100009813290_100015361967 [1,0,0,0,0,0|2,0,1]=4 2774 B13R0.336 FCOCCCCCCCCCCCl 34a_200000033068_100015361967 [1,0,0,0,0,0|2,0,1]=4 2775 B13R0.336 FCOCCCCCCCCCCCl 7a_200000033068_100015361967 [1,0,0,0,0,0|2,0,1]=4 2776 B13R0.336 NCCCCCCCCCCOCF 34a_100000066964_100015361967 [1,0,0,0,0,0|2,0,1]=4 2777 B15R0.1 C#CCCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100000753159 [0,1,0,0,0,0|0,0,3]=4 2778 B15R0.1 C#CCCC(=O)CCCCCC(=O)OCC 1458a_100000692101_100000755133 [0,1,0,0,0,0|0,0,3]=4 2779 B15R0.1 C/C=C/CC(=O)CCCCCC(=O)OCC 1458a_100000037472_100102629194 [0,1,0,0,0,0|0,0,3]=4 2780 B15R0.1 C=CCCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100000754431 [0,1,0,0,0,0|0,0,3]=4 2781 B15R0.1 C=CCCC(=O)CCCCCC(=O)OCC 1458a_100000749702_100000755133 [0,1,0,0,0,0|0,0,3]=4 2782 B15R0.1 C=CCCC(C)OCCCCC(=O)OCC 34a_100000765329_100000750268 [0,1,0,0,0,0|1,0,2]=4 2783 B15R0.1 C=CCCC(C)OCCCCC(=O)OCC 7a_100000765329_100000750268 [0,1,0,0,0,0|1,0,2]=4 2784 B15R0.1 C=CCCN(C)CCCCCC(=O)OCC 2230a_100020639649_100000755133 [0,1,0,0,0,0|1,0,2]=4 2785 B15R0.1 C=CCCN(C)CCCCCC(=O)OCC 269982a_100020639649_100000755133 [0,1,0,0,0,0|1,0,2]=4 2786 B15R0.1 CC#CCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100000748600 [0,1,0,0,0,0|0,0,3]=4 2787 B15R0.1 CC=CCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100000070051 [0,1,0,0,0,0|0,0,3]=4 2788 B15R0.1 CC=CCC(=O)CCCCCC(=O)OCC 1458a_100121576822_100000755133 [0,1,0,0,0,0|0,0,3]=4 2789 B15R0.1 CCC#CC(=O)CCCCCC(=O)OCC 1458a_100011827653_100000755133 [0,1,0,0,0,0|0,0,3]=4 2790 B15R0.1 CCC#CC(C)OCCCCC(=O)OCC 34a_100000033903_100000750268 [0,1,0,0,0,0|1,0,2]=4 2791 B15R0.1 CCC#CC(C)OCCCCC(=O)OCC 7a_100000033903_100000750268 [0,1,0,0,0,0|1,0,2]=4 2792 B15R0.1 CCC=CC(=O)CCCCCC(=O)OCC 1458a_100000212282_100000755133 [0,1,0,0,0,0|0,0,3]=4 2793 B15R0.1 CCCCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100000210211 [0,1,0,0,0,0|0,0,1]=2 2794 B15R0.1 CCCCC(=O)CCCCCC(=O)OCC 1458a_100000210183_100000755133 [0,1,0,0,0,0|0,0,1]=2 2795 B15R0.1 CCCCC(=O)CCCOCC(=O)OCC 1458a_100000210183_100009893628 [0,1,0,0,0,0|1,0,1]=3 2796 B15R0.1 CCCCC(=O)NCCCCC(=O)OCC 188690a_100000718961_100000210183 [0,1,0,0,0,0|1,0,1]=3 2797 B15R0.1 CCCCC(C)COC/C=C/C(=O)OCC 34a_100011995851_100016267167 [0,1,0,0,0,0|1,0,2]=4 2798 B15R0.1 CCCCC(C)COC/C=C/C(=O)OCC 7a_100011995851_100016267167 [0,1,0,0,0,0|1,0,2]=4 2799 B15R0.1 CCCCC(C)COCCCC(=O)OCC 34a_100011995851_100009991533 [0,1,0,0,0,0|1,0,0]=2 2800 B15R0.1 CCCCC(C)COCCCC(=O)OCC 7a_100011995851_100011215271 [0,1,0,0,0,0|1,0,0]=2 2801 B15R0.1 CCCCC(C)COCCNC(=O)OCC 7a_100011995851_200011445536 [0,1,0,0,0,0|2,0,0]=3 2802 B15R0.1 CCCCC(C)NCCCCC(=O)OCC 2230a_100000126638_100000750268 [0,1,0,0,0,0|1,0,0]=2 2803 B15R0.1 CCCCC(C)NCCOCC(=O)OCC 2230a_100000126638_100000088970 [0,1,0,0,0,0|2,0,0]=3 2804 B15R0.1 CCCCC(C)OCCCCC(=O)OCC 34a_100000687866_100000750268 [0,1,0,0,0,0|1,0,0]=2 2805 B15R0.1 CCCCC(C)OCCCCC(=O)OCC 7a_100000687866_100000750268 [0,1,0,0,0,0|1,0,0]=2 2806 B15R0.1 CCCCC(C)OCCOCC(=O)OCC 34a_100000687866_100000088970 [0,1,0,0,0,0|2,0,0]=3 2807 B15R0.1 CCCCC(C)OCCOCC(=O)OCC 7a_100000687866_100000088970 [0,1,0,0,0,0|2,0,0]=3 2808 B15R0.1 CCCCC(C)OCCSCC(=O)OCC 7a_200000230590_200011215066 [0,1,0,0,0,0|2,0,0]=3 2809 B15R0.1 CCCCC(C)SCCCCC(=O)OCC 62a_100000750268_200011215066 [0,1,0,0,0,0|1,0,0]=2 2810 B15R0.1 CCCCC(C)SCCCCC(=O)OCC 62a_200011215066_100000750268 [0,1,0,0,0,0|1,0,0]=2 2811 B15R0.1 CCCCC(C)SCCOCC(=O)OCC 62a_100000088970_200011215066 [0,1,0,0,0,0|2,0,0]=3 2812 B15R0.1 CCCCC(C)SCCOCC(=O)OCC 62a_200011215066_100000088970 [0,1,0,0,0,0|2,0,0]=3 2813 B15R0.1 CCCCN(C)CCCCCC(=O)OCC 2230a_100000207549_100000755133 [0,1,0,0,0,0|1,0,0]=2 2814 B15R0.1 CCCCN(C)CCCCCC(=O)OCC 269982a_100000207549_100000755133 [0,1,0,0,0,0|1,0,0]=2 2815 B15R0.1 CCCCN(C)CCCOCC(=O)OCC 2230a_100000207549_100009893628 [0,1,0,0,0,0|2,0,0]=3 2816 B15R0.1 CCCCN(C)CCCOCC(=O)OCC 269982a_100000207549_100009893628 [0,1,0,0,0,0|2,0,0]=3 2817 B15R0.1 CCCC[C@H](N)COC/C=C/C(=O)OCC 34a_100011934283_100016267167 [0,1,0,0,0,0|1,0,2]=4 2818 B15R0.1 CCCC[C@H](N)COCCCC(=O)OCC 34a_100011934283_100009991533 [0,1,0,0,0,0|1,0,0]=2 2819 B15R0.1 CCCNC(=O)CCCCCC(=O)OCC 11a_100020643023_100000037472 [0,1,0,0,0,0|1,0,1]=3 2820 B15R0.1 CCCNC(=O)CCCCCC(=O)OCC 1626a_100020643023_100000037472 [0,1,0,0,0,0|1,0,1]=3 2821 B15R0.1 CCCNC(=O)CCCCCC(=O)OCC 240690a_100020643023_100000037472 [0,1,0,0,0,0|1,0,1]=3 2822 B15R0.1 CCCNC(=O)CCCCCC(=O)OCC 527a_100020643023_100000037472 [0,1,0,0,0,0|1,0,1]=3 2823 B15R0.1 CCCNC(=O)CCCSCC(=O)OCC 62a_100000188475_100011194427 [0,1,0,0,0,0|2,0,1]=4 2824 B15R0.1 CCCNC(=O)CCCSCC(=O)OCC 62a_100011194427_100000188475 [0,1,0,0,0,0|2,0,1]=4 2825 B15R0.1 CCCNC(=O)CNCCCC(=O)OCC 2230a_100000174927_100009991533 [0,1,0,0,0,0|2,0,1]=4 2826 B15R0.1 CCCNC(=O)COCCCC(=O)OCC 7a_100012001163_100000183358 [0,1,0,0,0,0|2,0,1]=4 2827 B15R0.1 CCCNC(=O)CSCCCC(=O)OCC 62a_100000183358_100009991533 [0,1,0,0,0,0|2,0,1]=4 2828 B15R0.1 CCCNC(=O)CSCCCC(=O)OCC 62a_100009991533_100000183358 [0,1,0,0,0,0|2,0,1]=4 2829 B15R0.1 CCCOC(=O)COCCCC(=O)OCC 7a_100012001163_200011215008 [0,1,0,0,0,0|2,0,1]=4 2830 B15R0.1 CCCOC(=O)CSCCCC(=O)OCC 62a_100009991533_200011215008 [0,1,0,0,0,0|2,0,1]=4 2831 B15R0.1 CCCOC(=O)CSCCCC(=O)OCC 62a_200011215008_100009991533 [0,1,0,0,0,0|2,0,1]=4 2832 B15R0.1 CCCOC(C)CNCCCC(=O)OCC 2230a_100015185124_100009991533 [0,1,0,0,0,0|2,0,0]=3 2833 B15R0.1 CCCOC(C)CNCCCC(=O)OCC 34a_100015185124_100009991533 [0,1,0,0,0,0|2,0,0]=3 2834 B15R0.1 CCNNC(=O)CCCCCC(=O)OCC 22a_100000756455_100000037472 [0,1,0,0,0,0|2,0,1]=4 2835 B15R0.1 CCOC(=O)CCCCCC(=O)CCC#N 1458a_100000037472_100011215226 [0,1,0,0,0,0|1,0,2]=4 2836 B15R0.1 CCOC(=O)CCCCCC(=O)CCC#N 1458a_100011934036_100000755133 [0,1,0,0,0,0|1,0,2]=4 2837 B15R0.1 CCOC(=O)CCCCCC(=O)CCCF 1458a_100000037472_100011934791 [0,1,0,0,0,0|1,0,1]=3 2838 B15R0.1 CCOC(=O)CCCCCC(=O)CCCO 1458a_100000037472_100011215043 [0,1,0,0,0,0|1,0,1]=3 2839 B15R0.1 CCOC(=O)CCCCCC(=O)CCOC 1458a_100000037472_100000233755 [0,1,0,0,0,0|1,0,1]=3 2840 B15R0.1 CCOC(=O)CCCCCC(=O)CCOC 1458a_100000749529_100000755133 [0,1,0,0,0,0|1,0,1]=3 2841 B15R0.1 CCOC(=O)CCCCCC(=O)CCSC 1458a_100000037472_100000751147 [0,1,0,0,0,0|1,0,1]=3 2842 B15R0.1 CCOC(=O)CCCCCC(=O)CCSC 1458a_100000174002_100000755133 [0,1,0,0,0,0|1,0,1]=3 2843 B15R0.1 CCOC(=O)CCCCCC(=O)CSCC 1458a_100000230394_100000755133 [0,1,0,0,0,0|1,0,1]=3 2844 B15R0.1 CCOC(=O)CCCCCC(=O)NCCF 11a_100000724931_100000037472 [0,1,0,0,0,0|2,0,1]=4 2845 B15R0.1 CCOC(=O)CCCCCC(=O)NCCF 1626a_100000724931_100000037472 [0,1,0,0,0,0|2,0,1]=4 2846 B15R0.1 CCOC(=O)CCCCCC(=O)NCCF 240690a_100000724931_100000037472 [0,1,0,0,0,0|2,0,1]=4 2847 B15R0.1 CCOC(=O)CCCCCC(=O)NCCF 527a_100000724931_100000037472 [0,1,0,0,0,0|2,0,1]=4 2848 B15R0.1 CCOC(=O)CCCCCC(=O)NCCO 240690a_100000210304_100000037472 [0,1,0,0,0,0|2,0,1]=4 2849 B15R0.1 CCOC(=O)CCCCCC(=O)NCCO 527a_100000210304_100000037472 [0,1,0,0,0,0|2,0,1]=4 2850 B15R0.1 CCOC(=O)CCCCCN(C)CCC#N 2230a_100000184479_100000755133 [0,1,0,0,0,0|2,0,1]=4 2851 B15R0.1 CCOC(=O)CCCCCN(C)CCCO 2230a_100000213112_100000755133 [0,1,0,0,0,0|2,0,0]=3 2852 B15R0.1 CCOC(=O)CCCCCN(C)CCCO 269982a_100000213112_100000755133 [0,1,0,0,0,0|2,0,0]=3 2853 B15R0.1 CCOC(=O)CCCCCN(C)CCOC 2230a_100000743101_100000755133 [0,1,0,0,0,0|2,0,0]=3 2854 B15R0.1 CCOC(=O)CCCCCN(C)CCOC 269982a_100000743101_100000755133 [0,1,0,0,0,0|2,0,0]=3 2855 B15R0.1 CCOC(=O)CCCCCN(C)CCSC 2230a_100000686725_100000755133 [0,1,0,0,0,0|2,0,0]=3 2856 B15R0.1 CCOC(=O)CCCCCN(C)CCSC 269982a_100000686725_100000755133 [0,1,0,0,0,0|2,0,0]=3 2857 B15R0.1 CCOC(=O)CCCCNC(=O)CCOC 188690a_100000718961_100000749529 [0,1,0,0,0,0|2,0,1]=4 2858 B15R0.1 CCOC(=O)CCCCNC(=O)CCSC 188690a_100000718961_100000174002 [0,1,0,0,0,0|2,0,1]=4 2859 B15R0.1 CCOC(=O)CCCCNC(=O)CSCC 188690a_100000718961_100000230394 [0,1,0,0,0,0|2,0,1]=4 2860 B15R0.1 CCOC(=O)CCCCOC(C)CCCCl 34a_200000718107_100000750268 [0,1,0,0,0,0|2,0,0]=3 2861 B15R0.1 CCOC(=O)CCCCOC(C)CCCCl 7a_200000718107_100000750268 [0,1,0,0,0,0|2,0,0]=3 2862 B15R0.1 CCOC(=O)CCCNC[C@H](C)CCCO 2230a_100160569302_100009991533 [0,1,0,0,0,0|2,0,0]=3 2863 B15R0.1 CCOC(=O)CCCNC[C@H](C)CCCO 34a_100160569302_100009991533 [0,1,0,0,0,0|2,0,0]=3 2864 B15R0.1 CCOC(=O)CCCOC[C@@H](C)OCOC 34a_100016172286_100009991533 [0,1,0,0,0,0|3,0,0]=4 2865 B15R0.1 CCOC(=O)CCCOC[C@@H](C)OCOC 7a_100016172286_100011215271 [0,1,0,0,0,0|3,0,0]=4 2866 B15R0.1 CCOC(=O)CCCOC[C@@H](N)CCSC 34a_100011827619_100009991533 [0,1,0,0,0,0|2,0,0]=3 2867 B15R0.1 CCOC(=O)COCCCC(=O)CCOC 1458a_100000749529_100009893628 [0,1,0,0,0,0|2,0,1]=4 2868 B15R0.1 CCOC(=O)COCCCC(=O)CCSC 1458a_100000174002_100009893628 [0,1,0,0,0,0|2,0,1]=4 2869 B15R0.1 CCOC(=O)COCCCC(=O)CSCC 1458a_100000230394_100009893628 [0,1,0,0,0,0|2,0,1]=4 2870 B15R0.1 CCOC(=O)COCCCN(C)CCCO 2230a_100000213112_100009893628 [0,1,0,0,0,0|3,0,0]=4 2871 B15R0.1 CCOC(=O)COCCCN(C)CCCO 269982a_100000213112_100009893628 [0,1,0,0,0,0|3,0,0]=4 2872 B15R0.1 CCOC(=O)COCCCN(C)CCOC 2230a_100000743101_100009893628 [0,1,0,0,0,0|3,0,0]=4 2873 B15R0.1 CCOC(=O)COCCCN(C)CCOC 269982a_100000743101_100009893628 [0,1,0,0,0,0|3,0,0]=4 2874 B15R0.1 CCOC(=O)COCCCN(C)CCSC 2230a_100000686725_100009893628 [0,1,0,0,0,0|3,0,0]=4 2875 B15R0.1 CCOC(=O)COCCCN(C)CCSC 269982a_100000686725_100009893628 [0,1,0,0,0,0|3,0,0]=4 2876 B15R0.1 CCOC(=O)COCCOC(C)CCCCl 34a_200000718107_100000088970 [0,1,0,0,0,0|3,0,0]=4 2877 B15R0.1 CCOC(=O)COCCOC(C)CCCCl 7a_200000718107_100000088970 [0,1,0,0,0,0|3,0,0]=4 2878 B15R0.1 CCOCC(=O)CCCCCC(=O)OCC 1458a_100000211967_100000755133 [0,1,0,0,0,0|1,0,1]=3 2879 B15R0.1 CCOCC(=O)CCCOCC(=O)OCC 1458a_100000211967_100009893628 [0,1,0,0,0,0|2,0,1]=4 2880 B15R0.1 CCOCC(=O)NCCCCC(=O)OCC 188690a_100000718961_100000211967 [0,1,0,0,0,0|2,0,1]=4 2881 B15R0.1 CCOCC(C)OCCCCC(=O)OCC 34a_100000718985_100000750268 [0,1,0,0,0,0|2,0,0]=3 2882 B15R0.1 CCOCC(C)OCCCCC(=O)OCC 7a_100000718985_100000750268 [0,1,0,0,0,0|2,0,0]=3 2883 B15R0.1 CCOCC(C)OCCOCC(=O)OCC 34a_100000718985_100000088970 [0,1,0,0,0,0|3,0,0]=4 2884 B15R0.1 CCOCC(C)OCCOCC(=O)OCC 7a_100000718985_100000088970 [0,1,0,0,0,0|3,0,0]=4 2885 B15R0.1 CCOCC(O)CNCCCC(=O)OCC 2230a_102515437182_100009991533 [0,1,0,0,0,0|2,0,0]=3 2886 B15R0.1 CCOCC(O)CNCCCC(=O)OCC 34a_102515437182_100009991533 [0,1,0,0,0,0|2,0,0]=3 2887 B15R0.18 C#CCCCCC(=O)CCCC(=O)OCC 1458a_100000210991_100010269958 [0,1,0,0,0,0|0,0,3]=4 2888 B15R0.18 C#CCCCCC(=O)CCCC(=O)OCC 1458a_100000696528_100011215271 [0,1,0,0,0,0|0,0,3]=4 2889 B15R0.18 C=CCCCCC(=O)CCCC(=O)OCC 1458a_100000210991_100011215482 [0,1,0,0,0,0|0,0,3]=4 2890 B15R0.18 C=CCCCCC(=O)CCCC(=O)OCC 1458a_100011215552_100011215271 [0,1,0,0,0,0|0,0,3]=4 2891 B15R0.18 C=CCCCCN(C)CCCC(=O)OCC 2230a_100012000471_100009991533 [0,1,0,0,0,0|1,0,2]=4 2892 B15R0.18 C=CCCCCN(C)CCCC(=O)OCC 269982a_100012000471_100009991533 [0,1,0,0,0,0|1,0,2]=4 2893 B15R0.18 CC/C=C\CCC(=O)CCCC(=O)OCC 1458a_100000210991_100015370543 [0,1,0,0,0,0|0,0,3]=4 2894 B15R0.18 CCC/C=C/CC(=O)CCCC(=O)OCC 1458a_200016266809_100011215271 [0,1,0,0,0,0|0,0,3]=4 2895 B15R0.18 CCCCC=CC(=O)CCCC(=O)OCC 1458a_100016266645_100011215271 [0,1,0,0,0,0|0,0,3]=4 2896 B15R0.18 CCCCCCC(=O)CCCC(=O)NCC 1458a_100000199580_100000210757 [0,1,0,0,0,0|1,0,1]=3 2897 B15R0.18 CCCCCCC(=O)CCCC(=O)OCC 1458a_100000210991_100000210757 [0,1,0,0,0,0|0,0,1]=2 2898 B15R0.18 CCCCCCC(=O)CCCC(=O)OCC 1458a_100102632555_100011215271 [0,1,0,0,0,0|0,0,1]=2 2899 B15R0.18 CCCCCCC(=O)CCNC(=O)OCC 1458a_100102632555_200011445536 [0,1,0,0,0,0|1,0,1]=3 2900 B15R0.18 CCCCCCC(=O)NCCC(=O)NCC 11a_100025743525_100102632555 [0,1,0,0,0,0|2,0,1]=4 2901 B15R0.18 CCCCCCC(=O)NCCC(=O)NCC 1626a_100025743525_100102632555 [0,1,0,0,0,0|2,0,1]=4 2902 B15R0.18 CCCCCCC(=O)NCCC(=O)NCC 240690a_100025743525_100102632555 [0,1,0,0,0,0|2,0,1]=4 2903 B15R0.18 CCCCCCC(=O)NCCC(=O)NCC 527a_100025743525_100102632555 [0,1,0,0,0,0|2,0,1]=4 2904 B15R0.18 CCCCCCC(=O)NCCC(=O)OCC 188690a_100000746078_100102632555 [0,1,0,0,0,0|1,0,1]=3 2905 B15R0.18 CCCCCCC(C)NCCC(=O)NCC 2230a_100000210919_100000737597 [0,1,0,0,0,0|2,0,0]=3 2906 B15R0.18 CCCCCCC(C)NCCC(=O)NCC 270004a_100025743525_100000210826 [0,1,0,0,0,0|2,0,0]=3 2907 B15R0.18 CCCCCCC(C)NCCC(=O)NCC 34a_100025743525_100011215978 [0,1,0,0,0,0|2,0,0]=3 2908 B15R0.18 CCCCCCC(C)NCCC(=O)OCC 2230a_100000210919_100011206558 [0,1,0,0,0,0|1,0,0]=2 2909 B15R0.18 CCCCCCC(C)NCCC(=O)OCC 34a_100000210919_100000765890 [0,1,0,0,0,0|1,0,0]=2 2910 B15R0.18 CCCCCCC(C)NCOC(=O)CCC 2230a_100000210919_100000034017 [0,1,0,0,0,0|3,0,0]=4 2911 B15R0.18 CCCCCCC(C)NCOC(=O)CCC 34a_100000210919_100000034017 [0,1,0,0,0,0|3,0,0]=4 2912 B15R0.18 CCCCCCC(C)OCCC(=O)NCC 7a_100000210265_100000737597 [0,1,0,0,0,0|2,0,0]=3 2913 B15R0.18 CCCCCCC(C)OCCC(=O)OCC 34a_100000210265_100000765890 [0,1,0,0,0,0|1,0,0]=2 2914 B15R0.18 CCCCCCC(C)OCCC(=O)OCC 7a_100000210265_100011206558 [0,1,0,0,0,0|1,0,0]=2 2915 B15R0.18 CCCCCCC(C)OCOC(=O)CCC 34a_100000210265_100000034017 [0,1,0,0,0,0|3,0,0]=4 2916 B15R0.18 CCCCCCC(C)SCCC(=O)NCC 62a_100000737597_100011215978 [0,1,0,0,0,0|2,0,0]=3 2917 B15R0.18 CCCCCCC(C)SCCC(=O)NCC 62a_100011215978_100000737597 [0,1,0,0,0,0|2,0,0]=3 2918 B15R0.18 CCCCCCC(C)SCCC(=O)OCC 62a_100000765890_100011215978 [0,1,0,0,0,0|1,0,0]=2 2919 B15R0.18 CCCCCCC(C)SCCC(=O)OCC 62a_100011215978_100000765890 [0,1,0,0,0,0|1,0,0]=2 2920 B15R0.18 CCCCCCC(C)SCOC(=O)CCC 62a_100011215978_100000034017 [0,1,0,0,0,0|3,0,0]=4 2921 B15R0.18 CCCCCCC(C)SCOC(=O)OCC 62a_100011215978_100000075025 [0,1,0,0,0,0|2,0,0]=3 2922 B15R0.18 CCCCCCN(C)C/C=C/C(=O)OCC 2230a_106256046315_100016267167 [0,1,0,0,0,0|1,0,2]=4 2923 B15R0.18 CCCCCCN(C)C/C=C/C(=O)OCC 269982a_106256046315_100016267167 [0,1,0,0,0,0|1,0,2]=4 2924 B15R0.18 CCCCCCN(C)CCCC(=O)OCC 2230a_106256046315_100009991533 [0,1,0,0,0,0|1,0,0]=2 2925 B15R0.18 CCCCCCN(C)CCCC(=O)OCC 269982a_106256046315_100009991533 [0,1,0,0,0,0|1,0,0]=2 2926 B15R0.18 CCCCCCN(C)CCNC(=O)OCC 269982a_106256046315_200011445536 [0,1,0,0,0,0|2,0,0]=3 2927 B15R0.18 CCCCCNC(=O)CCCC(=O)NCC 11a_100000209983_100000199580 [0,1,0,0,0,0|2,0,1]=4 2928 B15R0.18 CCCCCNC(=O)CCCC(=O)NCC 1626a_100000209983_100000199580 [0,1,0,0,0,0|2,0,1]=4 2929 B15R0.18 CCCCCNC(=O)CCCC(=O)NCC 240690a_100000209983_100000199580 [0,1,0,0,0,0|2,0,1]=4 2930 B15R0.18 CCCCCNC(=O)CCCC(=O)NCC 527a_100000209983_100000199580 [0,1,0,0,0,0|2,0,1]=4 2931 B15R0.18 CCCCCNC(=O)CCCC(=O)OCC 11a_100000209983_100000210991 [0,1,0,0,0,0|1,0,1]=3 2932 B15R0.18 CCCCCNC(=O)CCCC(=O)OCC 1626a_100000209983_100000210991 [0,1,0,0,0,0|1,0,1]=3 2933 B15R0.18 CCCCCNC(=O)CCCC(=O)OCC 240690a_100000209983_100000210991 [0,1,0,0,0,0|1,0,1]=3 2934 B15R0.18 CCCCCNC(=O)CCCC(=O)OCC 527a_100000209983_100000210991 [0,1,0,0,0,0|1,0,1]=3 2935 B15R0.18 CCCCCNC(=O)CSCC(=O)OCC 62a_100000188475_100000230301 [0,1,0,0,0,0|2,0,1]=4 2936 B15R0.18 CCCCCNC(=O)CSCC(=O)OCC 62a_100000230301_100000188475 [0,1,0,0,0,0|2,0,1]=4 2937 B15R0.18 CCCCNN=C(C)CCCC(=O)OCC 4a_100025702795_100000032325 [0,1,0,0,0,0|2,0,1]=4 2938 B15R0.18 CCCCNNC(=O)CCCC(=O)OCC 22a_100025702795_100000210991 [0,1,0,0,0,0|2,0,1]=4 2939 B15R0.18 CCCCOCC(=O)CCCC(=O)NCC 1458a_100000199580_100011995733 [0,1,0,0,0,0|2,0,1]=4 2940 B15R0.18 CCCCOCC(=O)CCCC(=O)OCC 1458a_100000210991_100011995733 [0,1,0,0,0,0|1,0,1]=3 2941 B15R0.18 CCCCOCC(=O)CCCC(=O)OCC 1458a_100000757543_100011215271 [0,1,0,0,0,0|1,0,1]=3 2942 B15R0.18 CCCCOCC(=O)CCNC(=O)OCC 1458a_100000757543_200011445536 [0,1,0,0,0,0|2,0,1]=4 2943 B15R0.18 CCCCOCC(=O)NCCC(=O)OCC 188690a_100000746078_100000757543 [0,1,0,0,0,0|2,0,1]=4 2944 B15R0.18 CCCCOCC(C)OCCC(=O)NCC 7a_100011217071_100000737597 [0,1,0,0,0,0|3,0,0]=4 2945 B15R0.18 CCCCOCC(C)OCCC(=O)OCC 34a_100011217071_100000765890 [0,1,0,0,0,0|2,0,0]=3 2946 B15R0.18 CCCCOCC(C)OCCC(=O)OCC 7a_100011217071_100011206558 [0,1,0,0,0,0|2,0,0]=3 2947 B15R0.18 CCCCSCC(=O)CCCC(=O)OCC 1458a_100000191162_100011215271 [0,1,0,0,0,0|1,0,1]=3 2948 B15R0.18 CCCCSCC(=O)CCNC(=O)OCC 1458a_100000191162_200011445536 [0,1,0,0,0,0|2,0,1]=4 2949 B15R0.18 CCCCSCC(=O)NCCC(=O)OCC 188690a_100000746078_100000191162 [0,1,0,0,0,0|2,0,1]=4 2950 B15R0.18 CCCOCCC(=O)CCCC(=O)NCC 1458a_100000199580_100011215938 [0,1,0,0,0,0|2,0,1]=4 2951 B15R0.18 CCCOCCC(=O)CCCC(=O)OCC 1458a_100000210991_100011215938 [0,1,0,0,0,0|1,0,1]=3 2952 B15R0.18 CCNC(=O)CCCC(=O)CCCCCF 1458a_100000199580_100000729378 [0,1,0,0,0,0|2,0,1]=4 2953 B15R0.18 CCNC(=O)CCCC(=O)CCCCCO 1458a_100000199580_100000746330 [0,1,0,0,0,0|2,0,1]=4 2954 B15R0.18 CCNC(=O)CCCC(=O)CCCCOC 1458a_100000199580_100000755781 [0,1,0,0,0,0|2,0,1]=4 2955 B15R0.18 CCNC(=O)CCCC(=O)CCCOCC 1458a_100000199580_100012232248 [0,1,0,0,0,0|2,0,1]=4 2956 B15R0.18 CCOC(=O)CCCC(=O)CCCCC#N 1458a_100000210991_100000211819 [0,1,0,0,0,0|1,0,2]=4 2957 B15R0.18 CCOC(=O)CCCC(=O)CCCCCF 1458a_100000210991_100000729378 [0,1,0,0,0,0|1,0,1]=3 2958 B15R0.18 CCOC(=O)CCCC(=O)CCCCCO 1458a_100000210991_100000746330 [0,1,0,0,0,0|1,0,1]=3 2959 B15R0.18 CCOC(=O)CCCC(=O)CCCCCO 1458a_100102619762_100011215271 [0,1,0,0,0,0|1,0,1]=3 2960 B15R0.18 CCOC(=O)CCCC(=O)CCCCOC 1458a_100000210991_100000755781 [0,1,0,0,0,0|1,0,1]=3 2961 B15R0.18 CCOC(=O)CCCC(=O)CCOCCO 1458a_100000210991_100011215305 [0,1,0,0,0,0|2,0,1]=4 2962 B15R0.18 CCOC(=O)CCCC(=O)CCOCCO 1458a_100011229844_100011215271 [0,1,0,0,0,0|2,0,1]=4 2963 B15R0.18 CCOC(=O)CCCC(=O)COCCOC 1458a_100000211095_100011215271 [0,1,0,0,0,0|2,0,1]=4 2964 B15R0.18 CCOC(=O)CCCC(=O)NCCCCO 240690a_100000750430_100000210991 [0,1,0,0,0,0|2,0,1]=4 2965 B15R0.18 CCOC(=O)CCCC(=O)NCCCCO 527a_100000750430_100000210991 [0,1,0,0,0,0|2,0,1]=4 2966 B15R0.18 CCOC(=O)CCCC(=O)NCCCOC 1626a_100150723488_100000210991 [0,1,0,0,0,0|2,0,1]=4 2967 B15R0.18 CCOC(=O)CCCC(=O)NCCCOC 240690a_100150723488_100000210991 [0,1,0,0,0,0|2,0,1]=4 2968 B15R0.18 CCOC(=O)CCCC(=O)NCCCOC 527a_100150723488_100000210991 [0,1,0,0,0,0|2,0,1]=4 2969 B15R0.18 CCOC(=O)CCCC(=O)NCCCSC 11a_100000749238_100000210991 [0,1,0,0,0,0|2,0,1]=4 2970 B15R0.18 CCOC(=O)CCCC(=O)NCCCSC 1626a_100000749238_100000210991 [0,1,0,0,0,0|2,0,1]=4 2971 B15R0.18 CCOC(=O)CCCC(=O)NCCCSC 240690a_100000749238_100000210991 [0,1,0,0,0,0|2,0,1]=4 2972 B15R0.18 CCOC(=O)CCCC(=O)NCCCSC 527a_100000749238_100000210991 [0,1,0,0,0,0|2,0,1]=4 2973 B15R0.18 CCOC(=O)CCCC(=O)NCCSCC 11a_100000106463_100000210991 [0,1,0,0,0,0|2,0,1]=4 2974 B15R0.18 CCOC(=O)CCCC(=O)NCCSCC 1626a_100000106463_100000210991 [0,1,0,0,0,0|2,0,1]=4 2975 B15R0.18 CCOC(=O)CCCC(=O)NCCSCC 240690a_100000106463_100000210991 [0,1,0,0,0,0|2,0,1]=4 2976 B15R0.18 CCOC(=O)CCCC(=O)NCCSCC 527a_100000106463_100000210991 [0,1,0,0,0,0|2,0,1]=4 2977 B15R0.18 CCOC(=O)CCCN(C)CCCCCO 2230a_100000722520_100009991533 [0,1,0,0,0,0|2,0,0]=3 2978 B15R0.18 CCOC(=O)CCCN(C)CCCCCO 269982a_100000722520_100009991533 [0,1,0,0,0,0|2,0,0]=3 2979 B15R0.18 CCOC(=O)CCCN(C)CCOCCO 2230a_100000228057_100009991533 [0,1,0,0,0,0|3,0,0]=4 2980 B15R0.18 CCOC(=O)CCCN(C)CCOCCO 269982a_100000228057_100009991533 [0,1,0,0,0,0|3,0,0]=4 2981 B15R0.18 CCOC(=O)CCNC(=O)CCCCCO 188690a_100000746078_100102619762 [0,1,0,0,0,0|2,0,1]=4 2982 B15R0.18 CCOC(=O)NCCC(=O)CCCCCO 1458a_100102619762_200011445536 [0,1,0,0,0,0|2,0,1]=4 2983 B15R0.18 CCOC(=O)NCCN(C)CCCCCO 269982a_100000722520_200011445536 [0,1,0,0,0,0|3,0,0]=4 2984 B15R0.18 CCOCCCC(=O)CCCC(=O)OCC 1458a_100000210991_100012232248 [0,1,0,0,0,0|1,0,1]=3 2985 B15R0.18 CCOCCNC(=O)CCCC(=O)OCC 11a_100011200944_100000210991 [0,1,0,0,0,0|2,0,1]=4 2986 B15R0.18 CCOCCNC(=O)CCCC(=O)OCC 1626a_102516460346_100000210991 [0,1,0,0,0,0|2,0,1]=4 2987 B15R0.18 CCOCCNC(=O)CCCC(=O)OCC 240690a_100011200944_100000210991 [0,1,0,0,0,0|2,0,1]=4 2988 B15R0.18 CCOCCNC(=O)CCCC(=O)OCC 527a_100011200944_100000210991 [0,1,0,0,0,0|2,0,1]=4 2989 B15R0.69 C#CCCCCCCCCC(=O)CC(C)C 1458a_100000029693_100000210624 [0,1,0,0,0,0|1,0,2]=4 2990 B15R0.69 C#CCCCCCCCCC(=O)CC(C)O 1458a_100000029693_100011218427 [0,1,0,0,0,0|1,0,2]=4 2991 B15R0.69 C#CCCCCCCCCC(=O)NC(C)C 11a_100138425928_100000029693 [0,1,0,0,0,0|1,0,2]=4 2992 B15R0.69 C#CCCCCCCCCC(=O)NC(C)C 1626a_100138425928_100000029693 [0,1,0,0,0,0|1,0,2]=4 2993 B15R0.69 C#CCCCCCCCCC(=O)NC(C)C 240690a_100138425928_100000029693 [0,1,0,0,0,0|1,0,2]=4 2994 B15R0.69 C#CCCCCCCCCC(=O)NC(C)C 527a_100138425928_100000029693 [0,1,0,0,0,0|1,0,2]=4 2995 B15R0.69 C#CCCCCCCOCC(=O)OC(C)C 34a_100011217361_100011215430 [0,1,0,0,0,0|1,0,2]=4 2996 B15R0.69 C#CCCCCCCOCC(=O)OC(C)C 7a_100011217361_100011215430 [0,1,0,0,0,0|1,0,2]=4 2997 B15R0.69 C#CCCCCCCSCC(=O)OC(C)C 62a_100011215430_100012276617 [0,1,0,0,0,0|1,0,2]=4 2998 B15R0.69 C#CCCCCCCSCC(=O)OC(C)C 62a_100012276617_100011215430 [0,1,0,0,0,0|1,0,2]=4 2999 B15R0.69 C#CCCCCCOCCC(=O)OC(C)C 7a_100000766912_100000760027 [0,1,0,0,0,0|1,0,2]=4 3000 B15R0.69 C#CCCCCCSCCC(=O)OC(C)C 62a_100000760027_100012094781 [0,1,0,0,0,0|1,0,2]=4 3001 B15R0.69 C#CCCCCCSCCC(=O)OC(C)C 62a_100012094781_100000760027 [0,1,0,0,0,0|1,0,2]=4 3002 B15R0.69 C#CCCNCCCCCC(=O)OC(C)C 34a_100000755551_200010986244 [0,1,0,0,0,0|1,0,2]=4 3003 B15R0.69 C#CCCOCCCCCC(=O)OC(C)C 34a_100011215631_200010986244 [0,1,0,0,0,0|1,0,2]=4 3004 B15R0.69 C#CCCSCCCCCC(=O)OC(C)C 62a_100000688953_200010986244 [0,1,0,0,0,0|1,0,2]=4 3005 B15R0.69 C#CCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000688953 [0,1,0,0,0,0|1,0,2]=4 3006 B15R0.69 C/C=C/COCCCCCC(=O)OC(C)C 34a_100016270725_200010986244 [0,1,0,0,0,0|1,0,2]=4 3007 B15R0.69 C/C=C/CSCCCCCC(=O)OC(C)C 62a_100102629194_200010986244 [0,1,0,0,0,0|1,0,2]=4 3008 B15R0.69 C/C=C/CSCCCCCC(=O)OC(C)C 62a_200010986244_100102629194 [0,1,0,0,0,0|1,0,2]=4 3009 B15R0.69 C=C(C)CC(=O)CCCCCCCCCF 1458a_200009909015_100000748629 [0,1,0,0,0,0|2,0,1]=4 3010 B15R0.69 C=C(C)CC(=O)COCCCCCCCC 1458a_100000759886_100000748629 [0,1,0,0,0,0|2,0,1]=4 3011 B15R0.69 C=C(F)CC(=O)CCCCCCCCCC 1458a_100000210375_100009893438 [0,1,0,0,0,0|1,0,2]=4 3012 B15R0.69 C=CCCCCCCCCC(=O)CC(C)C 1458a_100000210554_100011933949 [0,1,0,0,0,0|1,0,2]=4 3013 B15R0.69 C=CCCCCCCCCC(=O)CC(C)C 1458a_100000211349_100000210624 [0,1,0,0,0,0|1,0,2]=4 3014 B15R0.69 C=CCCCCCCCCC(=O)CC(C)O 1458a_100000211349_100011218427 [0,1,0,0,0,0|1,0,2]=4 3015 B15R0.69 C=CCCCCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100011933949 [0,1,0,0,0,0|1,0,2]=4 3016 B15R0.69 C=CCCCCCCCCC(=O)NC(C)C 11a_100138425928_100000211349 [0,1,0,0,0,0|1,0,2]=4 3017 B15R0.69 C=CCCCCCCCCC(=O)NC(C)C 1626a_100138425928_100000211349 [0,1,0,0,0,0|1,0,2]=4 3018 B15R0.69 C=CCCCCCCCCC(=O)NC(C)C 240690a_100138425928_100000211349 [0,1,0,0,0,0|1,0,2]=4 3019 B15R0.69 C=CCCCCCCCCC(=O)NC(C)C 527a_100138425928_100000211349 [0,1,0,0,0,0|1,0,2]=4 3020 B15R0.69 C=CCCCCCCOCC(=O)OC(C)C 34a_200011216477_100011215430 [0,1,0,0,0,0|1,0,2]=4 3021 B15R0.69 C=CCCCCCCOCC(=O)OC(C)C 7a_200011216477_100011215430 [0,1,0,0,0,0|1,0,2]=4 3022 B15R0.69 C=CCCCCCCSCC(=O)OC(C)C 62a_100011215430_100011215473 [0,1,0,0,0,0|1,0,2]=4 3023 B15R0.69 C=CCCCCCCSCC(=O)OC(C)C 62a_100011215473_100011215430 [0,1,0,0,0,0|1,0,2]=4 3024 B15R0.69 C=CCCCCCOCCC(=O)OC(C)C 7a_100011216702_100000760027 [0,1,0,0,0,0|1,0,2]=4 3025 B15R0.69 C=CCCCCCSCCC(=O)OC(C)C 62a_100000700193_100000760027 [0,1,0,0,0,0|1,0,2]=4 3026 B15R0.69 C=CCCCCCSCCC(=O)OC(C)C 62a_100000760027_100000700193 [0,1,0,0,0,0|1,0,2]=4 3027 B15R0.69 C=CCCNCCCCCC(=O)OC(C)C 2230a_100015191253_200010986244 [0,1,0,0,0,0|1,0,2]=4 3028 B15R0.69 C=CCCOCCCCCC(=O)OC(C)C 34a_100011205117_200010986244 [0,1,0,0,0,0|1,0,2]=4 3029 B15R0.69 C=CCCSCCCCCC(=O)OC(C)C 62a_100000754431_200010986244 [0,1,0,0,0,0|1,0,2]=4 3030 B15R0.69 C=CCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000754431 [0,1,0,0,0,0|1,0,2]=4 3031 B15R0.69 CC#CCCCCCCCC(=O)CC(C)C 1458a_100000066323_100000210624 [0,1,0,0,0,0|1,0,2]=4 3032 B15R0.69 CC#CCCCCCCCC(=O)CC(C)O 1458a_100000066323_100011218427 [0,1,0,0,0,0|1,0,2]=4 3033 B15R0.69 CC#CCCCCCCCC(=O)NC(C)C 11a_100138425928_100000066323 [0,1,0,0,0,0|1,0,2]=4 3034 B15R0.69 CC#CCCCCCCCC(=O)NC(C)C 1626a_100138425928_100000066323 [0,1,0,0,0,0|1,0,2]=4 3035 B15R0.69 CC#CCCCCCCCC(=O)NC(C)C 240690a_100138425928_100000066323 [0,1,0,0,0,0|1,0,2]=4 3036 B15R0.69 CC#CCCCCCCCC(=O)NC(C)C 527a_100138425928_100000066323 [0,1,0,0,0,0|1,0,2]=4 3037 B15R0.69 CC#CCNCCCCCC(=O)OC(C)C 2230a_100000685387_200010986244 [0,1,0,0,0,0|1,0,2]=4 3038 B15R0.69 CC#CCNCCCCCC(=O)OC(C)C 34a_100000685387_200010986244 [0,1,0,0,0,0|1,0,2]=4 3039 B15R0.69 CC#CCOCCCCCC(=O)OC(C)C 34a_100000761923_200010986244 [0,1,0,0,0,0|1,0,2]=4 3040 B15R0.69 CC#CCSCCCCCC(=O)OC(C)C 62a_100000748600_200010986244 [0,1,0,0,0,0|1,0,2]=4 3041 B15R0.69 CC#CCSCCCCCC(=O)OC(C)C 62a_200010986244_100000748600 [0,1,0,0,0,0|1,0,2]=4 3042 B15R0.69 CC(=CC(=O)CCCCCCCCCO)C 1458a_100000211388_100009813782 [0,1,0,0,0,0|2,0,1]=4 3043 B15R0.69 CC(=CC(=O)CCCCCCCCCO)Cl 1458a_200042562850_100009813782 [0,1,0,0,0,0|2,0,1]=4 3044 B15R0.69 CC(=CC(=O)CCCCCCCCCO)I 1458a_100025716642_100009813782 [0,1,0,0,0,0|2,0,1]=4 3045 B15R0.69 CC(C)CC(=O)CCCCCCCCCF 1458a_200009909015_100000210624 [0,1,0,0,0,0|2,0,0]=3 3046 B15R0.69 CC(C)CC(=O)CCCCCCCCCO 1458a_100000210554_100009813782 [0,1,0,0,0,0|2,0,0]=3 3047 B15R0.69 CC(C)CC(=O)NCCCCCCCCO 240690a_102515433106_100000210554 [0,1,0,0,0,0|3,0,0]=4 3048 B15R0.69 CC(C)NC(=O)CCCCCCCCCF 11a_100138425928_200009909015 [0,1,0,0,0,0|2,0,0]=3 3049 B15R0.69 CC(C)NC(=O)CCCCCCCCCF 240690a_100138425928_200009909015 [0,1,0,0,0,0|2,0,0]=3 3050 B15R0.69 CC(C)NC(=O)CCCCCCCCCF 527a_100138425928_200009909015 [0,1,0,0,0,0|2,0,0]=3 3051 B15R0.69 CC(C)NC(=O)CCCCCCCCCO 240690a_100138425928_100000032657 [0,1,0,0,0,0|2,0,0]=3 3052 B15R0.69 CC(C)NC(=O)CCNCCCCCCO 2230a_100000686447_100000737564 [0,1,0,0,0,0|3,0,0]=4 3053 B15R0.69 CC(C)NC(=O)CCOCCCCCCBr 7a_100011215345_100000737564 [0,1,0,0,0,0|3,0,0]=4 3054 B15R0.69 CC(C)NC(=O)CCOCCCCCCCl 7a_100000766143_100000737564 [0,1,0,0,0,0|3,0,0]=4 3055 B15R0.69 CC(C)NC(=O)CCOCCCCCCF 7a_100000732779_100000737564 [0,1,0,0,0,0|3,0,0]=4 3056 B15R0.69 CC(C)NC(=O)CCSCCCCCCF 62a_100000737564_100015922095 [0,1,0,0,0,0|3,0,0]=4 3057 B15R0.69 CC(C)NC(=O)CCSCCCCCCF 62a_100015922095_100000737564 [0,1,0,0,0,0|3,0,0]=4 3058 B15R0.69 CC(C)NC(=O)CCSCCCCCCO 62a_100000737564_100000766143 [0,1,0,0,0,0|3,0,0]=4 3059 B15R0.69 CC(C)NC(=O)CCSCCCCCCO 62a_100000766143_100000737564 [0,1,0,0,0,0|3,0,0]=4 3060 B15R0.69 CC(C)NC(=O)CNCCCCCCCO 2230a_100000168517_100000760002 [0,1,0,0,0,0|3,0,0]=4 3061 B15R0.69 CC(C)NC(=O)CNCCCCCCCO 2230a_100011996573_100000183996 [0,1,0,0,0,0|3,0,0]=4 3062 B15R0.69 CC(C)NC(=O)CNCCCCCCCO 34a_100011996573_100000183996 [0,1,0,0,0,0|3,0,0]=4 3063 B15R0.69 CC(C)NC(=O)COCCCCCCCBr 34a_100000760002_100000183996 [0,1,0,0,0,0|3,0,0]=4 3064 B15R0.69 CC(C)NC(=O)COCCCCCCCBr 7a_100000760002_100000183996 [0,1,0,0,0,0|3,0,0]=4 3065 B15R0.69 CC(C)NC(=O)COCCCCCCCN 34a_100011996573_100000183996 [0,1,0,0,0,0|3,0,0]=4 3066 B15R0.69 CC(C)NC(=O)CSCCCCCCCO 62a_100000183996_100000760002 [0,1,0,0,0,0|3,0,0]=4 3067 B15R0.69 CC(C)NC(=O)CSCCCCCCCO 62a_100000760002_100000183996 [0,1,0,0,0,0|3,0,0]=4 3068 B15R0.69 CC(C)NC(=O)NCCCCCCCCO 2708a_100138425928_102515433106 [0,1,0,0,0,0|3,0,0]=4 3069 B15R0.69 CC(C)NC(=O)NCCCCCCCCO 2708a_102515433106_100138425928 [0,1,0,0,0,0|3,0,0]=4 3070 B15R0.69 CC(C)NC(=O)NCCCCCCCCO 273464a_100138425928_102515433106 [0,1,0,0,0,0|3,0,0]=4 3071 B15R0.69 CC(C)NC(=O)NCCCCCCCCO 512a_100138425928_102515433106 [0,1,0,0,0,0|3,0,0]=4 3072 B15R0.69 CC(C)NC(=O)NCCCCCCCCO 512a_102515433106_100138425928 [0,1,0,0,0,0|3,0,0]=4 3073 B15R0.69 CC(C)OC(=O)CCCCCNCCCF 2230a_100015189416_200010986244 [0,1,0,0,0,0|2,0,0]=3 3074 B15R0.69 CC(C)OC(=O)CCCCCNCCCF 34a_100015189416_200010986244 [0,1,0,0,0,0|2,0,0]=3 3075 B15R0.69 CC(C)OC(=O)CCCCCOCCCBr 34a_100011217188_200010986244 [0,1,0,0,0,0|2,0,0]=3 3076 B15R0.69 CC(C)OC(=O)CCCCCOCCCCl 34a_100000230001_200010986244 [0,1,0,0,0,0|2,0,0]=3 3077 B15R0.69 CC(C)OC(=O)CCCCCOCCCF 34a_100000759539_200010986244 [0,1,0,0,0,0|2,0,0]=3 3078 B15R0.69 CC(C)OC(=O)CCCCCOCCCN 34a_100000182051_200010986244 [0,1,0,0,0,0|2,0,0]=3 3079 B15R0.69 CC(C)OC(=O)CCCCCOCCON 34a_100000700252_200010986244 [0,1,0,0,0,0|3,0,0]=4 3080 B15R0.69 CC(C)OC(=O)CCCCCSCCC#N 62a_100011215226_200010986244 [0,1,0,0,0,0|2,0,1]=4 3081 B15R0.69 CC(C)OC(=O)CCCCCSCCC#N 62a_200010986244_100011215226 [0,1,0,0,0,0|2,0,1]=4 3082 B15R0.69 CC(C)OC(=O)CCCCCSCCCF 62a_100011934791_200010986244 [0,1,0,0,0,0|2,0,0]=3 3083 B15R0.69 CC(C)OC(=O)CCCCCSCCCF 62a_200010986244_100011934791 [0,1,0,0,0,0|2,0,0]=3 3084 B15R0.69 CC(C)OC(=O)CCCCCSCCCO 62a_100011215043_200010986244 [0,1,0,0,0,0|2,0,0]=3 3085 B15R0.69 CC(C)OC(=O)CCCCCSCCCO 62a_200010986244_100011215043 [0,1,0,0,0,0|2,0,0]=3 3086 B15R0.69 CC(C)OC(=O)CCNCCCCCCO 2230a_100000686447_100000760027 [0,1,0,0,0,0|2,0,0]=3 3087 B15R0.69 CC(C)OC(=O)CCOCCCCCCBr 7a_100011215345_100000760027 [0,1,0,0,0,0|2,0,0]=3 3088 B15R0.69 CC(C)OC(=O)CCOCCCCCCCl 7a_100000766143_100000760027 [0,1,0,0,0,0|2,0,0]=3 3089 B15R0.69 CC(C)OC(=O)CCOCCCCCCF 7a_100000732779_100000760027 [0,1,0,0,0,0|2,0,0]=3 3090 B15R0.69 CC(C)OC(=O)CCSCCCCCC#N 62a_100000760027_100009813376 [0,1,0,0,0,0|2,0,1]=4 3091 B15R0.69 CC(C)OC(=O)CCSCCCCCC#N 62a_100009813376_100000760027 [0,1,0,0,0,0|2,0,1]=4 3092 B15R0.69 CC(C)OC(=O)CCSCCCCCC=O 62a_100000139337_100000760027 [0,1,0,0,0,0|2,0,1]=4 3093 B15R0.69 CC(C)OC(=O)CCSCCCCCC=O 62a_100000760027_100000139337 [0,1,0,0,0,0|2,0,1]=4 3094 B15R0.69 CC(C)OC(=O)CCSCCCCCCF 62a_100000760027_100015922095 [0,1,0,0,0,0|2,0,0]=3 3095 B15R0.69 CC(C)OC(=O)CCSCCCCCCF 62a_100015922095_100000760027 [0,1,0,0,0,0|2,0,0]=3 3096 B15R0.69 CC(C)OC(=O)CCSCCCCCCO 62a_100000760027_100000766143 [0,1,0,0,0,0|2,0,0]=3 3097 B15R0.69 CC(C)OC(=O)CCSCCCCCCO 62a_100000766143_100000760027 [0,1,0,0,0,0|2,0,0]=3 3098 B15R0.69 CC(C)OC(=O)CNCCCCCCCO 2230a_100011996573_100011215430 [0,1,0,0,0,0|2,0,0]=3 3099 B15R0.69 CC(C)OC(=O)CNCCCCCCCO 34a_100011996573_100011215430 [0,1,0,0,0,0|2,0,0]=3 3100 B15R0.69 CC(C)OC(=O)CNCCCOCCCO 2230a_100011310245_100011215430 [0,1,0,0,0,0|3,0,0]=4 3101 B15R0.69 CC(C)OC(=O)CNCCCOCCCO 34a_100011310245_100011215430 [0,1,0,0,0,0|3,0,0]=4 3102 B15R0.69 CC(C)OC(=O)COCCCCCCCBr 34a_100000760002_100011215430 [0,1,0,0,0,0|2,0,0]=3 3103 B15R0.69 CC(C)OC(=O)COCCCCCCCBr 7a_100000760002_100011215430 [0,1,0,0,0,0|2,0,0]=3 3104 B15R0.69 CC(C)OC(=O)COCCCCCCCN 34a_100011996573_100011215430 [0,1,0,0,0,0|2,0,0]=3 3105 B15R0.69 CC(C)OC(=O)COCCCOCCCN 34a_100011310245_100011215430 [0,1,0,0,0,0|3,0,0]=4 3106 B15R0.69 CC(C)OC(=O)CSCCCCCCC#N 62a_100009813337_100011215430 [0,1,0,0,0,0|2,0,1]=4 3107 B15R0.69 CC(C)OC(=O)CSCCCCCCC#N 62a_100011215430_100009813337 [0,1,0,0,0,0|2,0,1]=4 3108 B15R0.69 CC(C)OC(=O)CSCCCCCCCO 62a_100000760002_100011215430 [0,1,0,0,0,0|2,0,0]=3 3109 B15R0.69 CC(C)OC(=O)CSCCCCCCCO 62a_100011215430_100000760002 [0,1,0,0,0,0|2,0,0]=3 3110 B15R0.69 CC(C)OC(=O)OCSCCCCCCF 62a_100000003507_100015922095 [0,1,0,0,0,0|3,0,0]=4 3111 B15R0.69 CC(C)OC(=O)OCSCCCCCCF 62a_100015922095_100000003507 [0,1,0,0,0,0|3,0,0]=4 3112 B15R0.69 CC(C)OC(=O)OCSCCCCCCO 62a_100000003507_100000766143 [0,1,0,0,0,0|3,0,0]=4 3113 B15R0.69 CC(C)OC(=O)OCSCCCCCCO 62a_100000766143_100000003507 [0,1,0,0,0,0|3,0,0]=4 3114 B15R0.69 CC(O)CC(=O)CCCCCCCCCF 1458a_200009909015_100011218427 [0,1,0,0,0,0|2,0,0]=3 3115 B15R0.69 CC/C=C/CCCOCCC(=O)OC(C)C 7a_100016287902_100000760027 [0,1,0,0,0,0|1,0,2]=4 3116 B15R0.69 CC/C=C\CCCCOCC(=O)OC(C)C 34a_100016287862_100011215430 [0,1,0,0,0,0|1,0,2]=4 3117 B15R0.69 CC/C=C\CCCCOCC(=O)OC(C)C 7a_100016287862_100011215430 [0,1,0,0,0,0|1,0,2]=4 3118 B15R0.69 CC=CCSCCCCCC(=O)OC(C)C 62a_100000070051_200010986244 [0,1,0,0,0,0|1,0,2]=4 3119 B15R0.69 CC=CCSCCCCCC(=O)OC(C)C 62a_200010986244_100000070051 [0,1,0,0,0,0|1,0,2]=4 3120 B15R0.69 CCC#CCCCCCCC(=O)CC(C)C 1458a_100000210554_200000036426 [0,1,0,0,0,0|1,0,2]=4 3121 B15R0.69 CCC#CCCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_200000036426 [0,1,0,0,0,0|1,0,2]=4 3122 B15R0.69 CCCC#CCCOCCC(=O)OC(C)C 7a_100000042726_100000760027 [0,1,0,0,0,0|1,0,2]=4 3123 B15R0.69 CCCC/C=C/COCCC(=O)OC(C)C 7a_200016272032_100000760027 [0,1,0,0,0,0|1,0,2]=4 3124 B15R0.69 CCCC/C=C\CCOCC(=O)OC(C)C 34a_200016286491_100011215430 [0,1,0,0,0,0|1,0,2]=4 3125 B15R0.69 CCCC/C=C\CCOCC(=O)OC(C)C 7a_200016286491_100011215430 [0,1,0,0,0,0|1,0,2]=4 3126 B15R0.69 CCCCC#CCCOCC(=O)OC(C)C 34a_100000037610_100011215430 [0,1,0,0,0,0|1,0,2]=4 3127 B15R0.69 CCCCC#CCCOCC(=O)OC(C)C 7a_100000037610_100011215430 [0,1,0,0,0,0|1,0,2]=4 3128 B15R0.69 CCCCC#CCOCCC(=O)OC(C)C 7a_200000034558_100000760027 [0,1,0,0,0,0|1,0,2]=4 3129 B15R0.69 CCCCC/C=C/COCC(=O)OC(C)C 34a_100016258190_100011215430 [0,1,0,0,0,0|1,0,2]=4 3130 B15R0.69 CCCCC/C=C/COCC(=O)OC(C)C 7a_100016258190_100011215430 [0,1,0,0,0,0|1,0,2]=4 3131 B15R0.69 CCCCCC#CCOCC(=O)OC(C)C 34a_200000033628_100011215430 [0,1,0,0,0,0|1,0,2]=4 3132 B15R0.69 CCCCCC#CCOCC(=O)OC(C)C 7a_200000033628_100011215430 [0,1,0,0,0,0|1,0,2]=4 3133 B15R0.69 CCCCCC#CCSCC(=O)OC(C)C 62a_100009816472_100011215430 [0,1,0,0,0,0|1,0,2]=4 3134 B15R0.69 CCCCCC#CCSCC(=O)OC(C)C 62a_100011215430_100009816472 [0,1,0,0,0,0|1,0,2]=4 3135 B15R0.69 CCCCCCCCC=CC(=O)CC(C)C 1458a_100015345288_100000210624 [0,1,0,0,0,0|1,0,2]=4 3136 B15R0.69 CCCCCCCCC=CC(=O)CC(C)O 1458a_100015345288_100011218427 [0,1,0,0,0,0|1,0,2]=4 3137 B15R0.69 CCCCCCCCC=CC(=O)NC(C)C 11a_100138425928_100015345288 [0,1,0,0,0,0|1,0,2]=4 3138 B15R0.69 CCCCCCCCC=CC(=O)NC(C)C 1626a_100138425928_100015345288 [0,1,0,0,0,0|1,0,2]=4 3139 B15R0.69 CCCCCCCCC=CC(=O)NC(C)C 240690a_100138425928_100015345288 [0,1,0,0,0,0|1,0,2]=4 3140 B15R0.69 CCCCCCCCCCC(=O)CC(=O)N 1458a_100000210375_100000187820 [0,1,0,0,0,0|2,0,1]=4 3141 B15R0.69 CCCCCCCCCCC(=O)CC(=O)N 1458a_100134613110_100000210319 [0,1,0,0,0,0|2,0,1]=4 3142 B15R0.69 CCCCCCCCCCC(=O)CC(=O)[O-] 1458a_100000210375_100020667443 [0,1,0,0,0,0|2,0,1]=4 3143 B15R0.69 CCCCCCCCCCC(=O)CC(C)O 1458a_100000210375_100011218427 [0,1,0,0,0,0|1,0,0]=2 3144 B15R0.69 CCCCCCCCCCC(=O)CC(F)F 1458a_100000210375_100011934356 [0,1,0,0,0,0|2,0,0]=3 3145 B15R0.69 CCCCCCCCCCC(=O)CN(C)C 1458a_100000750896_100000210319 [0,1,0,0,0,0|2,0,0]=3 3146 B15R0.69 CCCCCCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100000210319 [0,1,0,0,0,0|1,0,0]=2 3147 B15R0.69 CCCCCCCCCCC(=O)C[N+](=O)[O-] 1458a_100000210375_100000761209 [0,1,0,0,0,0|3,0,0]=4 3148 B15R0.69 CCCCCCCCCCC(=O)C[S+](C)C 1458a_200159257847_100000210319 [0,1,0,0,0,0|2,0,0]=3 3149 B15R0.69 CCCCCCCCCCC(=O)NC(C)C 11a_100138425928_100000210375 [0,1,0,0,0,0|1,0,0]=2 3150 B15R0.69 CCCCCCCCCCC(=O)NC(C)C 1626a_100138425928_100000210375 [0,1,0,0,0,0|1,0,0]=2 3151 B15R0.69 CCCCCCCCCCC(=O)NC(C)C 240690a_100138425928_100000210375 [0,1,0,0,0,0|1,0,0]=2 3152 B15R0.69 CCCCCCCCCCN(C)CC(C)C 2230a_100000207566_100000210760 [0,1,0,0,0,0|3,0,0]=4 3153 B15R0.69 CCCCCCCCCCN(C)CC(C)C 2230a_100000747067_100000210320 [0,1,0,0,0,0|3,0,0]=4 3154 B15R0.69 CCCCCCCCCCN(C)CC(C)C 269982a_100000207566_100000210624 [0,1,0,0,0,0|3,0,0]=4 3155 B15R0.69 CCCCCCCCCCN(C)CC(C)C 269982a_100000747067_100000210320 [0,1,0,0,0,0|3,0,0]=4 3156 B15R0.69 CCCCCCCCCCN(C)CC(C)C 270004a_100000207566_100000210432 [0,1,0,0,0,0|3,0,0]=4 3157 B15R0.69 CCCCCCCCCCN(C)CC(C)O 2230a_100000207566_100011218427 [0,1,0,0,0,0|3,0,0]=4 3158 B15R0.69 CCCCCCCCCCN(C)CC(C)O 2230a_100000227577_100000210320 [0,1,0,0,0,0|3,0,0]=4 3159 B15R0.69 CCCCCCCCCCN(C)CC(C)O 269982a_100000207566_100011218427 [0,1,0,0,0,0|3,0,0]=4 3160 B15R0.69 CCCCCCCCCCN(C)CC(C)O 269982a_100000227577_100000210320 [0,1,0,0,0,0|3,0,0]=4 3161 B15R0.69 CCCCCCCCCCN(C)C[C@@H](C)O 2230a_100000207566_100009817552 [0,1,0,0,0,0|3,0,0]=4 3162 B15R0.69 CCCCCCCCCCN(C)C[C@@H](C)O 269982a_100000207566_100009817552 [0,1,0,0,0,0|3,0,0]=4 3163 B15R0.69 CCCCCCCCCNC(=O)C=C(C)C 11a_100000212291_100000211388 [0,1,0,0,0,0|2,0,1]=4 3164 B15R0.69 CCCCCCCCCNC(=O)C=C(C)C 1626a_100000212291_100000211388 [0,1,0,0,0,0|2,0,1]=4 3165 B15R0.69 CCCCCCCCCNC(=O)C=C(C)C 240690a_100000212291_100000211388 [0,1,0,0,0,0|2,0,1]=4 3166 B15R0.69 CCCCCCCCCNC(=O)C=C(C)Cl 11a_100000212291_200042562850 [0,1,0,0,0,0|2,0,1]=4 3167 B15R0.69 CCCCCCCCCNC(=O)C=C(C)Cl 1626a_100000212291_200042562850 [0,1,0,0,0,0|2,0,1]=4 3168 B15R0.69 CCCCCCCCCNC(=O)C=C(C)Cl 240690a_100000212291_200042562850 [0,1,0,0,0,0|2,0,1]=4 3169 B15R0.69 CCCCCCCCCNC(=O)C=C(C)I 11a_100000212291_100025716642 [0,1,0,0,0,0|2,0,1]=4 3170 B15R0.69 CCCCCCCCCNC(=O)C=C(C)I 1626a_100000212291_100025716642 [0,1,0,0,0,0|2,0,1]=4 3171 B15R0.69 CCCCCCCCCNC(=O)CC(C)C 11a_100000212291_100000210554 [0,1,0,0,0,0|2,0,0]=3 3172 B15R0.69 CCCCCCCCCNC(=O)CC(C)C 1626a_100000212291_100000210554 [0,1,0,0,0,0|2,0,0]=3 3173 B15R0.69 CCCCCCCCCNC(=O)CC(C)C 240690a_100000212291_100000210554 [0,1,0,0,0,0|2,0,0]=3 3174 B15R0.69 CCCCCCCCCNC(=O)CC(C)C 527a_100000212291_100000210554 [0,1,0,0,0,0|2,0,0]=3 3175 B15R0.69 CCCCCCCCCNC(=O)CN(C)C 11a_100000212291_100000750896 [0,1,0,0,0,0|3,0,0]=4 3176 B15R0.69 CCCCCCCCCNC(=O)CN(C)C 240690a_100000212291_100000750896 [0,1,0,0,0,0|3,0,0]=4 3177 B15R0.69 CCCCCCCCCNC(=O)CN(C)C 527a_100000212291_100000750896 [0,1,0,0,0,0|3,0,0]=4 3178 B15R0.69 CCCCCCCCCNC(=O)C[C@@H](C)O 240690a_100000212291_100011933948 [0,1,0,0,0,0|2,0,0]=3 3179 B15R0.69 CCCCCCCCCNC(=O)C[S+](C)C 11a_100000212291_200159257847 [0,1,0,0,0,0|3,0,0]=4 3180 B15R0.69 CCCCCCCCCNC(=O)C[S+](C)C 1626a_100000212291_200159257847 [0,1,0,0,0,0|3,0,0]=4 3181 B15R0.69 CCCCCCCCCNC(=O)C[S+](C)C 240690a_100000212291_200159257847 [0,1,0,0,0,0|3,0,0]=4 3182 B15R0.69 CCCCCCCCCNC(=O)C[S+](C)C 527a_100000212291_200159257847 [0,1,0,0,0,0|3,0,0]=4 3183 B15R0.69 CCCCCCCCCNC(=O)NC(C)C 2708a_100000212291_100138425928 [0,1,0,0,0,0|2,0,0]=3 3184 B15R0.69 CCCCCCCCCNC(=O)NC(C)C 2708a_100138425928_100000212291 [0,1,0,0,0,0|2,0,0]=3 3185 B15R0.69 CCCCCCCCCNC(=O)NC(C)C 273464a_100138425928_100000212291 [0,1,0,0,0,0|2,0,0]=3 3186 B15R0.69 CCCCCCCCCNC(=O)NC(C)C 512a_100000212291_100138425928 [0,1,0,0,0,0|2,0,0]=3 3187 B15R0.69 CCCCCCCCCNC(=O)NC(C)C 512a_100138425928_100000212291 [0,1,0,0,0,0|2,0,0]=3 3188 B15R0.69 CCCCCCCCNCC(=O)NC(C)C 2230a_100000168517_100000210759 [0,1,0,0,0,0|2,0,0]=3 3189 B15R0.69 CCCCCCCCNCC(=O)NC(C)C 2230a_100000229939_100000183996 [0,1,0,0,0,0|2,0,0]=3 3190 B15R0.69 CCCCCCCCNCC(=O)NC(C)C 34a_100000229939_100000183996 [0,1,0,0,0,0|2,0,0]=3 3191 B15R0.69 CCCCCCCCNCC(=O)OC(C)C 2230a_100000229939_100011215430 [0,1,0,0,0,0|1,0,0]=2 3192 B15R0.69 CCCCCCCCNCC(=O)OC(C)C 34a_100000229939_100011215430 [0,1,0,0,0,0|1,0,0]=2 3193 B15R0.69 CCCCCCCCOCC(=O)CC(C)C 1458a_100000759886_100000210624 [0,1,0,0,0,0|2,0,0]=3 3194 B15R0.69 CCCCCCCCOCC(=O)CC(C)O 1458a_100000759886_100011218427 [0,1,0,0,0,0|2,0,0]=3 3195 B15R0.69 CCCCCCCCOCC(=O)CC(F)F 1458a_100000759886_100011934356 [0,1,0,0,0,0|3,0,0]=4 3196 B15R0.69 CCCCCCCCOCC(=O)NC(=O)C 7a_100000210232_100000183797 [0,1,0,0,0,0|2,0,1]=4 3197 B15R0.69 CCCCCCCCOCC(=O)NC(C)C 11a_100138425928_100000759886 [0,1,0,0,0,0|2,0,0]=3 3198 B15R0.69 CCCCCCCCOCC(=O)NC(C)C 1626a_100138425928_100000759886 [0,1,0,0,0,0|2,0,0]=3 3199 B15R0.69 CCCCCCCCOCC(=O)NC(C)C 240690a_100138425928_100000759886 [0,1,0,0,0,0|2,0,0]=3 3200 B15R0.69 CCCCCCCCOCC(=O)NC(C)C 34a_100000210232_100000183996 [0,1,0,0,0,0|2,0,0]=3 3201 B15R0.69 CCCCCCCCOCC(=O)NC(C)C 527a_100138425928_100000759886 [0,1,0,0,0,0|2,0,0]=3 3202 B15R0.69 CCCCCCCCOCC(=O)NC(C)C 7a_100000210232_100000183996 [0,1,0,0,0,0|2,0,0]=3 3203 B15R0.69 CCCCCCCCOCC(=O)OC(C)C 34a_100000210232_100011215430 [0,1,0,0,0,0|1,0,0]=2 3204 B15R0.69 CCCCCCCCOCC(=O)OC(C)C 7a_100000210232_100011215430 [0,1,0,0,0,0|1,0,0]=2 3205 B15R0.69 CCCCCCCCSCC(=O)NC(=O)C 62a_100000210759_100000183797 [0,1,0,0,0,0|2,0,1]=4 3206 B15R0.69 CCCCCCCCSCC(=O)NC(C)C 62a_100000183996_100000210317 [0,1,0,0,0,0|2,0,0]=3 3207 B15R0.69 CCCCCCCCSCC(=O)NC(C)C 62a_100000210759_100000183996 [0,1,0,0,0,0|2,0,0]=3 3208 B15R0.69 CCCCCCCCSCC(=O)OC(C)C 62a_100000210759_100011215430 [0,1,0,0,0,0|1,0,0]=2 3209 B15R0.69 CCCCCCCCSCC(=O)OC(C)C 62a_100011215430_100000210317 [0,1,0,0,0,0|1,0,0]=2 3210 B15R0.69 CCCCCCCNCCC(=O)NC(C)C 2230a_100000229938_100000737564 [0,1,0,0,0,0|2,0,0]=3 3211 B15R0.69 CCCCCCCNCCC(=O)OC(C)C 2230a_100000229938_100000760027 [0,1,0,0,0,0|1,0,0]=2 3212 B15R0.69 CCCCCCCOCCC(=O)NC(C)C 7a_100000210272_100000737564 [0,1,0,0,0,0|2,0,0]=3 3213 B15R0.69 CCCCCCCOCCC(=O)OC(C)C 7a_100000210272_100000760027 [0,1,0,0,0,0|1,0,0]=2 3214 B15R0.69 CCCCCCCSCCC(=O)NC(C)C 62a_100000210614_100000737564 [0,1,0,0,0,0|2,0,0]=3 3215 B15R0.69 CCCCCCCSCCC(=O)NC(C)C 62a_100000737564_100000210316 [0,1,0,0,0,0|2,0,0]=3 3216 B15R0.69 CCCCCCCSCCC(=O)OC(C)C 62a_100000210614_100000760027 [0,1,0,0,0,0|1,0,0]=2 3217 B15R0.69 CCCCCCCSCCC(=O)OC(C)C 62a_100000760027_100000210316 [0,1,0,0,0,0|1,0,0]=2 3218 B15R0.69 CCCCCCCSCOC(=O)OC(C)C 62a_100000003507_100000210316 [0,1,0,0,0,0|2,0,0]=3 3219 B15R0.69 CCCCCCCSCOC(=O)OC(C)C 62a_100000210614_100000003507 [0,1,0,0,0,0|2,0,0]=3 3220 B15R0.69 CCCCCNCCOCC(=O)NC(C)C 34a_100000224656_100000183996 [0,1,0,0,0,0|3,0,0]=4 3221 B15R0.69 CCCCCNCCOCC(=O)OC(C)C 34a_100000224656_100011215430 [0,1,0,0,0,0|2,0,0]=3 3222 B15R0.69 CCCCCOCCOCC(=O)NC(C)C 34a_100011215259_100000183996 [0,1,0,0,0,0|3,0,0]=4 3223 B15R0.69 CCCCCOCCOCC(=O)NC(C)C 7a_100011215259_100000183996 [0,1,0,0,0,0|3,0,0]=4 3224 B15R0.69 CCCCCOCCOCC(=O)OC(C)C 34a_100011215259_100011215430 [0,1,0,0,0,0|2,0,0]=3 3225 B15R0.69 CCCCCOCCOCC(=O)OC(C)C 7a_100011215259_100011215430 [0,1,0,0,0,0|2,0,0]=3 3226 B15R0.69 CCCCNCCCCCC(=O)OC(C)C 2230a_100000102301_200010986244 [0,1,0,0,0,0|1,0,0]=2 3227 B15R0.69 CCCCNCCCCCC(=O)OC(C)C 7a_106832991798_200010986244 [0,1,0,0,0,0|1,0,0]=2 3228 B15R0.69 CCCCOCCCCCC(=O)OC(C)C 34a_100000210227_200010986244 [0,1,0,0,0,0|1,0,0]=2 3229 B15R0.69 CCCCOCCCCCC(=O)OC(C)C 7a_100000210227_200010986244 [0,1,0,0,0,0|1,0,0]=2 3230 B15R0.69 CCCCOCCCNCC(=O)NC(C)C 2230a_200000211371_100000183996 [0,1,0,0,0,0|3,0,0]=4 3231 B15R0.69 CCCCOCCCNCC(=O)NC(C)C 34a_200000211371_100000183996 [0,1,0,0,0,0|3,0,0]=4 3232 B15R0.69 CCCCOCCCNCC(=O)OC(C)C 2230a_200000211371_100011215430 [0,1,0,0,0,0|2,0,0]=3 3233 B15R0.69 CCCCOCCCNCC(=O)OC(C)C 34a_200000211371_100011215430 [0,1,0,0,0,0|2,0,0]=3 3234 B15R0.69 CCCCOCCCOCC(=O)NC(C)C 34a_200011215613_100000183996 [0,1,0,0,0,0|3,0,0]=4 3235 B15R0.69 CCCCOCCCOCC(=O)NC(C)C 7a_200011215613_100000183996 [0,1,0,0,0,0|3,0,0]=4 3236 B15R0.69 CCCCOCCCOCC(=O)OC(C)C 34a_200011215613_100011215430 [0,1,0,0,0,0|2,0,0]=3 3237 B15R0.69 CCCCOCCCOCC(=O)OC(C)C 7a_200011215613_100011215430 [0,1,0,0,0,0|2,0,0]=3 3238 B15R0.69 CCCCOCCOCCC(=O)NC(C)C 7a_100000210238_100000737564 [0,1,0,0,0,0|3,0,0]=4 3239 B15R0.69 CCCCOCCOCCC(=O)OC(C)C 7a_100000210238_100000760027 [0,1,0,0,0,0|2,0,0]=3 3240 B15R0.69 CCCCOCCSCCC(=O)NC(C)C 62a_100000737564_100000743108 [0,1,0,0,0,0|3,0,0]=4 3241 B15R0.69 CCCCOCCSCCC(=O)NC(C)C 62a_100000743108_100000737564 [0,1,0,0,0,0|3,0,0]=4 3242 B15R0.69 CCCCOCCSCCC(=O)OC(C)C 62a_100000743108_100000760027 [0,1,0,0,0,0|2,0,0]=3 3243 B15R0.69 CCCCOCCSCCC(=O)OC(C)C 62a_100000760027_100000743108 [0,1,0,0,0,0|2,0,0]=3 3244 B15R0.69 CCCCOCCSCOC(=O)OC(C)C 62a_100000003507_100000743108 [0,1,0,0,0,0|3,0,0]=4 3245 B15R0.69 CCCCOCCSCOC(=O)OC(C)C 62a_100000743108_100000003507 [0,1,0,0,0,0|3,0,0]=4 3246 B15R0.69 CCCCSCCCCCC(=O)OC(C)C 62a_100000210211_200010986244 [0,1,0,0,0,0|1,0,0]=2 3247 B15R0.69 CCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000210210 [0,1,0,0,0,0|1,0,0]=2 3248 B15R0.69 CCCCSCCNCCC(=O)NC(C)C 2230a_100025743550_100000737564 [0,1,0,0,0,0|3,0,0]=4 3249 B15R0.69 CCCCSCCNCCC(=O)OC(C)C 2230a_100025743550_100000760027 [0,1,0,0,0,0|2,0,0]=3 3250 B15R0.69 CCCCSCCOCCC(=O)NC(C)C 7a_200000230436_100000737564 [0,1,0,0,0,0|3,0,0]=4 3251 B15R0.69 CCCCSCCOCCC(=O)OC(C)C 7a_200000230436_100000760027 [0,1,0,0,0,0|2,0,0]=3 3252 B15R0.69 CCCOCCCNCCC(=O)NC(C)C 2230a_100011217757_100000737564 [0,1,0,0,0,0|3,0,0]=4 3253 B15R0.69 CCCOCCCNCCC(=O)OC(C)C 2230a_100011217757_100000760027 [0,1,0,0,0,0|2,0,0]=3 3254 B15R0.69 CCOCCOCCNCC(=O)OC(C)C 2230a_100102712874_100011215430 [0,1,0,0,0,0|3,0,0]=4 3255 B15R0.69 CCOCCOCCNCC(=O)OC(C)C 34a_100102712874_100011215430 [0,1,0,0,0,0|3,0,0]=4 3256 B15R0.69 CCOCCOCCOCC(=O)OC(C)C 34a_100000210240_100011215430 [0,1,0,0,0,0|3,0,0]=4 3257 B15R0.69 CCOCCOCCOCC(=O)OC(C)C 7a_100000210240_100011215430 [0,1,0,0,0,0|3,0,0]=4 3258 B15R0.69 CCOCCOCCSCC(=O)OC(C)C 62a_100011211534_100011215430 [0,1,0,0,0,0|3,0,0]=4 3259 B15R0.69 CCOCCOCCSCC(=O)OC(C)C 62a_100011215430_100011211534 [0,1,0,0,0,0|3,0,0]=4 3260 B15R0.69 CCOCSCCCCCC(=O)OC(C)C 62a_100000739092_200010986244 [0,1,0,0,0,0|2,0,0]=3 3261 B15R0.69 CCOCSCCCCCC(=O)OC(C)C 62a_200010986244_100000739092 [0,1,0,0,0,0|2,0,0]=3 3262 B15R0.69 CN(C)CC(=O)CCCCCCCCCO 1458a_100000750896_100009813782 [0,1,0,0,0,0|3,0,0]=4 3263 B15R0.69 COCCCCCCNCC(=O)NC(C)C 2230a_100000168517_100011998445 [0,1,0,0,0,0|3,0,0]=4 3264 B15R0.69 COCCCCCCOCC(=O)NC(C)C 34a_200012092642_100000183996 [0,1,0,0,0,0|3,0,0]=4 3265 B15R0.69 COCCCCCCOCC(=O)NC(C)C 7a_200012092642_100000183996 [0,1,0,0,0,0|3,0,0]=4 3266 B15R0.69 COCCCCCCOCC(=O)OC(C)C 34a_200012092642_100011215430 [0,1,0,0,0,0|2,0,0]=3 3267 B15R0.69 COCCCCCCOCC(=O)OC(C)C 7a_200012092642_100011215430 [0,1,0,0,0,0|2,0,0]=3 3268 B15R0.69 COCCCCCCSCC(=O)NC(C)C 62a_100000183996_100011998445 [0,1,0,0,0,0|3,0,0]=4 3269 B15R0.69 COCCCCCCSCC(=O)NC(C)C 62a_100011998445_100000183996 [0,1,0,0,0,0|3,0,0]=4 3270 B15R0.69 COCCCCCCSCC(=O)OC(C)C 62a_100011215430_100011998445 [0,1,0,0,0,0|2,0,0]=3 3271 B15R0.69 COCCCCCCSCC(=O)OC(C)C 62a_100011998445_100011215430 [0,1,0,0,0,0|2,0,0]=3 3272 B15R0.69 COCCCCCNCCC(=O)NC(C)C 2230a_100000747528_100000737564 [0,1,0,0,0,0|3,0,0]=4 3273 B15R0.69 COCCCCCNCCC(=O)OC(C)C 2230a_100000747528_100000760027 [0,1,0,0,0,0|2,0,0]=3 3274 B15R0.69 COCCNCCCCCC(=O)OC(C)C 2230a_100000209980_200010986244 [0,1,0,0,0,0|2,0,0]=3 3275 B15R0.69 COCCOCCCCCC(=O)OC(C)C 34a_100000210237_200010986244 [0,1,0,0,0,0|2,0,0]=3 3276 B15R0.69 COCCOCCCNCC(=O)OC(C)C 2230a_100000206027_100011215430 [0,1,0,0,0,0|3,0,0]=4 3277 B15R0.69 COCCOCCCNCC(=O)OC(C)C 34a_100000206027_100011215430 [0,1,0,0,0,0|3,0,0]=4 3278 B15R0.69 COCCOCCCSCC(=O)OC(C)C 62a_100011215430_100011216529 [0,1,0,0,0,0|3,0,0]=4 3279 B15R0.69 COCCOCCCSCC(=O)OC(C)C 62a_100011216529_100011215430 [0,1,0,0,0,0|3,0,0]=4 3280 B15R0.69 COCCOCCNCCC(=O)OC(C)C 2230a_100000745349_100000760027 [0,1,0,0,0,0|3,0,0]=4 3281 B15R0.69 COCCOCCOCCC(=O)OC(C)C 7a_100011215163_100000760027 [0,1,0,0,0,0|3,0,0]=4 3282 B15R0.69 COCCOCCSCCC(=O)OC(C)C 62a_100000695917_100000760027 [0,1,0,0,0,0|3,0,0]=4 3283 B15R0.69 COCCOCCSCCC(=O)OC(C)C 62a_100000760027_100000695917 [0,1,0,0,0,0|3,0,0]=4 3284 B15R0.69 COCCSCCCCCC(=O)OC(C)C 62a_100000233755_200010986244 [0,1,0,0,0,0|2,0,0]=3 3285 B15R0.69 COCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000233755 [0,1,0,0,0,0|2,0,0]=3 3286 B15R0.69 CSCCNCCCCCC(=O)OC(C)C 2230a_100020590264_200010986244 [0,1,0,0,0,0|2,0,0]=3 3287 B15R0.69 CSCCOCCCCCC(=O)OC(C)C 34a_100000230434_200010986244 [0,1,0,0,0,0|2,0,0]=3 3288 B15R0.69 CSCCOCCCCCC(=O)OC(C)C 7a_100000230434_200010986244 [0,1,0,0,0,0|2,0,0]=3 3289 B15R0.69 CSCCSCCCCCC(=O)OC(C)C 62a_100000212216_200010986244 [0,1,0,0,0,0|2,0,0]=3 3290 B15R0.69 CSCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000751147 [0,1,0,0,0,0|2,0,0]=3 3291 B15R0.69 C[C@@H](O)CC(=O)CCCCCCCCCO 1458a_100011933948_100009813782 [0,1,0,0,0,0|2,0,0]=3 3292 B15R0.69 C[C@@H](O)CC(=O)NCCCCCCCCO 240690a_102515433106_100011933948 [0,1,0,0,0,0|3,0,0]=4 3293 B15R0.69 C[S+](C)CC(=O)CCCCCCCCCO 1458a_200159257847_100009813782 [0,1,0,0,0,0|3,0,0]=4 3294 B15R0.69 O=C(CCCCCCCCCF)CC(F)F 1458a_200009909015_100011934356 [0,1,0,0,0,0|3,0,0]=4 3295 B15R0.111 C=C(Br)CCOCCCCCC(=O)OCC 34a_100009813270_100000755133 [0,1,0,0,0,0|1,0,2]=4 3296 B15R0.111 C=C(C)CCOCCCCCC(=O)OCC 34a_100000764851_100000755133 [0,1,0,0,0,0|1,0,1]=3 3297 B15R0.111 C=C(C)CCOCCCCCC(=O)OCC 7a_100011214988_100000730704 [0,1,0,0,0,0|1,0,1]=3 3298 B15R0.111 C=C(C)CCOCCCOCC(=O)OCC 34a_100000764851_100009893628 [0,1,0,0,0,0|2,0,1]=4 3299 B15R0.111 C=C(C)CCSCCCCCC(=O)OCC 62a_100000730704_100000755133 [0,1,0,0,0,0|1,0,1]=3 3300 B15R0.111 C=C(C)CCSCCCCCC(=O)OCC 62a_100000755133_100000730704 [0,1,0,0,0,0|1,0,1]=3 3301 B15R0.111 C=C(C)CCSCCCOCC(=O)OCC 62a_100000730704_100009893628 [0,1,0,0,0,0|2,0,1]=4 3302 B15R0.111 C=C(C)CCSCCCOCC(=O)OCC 62a_100009893628_100000730704 [0,1,0,0,0,0|2,0,1]=4 3303 B15R0.111 C=C(C)COCCCCCCC(=O)OCC 34a_100000210245_100009814379 [0,1,0,0,0,0|1,0,1]=3 3304 B15R0.111 C=C(C)CSCCCCCCC(=O)OCC 62a_100000748629_100009814379 [0,1,0,0,0,0|1,0,1]=3 3305 B15R0.111 C=C(F)COCCCCCCC(=O)OCC 34a_200010262243_100009814379 [0,1,0,0,0,0|1,0,2]=4 3306 B15R0.111 C=C(F)CSCCCCCCC(=O)OCC 62a_100000042424_100009814379 [0,1,0,0,0,0|1,0,2]=4 3307 B15R0.111 C=COC(=O)CNCCCCCCC(C)C 2230a_100000211014_100000036128 [0,1,0,0,0,0|1,0,2]=4 3308 B15R0.111 C=COC(=O)CNCCCCCCC(C)C 34a_100000211014_100000036128 [0,1,0,0,0,0|1,0,2]=4 3309 B15R0.111 CC(C)CCCCCCNCC(=O)NCO 2230a_100000211014_100000185155 [0,1,0,0,0,0|3,0,0]=4 3310 B15R0.111 CC(C)CCCCCCNCC(=O)NCO 34a_100000211014_100000185155 [0,1,0,0,0,0|3,0,0]=4 3311 B15R0.111 CCCC(=O)CNCCCCCCC(C)C 2230a_100000211014_100000747444 [0,1,0,0,0,0|2,0,0]=3 3312 B15R0.111 CCCC(=O)OCNCCCCCC(C)C 2230a_100011290863_100000034017 [0,1,0,0,0,0|3,0,0]=4 3313 B15R0.111 CCCC(=O)OCNCCCCCC(C)C 34a_100011290863_100000034017 [0,1,0,0,0,0|3,0,0]=4 3314 B15R0.111 CCCC(=O)OCOCCCCCC(C)C 34a_100011995859_100000034017 [0,1,0,0,0,0|3,0,0]=4 3315 B15R0.111 CCCC(=O)OCSCCCCCC(C)C 62a_100000210682_100000034017 [0,1,0,0,0,0|3,0,0]=4 3316 B15R0.111 CCNC(=O)CCNCCCCCC(C)C 2230a_100011290863_100000737597 [0,1,0,0,0,0|2,0,0]=3 3317 B15R0.111 CCNC(=O)CCNCCCCCC(C)C 34a_100025743525_100000210682 [0,1,0,0,0,0|2,0,0]=3 3318 B15R0.111 CCNC(=O)CCNCCCOCC(C)C 2230a_100000205972_100000737597 [0,1,0,0,0,0|3,0,0]=4 3319 B15R0.111 CCNC(=O)CCOCCCCCC(C)C 7a_100011995859_100000737597 [0,1,0,0,0,0|2,0,0]=3 3320 B15R0.111 CCNC(=O)CCSCCCCCC(C)C 62a_100000210682_100000737597 [0,1,0,0,0,0|2,0,0]=3 3321 B15R0.111 CCNC(=O)CCSCCCCCC(C)C 62a_100000737597_100000210682 [0,1,0,0,0,0|2,0,0]=3 3322 B15R0.111 CCNC(=O)CNCCCCCCC(C)C 2230a_100000211014_100000183381 [0,1,0,0,0,0|2,0,0]=3 3323 B15R0.111 CCNC(=O)CNCCCCCCC(C)C 34a_100000211014_100000183381 [0,1,0,0,0,0|2,0,0]=3 3324 B15R0.111 CCNC(=O)COCCCCCNC(C)C 34a_100011629493_100000183381 [0,1,0,0,0,0|3,0,0]=4 3325 B15R0.111 CCOC(=O)/C=C/COCCCCC(C)C 34a_100011214890_100016267167 [0,1,0,0,0,0|1,0,2]=4 3326 B15R0.111 CCOC(=O)/C=C/COCCCCC(C)C 7a_100011214890_100016267167 [0,1,0,0,0,0|1,0,2]=4 3327 B15R0.111 CCOC(=O)/C=C/CSCCCCC(C)C 62a_100011216152_100016267167 [0,1,0,0,0,0|1,0,2]=4 3328 B15R0.111 CCOC(=O)/C=C/CSCCCCC(C)C 62a_100016267167_100011216152 [0,1,0,0,0,0|1,0,2]=4 3329 B15R0.111 CCOC(=O)CCCCC=NNCC(C)O 4a_200000730056_100012182868 [0,1,0,0,0,0|2,0,1]=4 3330 B15R0.111 CCOC(=O)CCCCCC=NNC(C)C 4a_100000741168_100000085164 [0,1,0,0,0,0|2,0,1]=4 3331 B15R0.111 CCOC(=O)CCCCCCCCC(=O)C 1458a_100000070787_100010175975 [0,1,0,0,0,0|0,0,1]=2 3332 B15R0.111 CCOC(=O)CCCCCCCCC(=O)C 1458a_200000016031_200000210301 [0,1,0,0,0,0|0,0,1]=2 3333 B15R0.111 CCOC(=O)CCCCCCCCC(=O)[13CH3] 1458a_200000016031_200025704644 [0,1,0,0,0,0|0,0,1]=2 3334 B15R0.111 CCOC(=O)CCCCCCCCN(C)C 2230a_100102631434_100010175975 [0,1,0,0,0,0|1,0,0]=2 3335 B15R0.111 CCOC(=O)CCCCCCCCN(C)C 269982a_100102631434_100010175975 [0,1,0,0,0,0|1,0,0]=2 3336 B15R0.111 CCOC(=O)CCCCCCCNC(C)C 2230a_100138425928_100009991516 [0,1,0,0,0,0|1,0,0]=2 3337 B15R0.111 CCOC(=O)CCCCCCCNC(C)C 34a_100138425928_100009991516 [0,1,0,0,0,0|1,0,0]=2 3338 B15R0.111 CCOC(=O)CCCCCCCOC(C)C 34a_100000212225_100009991516 [0,1,0,0,0,0|1,0,0]=2 3339 B15R0.111 CCOC(=O)CCCCCCCSC(C)C 62a_100000210206_100009991516 [0,1,0,0,0,0|1,0,0]=2 3340 B15R0.111 CCOC(=O)CCCCCCNCC(=O)N 2230a_100000711301_100009814379 [0,1,0,0,0,0|2,0,1]=4 3341 B15R0.111 CCOC(=O)CCCCCCNCC(=O)O 269956a_100016091260_100009814379 [0,1,0,0,0,0|2,0,1]=4 3342 B15R0.111 CCOC(=O)CCCCCCNCC(C)C 2230a_100000210953_100009814379 [0,1,0,0,0,0|1,0,0]=2 3343 B15R0.111 CCOC(=O)CCCCCCNCC(C)C 34a_100000210953_100009814379 [0,1,0,0,0,0|1,0,0]=2 3344 B15R0.111 CCOC(=O)CCCCCCNCC(C)O 2230a_100000210904_100009814379 [0,1,0,0,0,0|1,0,0]=2 3345 B15R0.111 CCOC(=O)CCCCCCNCC(C)O 34a_100000210904_100009814379 [0,1,0,0,0,0|1,0,0]=2 3346 B15R0.111 CCOC(=O)CCCCCCNCC(F)F 34a_100000765723_100009814379 [0,1,0,0,0,0|2,0,0]=3 3347 B15R0.111 CCOC(=O)CCCCCCOCC(=O)C 34a_100000211253_100009814379 [0,1,0,0,0,0|1,0,1]=3 3348 B15R0.111 CCOC(=O)CCCCCCOCC(C)Br 34a_100012180447_100009814379 [0,1,0,0,0,0|1,0,0]=2 3349 B15R0.111 CCOC(=O)CCCCCCOCC(C)C 34a_100000210257_100009814379 [0,1,0,0,0,0|1,0,0]=2 3350 B15R0.111 CCOC(=O)CCCCCCOCC(C)F 34a_100015925927_100009814379 [0,1,0,0,0,0|1,0,0]=2 3351 B15R0.111 CCOC(=O)CCCCCCOCC(F)F 34a_100000743014_100009814379 [0,1,0,0,0,0|2,0,0]=3 3352 B15R0.111 CCOC(=O)CCCCCCOC[C@@H](C)Cl 34a_100016084084_100009814379 [0,1,0,0,0,0|1,0,0]=2 3353 B15R0.111 CCOC(=O)CCCCCCOC[C@@H](C)N 34a_100000737577_100009814379 [0,1,0,0,0,0|1,0,0]=2 3354 B15R0.111 CCOC(=O)CCCCCCSCC(=O)N 62a_100000747473_100009814379 [0,1,0,0,0,0|2,0,1]=4 3355 B15R0.111 CCOC(=O)CCCCCCSCC(=O)[O-] 62a_100020667443_100009814379 [0,1,0,0,0,0|2,0,1]=4 3356 B15R0.111 CCOC(=O)CCCCCCSCC(C)C 62a_100000210624_100009814379 [0,1,0,0,0,0|1,0,0]=2 3357 B15R0.111 CCOC(=O)CCCCCCSCC(C)O 62a_100011218427_100009814379 [0,1,0,0,0,0|1,0,0]=2 3358 B15R0.111 CCOC(=O)CCCCCCSCC(F)F 62a_100011934356_100009814379 [0,1,0,0,0,0|2,0,0]=3 3359 B15R0.111 CCOC(=O)CCCCCCSC[C@@H](C)O 62a_100009817552_100009814379 [0,1,0,0,0,0|1,0,0]=2 3360 B15R0.111 CCOC(=O)CCCCCNCC=C(C)C 34a_100000718196_100000755133 [0,1,0,0,0,0|1,0,2]=4 3361 B15R0.111 CCOC(=O)CCCCCNCCC(C)O 2230a_200000755665_100000755133 [0,1,0,0,0,0|1,0,0]=2 3362 B15R0.111 CCOC(=O)CCCCCOCC=C(C)C 34a_100000753907_100000755133 [0,1,0,0,0,0|1,0,2]=4 3363 B15R0.111 CCOC(=O)CCCCCOCC=C(C)C 7a_100011214988_100000761012 [0,1,0,0,0,0|1,0,2]=4 3364 B15R0.111 CCOC(=O)CCCCCOCCC(=O)C 34a_100000759926_100000755133 [0,1,0,0,0,0|1,0,1]=3 3365 B15R0.111 CCOC(=O)CCCCCOCCC(=O)C 7a_100000759926_100000755133 [0,1,0,0,0,0|1,0,1]=3 3366 B15R0.111 CCOC(=O)CCCCCOCCC(=O)C 7a_100011214988_100000053229 [0,1,0,0,0,0|1,0,1]=3 3367 B15R0.111 CCOC(=O)CCCCCOCCC(=O)N 34a_100000757172_100000755133 [0,1,0,0,0,0|2,0,1]=4 3368 B15R0.111 CCOC(=O)CCCCCOCCC(=O)N 7a_100000757172_100000755133 [0,1,0,0,0,0|2,0,1]=4 3369 B15R0.111 CCOC(=O)CCCCCOCCC(=O)N 7a_100011214988_100000744528 [0,1,0,0,0,0|2,0,1]=4 3370 B15R0.111 CCOC(=O)CCCCCOCCC(C)Br 34a_100009893172_100000755133 [0,1,0,0,0,0|1,0,0]=2 3371 B15R0.111 CCOC(=O)CCCCCOCCC(C)C 34a_100000210254_100000755133 [0,1,0,0,0,0|1,0,0]=2 3372 B15R0.111 CCOC(=O)CCCCCOCCC(C)C 7a_100000210254_100000755133 [0,1,0,0,0,0|1,0,0]=2 3373 B15R0.111 CCOC(=O)CCCCCOCCC(C)C 7a_100011214988_100000210626 [0,1,0,0,0,0|1,0,0]=2 3374 B15R0.111 CCOC(=O)CCCCCOCCC(C)O 7a_100011214988_100012276601 [0,1,0,0,0,0|1,0,0]=2 3375 B15R0.111 CCOC(=O)CCCCCOCCC(F)F 34a_100103093639_100000755133 [0,1,0,0,0,0|2,0,0]=3 3376 B15R0.111 CCOC(=O)CCCCCOCCN(C)C 7a_100011214988_100000755713 [0,1,0,0,0,0|2,0,0]=3 3377 B15R0.111 CCOC(=O)CCCCCOCC[C@@H](C)N 34a_100000706166_100000755133 [0,1,0,0,0,0|1,0,0]=2 3378 B15R0.111 CCOC(=O)CCCCCSCC=C(C)C 62a_100000755133_100000761012 [0,1,0,0,0,0|1,0,2]=4 3379 B15R0.111 CCOC(=O)CCCCCSCC=C(C)C 62a_100000761012_100000755133 [0,1,0,0,0,0|1,0,2]=4 3380 B15R0.111 CCOC(=O)CCCCCSCCC(=O)C 62a_100000053229_100000755133 [0,1,0,0,0,0|1,0,1]=3 3381 B15R0.111 CCOC(=O)CCCCCSCCC(=O)C 62a_100000755133_100000053229 [0,1,0,0,0,0|1,0,1]=3 3382 B15R0.111 CCOC(=O)CCCCCSCCC(=O)N 62a_100000744528_100000755133 [0,1,0,0,0,0|2,0,1]=4 3383 B15R0.111 CCOC(=O)CCCCCSCCC(=O)N 62a_100000755133_100000744528 [0,1,0,0,0,0|2,0,1]=4 3384 B15R0.111 CCOC(=O)CCCCCSCCC(C)C 62a_100000210312_100000755133 [0,1,0,0,0,0|1,0,0]=2 3385 B15R0.111 CCOC(=O)CCCCCSCCC(C)C 62a_100000755133_100000210312 [0,1,0,0,0,0|1,0,0]=2 3386 B15R0.111 CCOC(=O)CCCCCSCCC(C)O 62a_100000755133_100012276601 [0,1,0,0,0,0|1,0,0]=2 3387 B15R0.111 CCOC(=O)CCCCCSCCC(C)O 62a_100012276601_100000755133 [0,1,0,0,0,0|1,0,0]=2 3388 B15R0.111 CCOC(=O)CCCCCSCCN(C)C 62a_100000755133_100000755713 [0,1,0,0,0,0|2,0,0]=3 3389 B15R0.111 CCOC(=O)CCCCCSCOC(=O)C 62a_100000076356_100000755133 [0,1,0,0,0,0|2,0,1]=4 3390 B15R0.111 CCOC(=O)CCCCCSCOC(=O)C 62a_100000755133_100000076356 [0,1,0,0,0,0|2,0,1]=4 3391 B15R0.111 CCOC(=O)CCCCCSCOC(C)C 62a_100000709892_100000755133 [0,1,0,0,0,0|2,0,0]=3 3392 B15R0.111 CCOC(=O)CCCCCSCOC(C)C 62a_100000755133_100000709892 [0,1,0,0,0,0|2,0,0]=3 3393 B15R0.111 CCOC(=O)CCCCNCCCC(=O)N 34a_100000739312_100000750268 [0,1,0,0,0,0|2,0,1]=4 3394 B15R0.111 CCOC(=O)CCCCNCCCC(C)C 2230a_200000737386_100000750268 [0,1,0,0,0,0|1,0,0]=2 3395 B15R0.111 CCOC(=O)CCCCNCCCC(C)C 34a_200000737386_100000750268 [0,1,0,0,0,0|1,0,0]=2 3396 B15R0.111 CCOC(=O)CCCCNCCCS(=O)C 2230a_200000753449_100000750268 [0,1,0,0,0,0|2,0,0]=3 3397 B15R0.111 CCOC(=O)CCCCNCCNC(=O)C 2230a_100000209853_100000750268 [0,1,0,0,0,0|2,0,1]=4 3398 B15R0.111 CCOC(=O)CCCCNCCOC(C)C 2230a_100000701111_100000750268 [0,1,0,0,0,0|2,0,0]=3 3399 B15R0.111 CCOC(=O)CCCCNCCOC(C)C 34a_100000701111_100000750268 [0,1,0,0,0,0|2,0,0]=3 3400 B15R0.111 CCOC(=O)CCCCNCCSC(C)C 2230a_100000731138_100000750268 [0,1,0,0,0,0|2,0,0]=3 3401 B15R0.111 CCOC(=O)CCCCNCCSC(C)C 34a_100000731138_100000750268 [0,1,0,0,0,0|2,0,0]=3 3402 B15R0.111 CCOC(=O)CCCCOCCCC(=O)C 34a_100000759063_100000750268 [0,1,0,0,0,0|1,0,1]=3 3403 B15R0.111 CCOC(=O)CCCCOCCCC(=O)C 7a_100000759063_100000750268 [0,1,0,0,0,0|1,0,1]=3 3404 B15R0.111 CCOC(=O)CCCCOCCCC(C)C 34a_100000210774_100000750268 [0,1,0,0,0,0|1,0,0]=2 3405 B15R0.111 CCOC(=O)CCCCOCCCC(C)C 7a_100000210774_100000750268 [0,1,0,0,0,0|1,0,0]=2 3406 B15R0.111 CCOC(=O)CCCCOCCC[N+](=O)[O-] 34a_200000037920_100000750268 [0,1,0,0,0,0|3,0,0]=4 3407 B15R0.111 CCOC(=O)CCCCOCCNC(=O)C 34a_100000158858_100000750268 [0,1,0,0,0,0|2,0,1]=4 3408 B15R0.111 CCOC(=O)CCCCOCCNC(C)C 34a_100000224655_100000750268 [0,1,0,0,0,0|2,0,0]=3 3409 B15R0.111 CCOC(=O)CCCCOCCOC(C)C 34a_100000211219_100000750268 [0,1,0,0,0,0|2,0,0]=3 3410 B15R0.111 CCOC(=O)CCCCOCCOC(C)C 7a_100000211219_100000750268 [0,1,0,0,0,0|2,0,0]=3 3411 B15R0.111 CCOC(=O)CCCCOCCSC(C)C 34a_200011212901_100000750268 [0,1,0,0,0,0|2,0,0]=3 3412 B15R0.111 CCOC(=O)CCCCOCCSC(C)C 7a_200011212901_100000750268 [0,1,0,0,0,0|2,0,0]=3 3413 B15R0.111 CCOC(=O)CCCCSCCC=C(C)C 62a_100000750268_100011217483 [0,1,0,0,0,0|1,0,2]=4 3414 B15R0.111 CCOC(=O)CCCCSCCC=C(C)C 62a_100011217483_100000750268 [0,1,0,0,0,0|1,0,2]=4 3415 B15R0.111 CCOC(=O)CCCCSCCCC(=O)C 62a_100000750268_100011215641 [0,1,0,0,0,0|1,0,1]=3 3416 B15R0.111 CCOC(=O)CCCCSCCCC(=O)C 62a_100011215641_100000750268 [0,1,0,0,0,0|1,0,1]=3 3417 B15R0.111 CCOC(=O)CCCCSCCCC(=O)N 62a_100000750268_100102525003 [0,1,0,0,0,0|2,0,1]=4 3418 B15R0.111 CCOC(=O)CCCCSCCCC(=O)N 62a_100102525003_100000750268 [0,1,0,0,0,0|2,0,1]=4 3419 B15R0.111 CCOC(=O)CCCCSCCCC(C)C 62a_100000750268_100011214892 [0,1,0,0,0,0|1,0,0]=2 3420 B15R0.111 CCOC(=O)CCCCSCCCC(C)C 62a_100011214892_100000750268 [0,1,0,0,0,0|1,0,0]=2 3421 B15R0.111 CCOC(=O)CCCCSCCCC(C)O 62a_100000750268_200000718107 [0,1,0,0,0,0|1,0,0]=2 3422 B15R0.111 CCOC(=O)CCCCSCCCC(C)O 62a_200000718107_100000750268 [0,1,0,0,0,0|1,0,0]=2 3423 B15R0.111 CCOC(=O)CCCCSCCCN(C)C 62a_100000750268_100000757444 [0,1,0,0,0,0|2,0,0]=3 3424 B15R0.111 CCOC(=O)CCCCSCCNC(=O)C 62a_100000189650_100000750268 [0,1,0,0,0,0|2,0,1]=4 3425 B15R0.111 CCOC(=O)CCCCSCCNC(=O)C 62a_100000750268_100000189650 [0,1,0,0,0,0|2,0,1]=4 3426 B15R0.111 CCOC(=O)CCCCSCCOC(=O)C 62a_100000750268_100009814007 [0,1,0,0,0,0|2,0,1]=4 3427 B15R0.111 CCOC(=O)CCCCSCCOC(=O)C 62a_100009814007_100000750268 [0,1,0,0,0,0|2,0,1]=4 3428 B15R0.111 CCOC(=O)CCCCSCCOC(C)C 62a_100000211751_100000750268 [0,1,0,0,0,0|2,0,0]=3 3429 B15R0.111 CCOC(=O)CCCCSCCOC(C)C 62a_100000750268_100000211751 [0,1,0,0,0,0|2,0,0]=3 3430 B15R0.111 CCOC(=O)CCCCSCCSC(C)C 62a_100000730970_100000750268 [0,1,0,0,0,0|2,0,0]=3 3431 B15R0.111 CCOC(=O)CCCCSCCSC(C)C 62a_100000750268_100000730970 [0,1,0,0,0,0|2,0,0]=3 3432 B15R0.111 CCOC(=O)CCCNCCCCC(=O)N 34a_100000696515_100009991533 [0,1,0,0,0,0|2,0,1]=4 3433 B15R0.111 CCOC(=O)CCCNCCCNC(=O)C 34a_100000736810_100009991533 [0,1,0,0,0,0|2,0,1]=4 3434 B15R0.111 CCOC(=O)CCCNCCCOC(C)C 2230a_100000737246_100009991533 [0,1,0,0,0,0|2,0,0]=3 3435 B15R0.111 CCOC(=O)CCCNCCCOC(C)C 34a_100000737246_100009991533 [0,1,0,0,0,0|2,0,0]=3 3436 B15R0.111 CCOC(=O)CCCOCCCCB(O)O 7a_100012001163_200009817182 [0,1,0,0,0,0|3,0,0]=4 3437 B15R0.111 CCOC(=O)CCCOCCCCC(=O)C 7a_100012001163_100000735457 [0,1,0,0,0,0|1,0,1]=3 3438 B15R0.111 CCOC(=O)CCCOCCCCC(=O)N 34a_100012022536_100009991533 [0,1,0,0,0,0|2,0,1]=4 3439 B15R0.111 CCOC(=O)CCCOCCCCC(=O)N 7a_100012022536_100011215271 [0,1,0,0,0,0|2,0,1]=4 3440 B15R0.111 CCOC(=O)CCCOCCCCC(C)C 34a_100011214890_100009991533 [0,1,0,0,0,0|1,0,0]=2 3441 B15R0.111 CCOC(=O)CCCOCCCCC(C)C 7a_100011214890_100011215271 [0,1,0,0,0,0|1,0,0]=2 3442 B15R0.111 CCOC(=O)CCCOCCCCC(C)C 7a_100012001163_100011216152 [0,1,0,0,0,0|1,0,0]=2 3443 B15R0.111 CCOC(=O)CCCOCCCC[N+](=O)[O-] 34a_200015379883_100009991533 [0,1,0,0,0,0|3,0,0]=4 3444 B15R0.111 CCOC(=O)CCCOCCCC[N+](=O)[O-] 7a_200015379883_100011215271 [0,1,0,0,0,0|3,0,0]=4 3445 B15R0.111 CCOC(=O)CCCOCCCNC(=O)C 34a_100000752032_100009991533 [0,1,0,0,0,0|2,0,1]=4 3446 B15R0.111 CCOC(=O)CCCOCCCNC(C)C 34a_100000182298_100009991533 [0,1,0,0,0,0|2,0,0]=3 3447 B15R0.111 CCOC(=O)CCCOCCCOC(=O)C 7a_100012001163_100000042594 [0,1,0,0,0,0|2,0,1]=4 3448 B15R0.111 CCOC(=O)CCCOCCCOC(=S)C 7a_100012001163_200135323944 [0,1,0,0,0,0|2,0,1]=4 3449 B15R0.111 CCOC(=O)CCCOCCCSC(=O)C 7a_100012001163_100000038929 [0,1,0,0,0,0|2,0,1]=4 3450 B15R0.111 CCOC(=O)CCCOCCNCC(C)C 34a_100015185251_100009991533 [0,1,0,0,0,0|2,0,0]=3 3451 B15R0.111 CCOC(=O)CCCOCCOCC(C)C 34a_100000703358_100009991533 [0,1,0,0,0,0|2,0,0]=3 3452 B15R0.111 CCOC(=O)CCCOCCOCC(C)C 7a_100000703358_100011215271 [0,1,0,0,0,0|2,0,0]=3 3453 B15R0.111 CCOC(=O)CCCOCCOCC(F)F 34a_100000704375_100009991533 [0,1,0,0,0,0|3,0,0]=4 3454 B15R0.111 CCOC(=O)CCCOCCOCC(F)F 7a_100000704375_100011215271 [0,1,0,0,0,0|3,0,0]=4 3455 B15R0.111 CCOC(=O)CCCOCCOCC(F)F 7a_100012001163_200012177212 [0,1,0,0,0,0|3,0,0]=4 3456 B15R0.111 CCOC(=O)CCCOCCSCC(C)C 34a_200000230437_100009991533 [0,1,0,0,0,0|2,0,0]=3 3457 B15R0.111 CCOC(=O)CCCOCCSCC(C)C 7a_200000230437_100011215271 [0,1,0,0,0,0|2,0,0]=3 3458 B15R0.111 CCOC(=O)CCCSCCCCB(O)O 62a_100009991533_200009817182 [0,1,0,0,0,0|3,0,0]=4 3459 B15R0.111 CCOC(=O)CCCSCCCCB(O)O 62a_200009817182_100009991533 [0,1,0,0,0,0|3,0,0]=4 3460 B15R0.111 CCOC(=O)CCCSCCCCC(=O)C 62a_100000735457_100009991533 [0,1,0,0,0,0|1,0,1]=3 3461 B15R0.111 CCOC(=O)CCCSCCCCC(=O)C 62a_100009991533_100000735457 [0,1,0,0,0,0|1,0,1]=3 3462 B15R0.111 CCOC(=O)CCCSCCCCC(C)C 62a_100009991533_100011216152 [0,1,0,0,0,0|1,0,0]=2 3463 B15R0.111 CCOC(=O)CCCSCCCCC(C)C 62a_100011216152_100009991533 [0,1,0,0,0,0|1,0,0]=2 3464 B15R0.111 CCOC(=O)CCCSCCCCN(C)C 62a_100009991533_100000690147 [0,1,0,0,0,0|2,0,0]=3 3465 B15R0.111 CCOC(=O)CCCSCCCOC(=O)C 62a_100000042594_100009991533 [0,1,0,0,0,0|2,0,1]=4 3466 B15R0.111 CCOC(=O)CCCSCCCOC(=O)C 62a_100009991533_100000042594 [0,1,0,0,0,0|2,0,1]=4 3467 B15R0.111 CCOC(=O)CCCSCCCOC(=S)C 62a_100009991533_200135323944 [0,1,0,0,0,0|2,0,1]=4 3468 B15R0.111 CCOC(=O)CCCSCCCOC(=S)C 62a_200135323944_100009991533 [0,1,0,0,0,0|2,0,1]=4 3469 B15R0.111 CCOC(=O)CCCSCCCSC(=O)C 62a_100000038929_100009991533 [0,1,0,0,0,0|2,0,1]=4 3470 B15R0.111 CCOC(=O)CCCSCCCSC(=O)C 62a_100009991533_100000038929 [0,1,0,0,0,0|2,0,1]=4 3471 B15R0.111 CCOC(=O)CCCSCCOCC(F)F 62a_100009991533_200012177212 [0,1,0,0,0,0|3,0,0]=4 3472 B15R0.111 CCOC(=O)CCCSCCOCC(F)F 62a_200012177212_100009991533 [0,1,0,0,0,0|3,0,0]=4 3473 B15R0.111 CCOC(=O)CCNCCCCCC(C)C 2230a_100011290863_100011206558 [0,1,0,0,0,0|1,0,0]=2 3474 B15R0.111 CCOC(=O)CCNCCCCCC(C)C 34a_100011290863_100000765890 [0,1,0,0,0,0|1,0,0]=2 3475 B15R0.111 CCOC(=O)CCNCCCCNC(=O)C 2230a_200011368371_100011206558 [0,1,0,0,0,0|2,0,1]=4 3476 B15R0.111 CCOC(=O)CCNCCCCNC(=O)C 34a_200011368371_100000765890 [0,1,0,0,0,0|2,0,1]=4 3477 B15R0.111 CCOC(=O)CCNCCCOCC(C)C 2230a_100000205972_100011206558 [0,1,0,0,0,0|2,0,0]=3 3478 B15R0.111 CCOC(=O)CCNCCCOCC(C)C 34a_100000205972_100000765890 [0,1,0,0,0,0|2,0,0]=3 3479 B15R0.111 CCOC(=O)CCOCCCCCC(=O)N 34a_100000123541_100000765890 [0,1,0,0,0,0|2,0,1]=4 3480 B15R0.111 CCOC(=O)CCOCCCCCC(=O)N 7a_100000123541_100011206558 [0,1,0,0,0,0|2,0,1]=4 3481 B15R0.111 CCOC(=O)CCOCCCCCC(=O)[O-] 7a_100102619762_100011206558 [0,1,0,0,0,0|2,0,1]=4 3482 B15R0.111 CCOC(=O)CCOCCCCCC(C)C 34a_100011995859_100000765890 [0,1,0,0,0,0|1,0,0]=2 3483 B15R0.111 CCOC(=O)CCOCCCCCC(C)C 7a_100011995859_100011206558 [0,1,0,0,0,0|1,0,0]=2 3484 B15R0.111 CCOC(=O)CCOCCCCNC(C)C 34a_100011521146_100000765890 [0,1,0,0,0,0|2,0,0]=3 3485 B15R0.111 CCOC(=O)CCOCCCCOC(=O)C 34a_100000073216_100000765890 [0,1,0,0,0,0|2,0,1]=4 3486 B15R0.111 CCOC(=O)CCOCCCCOC(=O)C 7a_100000073216_100011206558 [0,1,0,0,0,0|2,0,1]=4 3487 B15R0.111 CCOC(=O)CCOCCOCCC(=O)C 1458a_100000067408_200000210301 [0,1,0,0,0,0|2,0,1]=4 3488 B15R0.111 CCOC(=O)CCOCCOCCC(=O)[13CH3] 1458a_100000067408_200025704644 [0,1,0,0,0,0|2,0,1]=4 3489 B15R0.111 CCOC(=O)CCSCCCCCB(O)O 62a_100000765890_200009817188 [0,1,0,0,0,0|3,0,0]=4 3490 B15R0.111 CCOC(=O)CCSCCCCCB(O)O 62a_200009817188_100000765890 [0,1,0,0,0,0|3,0,0]=4 3491 B15R0.111 CCOC(=O)CCSCCCCCC(=O)N 62a_100000765890_100009817443 [0,1,0,0,0,0|2,0,1]=4 3492 B15R0.111 CCOC(=O)CCSCCCCCC(=O)N 62a_100009817443_100000765890 [0,1,0,0,0,0|2,0,1]=4 3493 B15R0.111 CCOC(=O)CCSCCCCCC(C)C 62a_100000210682_100000765890 [0,1,0,0,0,0|1,0,0]=2 3494 B15R0.111 CCOC(=O)CCSCCCCCC(C)C 62a_100000765890_100000210682 [0,1,0,0,0,0|1,0,0]=2 3495 B15R0.111 CCOC(=O)CCSCCCCOC(=O)C 62a_100000033659_100000765890 [0,1,0,0,0,0|2,0,1]=4 3496 B15R0.111 CCOC(=O)CCSCCCCOC(=O)C 62a_100000765890_100000033659 [0,1,0,0,0,0|2,0,1]=4 3497 B15R0.111 CCOC(=O)CCSCCCCSC(=O)C 62a_100000765890_200010402107 [0,1,0,0,0,0|2,0,1]=4 3498 B15R0.111 CCOC(=O)CCSCCCCSC(=O)C 62a_200010402107_100000765890 [0,1,0,0,0,0|2,0,1]=4 3499 B15R0.111 CCOC(=O)CNCCCCCCC(C)C 2230a_100000211014_100000188475 [0,1,0,0,0,0|1,0,0]=2 3500 B15R0.111 CCOC(=O)CNCCCCCCC(C)C 34a_100000211014_100000188475 [0,1,0,0,0,0|1,0,0]=2 3501 B15R0.111 CCOC(=O)CNCCCCCNC(=O)C 2230a_200012022750_100000188475 [0,1,0,0,0,0|2,0,1]=4 3502 B15R0.111 CCOC(=O)CNCCCCCNC(=O)C 34a_200012022750_100000188475 [0,1,0,0,0,0|2,0,1]=4 3503 B15R0.111 CCOC(=O)COCCCCCNC(C)C 34a_100011629493_100000188475 [0,1,0,0,0,0|2,0,0]=3 3504 B15R0.111 CCOC(=O)COCCCNCCC(C)O 2230a_200000755665_100009893628 [0,1,0,0,0,0|2,0,0]=3 3505 B15R0.111 CCOC(=O)COCCCOCCC(=O)C 34a_100000759926_100009893628 [0,1,0,0,0,0|2,0,1]=4 3506 B15R0.111 CCOC(=O)COCCCOCCC(=O)C 7a_100000759926_100009893628 [0,1,0,0,0,0|2,0,1]=4 3507 B15R0.111 CCOC(=O)COCCCOCCC(C)Br 34a_100009893172_100009893628 [0,1,0,0,0,0|2,0,0]=3 3508 B15R0.111 CCOC(=O)COCCCOCCC(C)C 34a_100000210254_100009893628 [0,1,0,0,0,0|2,0,0]=3 3509 B15R0.111 CCOC(=O)COCCCOCCC(C)C 7a_100000210254_100009893628 [0,1,0,0,0,0|2,0,0]=3 3510 B15R0.111 CCOC(=O)COCCCOCCC(F)F 34a_100103093639_100009893628 [0,1,0,0,0,0|3,0,0]=4 3511 B15R0.111 CCOC(=O)COCCCOCC[C@@H](C)N 34a_100000706166_100009893628 [0,1,0,0,0,0|2,0,0]=3 3512 B15R0.111 CCOC(=O)COCCCSCCC(=O)C 62a_100000053229_100009893628 [0,1,0,0,0,0|2,0,1]=4 3513 B15R0.111 CCOC(=O)COCCCSCCC(=O)C 62a_100009893628_100000053229 [0,1,0,0,0,0|2,0,1]=4 3514 B15R0.111 CCOC(=O)COCCCSCCC(C)C 62a_100000210312_100009893628 [0,1,0,0,0,0|2,0,0]=3 3515 B15R0.111 CCOC(=O)COCCCSCCC(C)C 62a_100009893628_100000210312 [0,1,0,0,0,0|2,0,0]=3 3516 B15R0.111 CCOC(=O)COCCCSCCC(C)O 62a_100009893628_100012276601 [0,1,0,0,0,0|2,0,0]=3 3517 B15R0.111 CCOC(=O)COCCCSCCC(C)O 62a_100012276601_100009893628 [0,1,0,0,0,0|2,0,0]=3 3518 B15R0.111 CCOC(=O)COCCCSCCN(C)C 62a_100009893628_100000755713 [0,1,0,0,0,0|3,0,0]=4 3519 B15R0.111 CCOC(=O)COCCCSCOC(C)C 62a_100000709892_100009893628 [0,1,0,0,0,0|3,0,0]=4 3520 B15R0.111 CCOC(=O)COCCCSCOC(C)C 62a_100009893628_100000709892 [0,1,0,0,0,0|3,0,0]=4 3521 B15R0.111 CCOC(=O)COCCNCCCC(C)C 2230a_200000737386_100000088970 [0,1,0,0,0,0|2,0,0]=3 3522 B15R0.111 CCOC(=O)COCCNCCCC(C)C 34a_200000737386_100000088970 [0,1,0,0,0,0|2,0,0]=3 3523 B15R0.111 CCOC(=O)COCCNCCCS(=O)C 2230a_200000753449_100000088970 [0,1,0,0,0,0|3,0,0]=4 3524 B15R0.111 CCOC(=O)COCCNCCOC(C)C 2230a_100000701111_100000088970 [0,1,0,0,0,0|3,0,0]=4 3525 B15R0.111 CCOC(=O)COCCNCCOC(C)C 34a_100000701111_100000088970 [0,1,0,0,0,0|3,0,0]=4 3526 B15R0.111 CCOC(=O)COCCNCCSC(C)C 2230a_100000731138_100000088970 [0,1,0,0,0,0|3,0,0]=4 3527 B15R0.111 CCOC(=O)COCCNCCSC(C)C 34a_100000731138_100000088970 [0,1,0,0,0,0|3,0,0]=4 3528 B15R0.111 CCOC(=O)COCCOCCCC(=O)C 34a_100000759063_100000088970 [0,1,0,0,0,0|2,0,1]=4 3529 B15R0.111 CCOC(=O)COCCOCCCC(=O)C 7a_100000759063_100000088970 [0,1,0,0,0,0|2,0,1]=4 3530 B15R0.111 CCOC(=O)COCCOCCCC(C)C 34a_100000210774_100000088970 [0,1,0,0,0,0|2,0,0]=3 3531 B15R0.111 CCOC(=O)COCCOCCCC(C)C 7a_100000210774_100000088970 [0,1,0,0,0,0|2,0,0]=3 3532 B15R0.111 CCOC(=O)COCCOCCNC(C)C 34a_100000224655_100000088970 [0,1,0,0,0,0|3,0,0]=4 3533 B15R0.111 CCOC(=O)COCCOCCOC(C)C 34a_100000211219_100000088970 [0,1,0,0,0,0|3,0,0]=4 3534 B15R0.111 CCOC(=O)COCCOCCOC(C)C 7a_100000211219_100000088970 [0,1,0,0,0,0|3,0,0]=4 3535 B15R0.111 CCOC(=O)COCCOCCSC(C)C 34a_200011212901_100000088970 [0,1,0,0,0,0|3,0,0]=4 3536 B15R0.111 CCOC(=O)COCCOCCSC(C)C 7a_200011212901_100000088970 [0,1,0,0,0,0|3,0,0]=4 3537 B15R0.111 CCOC(=O)COCCSCCCC(=O)C 62a_100000088970_100011215641 [0,1,0,0,0,0|2,0,1]=4 3538 B15R0.111 CCOC(=O)COCCSCCCC(=O)C 62a_100011215641_100000088970 [0,1,0,0,0,0|2,0,1]=4 3539 B15R0.111 CCOC(=O)COCCSCCCC(C)C 62a_100000088970_100011214892 [0,1,0,0,0,0|2,0,0]=3 3540 B15R0.111 CCOC(=O)COCCSCCCC(C)C 62a_100011214892_100000088970 [0,1,0,0,0,0|2,0,0]=3 3541 B15R0.111 CCOC(=O)COCCSCCCC(C)O 62a_100000088970_200000718107 [0,1,0,0,0,0|2,0,0]=3 3542 B15R0.111 CCOC(=O)COCCSCCCC(C)O 62a_200000718107_100000088970 [0,1,0,0,0,0|2,0,0]=3 3543 B15R0.111 CCOC(=O)COCCSCCCN(C)C 62a_100000088970_100000757444 [0,1,0,0,0,0|3,0,0]=4 3544 B15R0.111 CCOC(=O)COCCSCCOC(C)C 62a_100000088970_100000211751 [0,1,0,0,0,0|3,0,0]=4 3545 B15R0.111 CCOC(=O)COCCSCCOC(C)C 62a_100000211751_100000088970 [0,1,0,0,0,0|3,0,0]=4 3546 B15R0.111 CCOC(=O)COCCSCCSC(C)C 62a_100000088970_100000730970 [0,1,0,0,0,0|3,0,0]=4 3547 B15R0.111 CCOC(=O)COCCSCCSC(C)C 62a_100000730970_100000088970 [0,1,0,0,0,0|3,0,0]=4 3548 B15R0.111 CCOC(=O)CSCCCCCCB(O)O 62a_100000188475_100009817187 [0,1,0,0,0,0|3,0,0]=4 3549 B15R0.111 CCOC(=O)CSCCCCCCB(O)O 62a_100009817187_100000188475 [0,1,0,0,0,0|3,0,0]=4 3550 B15R0.111 CCOC(=O)CSCCCCCOC(=O)C 62a_100000033007_100000188475 [0,1,0,0,0,0|2,0,1]=4 3551 B15R0.111 CCOC(=O)CSCCCCCOC(=O)C 62a_100000188475_100000033007 [0,1,0,0,0,0|2,0,1]=4 3552 B15R0.111 CCOC(=O)CSCCOCCCC(=O)C 7a_200000230590_100011215641 [0,1,0,0,0,0|2,0,1]=4 3553 B15R0.111 CCOC(=O)CSCCOCCCC(C)C 7a_200000230590_100011214892 [0,1,0,0,0,0|2,0,0]=3 3554 B15R0.111 CCOC(=O)CSCCOCCCC(C)O 7a_200000230590_200000718107 [0,1,0,0,0,0|2,0,0]=3 3555 B15R0.111 CCOC(=O)CSCCOCCCN(C)C 7a_200000230590_100000757444 [0,1,0,0,0,0|3,0,0]=4 3556 B15R0.111 CCOC(=O)CSCCOCCOC(C)C 7a_200000230590_100000211751 [0,1,0,0,0,0|3,0,0]=4 3557 B15R0.111 CCOC(=O)CSCCOCCSC(C)C 7a_200000230590_100000730970 [0,1,0,0,0,0|3,0,0]=4 3558 B15R0.111 CCOC(=O)NCCOCCCCC(=O)C 34a_100000158857_100009817362 [0,1,0,0,0,0|2,0,1]=4 3559 B15R0.111 CCOC(=O)NCCOCCCCC(C)C 34a_100000158857_100011216152 [0,1,0,0,0,0|2,0,0]=3 3560 B15R0.111 CCOC(=O)NCCOCCCCC(C)C 7a_100011214890_200011445536 [0,1,0,0,0,0|2,0,0]=3 3561 B15R0.111 CCOC(=O)NCCOCCOCC(C)C 7a_100000703358_200011445536 [0,1,0,0,0,0|3,0,0]=4 3562 B15R0.111 CCOC(=O)NCCOCCSCC(C)C 7a_200000230437_200011445536 [0,1,0,0,0,0|3,0,0]=4 3563 B15R0.111 CCOC(=O)NCCSCCCCC(=O)C 62a_100000735457_200011445536 [0,1,0,0,0,0|2,0,1]=4 3564 B15R0.111 CCOC(=O)NCCSCCCCC(C)C 62a_100011216152_200011445536 [0,1,0,0,0,0|2,0,0]=3 3565 B15R0.111 CCOC(=O)OCSCCCCCC(C)C 62a_100000210682_100000075025 [0,1,0,0,0,0|2,0,0]=3 3566 B15R0.136 C#CCCCCCC(=O)CCC(=O)OCC 1458a_100000183558_100012094781 [0,1,0,0,0,0|0,0,3]=4 3567 B15R0.136 C#CCCCCCN(C)CCC(=O)OCC 2230a_100000745921_100012094781 [0,1,0,0,0,0|1,0,2]=4 3568 B15R0.136 C#CCCCCCN(C)CCC(=O)OCC 269982a_100000745921_100012094781 [0,1,0,0,0,0|1,0,2]=4 3569 B15R0.136 C#CCCCCNC(C)CCC(=O)OCC 2230a_100000706060_100000748298 [0,1,0,0,0,0|1,0,2]=4 3570 B15R0.136 C#CCCCCNC(C)CCC(=O)OCC 34a_100000706060_100000748298 [0,1,0,0,0,0|1,0,2]=4 3571 B15R0.136 C#CCCCCOC(C)CCC(=O)OCC 34a_100000766709_100000748298 [0,1,0,0,0,0|1,0,2]=4 3572 B15R0.136 C#CCCCCOC(C)CCC(=O)OCC 7a_100000766709_100000748298 [0,1,0,0,0,0|1,0,2]=4 3573 B15R0.136 C#CCCCCSC(C)CCC(=O)OCC 62a_100000748298_100010269958 [0,1,0,0,0,0|1,0,2]=4 3574 B15R0.136 C#CCCCCSC(C)CCC(=O)OCC 62a_100010269958_100000748298 [0,1,0,0,0,0|1,0,2]=4 3575 B15R0.136 C=CCCCCCC(=O)CCC(=O)OCC 1458a_100000183558_100000700193 [0,1,0,0,0,0|0,0,3]=4 3576 B15R0.136 C=CCCCCCN(C)CCC(=O)OCC 2230a_100000745921_100000700193 [0,1,0,0,0,0|1,0,2]=4 3577 B15R0.136 C=CCCCCCN(C)CCC(=O)OCC 269982a_100000745921_100000700193 [0,1,0,0,0,0|1,0,2]=4 3578 B15R0.136 C=CCCCCNC(C)CCC(=O)OCC 2230a_100000703577_100000748298 [0,1,0,0,0,0|1,0,2]=4 3579 B15R0.136 C=CCCCCNC(C)CCC(=O)OCC 34a_100000703577_100000748298 [0,1,0,0,0,0|1,0,2]=4 3580 B15R0.136 C=CCCCCOC(C)CCC(=O)OCC 34a_100000766645_100000748298 [0,1,0,0,0,0|1,0,2]=4 3581 B15R0.136 C=CCCCCOC(C)CCC(=O)OCC 7a_100000766645_100000748298 [0,1,0,0,0,0|1,0,2]=4 3582 B15R0.136 C=CCCCCSC(C)CCC(=O)OCC 62a_100000748298_100011215482 [0,1,0,0,0,0|1,0,2]=4 3583 B15R0.136 C=CCCCCSC(C)CCC(=O)OCC 62a_100011215482_100000748298 [0,1,0,0,0,0|1,0,2]=4 3584 B15R0.136 C=COC(=O)COC(C)CCCCCCC 34a_200011215852_100000036128 [0,1,0,0,0,0|1,0,2]=4 3585 B15R0.136 C=COC(=O)CSC(C)CCCCCCC 62a_100000036128_200011218727 [0,1,0,0,0,0|1,0,2]=4 3586 B15R0.136 C=COC(=O)CSC(C)CCCCCCC 62a_200011218727_100000036128 [0,1,0,0,0,0|1,0,2]=4 3587 B15R0.136 CC/C=C\CCOC(C)CCC(=O)OCC 34a_100016288707_100000748298 [0,1,0,0,0,0|1,0,2]=4 3588 B15R0.136 CC/C=C\CCOC(C)CCC(=O)OCC 7a_100016288707_100000748298 [0,1,0,0,0,0|1,0,2]=4 3589 B15R0.136 CC/C=C\CCSC(C)CCC(=O)OCC 62a_100000748298_100015370543 [0,1,0,0,0,0|1,0,2]=4 3590 B15R0.136 CC/C=C\CCSC(C)CCC(=O)OCC 62a_100015370543_100000748298 [0,1,0,0,0,0|1,0,2]=4 3591 B15R0.136 CC=CCCCOC(C)CCC(=O)OCC 34a_100020645299_100000748298 [0,1,0,0,0,0|1,0,2]=4 3592 B15R0.136 CCC#CCCOC(C)CCC(=O)OCC 34a_100000036655_100000748298 [0,1,0,0,0,0|1,0,2]=4 3593 B15R0.136 CCC#CCCOC(C)CCC(=O)OCC 7a_100000036655_100000748298 [0,1,0,0,0,0|1,0,2]=4 3594 B15R0.136 CCC/C=C/COC(C)CCC(=O)OCC 34a_100016278788_100000748298 [0,1,0,0,0,0|1,0,2]=4 3595 B15R0.136 CCC/C=C/COC(C)CCC(=O)OCC 7a_100016278788_100000748298 [0,1,0,0,0,0|1,0,2]=4 3596 B15R0.136 CCCC#CCOC(C)CCC(=O)OCC 34a_100000034806_100000748298 [0,1,0,0,0,0|1,0,2]=4 3597 B15R0.136 CCCC#CCOC(C)CCC(=O)OCC 7a_100000034806_100000748298 [0,1,0,0,0,0|1,0,2]=4 3598 B15R0.136 CCCCCCCC(=O)C=CC(=O)OCC 1458a_100000210415_100000210614 [0,1,0,0,0,0|0,0,3]=4 3599 B15R0.136 CCCCCCCC(=O)CCC(=O)NCC 1458a_100000199579_100000210614 [0,1,0,0,0,0|1,0,1]=3 3600 B15R0.136 CCCCCCCC(=O)CCC(=O)OCC 1458a_100000183558_100000210614 [0,1,0,0,0,0|0,0,1]=2 3601 B15R0.136 CCCCCCCC(=O)CNC(=O)OCC 1458a_100000190774_100000210614 [0,1,0,0,0,0|1,0,1]=3 3602 B15R0.136 CCCCCCCC(=O)COC(=O)CCC 1458a_100000211969_100000034017 [0,1,0,0,0,0|2,0,1]=4 3603 B15R0.136 CCCCCCCC(=O)NCC(=O)CCC 1458a_100000691742_100000210303 [0,1,0,0,0,0|2,0,1]=4 3604 B15R0.136 CCCCCCCC(=O)NCC(=O)NCC 11a_100015525214_100000691742 [0,1,0,0,0,0|2,0,1]=4 3605 B15R0.136 CCCCCCCC(=O)NCC(=O)NCC 11a_100016988866_100000211969 [0,1,0,0,0,0|2,0,1]=4 3606 B15R0.136 CCCCCCCC(=O)NCC(=O)NCC 1626a_100016988866_100000211969 [0,1,0,0,0,0|2,0,1]=4 3607 B15R0.136 CCCCCCCC(=O)NCC(=O)NCC 240690a_100015525214_100000691742 [0,1,0,0,0,0|2,0,1]=4 3608 B15R0.136 CCCCCCCC(=O)NCC(=O)NCC 240690a_100016988866_100000211969 [0,1,0,0,0,0|2,0,1]=4 3609 B15R0.136 CCCCCCCC(=O)NCC(=O)NCC 527a_100015525214_100000691742 [0,1,0,0,0,0|2,0,1]=4 3610 B15R0.136 CCCCCCCC(=O)NCC(=O)NCC 527a_100016988866_100000211969 [0,1,0,0,0,0|2,0,1]=4 3611 B15R0.136 CCCCCCCC(=O)NCC(=O)OCC 188690a_100000741813_100000211969 [0,1,0,0,0,0|1,0,1]=3 3612 B15R0.136 CCCCCCCC(=O)OCC(=O)CCC 1458a_100000211992_100009852258 [0,1,0,0,0,0|2,0,1]=4 3613 B15R0.136 CCCCCCCC(C)NCC(=O)NCC 2230a_100016988866_200011218727 [0,1,0,0,0,0|2,0,0]=3 3614 B15R0.136 CCCCCCCC(C)NCC(=O)NCC 270004a_100016988866_100000210596 [0,1,0,0,0,0|2,0,0]=3 3615 B15R0.136 CCCCCCCC(C)OCC(=O)CCC 7a_200011215852_100000747444 [0,1,0,0,0,0|2,0,0]=3 3616 B15R0.136 CCCCCCCC(C)OCC(=O)NCC 34a_200011215852_100000183381 [0,1,0,0,0,0|2,0,0]=3 3617 B15R0.136 CCCCCCCC(C)OCC(=O)NCC 7a_200011215852_100000183381 [0,1,0,0,0,0|2,0,0]=3 3618 B15R0.136 CCCCCCCC(C)OCC(=O)NCO 34a_200011215852_100000185155 [0,1,0,0,0,0|3,0,0]=4 3619 B15R0.136 CCCCCCCC(C)OCC(=O)NCO 7a_200011215852_100000185155 [0,1,0,0,0,0|3,0,0]=4 3620 B15R0.136 CCCCCCCC(C)OCC(=O)OCC 34a_200011215852_100000188475 [0,1,0,0,0,0|1,0,0]=2 3621 B15R0.136 CCCCCCCC(C)OCC(=O)OCC 7a_200011215852_100000188475 [0,1,0,0,0,0|1,0,0]=2 3622 B15R0.136 CCCCCCCC(C)SCC(=O)CCC 62a_100000747444_200011218727 [0,1,0,0,0,0|2,0,0]=3 3623 B15R0.136 CCCCCCCC(C)SCC(=O)CCC 62a_200011218727_100000747444 [0,1,0,0,0,0|2,0,0]=3 3624 B15R0.136 CCCCCCCC(C)SCC(=O)NCC 62a_100000183381_200011218727 [0,1,0,0,0,0|2,0,0]=3 3625 B15R0.136 CCCCCCCC(C)SCC(=O)NCC 62a_200011218727_100000183381 [0,1,0,0,0,0|2,0,0]=3 3626 B15R0.136 CCCCCCCC(C)SCC(=O)NCO 62a_100000185155_200011218727 [0,1,0,0,0,0|3,0,0]=4 3627 B15R0.136 CCCCCCCC(C)SCC(=O)NCO 62a_200011218727_100000185155 [0,1,0,0,0,0|3,0,0]=4 3628 B15R0.136 CCCCCCCC(C)SCC(=O)OCC 62a_100000188475_200011218727 [0,1,0,0,0,0|1,0,0]=2 3629 B15R0.136 CCCCCCCC(C)SCC(=O)OCC 62a_200011218727_100000188475 [0,1,0,0,0,0|1,0,0]=2 3630 B15R0.136 CCCCCCCN(C)CCC(=O)NCC 2230a_100000228206_100000737597 [0,1,0,0,0,0|2,0,0]=3 3631 B15R0.136 CCCCCCCN(C)CCC(=O)NCC 269982a_100000228206_100000737597 [0,1,0,0,0,0|2,0,0]=3 3632 B15R0.136 CCCCCCCN(C)CCC(=O)OCC 2230a_100000228206_100011206558 [0,1,0,0,0,0|1,0,0]=2 3633 B15R0.136 CCCCCCCN(C)CCC(=O)OCC 2230a_100000745921_100000210681 [0,1,0,0,0,0|1,0,0]=2 3634 B15R0.136 CCCCCCCN(C)CCC(=O)OCC 269982a_100000228206_100011206558 [0,1,0,0,0,0|1,0,0]=2 3635 B15R0.136 CCCCCCCN(C)CCC(=O)OCC 269982a_100000745921_100000210681 [0,1,0,0,0,0|1,0,0]=2 3636 B15R0.136 CCCCCCCN(C)COC(=O)CCC 2230a_100000228206_100000034017 [0,1,0,0,0,0|3,0,0]=4 3637 B15R0.136 CCCCCCCN(C)COC(=O)CCC 269982a_100000228206_100000034017 [0,1,0,0,0,0|3,0,0]=4 3638 B15R0.136 CCCCCCNC(=O)CCC(=O)NCC 11a_100000210581_100000199579 [0,1,0,0,0,0|2,0,1]=4 3639 B15R0.136 CCCCCCNC(=O)CCC(=O)NCC 1626a_100000210581_100000199579 [0,1,0,0,0,0|2,0,1]=4 3640 B15R0.136 CCCCCCNC(=O)CCC(=O)NCC 240690a_100000210581_100000199579 [0,1,0,0,0,0|2,0,1]=4 3641 B15R0.136 CCCCCCNC(=O)CCC(=O)OCC 11a_100000210581_100000183558 [0,1,0,0,0,0|1,0,1]=3 3642 B15R0.136 CCCCCCNC(=O)CCC(=O)OCC 1626a_100000210581_100000183558 [0,1,0,0,0,0|1,0,1]=3 3643 B15R0.136 CCCCCCNC(=O)CCC(=O)OCC 240690a_100000210581_100000183558 [0,1,0,0,0,0|1,0,1]=3 3644 B15R0.136 CCCCCCNC(=O)CNC(=O)OCC 11a_100000210581_100000190774 [0,1,0,0,0,0|2,0,1]=4 3645 B15R0.136 CCCCCCNC(=O)CNC(=O)OCC 1626a_100000210581_100000190774 [0,1,0,0,0,0|2,0,1]=4 3646 B15R0.136 CCCCCCNC(=O)CNC(=O)OCC 240690a_100000210581_100000190774 [0,1,0,0,0,0|2,0,1]=4 3647 B15R0.136 CCCCCCNC(=O)CNC(=O)OCC 527a_100000210581_100000190774 [0,1,0,0,0,0|2,0,1]=4 3648 B15R0.136 CCCCCCNC(C)CCC(=O)OCC 2230a_100000210581_100000748298 [0,1,0,0,0,0|1,0,0]=2 3649 B15R0.136 CCCCCCOC(C)CCC(=O)OCC 34a_100000210259_100000748298 [0,1,0,0,0,0|1,0,0]=2 3650 B15R0.136 CCCCCCOC(C)CCC(=O)OCC 7a_100000210259_100000748298 [0,1,0,0,0,0|1,0,0]=2 3651 B15R0.136 CCCCCCSC(C)CCC(=O)OCC 62a_100000210314_100000748298 [0,1,0,0,0,0|1,0,0]=2 3652 B15R0.136 CCCCCCSC(C)CCC(=O)OCC 62a_100000748298_100000210757 [0,1,0,0,0,0|1,0,0]=2 3653 B15R0.136 CCCCCNCC(=O)NCC(=O)OCC 2230a_100000209983_100011215850 [0,1,0,0,0,0|2,0,1]=4 3654 B15R0.136 CCCCCNN=C(C)CCC(=O)OCC 4a_100000694160_100011212338 [0,1,0,0,0,0|2,0,1]=4 3655 B15R0.136 CCCCCOCC(=O)NCC(=O)OCC 34a_100000210253_100011215850 [0,1,0,0,0,0|2,0,1]=4 3656 B15R0.136 CCCCCOCC(=O)NCC(=O)OCC 7a_100000210253_100011215850 [0,1,0,0,0,0|2,0,1]=4 3657 B15R0.136 CCCCCSCC(=O)NCC(=O)OCC 62a_100000210326_100011215850 [0,1,0,0,0,0|2,0,1]=4 3658 B15R0.136 CCCCCSCC(=O)NCC(=O)OCC 62a_100011215850_100000210326 [0,1,0,0,0,0|2,0,1]=4 3659 B15R0.136 CCCCOCCC(=O)CCC(=O)NCC 1458a_100000199579_100000743108 [0,1,0,0,0,0|2,0,1]=4 3660 B15R0.136 CCCCOCCC(=O)CCC(=O)OCC 1458a_100000183558_100000743108 [0,1,0,0,0,0|1,0,1]=3 3661 B15R0.136 CCCCOCCC(=O)CNC(=O)OCC 1458a_100000190774_100000743108 [0,1,0,0,0,0|2,0,1]=4 3662 B15R0.136 CCCCOCCN(C)CCC(=O)OCC 2230a_100000745921_100000743108 [0,1,0,0,0,0|2,0,0]=3 3663 B15R0.136 CCCCOCCN(C)CCC(=O)OCC 269982a_100000745921_100000743108 [0,1,0,0,0,0|2,0,0]=3 3664 B15R0.136 CCCCOCSC(C)CCC(=O)OCC 62a_100000748298_100011995733 [0,1,0,0,0,0|2,0,0]=3 3665 B15R0.136 CCCCOCSC(C)CCC(=O)OCC 62a_100011995733_100000748298 [0,1,0,0,0,0|2,0,0]=3 3666 B15R0.136 CCCOCCNC(=O)CCC(=O)OCC 1626a_100161115042_100000183558 [0,1,0,0,0,0|2,0,1]=4 3667 B15R0.136 CCCOCCNC(=O)CCC(=O)OCC 240690a_100161115042_100000183558 [0,1,0,0,0,0|2,0,1]=4 3668 B15R0.136 CCCOCCNC(C)CCC(=O)OCC 2230a_100161115042_100000748298 [0,1,0,0,0,0|2,0,0]=3 3669 B15R0.136 CCCOCCNC(C)CCC(=O)OCC 34a_100161115042_100000748298 [0,1,0,0,0,0|2,0,0]=3 3670 B15R0.136 CCCOCCOC(C)CCC(=O)OCC 34a_100000752267_100000748298 [0,1,0,0,0,0|2,0,0]=3 3671 B15R0.136 CCCOCCOC(C)CCC(=O)OCC 7a_100000752267_100000748298 [0,1,0,0,0,0|2,0,0]=3 3672 B15R0.136 CCCOCCSC(C)CCC(=O)OCC 62a_100000748298_100011215938 [0,1,0,0,0,0|2,0,0]=3 3673 B15R0.136 CCCOCCSC(C)CCC(=O)OCC 62a_100011215938_100000748298 [0,1,0,0,0,0|2,0,0]=3 3674 B15R0.136 CCCSCCNC(=O)CCC(=O)OCC 11a_100020603323_100000183558 [0,1,0,0,0,0|2,0,1]=4 3675 B15R0.136 CCCSCCNC(=O)CCC(=O)OCC 240690a_100020603323_100000183558 [0,1,0,0,0,0|2,0,1]=4 3676 B15R0.136 CCCSCCNC(C)CCC(=O)OCC 2230a_100020603323_100000748298 [0,1,0,0,0,0|2,0,0]=3 3677 B15R0.136 CCCSCCOC(C)CCC(=O)OCC 34a_200000230433_100000748298 [0,1,0,0,0,0|2,0,0]=3 3678 B15R0.136 CCCSCCOC(C)CCC(=O)OCC 7a_200000230433_100000748298 [0,1,0,0,0,0|2,0,0]=3 3679 B15R0.136 CCNC(=O)CCC(=O)CCCCCCF 1458a_100000199579_100015922095 [0,1,0,0,0,0|2,0,1]=4 3680 B15R0.136 CCNC(=O)CCC(=O)CCCCCCO 1458a_100000199579_100000766143 [0,1,0,0,0,0|2,0,1]=4 3681 B15R0.136 CCOC(=O)CCC(=O)CCCCCC#N 1458a_100000183558_100009813376 [0,1,0,0,0,0|1,0,2]=4 3682 B15R0.136 CCOC(=O)CCC(=O)CCCCCCF 1458a_100000183558_100015922095 [0,1,0,0,0,0|1,0,1]=3 3683 B15R0.136 CCOC(=O)CCC(=O)CCCCCCO 1458a_100000183558_100000766143 [0,1,0,0,0,0|1,0,1]=3 3684 B15R0.136 CCOC(=O)CCC(=O)CCOCCOC 1458a_100000183558_100000695917 [0,1,0,0,0,0|2,0,1]=4 3685 B15R0.136 CCOC(=O)CCC(=O)NCCCCCO 240690a_100000762737_100000183558 [0,1,0,0,0,0|2,0,1]=4 3686 B15R0.136 CCOC(=O)CCC(C)NCCCCCO 2230a_100000762737_100000748298 [0,1,0,0,0,0|2,0,0]=3 3687 B15R0.136 CCOC(=O)CCC(C)NCCCCCO 34a_100000762737_100000748298 [0,1,0,0,0,0|2,0,0]=3 3688 B15R0.136 CCOC(=O)CCC(C)NCCOCCO 2230a_100000211614_100000748298 [0,1,0,0,0,0|3,0,0]=4 3689 B15R0.136 CCOC(=O)CCC(C)NCCOCCO 34a_100000211614_100000748298 [0,1,0,0,0,0|3,0,0]=4 3690 B15R0.136 CCOC(=O)CCC(C)NCCSCCO 2230a_100011219999_100000748298 [0,1,0,0,0,0|3,0,0]=4 3691 B15R0.136 CCOC(=O)CCC(C)OCCCCCBr 34a_100000746331_100000748298 [0,1,0,0,0,0|2,0,0]=3 3692 B15R0.136 CCOC(=O)CCC(C)OCCCCCBr 7a_100000746331_100000748298 [0,1,0,0,0,0|2,0,0]=3 3693 B15R0.136 CCOC(=O)CCC(C)OCCCCCCl 34a_100000746330_100000748298 [0,1,0,0,0,0|2,0,0]=3 3694 B15R0.136 CCOC(=O)CCC(C)OCCCCCCl 7a_100000746330_100000748298 [0,1,0,0,0,0|2,0,0]=3 3695 B15R0.136 CCOC(=O)CCC(C)OCCCCCI 34a_200012148887_100000748298 [0,1,0,0,0,0|2,0,0]=3 3696 B15R0.136 CCOC(=O)CCC(C)OCCCCCI 7a_200012148887_100000748298 [0,1,0,0,0,0|2,0,0]=3 3697 B15R0.136 CCOC(=O)CCC(C)OCCCCCN 34a_100000762737_100000748298 [0,1,0,0,0,0|2,0,0]=3 3698 B15R0.136 CCOC(=O)CCC(C)OCCCCOC 34a_100000740925_100000748298 [0,1,0,0,0,0|2,0,0]=3 3699 B15R0.136 CCOC(=O)CCC(C)OCCCCSC 34a_100011217163_100000748298 [0,1,0,0,0,0|2,0,0]=3 3700 B15R0.136 CCOC(=O)CCC(C)OCCCCSC 7a_100011217163_100000748298 [0,1,0,0,0,0|2,0,0]=3 3701 B15R0.136 CCOC(=O)CCC(C)OCCCSCC 34a_100011216438_100000748298 [0,1,0,0,0,0|2,0,0]=3 3702 B15R0.136 CCOC(=O)CCC(C)OCCCSCC 7a_100011216438_100000748298 [0,1,0,0,0,0|2,0,0]=3 3703 B15R0.136 CCOC(=O)CCC(C)OCCOCCBr 34a_100000692535_100000748298 [0,1,0,0,0,0|3,0,0]=4 3704 B15R0.136 CCOC(=O)CCC(C)OCCOCCBr 7a_100000692535_100000748298 [0,1,0,0,0,0|3,0,0]=4 3705 B15R0.136 CCOC(=O)CCC(C)OCCOCCCl 34a_100011215305_100000748298 [0,1,0,0,0,0|3,0,0]=4 3706 B15R0.136 CCOC(=O)CCC(C)OCCOCCCl 7a_100011215305_100000748298 [0,1,0,0,0,0|3,0,0]=4 3707 B15R0.136 CCOC(=O)CCC(C)OCCOCCF 34a_200015357709_100000748298 [0,1,0,0,0,0|3,0,0]=4 3708 B15R0.136 CCOC(=O)CCC(C)OCCOCCF 7a_200015357709_100000748298 [0,1,0,0,0,0|3,0,0]=4 3709 B15R0.136 CCOC(=O)CCC(C)OCCOCCI 34a_100012149058_100000748298 [0,1,0,0,0,0|3,0,0]=4 3710 B15R0.136 CCOC(=O)CCC(C)OCCOCCI 7a_100012149058_100000748298 [0,1,0,0,0,0|3,0,0]=4 3711 B15R0.136 CCOC(=O)CCC(C)OCCOCCN 34a_100000211614_100000748298 [0,1,0,0,0,0|3,0,0]=4 3712 B15R0.136 CCOC(=O)CCC(C)SCCCCC#N 62a_100000748298_100000211819 [0,1,0,0,0,0|2,0,1]=4 3713 B15R0.136 CCOC(=O)CCC(C)SCCCCC#N 62a_100011219923_100000748298 [0,1,0,0,0,0|2,0,1]=4 3714 B15R0.136 CCOC(=O)CCC(C)SCCCCC=O 62a_100000139335_100000748298 [0,1,0,0,0,0|2,0,1]=4 3715 B15R0.136 CCOC(=O)CCC(C)SCCCCC=O 62a_100000748298_100000139335 [0,1,0,0,0,0|2,0,1]=4 3716 B15R0.136 CCOC(=O)CCC(C)SCCCCCF 62a_100000729378_100000748298 [0,1,0,0,0,0|2,0,0]=3 3717 B15R0.136 CCOC(=O)CCC(C)SCCCCCF 62a_100000748298_100000729378 [0,1,0,0,0,0|2,0,0]=3 3718 B15R0.136 CCOC(=O)CCC(C)SCCCCCO 62a_100000746330_100000748298 [0,1,0,0,0,0|2,0,0]=3 3719 B15R0.136 CCOC(=O)CCC(C)SCCCCCO 62a_100000748298_100000746330 [0,1,0,0,0,0|2,0,0]=3 3720 B15R0.136 CCOC(=O)CCC(C)SCCCCOC 62a_100000730899_100000748298 [0,1,0,0,0,0|2,0,0]=3 3721 B15R0.136 CCOC(=O)CCC(C)SCCCCOC 62a_100000748298_100000730899 [0,1,0,0,0,0|2,0,0]=3 3722 B15R0.136 CCOC(=O)CCC(C)SCCOCCO 62a_100000748298_100011215305 [0,1,0,0,0,0|3,0,0]=4 3723 B15R0.136 CCOC(=O)CCC(C)SCCOCCO 62a_100011215305_100000748298 [0,1,0,0,0,0|3,0,0]=4 3724 B15R0.136 CCOC(=O)CCC(C)SCOCCOC 62a_100000231047_100000748298 [0,1,0,0,0,0|3,0,0]=4 3725 B15R0.136 CCOC(=O)CCC(C)SCOCCOC 62a_100000748298_100000231047 [0,1,0,0,0,0|3,0,0]=4 3726 B15R0.136 CCOC(=O)CCN(C)CCCCCC#N 2230a_100000745921_100009813376 [0,1,0,0,0,0|2,0,1]=4 3727 B15R0.136 CCOC(=O)CCN(C)CCCCCC#N 269982a_100000745921_100009813376 [0,1,0,0,0,0|2,0,1]=4 3728 B15R0.136 CCOC(=O)CCN(C)CCCCCC=O 2230a_100000745921_100000139337 [0,1,0,0,0,0|2,0,1]=4 3729 B15R0.136 CCOC(=O)CCN(C)CCCCCC=O 269982a_100000745921_100000139337 [0,1,0,0,0,0|2,0,1]=4 3730 B15R0.136 CCOC(=O)CCN(C)CCCCCCF 2230a_100000745921_100015922095 [0,1,0,0,0,0|2,0,0]=3 3731 B15R0.136 CCOC(=O)CCN(C)CCCCCCF 269982a_100000745921_100015922095 [0,1,0,0,0,0|2,0,0]=3 3732 B15R0.136 CCOC(=O)CCN(C)CCCCCCO 2230a_100000745921_100000766143 [0,1,0,0,0,0|2,0,0]=3 3733 B15R0.136 CCOC(=O)CCN(C)CCCCCCO 269982a_100000745921_100000766143 [0,1,0,0,0,0|2,0,0]=3 3734 B15R0.136 CCOC(=O)CCN(C)CCOCCOC 2230a_100000745921_100000695917 [0,1,0,0,0,0|3,0,0]=4 3735 B15R0.136 CCOC(=O)CCN(C)CCOCCOC 269982a_100000745921_100000695917 [0,1,0,0,0,0|3,0,0]=4 3736 B15R0.136 CCOC(=O)CNC(=O)CCCCCCO 188690a_100000741813_100011996774 [0,1,0,0,0,0|2,0,1]=4 3737 B15R0.136 CCOC(=O)CNC(=O)CCCCCOC 188690a_100000741813_100011935119 [0,1,0,0,0,0|2,0,1]=4 3738 B15R0.136 CCOC(=O)NCC(=O)CCCCCCF 1458a_100000190774_100015922095 [0,1,0,0,0,0|2,0,1]=4 3739 B15R0.136 CCOC(=O)NCC(=O)CCCCCCO 1458a_100000190774_100000766143 [0,1,0,0,0,0|2,0,1]=4 3740 B15R0.136 CCOCCCNC(=O)CCC(=O)OCC 11a_100000210961_100000183558 [0,1,0,0,0,0|2,0,1]=4 3741 B15R0.136 CCOCCCNC(=O)CCC(=O)OCC 1626a_100000210961_100000183558 [0,1,0,0,0,0|2,0,1]=4 3742 B15R0.136 CCOCCCNC(=O)CCC(=O)OCC 240690a_100000210961_100000183558 [0,1,0,0,0,0|2,0,1]=4 3743 B15R0.136 CCOCCCNC(C)CCC(=O)OCC 2230a_100000210961_100000748298 [0,1,0,0,0,0|2,0,0]=3 3744 B15R0.136 CCOCCCNC(C)CCC(=O)OCC 34a_100000210961_100000748298 [0,1,0,0,0,0|2,0,0]=3 3745 B15R0.136 CCOCCCOC(C)CCC(=O)OCC 34a_100000757476_100000748298 [0,1,0,0,0,0|2,0,0]=3 3746 B15R0.136 CCOCCCOC(C)CCC(=O)OCC 7a_100000757476_100000748298 [0,1,0,0,0,0|2,0,0]=3 3747 B15R0.136 CCOCCCSC(C)CCC(=O)OCC 62a_100000748298_100012232248 [0,1,0,0,0,0|2,0,0]=3 3748 B15R0.136 CCOCCCSC(C)CCC(=O)OCC 62a_100012232248_100000748298 [0,1,0,0,0,0|2,0,0]=3 3749 B15R0.244 C#CCCCC(=O)CCCCC(=O)OCC 1458a_100000690238_100000750268 [0,1,0,0,0,0|0,0,3]=4 3750 B15R0.244 C#CCCCC(=O)CCCCC(=O)OCC 1458a_100011217402_100000731252 [0,1,0,0,0,0|0,0,3]=4 3751 B15R0.244 C=CCCCC(=O)CCCCC(=O)OCC 1458a_100000766728_100000750268 [0,1,0,0,0,0|0,0,3]=4 3752 B15R0.244 C=CCCCC(=O)CCCCC(=O)OCC 1458a_100011217402_100000757094 [0,1,0,0,0,0|0,0,3]=4 3753 B15R0.244 CC/C=C/CC(=O)CCCCC(=O)OCC 1458a_100016274230_100000750268 [0,1,0,0,0,0|0,0,3]=4 3754 B15R0.244 CC/C=C\CC(=O)CCCCC(=O)OCC 1458a_100011217402_100103147603 [0,1,0,0,0,0|0,0,3]=4 3755 B15R0.244 CCC#CCC(=O)CCCCC(=O)OCC 1458a_100011217402_100009813939 [0,1,0,0,0,0|0,0,3]=4 3756 B15R0.244 CCC#CCC(C)OCCCC(=O)OCC 34a_200000035118_100009991533 [0,1,0,0,0,0|1,0,2]=4 3757 B15R0.244 CCC#CCC(C)OCCCC(=O)OCC 7a_200000035118_100011215271 [0,1,0,0,0,0|1,0,2]=4 3758 B15R0.244 CCCC#CC(=O)CCCCC(=O)OCC 1458a_200011218047_100000750268 [0,1,0,0,0,0|0,0,3]=4 3759 B15R0.244 CCCC=CC(=O)CCCCC(=O)OCC 1458a_100000212230_100000750268 [0,1,0,0,0,0|0,0,3]=4 3760 B15R0.244 CCCCCC(=O)CCCCC(=O)OCC 1458a_100000212188_100000750268 [0,1,0,0,0,0|0,0,1]=2 3761 B15R0.244 CCCCCC(=O)CCCCC(=O)OCC 1458a_100011217402_100000210326 [0,1,0,0,0,0|0,0,1]=2 3762 B15R0.244 CCCCCC(=O)CCOCC(=O)OCC 1458a_100000212188_100000088970 [0,1,0,0,0,0|1,0,1]=3 3763 B15R0.244 CCCCCC(=O)CNCCC(=O)NCC 34a_100025743525_200012276598 [0,1,0,0,0,0|2,0,1]=4 3764 B15R0.244 CCCCCC(=O)CSCCC(=O)NCC 62a_100000737597_200012276598 [0,1,0,0,0,0|2,0,1]=4 3765 B15R0.244 CCCCCC(=O)CSCCC(=O)NCC 62a_200012276598_100000737597 [0,1,0,0,0,0|2,0,1]=4 3766 B15R0.244 CCCCCC(=O)CSCCC(=O)OCC 62a_100000765890_200012276598 [0,1,0,0,0,0|1,0,1]=3 3767 B15R0.244 CCCCCC(=O)CSCCC(=O)OCC 62a_200012276598_100000765890 [0,1,0,0,0,0|1,0,1]=3 3768 B15R0.244 CCCCCC(=O)CSCOC(=O)OCC 62a_200012276598_100000075025 [0,1,0,0,0,0|2,0,1]=4 3769 B15R0.244 CCCCCC(=O)NCCCC(=O)OCC 188690a_100000211256_100000212188 [0,1,0,0,0,0|1,0,1]=3 3770 B15R0.244 CCCCCC(C)NC/C=C/C(=O)OCC 2230a_100000211957_100016267167 [0,1,0,0,0,0|1,0,2]=4 3771 B15R0.244 CCCCCC(C)NCCCC(=O)OCC 2230a_100000211957_100009991533 [0,1,0,0,0,0|1,0,0]=2 3772 B15R0.244 CCCCCC(C)OC/C=C/C(=O)OCC 34a_100011215632_100016267167 [0,1,0,0,0,0|1,0,2]=4 3773 B15R0.244 CCCCCC(C)OC/C=C/C(=O)OCC 7a_100011215632_100016267167 [0,1,0,0,0,0|1,0,2]=4 3774 B15R0.244 CCCCCC(C)OCCCC(=O)OCC 34a_100011215632_100009991533 [0,1,0,0,0,0|1,0,0]=2 3775 B15R0.244 CCCCCC(C)OCCCC(=O)OCC 7a_100011215632_100011215271 [0,1,0,0,0,0|1,0,0]=2 3776 B15R0.244 CCCCCC(C)OCCCC(=O)OCC 7a_100012001163_200011218191 [0,1,0,0,0,0|1,0,0]=2 3777 B15R0.244 CCCCCC(C)OCCNC(=O)OCC 34a_100000158857_200011218191 [0,1,0,0,0,0|2,0,0]=3 3778 B15R0.244 CCCCCC(C)OCCNC(=O)OCC 7a_100011215632_200011445536 [0,1,0,0,0,0|2,0,0]=3 3779 B15R0.244 CCCCCC(C)SC/C=C/C(=O)OCC 62a_100016267167_200011218191 [0,1,0,0,0,0|1,0,2]=4 3780 B15R0.244 CCCCCC(C)SC/C=C/C(=O)OCC 62a_200011218191_100016267167 [0,1,0,0,0,0|1,0,2]=4 3781 B15R0.244 CCCCCC(C)SCCCC(=O)OCC 62a_100009991533_200011218191 [0,1,0,0,0,0|1,0,0]=2 3782 B15R0.244 CCCCCC(C)SCCCC(=O)OCC 62a_200011218191_100009991533 [0,1,0,0,0,0|1,0,0]=2 3783 B15R0.244 CCCCCC(C)SCCNC(=O)OCC 62a_200011218191_200011445536 [0,1,0,0,0,0|2,0,0]=3 3784 B15R0.244 CCCCCN(C)CCCCC(=O)OCC 2230a_100000223495_100000750268 [0,1,0,0,0,0|1,0,0]=2 3785 B15R0.244 CCCCCN(C)CCCCC(=O)OCC 269982a_100000223495_100000750268 [0,1,0,0,0,0|1,0,0]=2 3786 B15R0.244 CCCCCN(C)CCOCC(=O)OCC 2230a_100000223495_100000088970 [0,1,0,0,0,0|2,0,0]=3 3787 B15R0.244 CCCCCN(C)CCOCC(=O)OCC 269982a_100000223495_100000088970 [0,1,0,0,0,0|2,0,0]=3 3788 B15R0.244 CCCCNC(=O)CCCCC(=O)OCC 11a_100000102301_100011217402 [0,1,0,0,0,0|1,0,1]=3 3789 B15R0.244 CCCCNC(=O)CCCCC(=O)OCC 1626a_100000102301_100011217402 [0,1,0,0,0,0|1,0,1]=3 3790 B15R0.244 CCCCNC(=O)CCCCC(=O)OCC 240690a_100000102301_100011217402 [0,1,0,0,0,0|1,0,1]=3 3791 B15R0.244 CCCCNC(=O)CCCCC(=O)OCC 527a_100000102301_100011217402 [0,1,0,0,0,0|1,0,1]=3 3792 B15R0.244 CCCCNC(=O)CSCCC(=O)OCC 62a_100000182744_100000765890 [0,1,0,0,0,0|2,0,1]=4 3793 B15R0.244 CCCCNC(=O)CSCCC(=O)OCC 62a_100000765890_100000182744 [0,1,0,0,0,0|2,0,1]=4 3794 B15R0.244 CCCCOC(=O)CSCCC(=O)OCC 62a_100000211628_100000765890 [0,1,0,0,0,0|2,0,1]=4 3795 B15R0.244 CCCCOC(=O)CSCCC(=O)OCC 62a_100000765890_100000211628 [0,1,0,0,0,0|2,0,1]=4 3796 B15R0.244 CCCNNC(=O)CCCCC(=O)OCC 22a_100000740057_100011217402 [0,1,0,0,0,0|2,0,1]=4 3797 B15R0.244 CCCOCC(=O)CCCCC(=O)OCC 1458a_100000745993_100000750268 [0,1,0,0,0,0|1,0,1]=3 3798 B15R0.244 CCCOCC(=O)CCOCC(=O)OCC 1458a_100000745993_100000088970 [0,1,0,0,0,0|2,0,1]=4 3799 B15R0.244 CCCOCC(=O)NCCCC(=O)OCC 188690a_100000211256_100000745993 [0,1,0,0,0,0|2,0,1]=4 3800 B15R0.244 CCCOCC(=O)NCCCC(=O)OCC 34a_100000210258_100000183181 [0,1,0,0,0,0|2,0,1]=4 3801 B15R0.244 CCCSCC(=O)CCCCC(=O)OCC 1458a_100000217233_100000750268 [0,1,0,0,0,0|1,0,1]=3 3802 B15R0.244 CCCSCC(=O)CCOCC(=O)OCC 1458a_100000217233_100000088970 [0,1,0,0,0,0|2,0,1]=4 3803 B15R0.244 CCCSCC(=O)NCCCC(=O)OCC 188690a_100000211256_100000217233 [0,1,0,0,0,0|2,0,1]=4 3804 B15R0.244 CCCSCC(=O)NCCCC(=O)OCC 62a_100000183181_100000210303 [0,1,0,0,0,0|2,0,1]=4 3805 B15R0.244 CCCSCC(=O)NCCCC(=O)OCC 62a_100000210303_100000183181 [0,1,0,0,0,0|2,0,1]=4 3806 B15R0.244 CCOC(=O)CCCCC(=O)CCCC#N 1458a_100000075515_100000750268 [0,1,0,0,0,0|1,0,2]=4 3807 B15R0.244 CCOC(=O)CCCCC(=O)CCCC#N 1458a_100011217402_100000211468 [0,1,0,0,0,0|1,0,2]=4 3808 B15R0.244 CCOC(=O)CCCCC(=O)CCCCF 1458a_100011217402_100000729493 [0,1,0,0,0,0|1,0,1]=3 3809 B15R0.244 CCOC(=O)CCCCC(=O)CCCCO 1458a_100000695505_100000750268 [0,1,0,0,0,0|1,0,1]=3 3810 B15R0.244 CCOC(=O)CCCCC(=O)CCCCO 1458a_100011217402_100000210776 [0,1,0,0,0,0|1,0,1]=3 3811 B15R0.244 CCOC(=O)CCCCC(=O)CCCOC 1458a_100000741012_100000750268 [0,1,0,0,0,0|1,0,1]=3 3812 B15R0.244 CCOC(=O)CCCCC(=O)CCCOC 1458a_100011217402_100000740836 [0,1,0,0,0,0|1,0,1]=3 3813 B15R0.244 CCOC(=O)CCCCC(=O)CCCSC 1458a_100000173376_100000750268 [0,1,0,0,0,0|1,0,1]=3 3814 B15R0.244 CCOC(=O)CCCCC(=O)CCSCC 1458a_100000230768_100000750268 [0,1,0,0,0,0|1,0,1]=3 3815 B15R0.244 CCOC(=O)CCCCC(=O)CCSCC 1458a_100011217402_100000757381 [0,1,0,0,0,0|1,0,1]=3 3816 B15R0.244 CCOC(=O)CCCCC(=O)COCCO 1458a_100000708028_100000750268 [0,1,0,0,0,0|2,0,1]=4 3817 B15R0.244 CCOC(=O)CCCCC(=O)NCCCF 11a_100015189416_100011217402 [0,1,0,0,0,0|2,0,1]=4 3818 B15R0.244 CCOC(=O)CCCCC(=O)NCCCF 1626a_100015189416_100011217402 [0,1,0,0,0,0|2,0,1]=4 3819 B15R0.244 CCOC(=O)CCCCC(=O)NCCCF 240690a_100015189416_100011217402 [0,1,0,0,0,0|2,0,1]=4 3820 B15R0.244 CCOC(=O)CCCCC(=O)NCCCF 527a_100015189416_100011217402 [0,1,0,0,0,0|2,0,1]=4 3821 B15R0.244 CCOC(=O)CCCCC(=O)NCCCO 240690a_100000182051_100011217402 [0,1,0,0,0,0|2,0,1]=4 3822 B15R0.244 CCOC(=O)CCCCC(=O)NCCCO 527a_100000182051_100011217402 [0,1,0,0,0,0|2,0,1]=4 3823 B15R0.244 CCOC(=O)CCCCC(=O)NCCOC 1626a_100000209980_100011217402 [0,1,0,0,0,0|2,0,1]=4 3824 B15R0.244 CCOC(=O)CCCCC(=O)NCCOC 240690a_100000209980_100011217402 [0,1,0,0,0,0|2,0,1]=4 3825 B15R0.244 CCOC(=O)CCCCC(=O)NCCOC 527a_100000209980_100011217402 [0,1,0,0,0,0|2,0,1]=4 3826 B15R0.244 CCOC(=O)CCCCC(=O)NCCSC 11a_100020590264_100011217402 [0,1,0,0,0,0|2,0,1]=4 3827 B15R0.244 CCOC(=O)CCCCC(=O)NCCSC 1626a_100020590264_100011217402 [0,1,0,0,0,0|2,0,1]=4 3828 B15R0.244 CCOC(=O)CCCCC(=O)NCCSC 240690a_100020590264_100011217402 [0,1,0,0,0,0|2,0,1]=4 3829 B15R0.244 CCOC(=O)CCCCC(=O)NCCSC 527a_100020590264_100011217402 [0,1,0,0,0,0|2,0,1]=4 3830 B15R0.244 CCOC(=O)CCCCN(C)CCCCO 2230a_100000717598_100000750268 [0,1,0,0,0,0|2,0,0]=3 3831 B15R0.244 CCOC(=O)CCCCN(C)CCCCO 269982a_100000717598_100000750268 [0,1,0,0,0,0|2,0,0]=3 3832 B15R0.244 CCOC(=O)CCCCN(C)CCCOC 2230a_100000224831_100000750268 [0,1,0,0,0,0|2,0,0]=3 3833 B15R0.244 CCOC(=O)CCCCN(C)CCCOC 269982a_100000224831_100000750268 [0,1,0,0,0,0|2,0,0]=3 3834 B15R0.244 CCOC(=O)CCCNC(=O)CCCCO 188690a_100000211256_100000695505 [0,1,0,0,0,0|2,0,1]=4 3835 B15R0.244 CCOC(=O)CCCNC(=O)CCCOC 188690a_100000211256_100000741012 [0,1,0,0,0,0|2,0,1]=4 3836 B15R0.244 CCOC(=O)CCCNC(=O)CCCSC 188690a_100000211256_100000173376 [0,1,0,0,0,0|2,0,1]=4 3837 B15R0.244 CCOC(=O)CCCNC(=O)CCSCC 188690a_100000211256_100000230768 [0,1,0,0,0,0|2,0,1]=4 3838 B15R0.244 CCOC(=O)CCCOC(C)CCCOC 34a_200011539412_100009991533 [0,1,0,0,0,0|2,0,0]=3 3839 B15R0.244 CCOC(=O)CCCOC(C)CCCOC 7a_200011539412_100011215271 [0,1,0,0,0,0|2,0,0]=3 3840 B15R0.244 CCOC(=O)CCOC[C@@H](N)CCCCN 34a_100016993712_100000765890 [0,1,0,0,0,0|2,0,0]=3 3841 B15R0.244 CCOC(=O)COCCC(=O)CCCCO 1458a_100000695505_100000088970 [0,1,0,0,0,0|2,0,1]=4 3842 B15R0.244 CCOC(=O)COCCC(=O)CCCOC 1458a_100000741012_100000088970 [0,1,0,0,0,0|2,0,1]=4 3843 B15R0.244 CCOC(=O)COCCC(=O)CCCSC 1458a_100000173376_100000088970 [0,1,0,0,0,0|2,0,1]=4 3844 B15R0.244 CCOC(=O)COCCC(=O)CCSCC 1458a_100000230768_100000088970 [0,1,0,0,0,0|2,0,1]=4 3845 B15R0.244 CCOC(=O)COCCN(C)CCCCO 2230a_100000717598_100000088970 [0,1,0,0,0,0|3,0,0]=4 3846 B15R0.244 CCOC(=O)COCCN(C)CCCCO 269982a_100000717598_100000088970 [0,1,0,0,0,0|3,0,0]=4 3847 B15R0.244 CCOC(=O)COCCN(C)CCCOC 2230a_100000224831_100000088970 [0,1,0,0,0,0|3,0,0]=4 3848 B15R0.244 CCOC(=O)COCCN(C)CCCOC 269982a_100000224831_100000088970 [0,1,0,0,0,0|3,0,0]=4 3849 B15R0.244 CCOC(=O)NCCOC(C)CCCOC 7a_200011539412_200011445536 [0,1,0,0,0,0|3,0,0]=4 3850 B15R0.244 CCOCCC(=O)CCCCC(=O)OCC 1458a_100000749530_100000750268 [0,1,0,0,0,0|1,0,1]=3 3851 B15R0.244 CCOCCC(=O)CCCCC(=O)OCC 1458a_100011217402_100011215890 [0,1,0,0,0,0|1,0,1]=3 3852 B15R0.244 CCOCCC(=O)CCOCC(=O)OCC 1458a_100000749530_100000088970 [0,1,0,0,0,0|2,0,1]=4 3853 B15R0.244 CCOCCC(=O)NCCCC(=O)OCC 188690a_100000211256_100000749530 [0,1,0,0,0,0|2,0,1]=4 3854 B15R0.324 C#CC(C)C(=O)CCCCCCCCCC 1458a_100000210375_200000035995 [0,1,0,0,0,0|1,0,2]=4 3855 B15R0.324 C#CCCCCCCCCC(=O)C(C)CC 1458a_100000029693_100000758301 [0,1,0,0,0,0|1,0,2]=4 3856 B15R0.324 C#CCCCCCCCCC(=O)N(C)CC 11a_100000225621_100000029693 [0,1,0,0,0,0|1,0,2]=4 3857 B15R0.324 C#CCCCCCCCCC(=O)N(C)CC 1626a_100000225621_100000029693 [0,1,0,0,0,0|1,0,2]=4 3858 B15R0.324 C#CCCCCCCCCC(=O)N(C)CC 240690a_100000225621_100000029693 [0,1,0,0,0,0|1,0,2]=4 3859 B15R0.324 C#CCCCCCCCCC(=O)N(C)CC 527a_100000225621_100000029693 [0,1,0,0,0,0|1,0,2]=4 3860 B15R0.324 C/C=C(\C)/C(=O)CCCCCCCCCO 1458a_100020587367_100009813782 [0,1,0,0,0,0|2,0,1]=4 3861 B15R0.324 C/C=C(\C)/C(=O)NCCCCCCCCC 11a_100000212291_100020587367 [0,1,0,0,0,0|2,0,1]=4 3862 B15R0.324 C/C=C(\C)/C(=O)NCCCCCCCCC 1626a_100000212291_100020587367 [0,1,0,0,0,0|2,0,1]=4 3863 B15R0.324 C=CC(C)C(=O)CCCCCCCCCC 1458a_100011216780_100000210319 [0,1,0,0,0,0|1,0,2]=4 3864 B15R0.324 C=CCCCCCCCCC(=O)C(C)CC 1458a_100000211349_100000758301 [0,1,0,0,0,0|1,0,2]=4 3865 B15R0.324 C=CCCCCCCCCC(=O)C(C)CC 1458a_100011192722_100011933949 [0,1,0,0,0,0|1,0,2]=4 3866 B15R0.324 C=CCCCCCCCCC(=O)C(O)CC 1458a_100011196387_100011933949 [0,1,0,0,0,0|1,0,2]=4 3867 B15R0.324 C=CCCCCCCCCC(=O)N(C)CC 11a_100000225621_100000211349 [0,1,0,0,0,0|1,0,2]=4 3868 B15R0.324 C=CCCCCCCCCC(=O)N(C)CC 1626a_100000225621_100000211349 [0,1,0,0,0,0|1,0,2]=4 3869 B15R0.324 C=CCCCCCCCCC(=O)N(C)CC 240690a_100000225621_100000211349 [0,1,0,0,0,0|1,0,2]=4 3870 B15R0.324 C=CCCCCCCCCC(=O)N(C)CC 527a_100000225621_100000211349 [0,1,0,0,0,0|1,0,2]=4 3871 B15R0.324 CC#CCCCCCCCC(=O)C(C)CC 1458a_100000066323_100000758301 [0,1,0,0,0,0|1,0,2]=4 3872 B15R0.324 CC#CCCCCCCCC(=O)N(C)CC 11a_100000225621_100000066323 [0,1,0,0,0,0|1,0,2]=4 3873 B15R0.324 CC#CCCCCCCCC(=O)N(C)CC 1626a_100000225621_100000066323 [0,1,0,0,0,0|1,0,2]=4 3874 B15R0.324 CC#CCCCCCCCC(=O)N(C)CC 240690a_100000225621_100000066323 [0,1,0,0,0,0|1,0,2]=4 3875 B15R0.324 CC#CCCCCCCCC(=O)N(C)CC 527a_100000225621_100000066323 [0,1,0,0,0,0|1,0,2]=4 3876 B15R0.324 CCC#CCCCCCCC(=O)C(C)CC 1458a_100011192722_200000036426 [0,1,0,0,0,0|1,0,2]=4 3877 B15R0.324 CCC#CCCCCCCC(=O)C(O)CC 1458a_100011196387_200000036426 [0,1,0,0,0,0|1,0,2]=4 3878 B15R0.324 CCC(C)C(=O)CCCCCCCCCF 1458a_200009909015_100000758301 [0,1,0,0,0,0|2,0,0]=3 3879 B15R0.324 CCC(C)C(=O)CCCCCCCCCO 1458a_100011192722_100009813782 [0,1,0,0,0,0|2,0,0]=3 3880 B15R0.324 CCC(C)C(=O)NCCCCCCCCO 240690a_102515433106_100011192722 [0,1,0,0,0,0|3,0,0]=4 3881 B15R0.324 CCC(O)C(=O)CCCCCCCCCO 1458a_100011196387_100009813782 [0,1,0,0,0,0|2,0,0]=3 3882 B15R0.324 CCC(O)C(=O)NCCCCCCCCO 240690a_102515433106_100011196387 [0,1,0,0,0,0|3,0,0]=4 3883 B15R0.324 CCCCCCCCC=CC(=O)C(C)CC 1458a_100015345288_100000758301 [0,1,0,0,0,0|1,0,2]=4 3884 B15R0.324 CCCCCCCCC=CC(=O)N(C)CC 11a_100000225621_100015345288 [0,1,0,0,0,0|1,0,2]=4 3885 B15R0.324 CCCCCCCCC=CC(=O)N(C)CC 1626a_100000225621_100015345288 [0,1,0,0,0,0|1,0,2]=4 3886 B15R0.324 CCCCCCCCC=CC(=O)N(C)CC 240690a_100000225621_100015345288 [0,1,0,0,0,0|1,0,2]=4 3887 B15R0.324 CCCCCCCCCCC(=O)C(=O)NC 1458a_100011218921_100000210319 [0,1,0,0,0,0|2,0,0]=3 3888 B15R0.324 CCCCCCCCCCC(=O)C(C)C#N 1458a_100000210375_100000703298 [0,1,0,0,0,0|2,0,1]=4 3889 B15R0.324 CCCCCCCCCCC(=O)C(C)C#N 1458a_100000753662_100000210319 [0,1,0,0,0,0|2,0,1]=4 3890 B15R0.324 CCCCCCCCCCC(=O)C(C)OC 1458a_100000743197_100000210319 [0,1,0,0,0,0|2,0,0]=3 3891 B15R0.324 CCCCCCCCCCC(=O)C(C)SC 1458a_100000149566_100000210319 [0,1,0,0,0,0|2,0,0]=3 3892 B15R0.324 CCCCCCCCCCC(=O)C(O)CC 1458a_100011196387_100000210319 [0,1,0,0,0,0|1,0,0]=2 3893 B15R0.324 CCCCCCCCCCC(=O)C(O)CO 1458a_100011215603_100000210319 [0,1,0,0,0,0|2,0,0]=3 3894 B15R0.324 CCCCCCCCCCC(=O)N(C)CC 11a_100000225621_100000210375 [0,1,0,0,0,0|1,0,0]=2 3895 B15R0.324 CCCCCCCCCCC(=O)N(C)CC 1626a_100000225621_100000210375 [0,1,0,0,0,0|1,0,0]=2 3896 B15R0.324 CCCCCCCCCCC(=O)N(C)CC 240690a_100000225621_100000210375 [0,1,0,0,0,0|1,0,0]=2 3897 B15R0.324 CCCCCCCCCCN(C)C(=O)CC 11a_100000207566_100000210414 [0,1,0,0,0,0|3,0,0]=4 3898 B15R0.324 CCCCCCCCCCN(C)C(=O)CC 1626a_100000207566_100000210414 [0,1,0,0,0,0|3,0,0]=4 3899 B15R0.324 CCCCCCCCCCN(C)C(=O)CC 240690a_100000207566_100000210414 [0,1,0,0,0,0|3,0,0]=4 3900 B15R0.324 CCCCCCCCCCN(C)C(=O)CC 527a_100000207566_100000210414 [0,1,0,0,0,0|3,0,0]=4 3901 B15R0.324 CCCCCCCCCCN(C)C(C)CC 2230a_100000207566_100000758301 [0,1,0,0,0,0|3,0,0]=4 3902 B15R0.324 CCCCCCCCCCN(C)C(C)CC 2230a_100000741768_100000210320 [0,1,0,0,0,0|3,0,0]=4 3903 B15R0.324 CCCCCCCCCCN(C)C(C)CC 269982a_100000207566_100000758301 [0,1,0,0,0,0|3,0,0]=4 3904 B15R0.324 CCCCCCCCCCN(C)C(C)CC 269982a_100000741768_100000210320 [0,1,0,0,0,0|3,0,0]=4 3905 B15R0.324 CCCCCCCCCNC(=O)C(=O)NC 1626a_100000212291_100011218921 [0,1,0,0,0,0|3,0,0]=4 3906 B15R0.324 CCCCCCCCCNC(=O)C(=O)NC 240690a_100000212291_100011218921 [0,1,0,0,0,0|3,0,0]=4 3907 B15R0.324 CCCCCCCCCNC(=O)C(=O)NC 527a_100000212291_100011218921 [0,1,0,0,0,0|3,0,0]=4 3908 B15R0.324 CCCCCCCCCNC(=O)C(=O)OC 11a_100000212291_100000024059 [0,1,0,0,0,0|3,0,0]=4 3909 B15R0.324 CCCCCCCCCNC(=O)C(=O)OC 1626a_100000212291_100000024059 [0,1,0,0,0,0|3,0,0]=4 3910 B15R0.324 CCCCCCCCCNC(=O)C(=O)OC 240690a_100000212291_100000024059 [0,1,0,0,0,0|3,0,0]=4 3911 B15R0.324 CCCCCCCCCNC(=O)C(=O)OC 527a_100000212291_100000024059 [0,1,0,0,0,0|3,0,0]=4 3912 B15R0.324 CCCCCCCCCNC(=O)C(C)CC 11a_100000212291_100011192722 [0,1,0,0,0,0|2,0,0]=3 3913 B15R0.324 CCCCCCCCCNC(=O)C(C)CC 1626a_100000212291_100011192722 [0,1,0,0,0,0|2,0,0]=3 3914 B15R0.324 CCCCCCCCCNC(=O)C(C)CC 240690a_100000212291_100011192722 [0,1,0,0,0,0|2,0,0]=3 3915 B15R0.324 CCCCCCCCCNC(=O)C(C)CC 527a_100000212291_100011192722 [0,1,0,0,0,0|2,0,0]=3 3916 B15R0.324 CCCCCCCCCNC(=O)C(C)OC 11a_100000212291_100000743197 [0,1,0,0,0,0|3,0,0]=4 3917 B15R0.324 CCCCCCCCCNC(=O)C(C)OC 1626a_100000212291_100000743197 [0,1,0,0,0,0|3,0,0]=4 3918 B15R0.324 CCCCCCCCCNC(=O)C(C)OC 240690a_100000212291_100000743197 [0,1,0,0,0,0|3,0,0]=4 3919 B15R0.324 CCCCCCCCCNC(=O)C(C)OC 527a_100000212291_100000743197 [0,1,0,0,0,0|3,0,0]=4 3920 B15R0.324 CCCCCCCCCNC(=O)C(C)SC 11a_100000212291_100000149566 [0,1,0,0,0,0|3,0,0]=4 3921 B15R0.324 CCCCCCCCCNC(=O)C(C)SC 1626a_100000212291_100000149566 [0,1,0,0,0,0|3,0,0]=4 3922 B15R0.324 CCCCCCCCCNC(=O)C(C)SC 240690a_100000212291_100000149566 [0,1,0,0,0,0|3,0,0]=4 3923 B15R0.324 CCCCCCCCCNC(=O)C(C)SC 527a_100000212291_100000149566 [0,1,0,0,0,0|3,0,0]=4 3924 B15R0.324 CCCCCCCCCNC(=O)C(O)CC 240690a_100000212291_100011196387 [0,1,0,0,0,0|2,0,0]=3 3925 B15R0.324 CCCCCCCCCNC(=O)C(O)CO 240690a_100000212291_100011215603 [0,1,0,0,0,0|3,0,0]=4 3926 B15R0.324 CCCCCCCCCNC(=O)N(C)CC 2708a_100000212291_100000225621 [0,1,0,0,0,0|2,0,0]=3 3927 B15R0.324 CCCCCCCCCNC(=O)N(C)CC 273464a_100000212291_100000225621 [0,1,0,0,0,0|2,0,0]=3 3928 B15R0.324 CCCCCCCCNCC(=O)C(=O)OC 34a_100000229939_100011610305 [0,1,0,0,0,0|3,0,0]=4 3929 B15R0.324 CCCCCCCCNCC(=O)N(C)CC 2230a_100000229939_100000738999 [0,1,0,0,0,0|2,0,0]=3 3930 B15R0.324 CCCCCCCCNCC(=O)N(C)CC 34a_100000229939_100000738999 [0,1,0,0,0,0|2,0,0]=3 3931 B15R0.324 CCCCCCCCNCC(=O)N(C)OC 2230a_100000229939_100000764215 [0,1,0,0,0,0|3,0,0]=4 3932 B15R0.324 CCCCCCCCNCC(=O)N(C)OC 2230a_100015207273_100000210759 [0,1,0,0,0,0|3,0,0]=4 3933 B15R0.324 CCCCCCCCOCC(=O)C(=O)OC 34a_100000210232_100011610305 [0,1,0,0,0,0|3,0,0]=4 3934 B15R0.324 CCCCCCCCOCC(=O)C(C)CC 1458a_100000759886_100000758301 [0,1,0,0,0,0|2,0,0]=3 3935 B15R0.324 CCCCCCCCOCC(=O)N(C)CC 11a_100000225621_100000759886 [0,1,0,0,0,0|2,0,0]=3 3936 B15R0.324 CCCCCCCCOCC(=O)N(C)CC 1626a_100000225621_100000759886 [0,1,0,0,0,0|2,0,0]=3 3937 B15R0.324 CCCCCCCCOCC(=O)N(C)CC 240690a_100000225621_100000759886 [0,1,0,0,0,0|2,0,0]=3 3938 B15R0.324 CCCCCCCCOCC(=O)N(C)CC 34a_100000210232_100000738999 [0,1,0,0,0,0|2,0,0]=3 3939 B15R0.324 CCCCCCCCOCC(=O)N(C)CC 527a_100000225621_100000759886 [0,1,0,0,0,0|2,0,0]=3 3940 B15R0.324 CCCCCCCCOCC(=O)N(C)CC 7a_100000210232_100000738999 [0,1,0,0,0,0|2,0,0]=3 3941 B15R0.324 CCCCCCCCOCC(=O)N(C)OC 7a_100000210232_100000764215 [0,1,0,0,0,0|3,0,0]=4 3942 B15R0.324 CCCCCCCCSCC(=O)C(=O)OC 62a_100000210759_100011610305 [0,1,0,0,0,0|3,0,0]=4 3943 B15R0.324 CCCCCCCCSCC(=O)C(=O)OC 62a_100011610305_100000210317 [0,1,0,0,0,0|3,0,0]=4 3944 B15R0.324 CCCCCCCCSCC(=O)N(C)CC 62a_100000210759_100000738999 [0,1,0,0,0,0|2,0,0]=3 3945 B15R0.324 CCCCCCCCSCC(=O)N(C)CC 62a_100000738999_100000210317 [0,1,0,0,0,0|2,0,0]=3 3946 B15R0.324 CCCCCCCCSCC(=O)N(C)OC 62a_100000210759_100000764215 [0,1,0,0,0,0|3,0,0]=4 3947 B15R0.324 CCCCCCCCSCC(=O)N(C)OC 62a_100000764215_100000210317 [0,1,0,0,0,0|3,0,0]=4 3948 B15R0.324 CCCCCCOCCCC(=O)N(C)OC 7a_100000210259_100011842776 [0,1,0,0,0,0|3,0,0]=4 3949 B15R0.324 CCCCCCSCCCC(=O)N(C)OC 62a_100000210314_100011842776 [0,1,0,0,0,0|3,0,0]=4 3950 B15R0.324 CCCCCCSCCCC(=O)N(C)OC 62a_100011842776_100000210757 [0,1,0,0,0,0|3,0,0]=4 3951 B15R0.324 CCCCCNCCOCC(=O)N(C)CC 34a_100000224656_100000738999 [0,1,0,0,0,0|3,0,0]=4 3952 B15R0.324 CCCCCOCCOCC(=O)N(C)CC 34a_100011215259_100000738999 [0,1,0,0,0,0|3,0,0]=4 3953 B15R0.324 CCCCCOCCOCC(=O)N(C)CC 7a_100011215259_100000738999 [0,1,0,0,0,0|3,0,0]=4 3954 B15R0.324 CCCCOCCCNCC(=O)N(C)CC 2230a_200000211371_100000738999 [0,1,0,0,0,0|3,0,0]=4 3955 B15R0.324 CCCCOCCCNCC(=O)N(C)CC 34a_200000211371_100000738999 [0,1,0,0,0,0|3,0,0]=4 3956 B15R0.324 CCCCOCCCOCC(=O)N(C)CC 34a_200011215613_100000738999 [0,1,0,0,0,0|3,0,0]=4 3957 B15R0.324 CCCCOCCCOCC(=O)N(C)CC 7a_200011215613_100000738999 [0,1,0,0,0,0|3,0,0]=4 3958 B15R0.324 CCN(C)C(=O)CCCCCCCCCF 11a_100000225621_200009909015 [0,1,0,0,0,0|2,0,0]=3 3959 B15R0.324 CCN(C)C(=O)CCCCCCCCCF 240690a_100000225621_200009909015 [0,1,0,0,0,0|2,0,0]=3 3960 B15R0.324 CCN(C)C(=O)CCCCCCCCCF 527a_100000225621_200009909015 [0,1,0,0,0,0|2,0,0]=3 3961 B15R0.324 CCN(C)C(=O)CCCCCCCCCO 240690a_100000225621_100000032657 [0,1,0,0,0,0|2,0,0]=3 3962 B15R0.324 CCN(C)C(=O)CNCCCCCCCO 2230a_100011996573_100000738999 [0,1,0,0,0,0|3,0,0]=4 3963 B15R0.324 CCN(C)C(=O)CNCCCCCCCO 34a_100011996573_100000738999 [0,1,0,0,0,0|3,0,0]=4 3964 B15R0.324 CCN(C)C(=O)COCCCCCCCBr 34a_100000760002_100000738999 [0,1,0,0,0,0|3,0,0]=4 3965 B15R0.324 CCN(C)C(=O)COCCCCCCCBr 7a_100000760002_100000738999 [0,1,0,0,0,0|3,0,0]=4 3966 B15R0.324 CCN(C)C(=O)COCCCCCCCN 34a_100011996573_100000738999 [0,1,0,0,0,0|3,0,0]=4 3967 B15R0.324 CCN(C)C(=O)COCCCCCCOC 34a_200012092642_100000738999 [0,1,0,0,0,0|3,0,0]=4 3968 B15R0.324 CCN(C)C(=O)COCCCCCCOC 7a_200012092642_100000738999 [0,1,0,0,0,0|3,0,0]=4 3969 B15R0.324 CCN(C)C(=O)CSCCCCCCCO 62a_100000738999_100000760002 [0,1,0,0,0,0|3,0,0]=4 3970 B15R0.324 CCN(C)C(=O)CSCCCCCCCO 62a_100000760002_100000738999 [0,1,0,0,0,0|3,0,0]=4 3971 B15R0.324 CCN(C)C(=O)CSCCCCCCOC 62a_100000738999_100011998445 [0,1,0,0,0,0|3,0,0]=4 3972 B15R0.324 CCN(C)C(=O)CSCCCCCCOC 62a_100011998445_100000738999 [0,1,0,0,0,0|3,0,0]=4 3973 B15R0.324 CCN(C)C(=O)NCCCCCCCCO 2708a_102515433106_100000225621 [0,1,0,0,0,0|3,0,0]=4 3974 B15R0.324 CCN(C)C(=O)NCCCCCCCCO 273464a_102515433106_100000225621 [0,1,0,0,0,0|3,0,0]=4 3975 B15R0.324 CNC(=O)C(=O)CCCCCCCCCO 1458a_100011218921_100009813782 [0,1,0,0,0,0|3,0,0]=4 3976 B15R0.324 COC(C)C(=O)CCCCCCCCCO 1458a_100000743197_100009813782 [0,1,0,0,0,0|3,0,0]=4 3977 B15R0.324 CSC(C)C(=O)CCCCCCCCCO 1458a_100000149566_100009813782 [0,1,0,0,0,0|3,0,0]=4 3978 B15R0.324 O=C(CCCCCCCCCO)C(O)CO 1458a_100011215603_100009813782 [0,1,0,0,0,0|3,0,0]=4 3979 B15R0.366 C#CCC(=O)CCCCCCCCCCC 1458a_100000210736_100000184674 [0,1,0,0,0,0|1,0,2]=4 3980 B15R0.366 C#CCC(=O)CCCCCCCCCCC 1458a_100011220946_100011215454 [0,1,0,0,0,0|1,0,2]=4 3981 B15R0.366 C#CCC(=O)CCCCCCCCCCO 1458a_100011220946_100009813290 [0,1,0,0,0,0|1,0,2]=4 3982 B15R0.366 C#CCC(=O)NCCCCCCCCCC 1626a_100000684558_100011220946 [0,1,0,0,0,0|1,0,2]=4 3983 B15R0.366 C#CCC(=O)NCCCCCCCCCC 527a_100000684558_100011220946 [0,1,0,0,0,0|1,0,2]=4 3984 B15R0.366 C#CCCCCCCCNCC(=O)NCC 2230a_100016988866_100153394163 [0,1,0,0,0,0|1,0,2]=4 3985 B15R0.366 C#CCCCCCCCOCC(=O)CCC 7a_100000054614_100000747444 [0,1,0,0,0,0|1,0,2]=4 3986 B15R0.366 C#CCCCCCCCOCC(=O)NCC 34a_100000054614_100000183381 [0,1,0,0,0,0|1,0,2]=4 3987 B15R0.366 C#CCCCCCCCOCC(=O)NCC 7a_100000054614_100000183381 [0,1,0,0,0,0|1,0,2]=4 3988 B15R0.366 C#CCCCCCCCOCC(=O)OCC 34a_100000054614_100000188475 [0,1,0,0,0,0|0,0,2]=3 3989 B15R0.366 C#CCCCCCCCOCC(=O)OCC 7a_100000054614_100000188475 [0,1,0,0,0,0|0,0,2]=3 3990 B15R0.366 C#CCCCCCCCSCC(=O)CCC 62a_100000747444_100153394163 [0,1,0,0,0,0|1,0,2]=4 3991 B15R0.366 C#CCCCCCCCSCC(=O)CCC 62a_100153394163_100000747444 [0,1,0,0,0,0|1,0,2]=4 3992 B15R0.366 C#CCCCCCCCSCC(=O)NCC 62a_100000183381_100153394163 [0,1,0,0,0,0|1,0,2]=4 3993 B15R0.366 C#CCCCCCCCSCC(=O)NCC 62a_100153394163_100000183381 [0,1,0,0,0,0|1,0,2]=4 3994 B15R0.366 C#CCCCCCCCSCC(=O)OCC 62a_100000188475_100153394163 [0,1,0,0,0,0|0,0,2]=3 3995 B15R0.366 C#CCCCCCCCSCC(=O)OCC 62a_100153394163_100000188475 [0,1,0,0,0,0|0,0,2]=3 3996 B15R0.366 C#CCCCCCCNCCC(=O)NCC 34a_100025743525_100012276617 [0,1,0,0,0,0|1,0,2]=4 3997 B15R0.366 C#CCCCCCCOCCC(=O)NCC 7a_100011217361_100000737597 [0,1,0,0,0,0|1,0,2]=4 3998 B15R0.366 C#CCCCCCCOCCC(=O)OCC 34a_100011217361_100000765890 [0,1,0,0,0,0|0,0,2]=3 3999 B15R0.366 C#CCCCCCCOCCC(=O)OCC 7a_100011217361_100011206558 [0,1,0,0,0,0|0,0,2]=3 4000 B15R0.366 C#CCCCCCCSCCC(=O)NCC 62a_100000737597_100012276617 [0,1,0,0,0,0|1,0,2]=4 4001 B15R0.366 C#CCCCCCCSCCC(=O)NCC 62a_100012276617_100000737597 [0,1,0,0,0,0|1,0,2]=4 4002 B15R0.366 C#CCCCCCCSCCC(=O)OCC 62a_100000765890_100012276617 [0,1,0,0,0,0|0,0,2]=3 4003 B15R0.366 C#CCCCCCCSCCC(=O)OCC 62a_100012276617_100000765890 [0,1,0,0,0,0|0,0,2]=3 4004 B15R0.366 C#CCCCCCCSCOC(=O)OCC 62a_100012276617_100000075025 [0,1,0,0,0,0|1,0,2]=4 4005 B15R0.366 C#CCCCCCOCCCC(=O)OCC 34a_100000766912_100009991533 [0,1,0,0,0,0|0,0,2]=3 4006 B15R0.366 C#CCCCCCOCCCC(=O)OCC 7a_100000766912_100011215271 [0,1,0,0,0,0|0,0,2]=3 4007 B15R0.366 C#CCCCCCOCCCC(=O)OCC 7a_100012001163_100012094781 [0,1,0,0,0,0|0,0,2]=3 4008 B15R0.366 C#CCCCCCOCCNC(=O)OCC 34a_100000158857_100012094781 [0,1,0,0,0,0|1,0,2]=4 4009 B15R0.366 C#CCCCCCOCCNC(=O)OCC 7a_100000766912_200011445536 [0,1,0,0,0,0|1,0,2]=4 4010 B15R0.366 C#CCCCCCSCCCC(=O)OCC 62a_100009991533_100012094781 [0,1,0,0,0,0|0,0,2]=3 4011 B15R0.366 C#CCCCCCSCCCC(=O)OCC 62a_100012094781_100009991533 [0,1,0,0,0,0|0,0,2]=3 4012 B15R0.366 C#CCCCCCSCCNC(=O)OCC 62a_100012094781_200011445536 [0,1,0,0,0,0|1,0,2]=4 4013 B15R0.366 C#CCCCCNCCCCC(=O)OCC 2230a_100000706060_100000750268 [0,1,0,0,0,0|0,0,2]=3 4014 B15R0.366 C#CCCCCNCCCCC(=O)OCC 34a_100000706060_100000750268 [0,1,0,0,0,0|0,0,2]=3 4015 B15R0.366 C#CCCCCNCCOCC(=O)OCC 2230a_100000706060_100000088970 [0,1,0,0,0,0|1,0,2]=4 4016 B15R0.366 C#CCCCCNCCOCC(=O)OCC 34a_100000706060_100000088970 [0,1,0,0,0,0|1,0,2]=4 4017 B15R0.366 C#CCCCCOCCCCC(=O)OCC 34a_100000766709_100000750268 [0,1,0,0,0,0|0,0,2]=3 4018 B15R0.366 C#CCCCCOCCCCC(=O)OCC 7a_100000766709_100000750268 [0,1,0,0,0,0|0,0,2]=3 4019 B15R0.366 C#CCCCCOCCOCC(=O)OCC 34a_100000766709_100000088970 [0,1,0,0,0,0|1,0,2]=4 4020 B15R0.366 C#CCCCCOCCOCC(=O)OCC 7a_100000766709_100000088970 [0,1,0,0,0,0|1,0,2]=4 4021 B15R0.366 C#CCCCCOCCSCC(=O)OCC 7a_200000230590_100010269958 [0,1,0,0,0,0|1,0,2]=4 4022 B15R0.366 C#CCCCCSCCCCC(=O)OCC 62a_100000750268_100010269958 [0,1,0,0,0,0|0,0,2]=3 4023 B15R0.366 C#CCCCCSCCCCC(=O)OCC 62a_100010269958_100000750268 [0,1,0,0,0,0|0,0,2]=3 4024 B15R0.366 C#CCCCCSCCOCC(=O)OCC 62a_100000088970_100010269958 [0,1,0,0,0,0|1,0,2]=4 4025 B15R0.366 C#CCCCCSCCOCC(=O)OCC 62a_100010269958_100000088970 [0,1,0,0,0,0|1,0,2]=4 4026 B15R0.366 C#CCCCNCCCCCC(=O)OCC 34a_100000718082_100000755133 [0,1,0,0,0,0|0,0,2]=3 4027 B15R0.366 C#CCCCNCCCOCC(=O)OCC 34a_100000718082_100009893628 [0,1,0,0,0,0|1,0,2]=4 4028 B15R0.366 C#CCCCOCCCCCC(=O)OCC 34a_100000215630_100000755133 [0,1,0,0,0,0|0,0,2]=3 4029 B15R0.366 C#CCCCOCCCCCC(=O)OCC 7a_100000215630_100000755133 [0,1,0,0,0,0|0,0,2]=3 4030 B15R0.366 C#CCCCOCCCCCC(=O)OCC 7a_100011214988_100011215417 [0,1,0,0,0,0|0,0,2]=3 4031 B15R0.366 C#CCCCOCCCOCC(=O)OCC 34a_100000215630_100009893628 [0,1,0,0,0,0|1,0,2]=4 4032 B15R0.366 C#CCCCOCCCOCC(=O)OCC 7a_100000215630_100009893628 [0,1,0,0,0,0|1,0,2]=4 4033 B15R0.366 C#CCCCSCCCCCC(=O)OCC 62a_100000755133_100011215417 [0,1,0,0,0,0|0,0,2]=3 4034 B15R0.366 C#CCCCSCCCCCC(=O)OCC 62a_100011215417_100000755133 [0,1,0,0,0,0|0,0,2]=3 4035 B15R0.366 C#CCCCSCCCOCC(=O)OCC 62a_100009893628_100011215417 [0,1,0,0,0,0|1,0,2]=4 4036 B15R0.366 C#CCCCSCCCOCC(=O)OCC 62a_100011215417_100009893628 [0,1,0,0,0,0|1,0,2]=4 4037 B15R0.366 C#CCCNCCCCCCC(=O)OCC 34a_100000755551_100009814379 [0,1,0,0,0,0|0,0,2]=3 4038 B15R0.366 C#CCCOCCCCCCC(=O)OCC 34a_100011215631_100009814379 [0,1,0,0,0,0|0,0,2]=3 4039 B15R0.366 C#CCCSCCCCCCC(=O)OCC 62a_100000688953_100009814379 [0,1,0,0,0,0|0,0,2]=3 4040 B15R0.366 C#CCNCCCCCCCC(=O)OCC 34a_100000212058_100009991516 [0,1,0,0,0,0|0,0,2]=3 4041 B15R0.366 C#CCOCCCCCCCC(=O)OCC 34a_100000210247_100009991516 [0,1,0,0,0,0|0,0,2]=3 4042 B15R0.366 C#CCOCCNCCCCC(=O)OCC 2230a_100000700922_100000750268 [0,1,0,0,0,0|1,0,2]=4 4043 B15R0.366 C#CCOCCNCCCCC(=O)OCC 34a_100000700922_100000750268 [0,1,0,0,0,0|1,0,2]=4 4044 B15R0.366 C#CCOCCOCCCCC(=O)OCC 34a_100000054580_100000750268 [0,1,0,0,0,0|1,0,2]=4 4045 B15R0.366 C#CCOCCOCCCCC(=O)OCC 7a_100000054580_100000750268 [0,1,0,0,0,0|1,0,2]=4 4046 B15R0.366 C#CCOCCSCCCCC(=O)OCC 62a_100000750268_100010402529 [0,1,0,0,0,0|1,0,2]=4 4047 B15R0.366 C#CCOCCSCCCCC(=O)OCC 62a_100010402529_100000750268 [0,1,0,0,0,0|1,0,2]=4 4048 B15R0.366 C#CCSCCCCCCCC(=O)OCC 62a_100000038162_100009991516 [0,1,0,0,0,0|0,0,2]=3 4049 B15R0.366 C/C=C/CCOCCCCCC(=O)OCC 34a_100016278192_100000755133 [0,1,0,0,0,0|0,0,2]=3 4050 B15R0.366 C/C=C/CCOCCCOCC(=O)OCC 34a_100016278192_100009893628 [0,1,0,0,0,0|1,0,2]=4 4051 B15R0.366 C/C=C/COCCCCCCC(=O)OCC 34a_100016270725_100009814379 [0,1,0,0,0,0|0,0,2]=3 4052 B15R0.366 C/C=C/CSCCCCCCC(=O)OCC 62a_100102629194_100009814379 [0,1,0,0,0,0|0,0,2]=3 4053 B15R0.366 C=CCC(=O)CCCCCCCCCCO 1458a_100000210193_100009813290 [0,1,0,0,0,0|1,0,2]=4 4054 B15R0.366 C=CCC(=O)NCCCCCCCCCC 11a_100000684558_100000210193 [0,1,0,0,0,0|1,0,2]=4 4055 B15R0.366 C=CCC(=O)NCCCCCCCCCC 1626a_100000684558_100000210193 [0,1,0,0,0,0|1,0,2]=4 4056 B15R0.366 C=CCC(=O)NCCCCCCCCCC 240690a_100000684558_100000210193 [0,1,0,0,0,0|1,0,2]=4 4057 B15R0.366 C=CCC(=O)NCCCCCCCCCC 527a_100000684558_100000210193 [0,1,0,0,0,0|1,0,2]=4 4058 B15R0.366 C=CCCCCCCCCCC(=O)C#CC 1458a_100000763181_100009814027 [0,1,0,0,0,0|1,0,2]=4 4059 B15R0.366 C=CCCCCCCCCCC(=O)C=CC 1458a_100000210699_100009814027 [0,1,0,0,0,0|1,0,2]=4 4060 B15R0.366 C=CCCCCCCCCCC(=O)CCO 1458a_100011216618_100009814027 [0,1,0,0,0,0|2,0,1]=4 4061 B15R0.366 C=CCCCCCCCCCC(=O)COC 1458a_100000210968_100009814027 [0,1,0,0,0,0|2,0,1]=4 4062 B15R0.366 C=CCCCCCCCCCC(=O)CSC 1458a_100000184570_100009814027 [0,1,0,0,0,0|2,0,1]=4 4063 B15R0.366 C=CCCCCCCCNCC(=O)NCC 2230a_100016988866_100012355270 [0,1,0,0,0,0|1,0,2]=4 4064 B15R0.366 C=CCCCCCCCOCC(=O)CCC 7a_100000730831_100000747444 [0,1,0,0,0,0|1,0,2]=4 4065 B15R0.366 C=CCCCCCCCOCC(=O)NCC 34a_100000730831_100000183381 [0,1,0,0,0,0|1,0,2]=4 4066 B15R0.366 C=CCCCCCCCOCC(=O)NCC 7a_100000730831_100000183381 [0,1,0,0,0,0|1,0,2]=4 4067 B15R0.366 C=CCCCCCCCOCC(=O)OCC 34a_100000730831_100000188475 [0,1,0,0,0,0|0,0,2]=3 4068 B15R0.366 C=CCCCCCCCOCC(=O)OCC 7a_100000730831_100000188475 [0,1,0,0,0,0|0,0,2]=3 4069 B15R0.366 C=CCCCCCCCSCC(=O)CCC 62a_100000747444_100012355270 [0,1,0,0,0,0|1,0,2]=4 4070 B15R0.366 C=CCCCCCCCSCC(=O)CCC 62a_100012355270_100000747444 [0,1,0,0,0,0|1,0,2]=4 4071 B15R0.366 C=CCCCCCCCSCC(=O)NCC 62a_100000183381_100012355270 [0,1,0,0,0,0|1,0,2]=4 4072 B15R0.366 C=CCCCCCCCSCC(=O)NCC 62a_100012355270_100000183381 [0,1,0,0,0,0|1,0,2]=4 4073 B15R0.366 C=CCCCCCCCSCC(=O)OCC 62a_100000188475_100012355270 [0,1,0,0,0,0|0,0,2]=3 4074 B15R0.366 C=CCCCCCCCSCC(=O)OCC 62a_100012355270_100000188475 [0,1,0,0,0,0|0,0,2]=3 4075 B15R0.366 C=CCCCCCCNCCC(=O)NCC 34a_100025743525_100011215473 [0,1,0,0,0,0|1,0,2]=4 4076 B15R0.366 C=CCCCCCCOCCC(=O)NCC 7a_200011216477_100000737597 [0,1,0,0,0,0|1,0,2]=4 4077 B15R0.366 C=CCCCCCCOCCC(=O)OCC 34a_200011216477_100000765890 [0,1,0,0,0,0|0,0,2]=3 4078 B15R0.366 C=CCCCCCCOCCC(=O)OCC 7a_200011216477_100011206558 [0,1,0,0,0,0|0,0,2]=3 4079 B15R0.366 C=CCCCCCCSCCC(=O)NCC 62a_100000737597_100011215473 [0,1,0,0,0,0|1,0,2]=4 4080 B15R0.366 C=CCCCCCCSCCC(=O)NCC 62a_100011215473_100000737597 [0,1,0,0,0,0|1,0,2]=4 4081 B15R0.366 C=CCCCCCCSCCC(=O)OCC 62a_100000765890_100011215473 [0,1,0,0,0,0|0,0,2]=3 4082 B15R0.366 C=CCCCCCCSCCC(=O)OCC 62a_100011215473_100000765890 [0,1,0,0,0,0|0,0,2]=3 4083 B15R0.366 C=CCCCCCCSCOC(=O)OCC 62a_100011215473_100000075025 [0,1,0,0,0,0|1,0,2]=4 4084 B15R0.366 C=CCCCCCOCCCC(=O)OCC 34a_100011216702_100009991533 [0,1,0,0,0,0|0,0,2]=3 4085 B15R0.366 C=CCCCCCOCCCC(=O)OCC 7a_100011216702_100011215271 [0,1,0,0,0,0|0,0,2]=3 4086 B15R0.366 C=CCCCCCOCCCC(=O)OCC 7a_100012001163_100000700193 [0,1,0,0,0,0|0,0,2]=3 4087 B15R0.366 C=CCCCCCOCCNC(=O)OCC 34a_100000158857_100000700193 [0,1,0,0,0,0|1,0,2]=4 4088 B15R0.366 C=CCCCCCOCCNC(=O)OCC 7a_100011216702_200011445536 [0,1,0,0,0,0|1,0,2]=4 4089 B15R0.366 C=CCCCCCSCCCC(=O)OCC 62a_100000700193_100009991533 [0,1,0,0,0,0|0,0,2]=3 4090 B15R0.366 C=CCCCCCSCCCC(=O)OCC 62a_100009991533_100000700193 [0,1,0,0,0,0|0,0,2]=3 4091 B15R0.366 C=CCCCCCSCCNC(=O)OCC 62a_100000700193_200011445536 [0,1,0,0,0,0|1,0,2]=4 4092 B15R0.366 C=CCCCCNCCCCC(=O)OCC 2230a_100000703577_100000750268 [0,1,0,0,0,0|0,0,2]=3 4093 B15R0.366 C=CCCCCNCCCCC(=O)OCC 34a_100000703577_100000750268 [0,1,0,0,0,0|0,0,2]=3 4094 B15R0.366 C=CCCCCNCCOCC(=O)OCC 2230a_100000703577_100000088970 [0,1,0,0,0,0|1,0,2]=4 4095 B15R0.366 C=CCCCCNCCOCC(=O)OCC 34a_100000703577_100000088970 [0,1,0,0,0,0|1,0,2]=4 4096 B15R0.366 C=CCCCCOCCCCC(=O)OCC 34a_100000766645_100000750268 [0,1,0,0,0,0|0,0,2]=3 4097 B15R0.366 C=CCCCCOCCCCC(=O)OCC 7a_100000766645_100000750268 [0,1,0,0,0,0|0,0,2]=3 4098 B15R0.366 C=CCCCCOCCOCC(=O)OCC 34a_100000766645_100000088970 [0,1,0,0,0,0|1,0,2]=4 4099 B15R0.366 C=CCCCCOCCOCC(=O)OCC 7a_100000766645_100000088970 [0,1,0,0,0,0|1,0,2]=4 4100 B15R0.366 C=CCCCCOCCSCC(=O)OCC 7a_200000230590_100011215482 [0,1,0,0,0,0|1,0,2]=4 4101 B15R0.366 C=CCCCCSCCCCC(=O)OCC 62a_100000750268_100011215482 [0,1,0,0,0,0|0,0,2]=3 4102 B15R0.366 C=CCCCCSCCCCC(=O)OCC 62a_100011215482_100000750268 [0,1,0,0,0,0|0,0,2]=3 4103 B15R0.366 C=CCCCCSCCOCC(=O)OCC 62a_100000088970_100011215482 [0,1,0,0,0,0|1,0,2]=4 4104 B15R0.366 C=CCCCCSCCOCC(=O)OCC 62a_100011215482_100000088970 [0,1,0,0,0,0|1,0,2]=4 4105 B15R0.366 C=CCCCNCCCCCC(=O)OCC 2230a_100000700776_100000755133 [0,1,0,0,0,0|0,0,2]=3 4106 B15R0.366 C=CCCCNCCCCCC(=O)OCC 34a_100000700776_100000755133 [0,1,0,0,0,0|0,0,2]=3 4107 B15R0.366 C=CCCCNCCCOCC(=O)OCC 2230a_100000700776_100009893628 [0,1,0,0,0,0|1,0,2]=4 4108 B15R0.366 C=CCCCNCCCOCC(=O)OCC 34a_100000700776_100009893628 [0,1,0,0,0,0|1,0,2]=4 4109 B15R0.366 C=CCCCOCCCCCC(=O)OCC 34a_100000758997_100000755133 [0,1,0,0,0,0|0,0,2]=3 4110 B15R0.366 C=CCCCOCCCCCC(=O)OCC 7a_100000758997_100000755133 [0,1,0,0,0,0|0,0,2]=3 4111 B15R0.366 C=CCCCOCCCCCC(=O)OCC 7a_100011214988_100000757094 [0,1,0,0,0,0|0,0,2]=3 4112 B15R0.366 C=CCCCOCCCOCC(=O)OCC 34a_100000758997_100009893628 [0,1,0,0,0,0|1,0,2]=4 4113 B15R0.366 C=CCCCOCCCOCC(=O)OCC 7a_100000758997_100009893628 [0,1,0,0,0,0|1,0,2]=4 4114 B15R0.366 C=CCCCSCCCCCC(=O)OCC 62a_100000755133_100000757094 [0,1,0,0,0,0|0,0,2]=3 4115 B15R0.366 C=CCCCSCCCCCC(=O)OCC 62a_100011713584_100000755133 [0,1,0,0,0,0|0,0,2]=3 4116 B15R0.366 C=CCCCSCCCOCC(=O)OCC 62a_100009893628_100000757094 [0,1,0,0,0,0|1,0,2]=4 4117 B15R0.366 C=CCCCSCCCOCC(=O)OCC 62a_100011713584_100009893628 [0,1,0,0,0,0|1,0,2]=4 4118 B15R0.366 C=CCCNCCCCCCC(=O)OCC 2230a_100015191253_100009814379 [0,1,0,0,0,0|0,0,2]=3 4119 B15R0.366 C=CCCOCCCCCCC(=O)OCC 34a_100011205117_100009814379 [0,1,0,0,0,0|0,0,2]=3 4120 B15R0.366 C=CCCSCCCCCCC(=O)OCC 62a_100000754431_100009814379 [0,1,0,0,0,0|0,0,2]=3 4121 B15R0.366 C=CCNCCCCCCCC(=O)OCC 2230a_100020586998_100009991516 [0,1,0,0,0,0|0,0,2]=3 4122 B15R0.366 C=CCOCCCCCCCC(=O)OCC 34a_200000210373_100009991516 [0,1,0,0,0,0|0,0,2]=3 4123 B15R0.366 C=CCOCCOCCCCC(=O)OCC 34a_100000037705_100000750268 [0,1,0,0,0,0|1,0,2]=4 4124 B15R0.366 C=CCOCCOCCCCC(=O)OCC 7a_100000037705_100000750268 [0,1,0,0,0,0|1,0,2]=4 4125 B15R0.366 C=CCSCCCCCCCC(=O)OCC 62a_100000210623_100009991516 [0,1,0,0,0,0|0,0,2]=3 4126 B15R0.366 C=COC(=O)CNCCCCCCCCC 2230a_100000212291_100000036128 [0,1,0,0,0,0|0,0,2]=3 4127 B15R0.366 C=COC(=O)CNCCCCCCCCC 34a_100000212291_100000036128 [0,1,0,0,0,0|0,0,2]=3 4128 B15R0.366 C=COC(=O)CNCCCCCCCCO 2230a_102515433106_100000036128 [0,1,0,0,0,0|1,0,2]=4 4129 B15R0.366 C=COC(=O)CNCCCCCCCCO 34a_102515433106_100000036128 [0,1,0,0,0,0|1,0,2]=4 4130 B15R0.366 C=COC(=O)COCCCCCCCCBr 34a_100009813846_100000036128 [0,1,0,0,0,0|1,0,2]=4 4131 B15R0.366 C=COC(=O)COCCCCCCCCC 34a_100000210712_100000036128 [0,1,0,0,0,0|0,0,2]=3 4132 B15R0.366 C=COC(=O)COCCCCCCCCCl 34a_100000033203_100000036128 [0,1,0,0,0,0|1,0,2]=4 4133 B15R0.366 C=COC(=O)COCCCCCCCCN 34a_102515433106_100000036128 [0,1,0,0,0,0|1,0,2]=4 4134 B15R0.366 C=COC(=O)COCCCCNCCCC 34a_200011216965_100000036128 [0,1,0,0,0,0|1,0,2]=4 4135 B15R0.366 C=COC(=O)COCCCCOCCCC 34a_200000760531_100000036128 [0,1,0,0,0,0|1,0,2]=4 4136 B15R0.366 C=COC(=O)COCCOCCCCCC 34a_100000691444_100000036128 [0,1,0,0,0,0|1,0,2]=4 4137 B15R0.366 C=COC(=O)CSCCCCCCCCC 62a_100000036128_100000210670 [0,1,0,0,0,0|0,0,2]=3 4138 B15R0.366 C=COC(=O)CSCCCCCCCCO 62a_100000033203_100000036128 [0,1,0,0,0,0|1,0,2]=4 4139 B15R0.366 C=COC(=O)CSCCCCCCCCO 62a_100000036128_100000033203 [0,1,0,0,0,0|1,0,2]=4 4140 B15R0.366 C=COCCCCOCCCC(=O)OCC 34a_100000031558_100009991533 [0,1,0,0,0,0|1,0,2]=4 4141 B15R0.366 C=COCCCCOCCCC(=O)OCC 7a_100000031558_100011215271 [0,1,0,0,0,0|1,0,2]=4 4142 B15R0.366 C=COCCCNCCCCC(=O)OCC 2230a_100000210767_100000750268 [0,1,0,0,0,0|1,0,2]=4 4143 B15R0.366 C=COCCCNCCCCC(=O)OCC 34a_100000210767_100000750268 [0,1,0,0,0,0|1,0,2]=4 4144 B15R0.366 C=COCCOCCCCCC(=O)OCC 34a_100000033082_100000755133 [0,1,0,0,0,0|1,0,2]=4 4145 B15R0.366 C=COCCOCCCCCC(=O)OCC 7a_100011214988_100000039644 [0,1,0,0,0,0|1,0,2]=4 4146 B15R0.366 C=COCCSCCCCCC(=O)OCC 62a_100000039644_100000755133 [0,1,0,0,0,0|1,0,2]=4 4147 B15R0.366 C=COCCSCCCCCC(=O)OCC 62a_100000755133_100000039644 [0,1,0,0,0,0|1,0,2]=4 4148 B15R0.366 CC#CC(=O)CCCCCCCCCCC 1458a_100000763181_100011215454 [0,1,0,0,0,0|1,0,1]=3 4149 B15R0.366 CC#CC(=O)CCCCCCCCCCO 1458a_100000763181_100009813290 [0,1,0,0,0,0|1,0,1]=3 4150 B15R0.366 CC#CCCOCCCCCC(=O)OCC 34a_100000750427_100000755133 [0,1,0,0,0,0|0,0,2]=3 4151 B15R0.366 CC#CCCOCCCOCC(=O)OCC 34a_100000750427_100009893628 [0,1,0,0,0,0|1,0,2]=4 4152 B15R0.366 CC#CCNCCCCCCC(=O)OCC 2230a_100000685387_100009814379 [0,1,0,0,0,0|0,0,2]=3 4153 B15R0.366 CC#CCNCCCCCCC(=O)OCC 34a_100000685387_100009814379 [0,1,0,0,0,0|0,0,2]=3 4154 B15R0.366 CC#CCOCCCCCCC(=O)OCC 34a_100000761923_100009814379 [0,1,0,0,0,0|0,0,2]=3 4155 B15R0.366 CC#CCSCCCCCCC(=O)OCC 62a_100000748600_100009814379 [0,1,0,0,0,0|0,0,2]=3 4156 B15R0.366 CC/C=C/CCCOCCCC(=O)OCC 34a_100016287902_100009991533 [0,1,0,0,0,0|0,0,2]=3 4157 B15R0.366 CC/C=C/CCCOCCCC(=O)OCC 7a_100016287902_100011215271 [0,1,0,0,0,0|0,0,2]=3 4158 B15R0.366 CC/C=C/CCCOCCNC(=O)OCC 7a_100016287902_200011445536 [0,1,0,0,0,0|1,0,2]=4 4159 B15R0.366 CC/C=C\CCCCCOCC(=O)CCC 7a_100016268722_100000747444 [0,1,0,0,0,0|1,0,2]=4 4160 B15R0.366 CC/C=C\CCCCCOCC(=O)NCC 34a_100016268722_100000183381 [0,1,0,0,0,0|1,0,2]=4 4161 B15R0.366 CC/C=C\CCCCCOCC(=O)NCC 7a_100016268722_100000183381 [0,1,0,0,0,0|1,0,2]=4 4162 B15R0.366 CC/C=C\CCCCCOCC(=O)OCC 34a_100016268722_100000188475 [0,1,0,0,0,0|0,0,2]=3 4163 B15R0.366 CC/C=C\CCCCCOCC(=O)OCC 7a_100016268722_100000188475 [0,1,0,0,0,0|0,0,2]=3 4164 B15R0.366 CC/C=C\CCCCOCCC(=O)NCC 7a_100016287862_100000737597 [0,1,0,0,0,0|1,0,2]=4 4165 B15R0.366 CC/C=C\CCCCOCCC(=O)OCC 34a_100016287862_100000765890 [0,1,0,0,0,0|0,0,2]=3 4166 B15R0.366 CC/C=C\CCCCOCCC(=O)OCC 7a_100016287862_100011206558 [0,1,0,0,0,0|0,0,2]=3 4167 B15R0.366 CC/C=C\CCOCCCCC(=O)OCC 34a_100016288707_100000750268 [0,1,0,0,0,0|0,0,2]=3 4168 B15R0.366 CC/C=C\CCOCCCCC(=O)OCC 7a_100016288707_100000750268 [0,1,0,0,0,0|0,0,2]=3 4169 B15R0.366 CC/C=C\CCOCCOCC(=O)OCC 34a_100016288707_100000088970 [0,1,0,0,0,0|1,0,2]=4 4170 B15R0.366 CC/C=C\CCOCCOCC(=O)OCC 7a_100016288707_100000088970 [0,1,0,0,0,0|1,0,2]=4 4171 B15R0.366 CC/C=C\CCOCCSCC(=O)OCC 7a_200000230590_100015370543 [0,1,0,0,0,0|1,0,2]=4 4172 B15R0.366 CC/C=C\CCSCCCCC(=O)OCC 62a_100000750268_100015370543 [0,1,0,0,0,0|0,0,2]=3 4173 B15R0.366 CC/C=C\CCSCCCCC(=O)OCC 62a_100015370543_100000750268 [0,1,0,0,0,0|0,0,2]=3 4174 B15R0.366 CC/C=C\CCSCCOCC(=O)OCC 62a_100000088970_100015370543 [0,1,0,0,0,0|1,0,2]=4 4175 B15R0.366 CC/C=C\CCSCCOCC(=O)OCC 62a_100015370543_100000088970 [0,1,0,0,0,0|1,0,2]=4 4176 B15R0.366 CC/C=C\COCCCCCC(=O)OCC 34a_100016268518_100000755133 [0,1,0,0,0,0|0,0,2]=3 4177 B15R0.366 CC/C=C\COCCCCCC(=O)OCC 7a_100011214988_100103147603 [0,1,0,0,0,0|0,0,2]=3 4178 B15R0.366 CC/C=C\COCCCOCC(=O)OCC 34a_100016268518_100009893628 [0,1,0,0,0,0|1,0,2]=4 4179 B15R0.366 CC/C=C\CSCCCCCC(=O)OCC 62a_100000755133_100103147603 [0,1,0,0,0,0|0,0,2]=3 4180 B15R0.366 CC/C=C\CSCCCCCC(=O)OCC 62a_100103147603_100000755133 [0,1,0,0,0,0|0,0,2]=3 4181 B15R0.366 CC/C=C\CSCCCOCC(=O)OCC 62a_100009893628_100103147603 [0,1,0,0,0,0|1,0,2]=4 4182 B15R0.366 CC/C=C\CSCCCOCC(=O)OCC 62a_100103147603_100009893628 [0,1,0,0,0,0|1,0,2]=4 4183 B15R0.366 CC=C=CCCOCCCCC(=O)OCC 34a_100011020354_100000750268 [0,1,0,0,0,0|0,0,3]=4 4184 B15R0.366 CC=CC(=O)CCCCCCCCCCO 1458a_100000210699_100009813290 [0,1,0,0,0,0|1,0,1]=3 4185 B15R0.366 CC=CC(=O)NCCCCCCCCCC 11a_100000684558_100000210699 [0,1,0,0,0,0|1,0,1]=3 4186 B15R0.366 CC=CC(=O)NCCCCCCCCCC 1626a_100000684558_100000210699 [0,1,0,0,0,0|1,0,1]=3 4187 B15R0.366 CC=CC(=O)NCCCCCCCCCC 240690a_100000684558_100000210699 [0,1,0,0,0,0|1,0,1]=3 4188 B15R0.366 CC=CC(=O)NCCCCCCCCCO 240690a_100000078944_100000210699 [0,1,0,0,0,0|2,0,1]=4 4189 B15R0.366 CC=CCCCOCCCCC(=O)OCC 34a_100020645299_100000750268 [0,1,0,0,0,0|0,0,2]=3 4190 B15R0.366 CC=CCCCOCCOCC(=O)OCC 34a_100020645299_100000088970 [0,1,0,0,0,0|1,0,2]=4 4191 B15R0.366 CC=CCSCCCCCCC(=O)OCC 62a_100000070051_100009814379 [0,1,0,0,0,0|0,0,2]=3 4192 B15R0.366 CCC#CCCOCCCCC(=O)OCC 34a_100000036655_100000750268 [0,1,0,0,0,0|0,0,2]=3 4193 B15R0.366 CCC#CCCOCCCCC(=O)OCC 7a_100000036655_100000750268 [0,1,0,0,0,0|0,0,2]=3 4194 B15R0.366 CCC#CCCOCCOCC(=O)OCC 34a_100000036655_100000088970 [0,1,0,0,0,0|1,0,2]=4 4195 B15R0.366 CCC#CCCOCCOCC(=O)OCC 7a_100000036655_100000088970 [0,1,0,0,0,0|1,0,2]=4 4196 B15R0.366 CCC#CCOCCCCCC(=O)OCC 34a_100000032950_100000755133 [0,1,0,0,0,0|0,0,2]=3 4197 B15R0.366 CCC#CCOCCCCCC(=O)OCC 7a_100011214988_100009813939 [0,1,0,0,0,0|0,0,2]=3 4198 B15R0.366 CCC#CCOCCCOCC(=O)OCC 34a_100000032950_100009893628 [0,1,0,0,0,0|1,0,2]=4 4199 B15R0.366 CCC#CCSCCCCCC(=O)OCC 62a_100000755133_100009813939 [0,1,0,0,0,0|0,0,2]=3 4200 B15R0.366 CCC#CCSCCCCCC(=O)OCC 62a_100009813939_100000755133 [0,1,0,0,0,0|0,0,2]=3 4201 B15R0.366 CCC#CCSCCCOCC(=O)OCC 62a_100009813939_100009893628 [0,1,0,0,0,0|1,0,2]=4 4202 B15R0.366 CCC#CCSCCCOCC(=O)OCC 62a_100009893628_100009813939 [0,1,0,0,0,0|1,0,2]=4 4203 B15R0.366 CCC/C=C/COCCCCC(=O)OCC 34a_100016278788_100000750268 [0,1,0,0,0,0|0,0,2]=3 4204 B15R0.366 CCC/C=C/COCCCCC(=O)OCC 7a_100016278788_100000750268 [0,1,0,0,0,0|0,0,2]=3 4205 B15R0.366 CCC/C=C/COCCOCC(=O)OCC 34a_100016278788_100000088970 [0,1,0,0,0,0|1,0,2]=4 4206 B15R0.366 CCC/C=C/COCCOCC(=O)OCC 7a_100016278788_100000088970 [0,1,0,0,0,0|1,0,2]=4 4207 B15R0.366 CCCC#CCCOCCCC(=O)OCC 34a_100000042726_100009991533 [0,1,0,0,0,0|0,0,2]=3 4208 B15R0.366 CCCC#CCCOCCCC(=O)OCC 7a_100000042726_100011215271 [0,1,0,0,0,0|0,0,2]=3 4209 B15R0.366 CCCC#CCCOCCNC(=O)OCC 7a_100000042726_200011445536 [0,1,0,0,0,0|1,0,2]=4 4210 B15R0.366 CCCC#CCOCCCCC(=O)OCC 34a_100000034806_100000750268 [0,1,0,0,0,0|0,0,2]=3 4211 B15R0.366 CCCC#CCOCCCCC(=O)OCC 7a_100000034806_100000750268 [0,1,0,0,0,0|0,0,2]=3 4212 B15R0.366 CCCC#CCOCCOCC(=O)OCC 34a_100000034806_100000088970 [0,1,0,0,0,0|1,0,2]=4 4213 B15R0.366 CCCC#CCOCCOCC(=O)OCC 7a_100000034806_100000088970 [0,1,0,0,0,0|1,0,2]=4 4214 B15R0.366 CCCC(=O)CCCCCCCCCCO 1458a_100000211992_100009813290 [0,1,0,0,0,0|1,0,0]=2 4215 B15R0.366 CCCC(=O)CNCCCCCCCCO 2230a_102515433106_100000747444 [0,1,0,0,0,0|2,0,0]=3 4216 B15R0.366 CCCC(=O)COCCCCCCCCBr 7a_100009813846_100000747444 [0,1,0,0,0,0|2,0,0]=3 4217 B15R0.366 CCCC(=O)COCCCCCCCCCl 7a_100000033203_100000747444 [0,1,0,0,0,0|2,0,0]=3 4218 B15R0.366 CCCC(=O)COCCCOCCCOC 7a_200011215475_100000747444 [0,1,0,0,0,0|3,0,0]=4 4219 B15R0.366 CCCC(=O)CSCCCCCCCCO 62a_100000033203_100000747444 [0,1,0,0,0,0|2,0,0]=3 4220 B15R0.366 CCCC(=O)CSCCCCCCCCO 62a_100000747444_100000033203 [0,1,0,0,0,0|2,0,0]=3 4221 B15R0.366 CCCC(=O)NCCCCCCCCCO 240690a_100000078944_100000211992 [0,1,0,0,0,0|2,0,0]=3 4222 B15R0.366 CCCC(=O)OCNCCCCCCCO 2230a_100011996573_100000034017 [0,1,0,0,0,0|3,0,0]=4 4223 B15R0.366 CCCC(=O)OCNCCCCCCCO 34a_100011996573_100000034017 [0,1,0,0,0,0|3,0,0]=4 4224 B15R0.366 CCCC(=O)OCOCCCCCCCBr 34a_100000760002_100000034017 [0,1,0,0,0,0|3,0,0]=4 4225 B15R0.366 CCCC(=O)OCOCCCCCCCN 34a_100011996573_100000034017 [0,1,0,0,0,0|3,0,0]=4 4226 B15R0.366 CCCC(=O)OCOCCCCCCOC 34a_200012092642_100000034017 [0,1,0,0,0,0|3,0,0]=4 4227 B15R0.366 CCCC(=O)OCSCCCCCCCO 62a_100000760002_100000034017 [0,1,0,0,0,0|3,0,0]=4 4228 B15R0.366 CCCC(=O)OCSCCCCCCOC 62a_100011998445_100000034017 [0,1,0,0,0,0|3,0,0]=4 4229 B15R0.366 CCCC/C=C/COCCCC(=O)OCC 34a_200016272032_100009991533 [0,1,0,0,0,0|0,0,2]=3 4230 B15R0.366 CCCC/C=C/COCCCC(=O)OCC 7a_200016272032_100011215271 [0,1,0,0,0,0|0,0,2]=3 4231 B15R0.366 CCCC/C=C/COCCNC(=O)OCC 7a_200016272032_200011445536 [0,1,0,0,0,0|1,0,2]=4 4232 B15R0.366 CCCC/C=C\CCOCCC(=O)NCC 7a_200016286491_100000737597 [0,1,0,0,0,0|1,0,2]=4 4233 B15R0.366 CCCC/C=C\CCOCCC(=O)OCC 34a_200016286491_100000765890 [0,1,0,0,0,0|0,0,2]=3 4234 B15R0.366 CCCC/C=C\CCOCCC(=O)OCC 7a_200016286491_100011206558 [0,1,0,0,0,0|0,0,2]=3 4235 B15R0.366 CCCCC#CCCCNCC(=O)NCC 2230a_100016988866_200000047210 [0,1,0,0,0,0|1,0,2]=4 4236 B15R0.366 CCCCC#CCCCSCC(=O)CCC 62a_100000747444_200000047210 [0,1,0,0,0,0|1,0,2]=4 4237 B15R0.366 CCCCC#CCCCSCC(=O)CCC 62a_200000047210_100000747444 [0,1,0,0,0,0|1,0,2]=4 4238 B15R0.366 CCCCC#CCCCSCC(=O)NCC 62a_100000183381_200000047210 [0,1,0,0,0,0|1,0,2]=4 4239 B15R0.366 CCCCC#CCCCSCC(=O)NCC 62a_200000047210_100000183381 [0,1,0,0,0,0|1,0,2]=4 4240 B15R0.366 CCCCC#CCCCSCC(=O)OCC 62a_100000188475_200000047210 [0,1,0,0,0,0|0,0,2]=3 4241 B15R0.366 CCCCC#CCCCSCC(=O)OCC 62a_200000047210_100000188475 [0,1,0,0,0,0|0,0,2]=3 4242 B15R0.366 CCCCC#CCCOCCC(=O)NCC 7a_100000037610_100000737597 [0,1,0,0,0,0|1,0,2]=4 4243 B15R0.366 CCCCC#CCCOCCC(=O)OCC 34a_100000037610_100000765890 [0,1,0,0,0,0|0,0,2]=3 4244 B15R0.366 CCCCC#CCCOCCC(=O)OCC 7a_100000037610_100011206558 [0,1,0,0,0,0|0,0,2]=3 4245 B15R0.366 CCCCC#CCOCCCC(=O)OCC 34a_200000034558_100009991533 [0,1,0,0,0,0|0,0,2]=3 4246 B15R0.366 CCCCC#CCOCCCC(=O)OCC 7a_200000034558_100011215271 [0,1,0,0,0,0|0,0,2]=3 4247 B15R0.366 CCCCC#CCOCCNC(=O)OCC 7a_200000034558_200011445536 [0,1,0,0,0,0|1,0,2]=4 4248 B15R0.366 CCCCC/C=C/COCCC(=O)NCC 7a_100016258190_100000737597 [0,1,0,0,0,0|1,0,2]=4 4249 B15R0.366 CCCCC/C=C/COCCC(=O)OCC 34a_100016258190_100000765890 [0,1,0,0,0,0|0,0,2]=3 4250 B15R0.366 CCCCC/C=C/COCCC(=O)OCC 7a_100016258190_100011206558 [0,1,0,0,0,0|0,0,2]=3 4251 B15R0.366 CCCCC/C=C\CCOCC(=O)CCC 7a_100016277358_100000747444 [0,1,0,0,0,0|1,0,2]=4 4252 B15R0.366 CCCCC/C=C\CCOCC(=O)NCC 34a_100016277358_100000183381 [0,1,0,0,0,0|1,0,2]=4 4253 B15R0.366 CCCCC/C=C\CCOCC(=O)NCC 7a_100016277358_100000183381 [0,1,0,0,0,0|1,0,2]=4 4254 B15R0.366 CCCCC/C=C\CCOCC(=O)OCC 34a_100016277358_100000188475 [0,1,0,0,0,0|0,0,2]=3 4255 B15R0.366 CCCCC/C=C\CCOCC(=O)OCC 7a_100016277358_100000188475 [0,1,0,0,0,0|0,0,2]=3 4256 B15R0.366 CCCCCC#CCCOCC(=O)CCC 7a_200000042877_100000747444 [0,1,0,0,0,0|1,0,2]=4 4257 B15R0.366 CCCCCC#CCCOCC(=O)NCC 34a_200000042877_100000183381 [0,1,0,0,0,0|1,0,2]=4 4258 B15R0.366 CCCCCC#CCCOCC(=O)NCC 7a_200000042877_100000183381 [0,1,0,0,0,0|1,0,2]=4 4259 B15R0.366 CCCCCC#CCCOCC(=O)OCC 34a_200000042877_100000188475 [0,1,0,0,0,0|0,0,2]=3 4260 B15R0.366 CCCCCC#CCCOCC(=O)OCC 7a_200000042877_100000188475 [0,1,0,0,0,0|0,0,2]=3 4261 B15R0.366 CCCCCC#CCNCCC(=O)NCC 34a_100025743525_100009816472 [0,1,0,0,0,0|1,0,2]=4 4262 B15R0.366 CCCCCC#CCOCCC(=O)NCC 7a_200000033628_100000737597 [0,1,0,0,0,0|1,0,2]=4 4263 B15R0.366 CCCCCC#CCOCCC(=O)OCC 34a_200000033628_100000765890 [0,1,0,0,0,0|0,0,2]=3 4264 B15R0.366 CCCCCC#CCOCCC(=O)OCC 7a_200000033628_100011206558 [0,1,0,0,0,0|0,0,2]=3 4265 B15R0.366 CCCCCC#CCSCCC(=O)NCC 62a_100000737597_100009816472 [0,1,0,0,0,0|1,0,2]=4 4266 B15R0.366 CCCCCC#CCSCCC(=O)NCC 62a_100009816472_100000737597 [0,1,0,0,0,0|1,0,2]=4 4267 B15R0.366 CCCCCC#CCSCCC(=O)OCC 62a_100000765890_100009816472 [0,1,0,0,0,0|0,0,2]=3 4268 B15R0.366 CCCCCC#CCSCCC(=O)OCC 62a_100009816472_100000765890 [0,1,0,0,0,0|0,0,2]=3 4269 B15R0.366 CCCCCC#CCSCOC(=O)OCC 62a_100009816472_100000075025 [0,1,0,0,0,0|1,0,2]=4 4270 B15R0.366 CCCCCC/C=C/COCC(=O)CCC 7a_200016276170_100000747444 [0,1,0,0,0,0|1,0,2]=4 4271 B15R0.366 CCCCCC/C=C/COCC(=O)NCC 34a_200016276170_100000183381 [0,1,0,0,0,0|1,0,2]=4 4272 B15R0.366 CCCCCC/C=C/COCC(=O)NCC 7a_200016276170_100000183381 [0,1,0,0,0,0|1,0,2]=4 4273 B15R0.366 CCCCCC/C=C/COCC(=O)OCC 34a_200016276170_100000188475 [0,1,0,0,0,0|0,0,2]=3 4274 B15R0.366 CCCCCC/C=C/COCC(=O)OCC 7a_200016276170_100000188475 [0,1,0,0,0,0|0,0,2]=3 4275 B15R0.366 CCCCCCC#CCOCC(=O)CCC 7a_200000037284_100000747444 [0,1,0,0,0,0|1,0,2]=4 4276 B15R0.366 CCCCCCC#CCOCC(=O)NCC 34a_200000037284_100000183381 [0,1,0,0,0,0|1,0,2]=4 4277 B15R0.366 CCCCCCC#CCOCC(=O)NCC 7a_200000037284_100000183381 [0,1,0,0,0,0|1,0,2]=4 4278 B15R0.366 CCCCCCC#CCOCC(=O)OCC 34a_200000037284_100000188475 [0,1,0,0,0,0|0,0,2]=3 4279 B15R0.366 CCCCCCC#CCOCC(=O)OCC 7a_200000037284_100000188475 [0,1,0,0,0,0|0,0,2]=3 4280 B15R0.366 CCCCCCCCC=NNC(=O)CCC 4a_100000189770_100011218696 [0,1,0,0,0,0|2,0,1]=4 4281 B15R0.366 CCCCCCCCCC=CC(=O)CCF 1458a_200015352897_100011217306 [0,1,0,0,0,0|2,0,1]=4 4282 B15R0.366 CCCCCCCCCC=CC(=O)CCO 1458a_200015352897_100000211926 [0,1,0,0,0,0|2,0,1]=4 4283 B15R0.366 CCCCCCCCCC=CC(=O)NCC 11a_100015525214_200015352897 [0,1,0,0,0,0|1,0,1]=3 4284 B15R0.366 CCCCCCCCCC=CC(=O)NCC 240690a_100015525214_200015352897 [0,1,0,0,0,0|1,0,1]=3 4285 B15R0.366 CCCCCCCCCC=CC(=O)NNC 22a_100016993582_200015352897 [0,1,0,0,0,0|2,0,1]=4 4286 B15R0.366 CCCCCCCCCCCC(=O)CC#N 1458a_100000210736_100011214920 [0,1,0,0,0,0|2,0,1]=4 4287 B15R0.366 CCCCCCCCCCCC(=O)CC#N 1458a_100051588842_100011215454 [0,1,0,0,0,0|2,0,1]=4 4288 B15R0.366 CCCCCCCCCCCC(=O)CCF 1458a_100000210736_100011217306 [0,1,0,0,0,0|2,0,0]=3 4289 B15R0.366 CCCCCCCCCCCC(=O)CCO 1458a_100000210736_100000211926 [0,1,0,0,0,0|2,0,0]=3 4290 B15R0.366 CCCCCCCCCCCC(=O)CCO 1458a_100011216618_100011215454 [0,1,0,0,0,0|2,0,0]=3 4291 B15R0.366 CCCCCCCCCCCC(=O)COC 1458a_100000210968_100011215454 [0,1,0,0,0,0|2,0,0]=3 4292 B15R0.366 CCCCCCCCCCCC(=O)CSC 1458a_100000184570_100011215454 [0,1,0,0,0,0|2,0,0]=3 4293 B15R0.366 CCCCCCCCCCCC(=O)NCC 11a_100015525214_100000210736 [0,1,0,0,0,0|1,0,0]=2 4294 B15R0.366 CCCCCCCCCCCC(=O)NCC 240690a_100015525214_100000210736 [0,1,0,0,0,0|1,0,0]=2 4295 B15R0.366 CCCCCCCCCCCC(=O)NNC 22a_100016993582_100000210736 [0,1,0,0,0,0|2,0,0]=3 4296 B15R0.366 CCCCCCCCCCCC(C)NCC 270004a_100015525214_100011216755 [0,1,0,0,0,0|2,0,1]=4 4297 B15R0.366 CCCCCCCCCCCN(C)CCC 2230a_100000747261_100011215454 [0,1,0,0,0,0|3,0,0]=4 4298 B15R0.366 CCCCCCCCCCCN(C)CCC 269982a_100000747261_100011215454 [0,1,0,0,0,0|3,0,0]=4 4299 B15R0.366 CCCCCCCCCCNC(=O)C=CBr 1626a_100000684558_100016273825 [0,1,0,0,0,0|2,0,1]=4 4300 B15R0.366 CCCCCCCCCCNC(=O)C=CBr 240690a_100000684558_100016273825 [0,1,0,0,0,0|2,0,1]=4 4301 B15R0.366 CCCCCCCCCCNC(=O)C=CCl 11a_100000684558_200016279998 [0,1,0,0,0,0|2,0,1]=4 4302 B15R0.366 CCCCCCCCCCNC(=O)C=CCl 1626a_100000684558_200016279998 [0,1,0,0,0,0|2,0,1]=4 4303 B15R0.366 CCCCCCCCCCNC(=O)C=CCl 240690a_100000684558_200016279998 [0,1,0,0,0,0|2,0,1]=4 4304 B15R0.366 CCCCCCCCCCNC(=O)C=CI 1626a_100000684558_100016256311 [0,1,0,0,0,0|2,0,1]=4 4305 B15R0.366 CCCCCCCCCCNC(=O)CC#N 1626a_100000684558_100051588842 [0,1,0,0,0,0|2,0,1]=4 4306 B15R0.366 CCCCCCCCCCNC(=O)CC#N 240690a_100000684558_100051588842 [0,1,0,0,0,0|2,0,1]=4 4307 B15R0.366 CCCCCCCCCCNC(=O)CCC 11a_100000684558_100000211992 [0,1,0,0,0,0|1,0,0]=2 4308 B15R0.366 CCCCCCCCCCNC(=O)CCC 1626a_100000684558_100000211992 [0,1,0,0,0,0|1,0,0]=2 4309 B15R0.366 CCCCCCCCCCNC(=O)CCC 240690a_100000684558_100000211992 [0,1,0,0,0,0|1,0,0]=2 4310 B15R0.366 CCCCCCCCCCNC(=O)CCC 527a_100000684558_100000211992 [0,1,0,0,0,0|1,0,0]=2 4311 B15R0.366 CCCCCCCCCCNC(=O)CCO 240690a_100000684558_100011216618 [0,1,0,0,0,0|2,0,0]=3 4312 B15R0.366 CCCCCCCCCCNC(=O)COC 11a_100000684558_100000210968 [0,1,0,0,0,0|2,0,0]=3 4313 B15R0.366 CCCCCCCCCCNC(=O)COC 1626a_100000684558_100000210968 [0,1,0,0,0,0|2,0,0]=3 4314 B15R0.366 CCCCCCCCCCNC(=O)COC 240690a_100000684558_100000210968 [0,1,0,0,0,0|2,0,0]=3 4315 B15R0.366 CCCCCCCCCCNC(=O)COC 527a_100000684558_100000210968 [0,1,0,0,0,0|2,0,0]=3 4316 B15R0.366 CCCCCCCCCCNC(=O)CSC 11a_100000684558_100000184570 [0,1,0,0,0,0|2,0,0]=3 4317 B15R0.366 CCCCCCCCCCNC(=O)CSC 1626a_100000684558_100000184570 [0,1,0,0,0,0|2,0,0]=3 4318 B15R0.366 CCCCCCCCCCNC(=O)CSC 240690a_100000684558_100000184570 [0,1,0,0,0,0|2,0,0]=3 4319 B15R0.366 CCCCCCCCCCNC(=O)CSC 527a_100000684558_100000184570 [0,1,0,0,0,0|2,0,0]=3 4320 B15R0.366 CCCCCCCCCCNC(=O)NCC 2708a_100000684558_100015525214 [0,1,0,0,0,0|1,0,0]=2 4321 B15R0.366 CCCCCCCCCCNC(=O)NCC 2708a_100015525214_100000684558 [0,1,0,0,0,0|1,0,0]=2 4322 B15R0.366 CCCCCCCCCCNC(=O)NCC 273464a_100000684558_100015525214 [0,1,0,0,0,0|1,0,0]=2 4323 B15R0.366 CCCCCCCCCCNC(=O)NCC 273464a_100015525214_100000684558 [0,1,0,0,0,0|1,0,0]=2 4324 B15R0.366 CCCCCCCCCCNC(=O)NCC 512a_100000684558_100015525214 [0,1,0,0,0,0|1,0,0]=2 4325 B15R0.366 CCCCCCCCCCNC(=O)NCC 512a_100015525214_100000684558 [0,1,0,0,0,0|1,0,0]=2 4326 B15R0.366 CCCCCCCCCCNC(=O)NNC 273464a_100000684558_100016993582 [0,1,0,0,0,0|2,0,0]=3 4327 B15R0.366 CCCCCCCCCCNC(=O)NNC 512a_100000684558_100016993582 [0,1,0,0,0,0|2,0,0]=3 4328 B15R0.366 CCCCCCCCCCNC(=O)NNC 512a_100016993582_100000684558 [0,1,0,0,0,0|2,0,0]=3 4329 B15R0.366 CCCCCCCCCCNC(C)CCC 2230a_100000684558_100000766640 [0,1,0,0,0,0|2,0,1]=4 4330 B15R0.366 CCCCCCCCCCNC(C)CCC 2230a_100000741246_100000210320 [0,1,0,0,0,0|2,0,1]=4 4331 B15R0.366 CCCCCCCCCCNC(C)CCC 270004a_100000684558_100000211909 [0,1,0,0,0,0|2,0,1]=4 4332 B15R0.366 CCCCCCCCCCNC(C)CCC 34a_100000684558_100000766640 [0,1,0,0,0,0|2,0,1]=4 4333 B15R0.366 CCCCCCCCCCOC(=O)CNC 2230a_106832991635_100000210668 [0,1,0,0,0,0|2,0,0]=3 4334 B15R0.366 CCCCCCCCCCOC(=O)CNC 34a_100102657272_100000210668 [0,1,0,0,0,0|2,0,0]=3 4335 B15R0.366 CCCCCCCCCCOC(=O)CNC 7a_106832991635_100000210668 [0,1,0,0,0,0|2,0,0]=3 4336 B15R0.366 CCCCCCCCCCOC(=O)COC 34a_100138415774_100000210668 [0,1,0,0,0,0|2,0,0]=3 4337 B15R0.366 CCCCCCCCCCOC(=O)CSC 62a_100000680656_200000210301 [0,1,0,0,0,0|2,0,0]=3 4338 B15R0.366 CCCCCCCCCCOC(=O)CSC 62a_200000210301_100000680656 [0,1,0,0,0,0|2,0,0]=3 4339 B15R0.366 CCCCCCCCCCOC(=O)CS[13CH3] 62a_100000680656_200025704644 [0,1,0,0,0,0|2,0,0]=3 4340 B15R0.366 CCCCCCCCCCOC(=O)CS[13CH3] 62a_200025704644_100000680656 [0,1,0,0,0,0|2,0,0]=3 4341 B15R0.366 CCCCCCCCCNCC(=O)CCC 2230a_100000212291_100000747444 [0,1,0,0,0,0|1,0,0]=2 4342 B15R0.366 CCCCCCCCCNCC(=O)NCC 2230a_100000212291_100000183381 [0,1,0,0,0,0|1,0,0]=2 4343 B15R0.366 CCCCCCCCCNCC(=O)NCC 2230a_100016988866_100011214924 [0,1,0,0,0,0|1,0,0]=2 4344 B15R0.366 CCCCCCCCCNCC(=O)NCC 34a_100000212291_100000183381 [0,1,0,0,0,0|1,0,0]=2 4345 B15R0.366 CCCCCCCCCNCC(=O)NCO 2230a_100000212291_100000185155 [0,1,0,0,0,0|2,0,0]=3 4346 B15R0.366 CCCCCCCCCNCC(=O)NCO 34a_100000212291_100000185155 [0,1,0,0,0,0|2,0,0]=3 4347 B15R0.366 CCCCCCCCCNCC(=O)OCC 2230a_100000212291_100000188475 [0,1,0,0,0,0|0,0,0]=1 4348 B15R0.366 CCCCCCCCCNCC(=O)OCC 34a_100000212291_100000188475 [0,1,0,0,0,0|0,0,0]=1 4349 B15R0.366 CCCCCCCCCNCC(C)CCC 2230a_100000212291_100011216630 [0,1,0,0,0,0|2,0,1]=4 4350 B15R0.366 CCCCCCCCCNCC(C)CCC 270004a_100000212291_100000243154 [0,1,0,0,0,0|2,0,1]=4 4351 B15R0.366 CCCCCCCCCNCC(C)CCC 34a_100000212291_100011216630 [0,1,0,0,0,0|2,0,1]=4 4352 B15R0.366 CCCCCCCCCOCC(=O)CCC 7a_100000210712_100000747444 [0,1,0,0,0,0|1,0,0]=2 4353 B15R0.366 CCCCCCCCCOCC(=O)NCC 34a_100000210712_100000183381 [0,1,0,0,0,0|1,0,0]=2 4354 B15R0.366 CCCCCCCCCOCC(=O)NCC 7a_100000210712_100000183381 [0,1,0,0,0,0|1,0,0]=2 4355 B15R0.366 CCCCCCCCCOCC(=O)NCO 34a_100000210712_100000185155 [0,1,0,0,0,0|2,0,0]=3 4356 B15R0.366 CCCCCCCCCOCC(=O)NCO 7a_100000210712_100000185155 [0,1,0,0,0,0|2,0,0]=3 4357 B15R0.366 CCCCCCCCCOCC(=O)OCC 34a_100000210712_100000188475 [0,1,0,0,0,0|0,0,0]=1 4358 B15R0.366 CCCCCCCCCOCC(=O)OCC 7a_100000210712_100000188475 [0,1,0,0,0,0|0,0,0]=1 4359 B15R0.366 CCCCCCCCCOC[C@@H](N)CCC 34a_100000732646_100011214924 [0,1,0,0,0,0|2,0,1]=4 4360 B15R0.366 CCCCCCCCCSCC(=O)CCC 62a_100000747444_100000210670 [0,1,0,0,0,0|1,0,0]=2 4361 B15R0.366 CCCCCCCCCSCC(=O)NCC 62a_100000183381_100000210670 [0,1,0,0,0,0|1,0,0]=2 4362 B15R0.366 CCCCCCCCCSCC(=O)NCO 62a_100000185155_100000210670 [0,1,0,0,0,0|2,0,0]=3 4363 B15R0.366 CCCCCCCCCSCC(=O)OCC 62a_100000188475_100000210670 [0,1,0,0,0,0|0,0,0]=1 4364 B15R0.366 CCCCCCCCNCCC(=O)NCC 2230a_100000229939_100000737597 [0,1,0,0,0,0|1,0,0]=2 4365 B15R0.366 CCCCCCCCNCCC(=O)NCC 34a_100025743525_100000210759 [0,1,0,0,0,0|1,0,0]=2 4366 B15R0.366 CCCCCCCCNCCC(=O)OCC 2230a_100000229939_100011206558 [0,1,0,0,0,0|0,0,0]=1 4367 B15R0.366 CCCCCCCCNCCC(=O)OCC 34a_100000229939_100000765890 [0,1,0,0,0,0|0,0,0]=1 4368 B15R0.366 CCCCCCCCNCOC(=O)CCC 2230a_100000229939_100000034017 [0,1,0,0,0,0|2,0,0]=3 4369 B15R0.366 CCCCCCCCNCOC(=O)CCC 34a_100000229939_100000034017 [0,1,0,0,0,0|2,0,0]=3 4370 B15R0.366 CCCCCCCCOCCC(=O)NCC 7a_100000210232_100000737597 [0,1,0,0,0,0|1,0,0]=2 4371 B15R0.366 CCCCCCCCOCCC(=O)OCC 34a_100000210232_100000765890 [0,1,0,0,0,0|0,0,0]=1 4372 B15R0.366 CCCCCCCCOCCC(=O)OCC 7a_100000210232_100011206558 [0,1,0,0,0,0|0,0,0]=1 4373 B15R0.366 CCCCCCCCOCC[C@@H](N)CCC 34a_100015193777_100000210759 [0,1,0,0,0,0|2,0,1]=4 4374 B15R0.366 CCCCCCCCOCOC(=O)CCC 34a_100000210232_100000034017 [0,1,0,0,0,0|2,0,0]=3 4375 B15R0.366 CCCCCCCCSCCC(=O)NCC 62a_100000210759_100000737597 [0,1,0,0,0,0|1,0,0]=2 4376 B15R0.366 CCCCCCCCSCCC(=O)NCC 62a_100000737597_100000210317 [0,1,0,0,0,0|1,0,0]=2 4377 B15R0.366 CCCCCCCCSCCC(=O)OCC 62a_100000210759_100000765890 [0,1,0,0,0,0|0,0,0]=1 4378 B15R0.366 CCCCCCCCSCCC(=O)OCC 62a_100000765890_100000210317 [0,1,0,0,0,0|0,0,0]=1 4379 B15R0.366 CCCCCCCCSCOC(=O)CCC 62a_100000210759_100000034017 [0,1,0,0,0,0|2,0,0]=3 4380 B15R0.366 CCCCCCCCSCOC(=O)OCC 62a_100000210759_100000075025 [0,1,0,0,0,0|1,0,0]=2 4381 B15R0.366 CCCCCCCNC/C=C/C(=O)OCC 2230a_100000229938_100016267167 [0,1,0,0,0,0|0,0,2]=3 4382 B15R0.366 CCCCCCCNCCCC(=O)OCC 2230a_100000229938_100009991533 [0,1,0,0,0,0|0,0,0]=1 4383 B15R0.366 CCCCCCCOC/C=C/C(=O)OCC 34a_100000210272_100016267167 [0,1,0,0,0,0|0,0,2]=3 4384 B15R0.366 CCCCCCCOC/C=C/C(=O)OCC 7a_100000210272_100016267167 [0,1,0,0,0,0|0,0,2]=3 4385 B15R0.366 CCCCCCCOCCCC(=O)OCC 34a_100000210272_100009991533 [0,1,0,0,0,0|0,0,0]=1 4386 B15R0.366 CCCCCCCOCCCC(=O)OCC 7a_100000210272_100011215271 [0,1,0,0,0,0|0,0,0]=1 4387 B15R0.366 CCCCCCCOCCCC(=O)OCC 7a_100012001163_100000210614 [0,1,0,0,0,0|0,0,0]=1 4388 B15R0.366 CCCCCCCOCCNC(=O)OCC 34a_100000158857_100000210614 [0,1,0,0,0,0|1,0,0]=2 4389 B15R0.366 CCCCCCCOCCNC(=O)OCC 7a_100000210272_200011445536 [0,1,0,0,0,0|1,0,0]=2 4390 B15R0.366 CCCCCCCSC/C=C/C(=O)OCC 62a_100000210614_100016267167 [0,1,0,0,0,0|0,0,2]=3 4391 B15R0.366 CCCCCCCSC/C=C/C(=O)OCC 62a_100016267167_100000210316 [0,1,0,0,0,0|0,0,2]=3 4392 B15R0.366 CCCCCCCSCCCC(=O)OCC 62a_100000210614_100009991533 [0,1,0,0,0,0|0,0,0]=1 4393 B15R0.366 CCCCCCCSCCCC(=O)OCC 62a_100009991533_100000210316 [0,1,0,0,0,0|0,0,0]=1 4394 B15R0.366 CCCCCCCSCCNC(=O)OCC 62a_100000210614_200011445536 [0,1,0,0,0,0|1,0,0]=2 4395 B15R0.366 CCCCCCNCCCCC(=O)OCC 2230a_100000210581_100000750268 [0,1,0,0,0,0|0,0,0]=1 4396 B15R0.366 CCCCCCNCCOCC(=O)OCC 2230a_100000210581_100000088970 [0,1,0,0,0,0|1,0,0]=2 4397 B15R0.366 CCCCCCOCCCCC(=O)OCC 34a_100000210259_100000750268 [0,1,0,0,0,0|0,0,0]=1 4398 B15R0.366 CCCCCCOCCCCC(=O)OCC 7a_100000210259_100000750268 [0,1,0,0,0,0|0,0,0]=1 4399 B15R0.366 CCCCCCOCCOCC(=O)CCC 7a_100000691444_100000747444 [0,1,0,0,0,0|2,0,0]=3 4400 B15R0.366 CCCCCCOCCOCC(=O)NCC 34a_100000691444_100000183381 [0,1,0,0,0,0|2,0,0]=3 4401 B15R0.366 CCCCCCOCCOCC(=O)NCC 7a_100000691444_100000183381 [0,1,0,0,0,0|2,0,0]=3 4402 B15R0.366 CCCCCCOCCOCC(=O)NCO 34a_100000691444_100000185155 [0,1,0,0,0,0|3,0,0]=4 4403 B15R0.366 CCCCCCOCCOCC(=O)NCO 7a_100000691444_100000185155 [0,1,0,0,0,0|3,0,0]=4 4404 B15R0.366 CCCCCCOCCOCC(=O)OCC 34a_100000210259_100000088970 [0,1,0,0,0,0|1,0,0]=2 4405 B15R0.366 CCCCCCOCCOCC(=O)OCC 34a_100000691444_100000188475 [0,1,0,0,0,0|1,0,0]=2 4406 B15R0.366 CCCCCCOCCOCC(=O)OCC 7a_100000210259_100000088970 [0,1,0,0,0,0|1,0,0]=2 4407 B15R0.366 CCCCCCOCCOCC(=O)OCC 7a_100000691444_100000188475 [0,1,0,0,0,0|1,0,0]=2 4408 B15R0.366 CCCCCCOCCSCC(=O)OCC 7a_200000230590_100000210314 [0,1,0,0,0,0|1,0,0]=2 4409 B15R0.366 CCCCCCSCC=NNC(=O)OCC 62a_100000210314_100015372823 [0,1,0,0,0,0|2,0,1]=4 4410 B15R0.366 CCCCCCSCCCCC(=O)OCC 62a_100000210314_100000750268 [0,1,0,0,0,0|0,0,0]=1 4411 B15R0.366 CCCCCCSCCCCC(=O)OCC 62a_100000750268_100000210757 [0,1,0,0,0,0|0,0,0]=1 4412 B15R0.366 CCCCCCSCCOCC(=O)OCC 62a_100000088970_100000210757 [0,1,0,0,0,0|1,0,0]=2 4413 B15R0.366 CCCCCCSCCOCC(=O)OCC 62a_100000210314_100000088970 [0,1,0,0,0,0|1,0,0]=2 4414 B15R0.366 CCCCCNCCCCCC(=O)OCC 2230a_100000209983_100000755133 [0,1,0,0,0,0|0,0,0]=1 4415 B15R0.366 CCCCCNCCCOCC(=O)OCC 2230a_100000209983_100009893628 [0,1,0,0,0,0|1,0,0]=2 4416 B15R0.366 CCCCCNCCOCCC(=O)OCC 34a_100000224656_100000765890 [0,1,0,0,0,0|1,0,0]=2 4417 B15R0.366 CCCCCNCCOCOC(=O)CCC 34a_100000224656_100000034017 [0,1,0,0,0,0|3,0,0]=4 4418 B15R0.366 CCCCCOCCCCCC(=O)OCC 34a_100000210253_100000755133 [0,1,0,0,0,0|0,0,0]=1 4419 B15R0.366 CCCCCOCCCCCC(=O)OCC 7a_100000210253_100000755133 [0,1,0,0,0,0|0,0,0]=1 4420 B15R0.366 CCCCCOCCCCCC(=O)OCC 7a_100011214988_100000210326 [0,1,0,0,0,0|0,0,0]=1 4421 B15R0.366 CCCCCOCCCOCC(=O)OCC 34a_100000210253_100009893628 [0,1,0,0,0,0|1,0,0]=2 4422 B15R0.366 CCCCCOCCCOCC(=O)OCC 7a_100000210253_100009893628 [0,1,0,0,0,0|1,0,0]=2 4423 B15R0.366 CCCCCOCCOCCC(=O)NCC 7a_100011215259_100000737597 [0,1,0,0,0,0|2,0,0]=3 4424 B15R0.366 CCCCCOCCOCCC(=O)OCC 34a_100011215259_100000765890 [0,1,0,0,0,0|1,0,0]=2 4425 B15R0.366 CCCCCOCCOCCC(=O)OCC 7a_100011215259_100011206558 [0,1,0,0,0,0|1,0,0]=2 4426 B15R0.366 CCCCCOCCOCOC(=O)CCC 34a_100011215259_100000034017 [0,1,0,0,0,0|3,0,0]=4 4427 B15R0.366 CCCCCSCCCCCC(=O)OCC 62a_100000210326_100000755133 [0,1,0,0,0,0|0,0,0]=1 4428 B15R0.366 CCCCCSCCCCCC(=O)OCC 62a_100000755133_100000210326 [0,1,0,0,0,0|0,0,0]=1 4429 B15R0.366 CCCCCSCCCOCC(=O)OCC 62a_100000210326_100009893628 [0,1,0,0,0,0|1,0,0]=2 4430 B15R0.366 CCCCCSCCCOCC(=O)OCC 62a_100009893628_100000210326 [0,1,0,0,0,0|1,0,0]=2 4431 B15R0.366 CCCCNCCCCCCC(=O)OCC 2230a_100000102301_100009814379 [0,1,0,0,0,0|0,0,0]=1 4432 B15R0.366 CCCCNCCCCCCC(=O)OCC 7a_106832991798_100009814379 [0,1,0,0,0,0|0,0,0]=1 4433 B15R0.366 CCCCNCCCCOCC(=O)NCC 34a_200011216965_100000183381 [0,1,0,0,0,0|2,0,0]=3 4434 B15R0.366 CCCCNCCCCOCC(=O)NCO 34a_200011216965_100000185155 [0,1,0,0,0,0|3,0,0]=4 4435 B15R0.366 CCCCNCCCCOCC(=O)OCC 34a_200011216965_100000188475 [0,1,0,0,0,0|1,0,0]=2 4436 B15R0.366 CCCCNN=CCCCCC(=O)OCC 4a_100025702795_100012182868 [0,1,0,0,0,0|1,0,1]=3 4437 B15R0.366 CCCCOCCCCCCC(=O)OCC 34a_100000210227_100009814379 [0,1,0,0,0,0|0,0,0]=1 4438 B15R0.366 CCCCOCCCCCCC(=O)OCC 7a_100000210227_100009814379 [0,1,0,0,0,0|0,0,0]=1 4439 B15R0.366 CCCCOCCCCOCC(=O)CCC 7a_200000760531_100000747444 [0,1,0,0,0,0|2,0,0]=3 4440 B15R0.366 CCCCOCCCCOCC(=O)NCC 34a_200000760531_100000183381 [0,1,0,0,0,0|2,0,0]=3 4441 B15R0.366 CCCCOCCCCOCC(=O)NCC 7a_200000760531_100000183381 [0,1,0,0,0,0|2,0,0]=3 4442 B15R0.366 CCCCOCCCCOCC(=O)NCO 34a_200000760531_100000185155 [0,1,0,0,0,0|3,0,0]=4 4443 B15R0.366 CCCCOCCCCOCC(=O)NCO 7a_200000760531_100000185155 [0,1,0,0,0,0|3,0,0]=4 4444 B15R0.366 CCCCOCCCCOCC(=O)OCC 34a_200000760531_100000188475 [0,1,0,0,0,0|1,0,0]=2 4445 B15R0.366 CCCCOCCCCOCC(=O)OCC 7a_200000760531_100000188475 [0,1,0,0,0,0|1,0,0]=2 4446 B15R0.366 CCCCOCCCNCCC(=O)NCC 2230a_200000211371_100000737597 [0,1,0,0,0,0|2,0,0]=3 4447 B15R0.366 CCCCOCCCNCCC(=O)OCC 2230a_200000211371_100011206558 [0,1,0,0,0,0|1,0,0]=2 4448 B15R0.366 CCCCOCCCNCCC(=O)OCC 34a_200000211371_100000765890 [0,1,0,0,0,0|1,0,0]=2 4449 B15R0.366 CCCCOCCCNCOC(=O)CCC 2230a_200000211371_100000034017 [0,1,0,0,0,0|3,0,0]=4 4450 B15R0.366 CCCCOCCCNCOC(=O)CCC 34a_200000211371_100000034017 [0,1,0,0,0,0|3,0,0]=4 4451 B15R0.366 CCCCOCCCOCCC(=O)NCC 7a_200011215613_100000737597 [0,1,0,0,0,0|2,0,0]=3 4452 B15R0.366 CCCCOCCCOCCC(=O)OCC 34a_200011215613_100000765890 [0,1,0,0,0,0|1,0,0]=2 4453 B15R0.366 CCCCOCCCOCCC(=O)OCC 7a_200011215613_100011206558 [0,1,0,0,0,0|1,0,0]=2 4454 B15R0.366 CCCCOCCCOCOC(=O)CCC 34a_200011215613_100000034017 [0,1,0,0,0,0|3,0,0]=4 4455 B15R0.366 CCCCOCCOC/C=C/C(=O)OCC 34a_100000210238_100016267167 [0,1,0,0,0,0|1,0,2]=4 4456 B15R0.366 CCCCOCCOC/C=C/C(=O)OCC 7a_100000210238_100016267167 [0,1,0,0,0,0|1,0,2]=4 4457 B15R0.366 CCCCOCCOCCCC(=O)OCC 34a_100000210238_100009991533 [0,1,0,0,0,0|1,0,0]=2 4458 B15R0.366 CCCCOCCOCCCC(=O)OCC 7a_100000210238_100011215271 [0,1,0,0,0,0|1,0,0]=2 4459 B15R0.366 CCCCOCCOCCCC(=O)OCC 7a_100012001163_100000743108 [0,1,0,0,0,0|1,0,0]=2 4460 B15R0.366 CCCCOCCOCCNC(=O)OCC 34a_100000158857_100000743108 [0,1,0,0,0,0|2,0,0]=3 4461 B15R0.366 CCCCOCCOCCNC(=O)OCC 7a_100000210238_200011445536 [0,1,0,0,0,0|2,0,0]=3 4462 B15R0.366 CCCCOCCSC/C=C/C(=O)OCC 62a_100000743108_100016267167 [0,1,0,0,0,0|1,0,2]=4 4463 B15R0.366 CCCCOCCSC/C=C/C(=O)OCC 62a_100016267167_100000743108 [0,1,0,0,0,0|1,0,2]=4 4464 B15R0.366 CCCCOCCSCCCC(=O)OCC 62a_100000743108_100009991533 [0,1,0,0,0,0|1,0,0]=2 4465 B15R0.366 CCCCOCCSCCCC(=O)OCC 62a_100009991533_100000743108 [0,1,0,0,0,0|1,0,0]=2 4466 B15R0.366 CCCCOCCSCCNC(=O)OCC 62a_100000743108_200011445536 [0,1,0,0,0,0|2,0,0]=3 4467 B15R0.366 CCCCOCSCCCCC(=O)OCC 62a_100000750268_100011995733 [0,1,0,0,0,0|1,0,0]=2 4468 B15R0.366 CCCCOCSCCCCC(=O)OCC 62a_100011995733_100000750268 [0,1,0,0,0,0|1,0,0]=2 4469 B15R0.366 CCCCOCSCCOCC(=O)OCC 62a_100000088970_100011995733 [0,1,0,0,0,0|2,0,0]=3 4470 B15R0.366 CCCCOCSCCOCC(=O)OCC 62a_100011995733_100000088970 [0,1,0,0,0,0|2,0,0]=3 4471 B15R0.366 CCCCSCCCCCCC(=O)OCC 62a_100000210211_100009814379 [0,1,0,0,0,0|0,0,0]=1 4472 B15R0.366 CCCCSCCNC/C=C/C(=O)OCC 2230a_100025743550_100016267167 [0,1,0,0,0,0|1,0,2]=4 4473 B15R0.366 CCCCSCCNCCCC(=O)OCC 2230a_100025743550_100009991533 [0,1,0,0,0,0|1,0,0]=2 4474 B15R0.366 CCCCSCCOC/C=C/C(=O)OCC 34a_200000230436_100016267167 [0,1,0,0,0,0|1,0,2]=4 4475 B15R0.366 CCCCSCCOC/C=C/C(=O)OCC 7a_200000230436_100016267167 [0,1,0,0,0,0|1,0,2]=4 4476 B15R0.366 CCCCSCCOCCCC(=O)OCC 34a_200000230436_100009991533 [0,1,0,0,0,0|1,0,0]=2 4477 B15R0.366 CCCCSCCOCCCC(=O)OCC 7a_200000230436_100011215271 [0,1,0,0,0,0|1,0,0]=2 4478 B15R0.366 CCCCSCCOCCNC(=O)OCC 7a_200000230436_200011445536 [0,1,0,0,0,0|2,0,0]=3 4479 B15R0.366 CCCN(C)CCCCCCCCCCO 2230a_100000747261_100009813290 [0,1,0,0,0,0|3,0,0]=4 4480 B15R0.366 CCCN(C)CCCCCCCCCCO 269982a_100000747261_100009813290 [0,1,0,0,0,0|3,0,0]=4 4481 B15R0.366 CCCNN=CCCCCCC(=O)OCC 4a_100000740057_100000085164 [0,1,0,0,0,0|1,0,1]=3 4482 B15R0.366 CCCOCCCCCCCC(=O)OCC 34a_100000210258_100009991516 [0,1,0,0,0,0|0,0,0]=1 4483 B15R0.366 CCCOCCCNC/C=C/C(=O)OCC 2230a_100011217757_100016267167 [0,1,0,0,0,0|1,0,2]=4 4484 B15R0.366 CCCOCCCNC/C=C/C(=O)OCC 34a_100011217757_100016267167 [0,1,0,0,0,0|1,0,2]=4 4485 B15R0.366 CCCOCCCNCCCC(=O)OCC 2230a_100011217757_100009991533 [0,1,0,0,0,0|1,0,0]=2 4486 B15R0.366 CCCOCCCNCCCC(=O)OCC 34a_100011217757_100009991533 [0,1,0,0,0,0|1,0,0]=2 4487 B15R0.366 CCCOCCNCCCCC(=O)OCC 2230a_100161115042_100000750268 [0,1,0,0,0,0|1,0,0]=2 4488 B15R0.366 CCCOCCNCCCCC(=O)OCC 34a_100161115042_100000750268 [0,1,0,0,0,0|1,0,0]=2 4489 B15R0.366 CCCOCCNCCOCC(=O)OCC 2230a_100161115042_100000088970 [0,1,0,0,0,0|2,0,0]=3 4490 B15R0.366 CCCOCCNCCOCC(=O)OCC 34a_100161115042_100000088970 [0,1,0,0,0,0|2,0,0]=3 4491 B15R0.366 CCCOCCOCCCCC(=O)OCC 34a_100000752267_100000750268 [0,1,0,0,0,0|1,0,0]=2 4492 B15R0.366 CCCOCCOCCCCC(=O)OCC 7a_100000752267_100000750268 [0,1,0,0,0,0|1,0,0]=2 4493 B15R0.366 CCCOCCOCCNCC(=O)CCC 2230a_200011904461_100000747444 [0,1,0,0,0,0|3,0,0]=4 4494 B15R0.366 CCCOCCOCCNCC(=O)NCC 2230a_200011904461_100000183381 [0,1,0,0,0,0|3,0,0]=4 4495 B15R0.366 CCCOCCOCCNCC(=O)NCC 34a_200011904461_100000183381 [0,1,0,0,0,0|3,0,0]=4 4496 B15R0.366 CCCOCCOCCNCC(=O)OCC 2230a_200011904461_100000188475 [0,1,0,0,0,0|2,0,0]=3 4497 B15R0.366 CCCOCCOCCNCC(=O)OCC 34a_200011904461_100000188475 [0,1,0,0,0,0|2,0,0]=3 4498 B15R0.366 CCCOCCOCCOCC(=O)OCC 34a_100000752267_100000088970 [0,1,0,0,0,0|2,0,0]=3 4499 B15R0.366 CCCOCCOCCOCC(=O)OCC 7a_100000752267_100000088970 [0,1,0,0,0,0|2,0,0]=3 4500 B15R0.366 CCCOCCOCCSCC(=O)OCC 7a_200000230590_100011215938 [0,1,0,0,0,0|2,0,0]=3 4501 B15R0.366 CCCOCCSCCCCC(=O)OCC 62a_100000750268_100011215938 [0,1,0,0,0,0|1,0,0]=2 4502 B15R0.366 CCCOCCSCCCCC(=O)OCC 62a_100011215938_100000750268 [0,1,0,0,0,0|1,0,0]=2 4503 B15R0.366 CCCOCCSCCOCC(=O)OCC 62a_100000088970_100011215938 [0,1,0,0,0,0|2,0,0]=3 4504 B15R0.366 CCCOCCSCCOCC(=O)OCC 62a_100011215938_100000088970 [0,1,0,0,0,0|2,0,0]=3 4505 B15R0.366 CCCSCCCCCCCC(=O)OCC 62a_100000210303_100009991516 [0,1,0,0,0,0|0,0,0]=1 4506 B15R0.366 CCCSCCNCCCCC(=O)OCC 2230a_100020603323_100000750268 [0,1,0,0,0,0|1,0,0]=2 4507 B15R0.366 CCCSCCNCCOCC(=O)OCC 2230a_100020603323_100000088970 [0,1,0,0,0,0|2,0,0]=3 4508 B15R0.366 CCCSCCOCCCCC(=O)OCC 34a_200000230433_100000750268 [0,1,0,0,0,0|1,0,0]=2 4509 B15R0.366 CCCSCCOCCCCC(=O)OCC 7a_200000230433_100000750268 [0,1,0,0,0,0|1,0,0]=2 4510 B15R0.366 CCCSCCOCCOCC(=O)OCC 34a_200000230433_100000088970 [0,1,0,0,0,0|2,0,0]=3 4511 B15R0.366 CCCSCCOCCOCC(=O)OCC 7a_200000230433_100000088970 [0,1,0,0,0,0|2,0,0]=3 4512 B15R0.366 CCNC(=O)CCCCCCCCCCO 240690a_100015525214_200000016029 [0,1,0,0,0,0|1,0,0]=2 4513 B15R0.366 CCNC(=O)CCNCCCCCCCO 2230a_100011996573_100000737597 [0,1,0,0,0,0|2,0,0]=3 4514 B15R0.366 CCNC(=O)CCNCCCCCCCO 34a_100025743525_100000760002 [0,1,0,0,0,0|2,0,0]=3 4515 B15R0.366 CCNC(=O)CCNCCCCCCOC 34a_100025743525_100011998445 [0,1,0,0,0,0|2,0,0]=3 4516 B15R0.366 CCNC(=O)CCNCCCOCCCO 2230a_100011310245_100000737597 [0,1,0,0,0,0|3,0,0]=4 4517 B15R0.366 CCNC(=O)CCNCCCOCCOC 2230a_100000206027_100000737597 [0,1,0,0,0,0|3,0,0]=4 4518 B15R0.366 CCNC(=O)CCNCCCOCCOC 34a_100025743525_100011216529 [0,1,0,0,0,0|3,0,0]=4 4519 B15R0.366 CCNC(=O)CCNCCOCCOCC 2230a_100102712874_100000737597 [0,1,0,0,0,0|3,0,0]=4 4520 B15R0.366 CCNC(=O)CCNCCOCCOCC 34a_100025743525_100011211534 [0,1,0,0,0,0|3,0,0]=4 4521 B15R0.366 CCNC(=O)CCOCCCCCCCBr 7a_100000760002_100000737597 [0,1,0,0,0,0|2,0,0]=3 4522 B15R0.366 CCNC(=O)CCOCCCCCCOC 7a_200012092642_100000737597 [0,1,0,0,0,0|2,0,0]=3 4523 B15R0.366 CCNC(=O)CCOCCOCCOCC 7a_100000210240_100000737597 [0,1,0,0,0,0|3,0,0]=4 4524 B15R0.366 CCNC(=O)CCSCCCCCCC#N 62a_100000737597_100009813337 [0,1,0,0,0,0|2,0,1]=4 4525 B15R0.366 CCNC(=O)CCSCCCCCCC#N 62a_100009813337_100000737597 [0,1,0,0,0,0|2,0,1]=4 4526 B15R0.366 CCNC(=O)CCSCCCCCCCO 62a_100000737597_100000760002 [0,1,0,0,0,0|2,0,0]=3 4527 B15R0.366 CCNC(=O)CCSCCCCCCCO 62a_100000760002_100000737597 [0,1,0,0,0,0|2,0,0]=3 4528 B15R0.366 CCNC(=O)CCSCCCCCCOC 62a_100000737597_100011998445 [0,1,0,0,0,0|2,0,0]=3 4529 B15R0.366 CCNC(=O)CCSCCCCCCOC 62a_100011998445_100000737597 [0,1,0,0,0,0|2,0,0]=3 4530 B15R0.366 CCNC(=O)CCSCCCOCCOC 62a_100000737597_100011216529 [0,1,0,0,0,0|3,0,0]=4 4531 B15R0.366 CCNC(=O)CCSCCCOCCOC 62a_100011216529_100000737597 [0,1,0,0,0,0|3,0,0]=4 4532 B15R0.366 CCNC(=O)CCSCCOCCOCC 62a_100000737597_100011211534 [0,1,0,0,0,0|3,0,0]=4 4533 B15R0.366 CCNC(=O)CCSCCOCCOCC 62a_100011211534_100000737597 [0,1,0,0,0,0|3,0,0]=4 4534 B15R0.366 CCNC(=O)CNCCCCCCCCO 2230a_100016988866_100000033203 [0,1,0,0,0,0|2,0,0]=3 4535 B15R0.366 CCNC(=O)CNCCCCCCCCO 2230a_102515433106_100000183381 [0,1,0,0,0,0|2,0,0]=3 4536 B15R0.366 CCNC(=O)CNCCCCCCCCO 34a_102515433106_100000183381 [0,1,0,0,0,0|2,0,0]=3 4537 B15R0.366 CCNC(=O)COCCCCCCCCBr 34a_100009813846_100000183381 [0,1,0,0,0,0|2,0,0]=3 4538 B15R0.366 CCNC(=O)COCCCCCCCCBr 7a_100009813846_100000183381 [0,1,0,0,0,0|2,0,0]=3 4539 B15R0.366 CCNC(=O)COCCCCCCCCCl 34a_100000033203_100000183381 [0,1,0,0,0,0|2,0,0]=3 4540 B15R0.366 CCNC(=O)COCCCCCCCCCl 7a_100000033203_100000183381 [0,1,0,0,0,0|2,0,0]=3 4541 B15R0.366 CCNC(=O)COCCCCCCCCN 34a_102515433106_100000183381 [0,1,0,0,0,0|2,0,0]=3 4542 B15R0.366 CCNC(=O)COCCCCCNCCN 34a_103619048469_100000183381 [0,1,0,0,0,0|3,0,0]=4 4543 B15R0.366 CCNC(=O)COCCCOCCCOC 34a_200011215475_100000183381 [0,1,0,0,0,0|3,0,0]=4 4544 B15R0.366 CCNC(=O)COCCCOCCCOC 7a_200011215475_100000183381 [0,1,0,0,0,0|3,0,0]=4 4545 B15R0.366 CCNC(=O)CSCCCCCCCCO 62a_100000033203_100000183381 [0,1,0,0,0,0|2,0,0]=3 4546 B15R0.366 CCNC(=O)CSCCCCCCCCO 62a_100000183381_100000033203 [0,1,0,0,0,0|2,0,0]=3 4547 B15R0.366 CCNC(=O)NCCCCCCCCCO 2708a_100000078944_100015525214 [0,1,0,0,0,0|2,0,0]=3 4548 B15R0.366 CCNC(=O)NCCCCCCCCCO 2708a_100015525214_100000078944 [0,1,0,0,0,0|2,0,0]=3 4549 B15R0.366 CCNC(=O)NCCCCCCCCCO 273464a_100000078944_100015525214 [0,1,0,0,0,0|2,0,0]=3 4550 B15R0.366 CCNC(=O)NCCCCCCCCCO 273464a_100015525214_100000078944 [0,1,0,0,0,0|2,0,0]=3 4551 B15R0.366 CCNC(=O)NCCCCCCCCCO 512a_100000078944_100015525214 [0,1,0,0,0,0|2,0,0]=3 4552 B15R0.366 CCNC(=O)NCCCCCCCCCO 512a_100015525214_100000078944 [0,1,0,0,0,0|2,0,0]=3 4553 B15R0.366 CCNCCCCCCCCC(=O)OCC 2230a_100015525214_100010175975 [0,1,0,0,0,0|0,0,0]=1 4554 B15R0.366 CCOC(=O)/C=C/CNCCCCCCO 2230a_100000686447_100016267167 [0,1,0,0,0,0|1,0,2]=4 4555 B15R0.366 CCOC(=O)/C=C/CNCCCCCCO 34a_100000686447_100016267167 [0,1,0,0,0,0|1,0,2]=4 4556 B15R0.366 CCOC(=O)/C=C/CNCCCCCOC 2230a_100000747528_100016267167 [0,1,0,0,0,0|1,0,2]=4 4557 B15R0.366 CCOC(=O)/C=C/CNCCCCCOC 34a_100000747528_100016267167 [0,1,0,0,0,0|1,0,2]=4 4558 B15R0.366 CCOC(=O)/C=C/COCCCCCCBr 34a_100011215345_100016267167 [0,1,0,0,0,0|1,0,2]=4 4559 B15R0.366 CCOC(=O)/C=C/COCCCCCCBr 7a_100011215345_100016267167 [0,1,0,0,0,0|1,0,2]=4 4560 B15R0.366 CCOC(=O)/C=C/COCCCCCCCl 34a_100000766143_100016267167 [0,1,0,0,0,0|1,0,2]=4 4561 B15R0.366 CCOC(=O)/C=C/COCCCCCCCl 7a_100000766143_100016267167 [0,1,0,0,0,0|1,0,2]=4 4562 B15R0.366 CCOC(=O)/C=C/COCCCCCCF 34a_100000732779_100016267167 [0,1,0,0,0,0|1,0,2]=4 4563 B15R0.366 CCOC(=O)/C=C/COCCCCCCF 7a_100000732779_100016267167 [0,1,0,0,0,0|1,0,2]=4 4564 B15R0.366 CCOC(=O)/C=C/COCCCCCCN 34a_100000686447_100016267167 [0,1,0,0,0,0|1,0,2]=4 4565 B15R0.366 CCOC(=O)/C=C/COCCCCCNC 34a_100000722520_100016267167 [0,1,0,0,0,0|1,0,2]=4 4566 B15R0.366 CCOC(=O)/C=C/CSCCCCCCF 62a_100015922095_100016267167 [0,1,0,0,0,0|1,0,2]=4 4567 B15R0.366 CCOC(=O)/C=C/CSCCCCCCF 62a_100016267167_100015922095 [0,1,0,0,0,0|1,0,2]=4 4568 B15R0.366 CCOC(=O)/C=C/CSCCCCCCO 62a_100000766143_100016267167 [0,1,0,0,0,0|1,0,2]=4 4569 B15R0.366 CCOC(=O)/C=C/CSCCCCCCO 62a_100016267167_100000766143 [0,1,0,0,0,0|1,0,2]=4 4570 B15R0.366 CCOC(=O)CCCCCC=NNCCO 4a_100000210001_100000085164 [0,1,0,0,0,0|2,0,1]=4 4571 B15R0.366 CCOC(=O)CCCCCCCCCNC 2230a_106832991635_100009828014 [0,1,0,0,0,0|0,0,0]=1 4572 B15R0.366 CCOC(=O)CCCCCCCCCNC 34a_100102657272_100009828014 [0,1,0,0,0,0|0,0,0]=1 4573 B15R0.366 CCOC(=O)CCCCCCCCCNC 7a_106832991635_100009828014 [0,1,0,0,0,0|0,0,0]=1 4574 B15R0.366 CCOC(=O)CCCCCCCCCOC 34a_100138415774_100009828014 [0,1,0,0,0,0|0,0,0]=1 4575 B15R0.366 CCOC(=O)CCCCCCCCCSC 62a_200000210301_100009828014 [0,1,0,0,0,0|0,0,0]=1 4576 B15R0.366 CCOC(=O)CCCCCCCCCS[13CH3] 62a_200025704644_100009828014 [0,1,0,0,0,0|0,0,0]=1 4577 B15R0.366 CCOC(=O)CCCCCCCCSCC 62a_100000210202_100010175975 [0,1,0,0,0,0|0,0,0]=1 4578 B15R0.366 CCOC(=O)CCCCCCCCSCF 62a_100015361967_100010175975 [0,1,0,0,0,0|1,0,0]=2 4579 B15R0.366 CCOC(=O)CCCCCCCNCCF 34a_100000724931_100009991516 [0,1,0,0,0,0|1,0,0]=2 4580 B15R0.366 CCOC(=O)CCCCCCCNCCO 2230a_100016997473_100009991516 [0,1,0,0,0,0|1,0,0]=2 4581 B15R0.366 CCOC(=O)CCCCCCCNCCO 34a_100016990907_100009991516 [0,1,0,0,0,0|1,0,0]=2 4582 B15R0.366 CCOC(=O)CCCCCCCOCCBr 34a_100000211926_100009991516 [0,1,0,0,0,0|1,0,0]=2 4583 B15R0.366 CCOC(=O)CCCCCCCOCCN 34a_100000210304_100009991516 [0,1,0,0,0,0|1,0,0]=2 4584 B15R0.366 CCOC(=O)CCCCCCCSCC#N 62a_100011215382_100009991516 [0,1,0,0,0,0|1,0,1]=3 4585 B15R0.366 CCOC(=O)CCCCCCCSCC=O 62a_200015260668_100009991516 [0,1,0,0,0,0|1,0,1]=3 4586 B15R0.366 CCOC(=O)CCCCCCCSCCF 62a_100011217306_100009991516 [0,1,0,0,0,0|1,0,0]=2 4587 B15R0.366 CCOC(=O)CCCCCCCSCCO 62a_100000211926_100009991516 [0,1,0,0,0,0|1,0,0]=2 4588 B15R0.366 CCOC(=O)CCCCCCCSCOC 62a_100000766300_100009991516 [0,1,0,0,0,0|1,0,0]=2 4589 B15R0.366 CCOC(=O)CCCCCCCSCSC 62a_100011218213_100009991516 [0,1,0,0,0,0|1,0,0]=2 4590 B15R0.366 CCOC(=O)CCCCCCNCCCF 2230a_100015189416_100009814379 [0,1,0,0,0,0|1,0,0]=2 4591 B15R0.366 CCOC(=O)CCCCCCNCCCF 34a_100015189416_100009814379 [0,1,0,0,0,0|1,0,0]=2 4592 B15R0.366 CCOC(=O)CCCCCCNCCOC 2230a_100000209980_100009814379 [0,1,0,0,0,0|1,0,0]=2 4593 B15R0.366 CCOC(=O)CCCCCCNCCSC 2230a_100020590264_100009814379 [0,1,0,0,0,0|1,0,0]=2 4594 B15R0.366 CCOC(=O)CCCCCCOCCCBr 34a_100011217188_100009814379 [0,1,0,0,0,0|1,0,0]=2 4595 B15R0.366 CCOC(=O)CCCCCCOCCCCl 34a_100000230001_100009814379 [0,1,0,0,0,0|1,0,0]=2 4596 B15R0.366 CCOC(=O)CCCCCCOCCCF 34a_100000759539_100009814379 [0,1,0,0,0,0|1,0,0]=2 4597 B15R0.366 CCOC(=O)CCCCCCOCCCN 34a_100000182051_100009814379 [0,1,0,0,0,0|1,0,0]=2 4598 B15R0.366 CCOC(=O)CCCCCCOCCOC 34a_100000210237_100009814379 [0,1,0,0,0,0|1,0,0]=2 4599 B15R0.366 CCOC(=O)CCCCCCOCCON 34a_100000700252_100009814379 [0,1,0,0,0,0|2,0,0]=3 4600 B15R0.366 CCOC(=O)CCCCCCOCCSC 34a_100000230434_100009814379 [0,1,0,0,0,0|1,0,0]=2 4601 B15R0.366 CCOC(=O)CCCCCCOCCSC 7a_100000230434_100009814379 [0,1,0,0,0,0|1,0,0]=2 4602 B15R0.366 CCOC(=O)CCCCCCSCCC#N 62a_100011215226_100009814379 [0,1,0,0,0,0|1,0,1]=3 4603 B15R0.366 CCOC(=O)CCCCCCSCCCF 62a_100011934791_100009814379 [0,1,0,0,0,0|1,0,0]=2 4604 B15R0.366 CCOC(=O)CCCCCCSCCCO 62a_100011215043_100009814379 [0,1,0,0,0,0|1,0,0]=2 4605 B15R0.366 CCOC(=O)CCCCCCSCCOC 62a_100000233755_100009814379 [0,1,0,0,0,0|1,0,0]=2 4606 B15R0.366 CCOC(=O)CCCCCCSCCSC 62a_100000212216_100009814379 [0,1,0,0,0,0|1,0,0]=2 4607 B15R0.366 CCOC(=O)CCCCCCSCSC#N 62a_100000211825_100009814379 [0,1,0,0,0,0|2,0,1]=4 4608 B15R0.366 CCOC(=O)CCCCCNCCCCO 2230a_100000750430_100000755133 [0,1,0,0,0,0|1,0,0]=2 4609 B15R0.366 CCOC(=O)CCCCCNCCCCO 34a_100000750430_100000755133 [0,1,0,0,0,0|1,0,0]=2 4610 B15R0.366 CCOC(=O)CCCCCNCCCOC 34a_100150723488_100000755133 [0,1,0,0,0,0|1,0,0]=2 4611 B15R0.366 CCOC(=O)CCCCCNCCCSC 2230a_100000749238_100000755133 [0,1,0,0,0,0|1,0,0]=2 4612 B15R0.366 CCOC(=O)CCCCCNCCSCC 2230a_100000106463_100000755133 [0,1,0,0,0,0|1,0,0]=2 4613 B15R0.366 CCOC(=O)CCCCCOCC#CCCl 34a_200000047223_100000755133 [0,1,0,0,0,0|1,0,2]=4 4614 B15R0.366 CCOC(=O)CCCCCOCC#CCO 7a_100011214988_200000047223 [0,1,0,0,0,0|1,0,2]=4 4615 B15R0.366 CCOC(=O)CCCCCOCCCC#N 7a_100011214988_100000687738 [0,1,0,0,0,0|1,0,1]=3 4616 B15R0.366 CCOC(=O)CCCCCOCCCC=O 7a_100011214988_200011292268 [0,1,0,0,0,0|1,0,1]=3 4617 B15R0.366 CCOC(=O)CCCCCOCCCCBr 34a_100011216708_100000755133 [0,1,0,0,0,0|1,0,0]=2 4618 B15R0.366 CCOC(=O)CCCCCOCCCCCl 34a_100000210776_100000755133 [0,1,0,0,0,0|1,0,0]=2 4619 B15R0.366 CCOC(=O)CCCCCOCCCCCl 7a_100000210776_100000755133 [0,1,0,0,0,0|1,0,0]=2 4620 B15R0.366 CCOC(=O)CCCCCOCCCCF 34a_100011995726_100000755133 [0,1,0,0,0,0|1,0,0]=2 4621 B15R0.366 CCOC(=O)CCCCCOCCCCF 7a_100011214988_100000729493 [0,1,0,0,0,0|1,0,0]=2 4622 B15R0.366 CCOC(=O)CCCCCOCCCCF 7a_100011995726_100000755133 [0,1,0,0,0,0|1,0,0]=2 4623 B15R0.366 CCOC(=O)CCCCCOCCCCI 34a_200012148704_100000755133 [0,1,0,0,0,0|1,0,0]=2 4624 B15R0.366 CCOC(=O)CCCCCOCCCCN 34a_100000750430_100000755133 [0,1,0,0,0,0|1,0,0]=2 4625 B15R0.366 CCOC(=O)CCCCCOCCCCO 7a_100011214988_100000210776 [0,1,0,0,0,0|1,0,0]=2 4626 B15R0.366 CCOC(=O)CCCCCOCCCNC 34a_100000213112_100000755133 [0,1,0,0,0,0|1,0,0]=2 4627 B15R0.366 CCOC(=O)CCCCCOCCCOC 34a_100000740835_100000755133 [0,1,0,0,0,0|1,0,0]=2 4628 B15R0.366 CCOC(=O)CCCCCOCCCOC 7a_100011214988_100000740836 [0,1,0,0,0,0|1,0,0]=2 4629 B15R0.366 CCOC(=O)CCCCCOCCCSC 34a_100000690336_100000755133 [0,1,0,0,0,0|1,0,0]=2 4630 B15R0.366 CCOC(=O)CCCCCOCCCSC 7a_100000690336_100000755133 [0,1,0,0,0,0|1,0,0]=2 4631 B15R0.366 CCOC(=O)CCCCCOCCSCC 34a_100000212035_100000755133 [0,1,0,0,0,0|1,0,0]=2 4632 B15R0.366 CCOC(=O)CCCCCOCCSCC 7a_100000212035_100000755133 [0,1,0,0,0,0|1,0,0]=2 4633 B15R0.366 CCOC(=O)CCCCCOCCSCC 7a_100011214988_100000757381 [0,1,0,0,0,0|1,0,0]=2 4634 B15R0.366 CCOC(=O)CCCCCSCC#CCO 62a_100000755133_200000047223 [0,1,0,0,0,0|1,0,2]=4 4635 B15R0.366 CCOC(=O)CCCCCSCC#CCO 62a_200000047223_100000755133 [0,1,0,0,0,0|1,0,2]=4 4636 B15R0.366 CCOC(=O)CCCCCSCCCC#N 62a_100000687738_100000755133 [0,1,0,0,0,0|1,0,1]=3 4637 B15R0.366 CCOC(=O)CCCCCSCCCC#N 62a_100000755133_100000687738 [0,1,0,0,0,0|1,0,1]=3 4638 B15R0.366 CCOC(=O)CCCCCSCCCC=O 62a_100000755133_200011292268 [0,1,0,0,0,0|1,0,1]=3 4639 B15R0.366 CCOC(=O)CCCCCSCCCC=O 62a_200011292268_100000755133 [0,1,0,0,0,0|1,0,1]=3 4640 B15R0.366 CCOC(=O)CCCCCSCCCCF 62a_100000729493_100000755133 [0,1,0,0,0,0|1,0,0]=2 4641 B15R0.366 CCOC(=O)CCCCCSCCCCF 62a_100000755133_100000729493 [0,1,0,0,0,0|1,0,0]=2 4642 B15R0.366 CCOC(=O)CCCCCSCCCCO 62a_100000210776_100000755133 [0,1,0,0,0,0|1,0,0]=2 4643 B15R0.366 CCOC(=O)CCCCCSCCCCO 62a_100000755133_100000210776 [0,1,0,0,0,0|1,0,0]=2 4644 B15R0.366 CCOC(=O)CCCCCSCCCOC 62a_100000709357_100000755133 [0,1,0,0,0,0|1,0,0]=2 4645 B15R0.366 CCOC(=O)CCCCCSCCCOC 62a_100000755133_100000709357 [0,1,0,0,0,0|1,0,0]=2 4646 B15R0.366 CCOC(=O)CCCCCSCCSC#N 62a_100000034367_100000755133 [0,1,0,0,0,0|2,0,1]=4 4647 B15R0.366 CCOC(=O)CCCCCSCCSC#N 62a_100000755133_100000034367 [0,1,0,0,0,0|2,0,1]=4 4648 B15R0.366 CCOC(=O)CCCCCSCCSCC 62a_100000755133_100000757381 [0,1,0,0,0,0|1,0,0]=2 4649 B15R0.366 CCOC(=O)CCCCCSCCSCC 62a_100000757381_100000755133 [0,1,0,0,0,0|1,0,0]=2 4650 B15R0.366 CCOC(=O)CCCCNCCCCCO 2230a_100000762737_100000750268 [0,1,0,0,0,0|1,0,0]=2 4651 B15R0.366 CCOC(=O)CCCCNCCCCCO 34a_100000762737_100000750268 [0,1,0,0,0,0|1,0,0]=2 4652 B15R0.366 CCOC(=O)CCCCNCCCN=[N+]=[N-] 2230a_100000744732_100000750268 [0,1,0,0,0,0|3,0,0]=4 4653 B15R0.366 CCOC(=O)CCCCNCCOCCO 2230a_100000211614_100000750268 [0,1,0,0,0,0|2,0,0]=3 4654 B15R0.366 CCOC(=O)CCCCNCCOCCO 34a_100000211614_100000750268 [0,1,0,0,0,0|2,0,0]=3 4655 B15R0.366 CCOC(=O)CCCCNCCSCCO 2230a_100011219999_100000750268 [0,1,0,0,0,0|2,0,0]=3 4656 B15R0.366 CCOC(=O)CCCCOCCCCCBr 34a_100000746331_100000750268 [0,1,0,0,0,0|1,0,0]=2 4657 B15R0.366 CCOC(=O)CCCCOCCCCCBr 7a_100000746331_100000750268 [0,1,0,0,0,0|1,0,0]=2 4658 B15R0.366 CCOC(=O)CCCCOCCCCCCl 34a_100000746330_100000750268 [0,1,0,0,0,0|1,0,0]=2 4659 B15R0.366 CCOC(=O)CCCCOCCCCCCl 7a_100000746330_100000750268 [0,1,0,0,0,0|1,0,0]=2 4660 B15R0.366 CCOC(=O)CCCCOCCCCCI 34a_200012148887_100000750268 [0,1,0,0,0,0|1,0,0]=2 4661 B15R0.366 CCOC(=O)CCCCOCCCCCI 7a_200012148887_100000750268 [0,1,0,0,0,0|1,0,0]=2 4662 B15R0.366 CCOC(=O)CCCCOCCCCCN 34a_100000762737_100000750268 [0,1,0,0,0,0|1,0,0]=2 4663 B15R0.366 CCOC(=O)CCCCOCCCCOC 34a_100000740925_100000750268 [0,1,0,0,0,0|1,0,0]=2 4664 B15R0.366 CCOC(=O)CCCCOCCCCSC 34a_100011217163_100000750268 [0,1,0,0,0,0|1,0,0]=2 4665 B15R0.366 CCOC(=O)CCCCOCCCCSC 7a_100011217163_100000750268 [0,1,0,0,0,0|1,0,0]=2 4666 B15R0.366 CCOC(=O)CCCCOCCCSCC 34a_100011216438_100000750268 [0,1,0,0,0,0|1,0,0]=2 4667 B15R0.366 CCOC(=O)CCCCOCCCSCC 7a_100011216438_100000750268 [0,1,0,0,0,0|1,0,0]=2 4668 B15R0.366 CCOC(=O)CCCCOCCOCCBr 34a_100000692535_100000750268 [0,1,0,0,0,0|2,0,0]=3 4669 B15R0.366 CCOC(=O)CCCCOCCOCCBr 7a_100000692535_100000750268 [0,1,0,0,0,0|2,0,0]=3 4670 B15R0.366 CCOC(=O)CCCCOCCOCCCl 34a_100011215305_100000750268 [0,1,0,0,0,0|2,0,0]=3 4671 B15R0.366 CCOC(=O)CCCCOCCOCCCl 7a_100011215305_100000750268 [0,1,0,0,0,0|2,0,0]=3 4672 B15R0.366 CCOC(=O)CCCCOCCOCCF 34a_200015357709_100000750268 [0,1,0,0,0,0|2,0,0]=3 4673 B15R0.366 CCOC(=O)CCCCOCCOCCF 7a_200015357709_100000750268 [0,1,0,0,0,0|2,0,0]=3 4674 B15R0.366 CCOC(=O)CCCCOCCOCCI 34a_100012149058_100000750268 [0,1,0,0,0,0|2,0,0]=3 4675 B15R0.366 CCOC(=O)CCCCOCCOCCI 7a_100012149058_100000750268 [0,1,0,0,0,0|2,0,0]=3 4676 B15R0.366 CCOC(=O)CCCCOCCOCCN 34a_100000211614_100000750268 [0,1,0,0,0,0|2,0,0]=3 4677 B15R0.366 CCOC(=O)CCCCSCCCCC#N 62a_100000750268_100000211819 [0,1,0,0,0,0|1,0,1]=3 4678 B15R0.366 CCOC(=O)CCCCSCCCCC#N 62a_100011219923_100000750268 [0,1,0,0,0,0|1,0,1]=3 4679 B15R0.366 CCOC(=O)CCCCSCCCCC=O 62a_100000139335_100000750268 [0,1,0,0,0,0|1,0,1]=3 4680 B15R0.366 CCOC(=O)CCCCSCCCCC=O 62a_100000750268_100000139335 [0,1,0,0,0,0|1,0,1]=3 4681 B15R0.366 CCOC(=O)CCCCSCCCCCF 62a_100000729378_100000750268 [0,1,0,0,0,0|1,0,0]=2 4682 B15R0.366 CCOC(=O)CCCCSCCCCCF 62a_100000750268_100000729378 [0,1,0,0,0,0|1,0,0]=2 4683 B15R0.366 CCOC(=O)CCCCSCCCCCO 62a_100000746330_100000750268 [0,1,0,0,0,0|1,0,0]=2 4684 B15R0.366 CCOC(=O)CCCCSCCCCCO 62a_100000750268_100000746330 [0,1,0,0,0,0|1,0,0]=2 4685 B15R0.366 CCOC(=O)CCCCSCCCCOC 62a_100000730899_100000750268 [0,1,0,0,0,0|1,0,0]=2 4686 B15R0.366 CCOC(=O)CCCCSCCCCOC 62a_100000750268_100000730899 [0,1,0,0,0,0|1,0,0]=2 4687 B15R0.366 CCOC(=O)CCCCSCCOCC#N 62a_100000750268_200000047693 [0,1,0,0,0,0|2,0,1]=4 4688 B15R0.366 CCOC(=O)CCCCSCCOCC#N 62a_200000047693_100000750268 [0,1,0,0,0,0|2,0,1]=4 4689 B15R0.366 CCOC(=O)CCCCSCCOCCO 62a_100000750268_100011215305 [0,1,0,0,0,0|2,0,0]=3 4690 B15R0.366 CCOC(=O)CCCCSCCOCCO 62a_100011215305_100000750268 [0,1,0,0,0,0|2,0,0]=3 4691 B15R0.366 CCOC(=O)CCCCSCOCCOC 62a_100000231047_100000750268 [0,1,0,0,0,0|2,0,0]=3 4692 B15R0.366 CCOC(=O)CCCCSCOCCOC 62a_100000750268_100000231047 [0,1,0,0,0,0|2,0,0]=3 4693 B15R0.366 CCOC(=O)CCCNCCCCCCO 2230a_100000686447_100009991533 [0,1,0,0,0,0|1,0,0]=2 4694 B15R0.366 CCOC(=O)CCCNCCCCCCO 34a_100000686447_100009991533 [0,1,0,0,0,0|1,0,0]=2 4695 B15R0.366 CCOC(=O)CCCNCCCCCOC 2230a_100000747528_100009991533 [0,1,0,0,0,0|1,0,0]=2 4696 B15R0.366 CCOC(=O)CCCNCCCCCOC 34a_100000747528_100009991533 [0,1,0,0,0,0|1,0,0]=2 4697 B15R0.366 CCOC(=O)CCCNCCCCN=[N+]=[N-] 2230a_100000101370_100009991533 [0,1,0,0,0,0|3,0,0]=4 4698 B15R0.366 CCOC(=O)CCCNCCOCCOC 2230a_100000745349_100009991533 [0,1,0,0,0,0|2,0,0]=3 4699 B15R0.366 CCOC(=O)CCCNCCOCCOC 34a_100000745349_100009991533 [0,1,0,0,0,0|2,0,0]=3 4700 B15R0.366 CCOC(=O)CCCOCCCCCC#N 7a_100012001163_100009813376 [0,1,0,0,0,0|1,0,1]=3 4701 B15R0.366 CCOC(=O)CCCOCCCCCC=O 7a_100012001163_100000139337 [0,1,0,0,0,0|1,0,1]=3 4702 B15R0.366 CCOC(=O)CCCOCCCCCCBr 34a_100011215345_100009991533 [0,1,0,0,0,0|1,0,0]=2 4703 B15R0.366 CCOC(=O)CCCOCCCCCCBr 7a_100011215345_100011215271 [0,1,0,0,0,0|1,0,0]=2 4704 B15R0.366 CCOC(=O)CCCOCCCCCCCl 34a_100000766143_100009991533 [0,1,0,0,0,0|1,0,0]=2 4705 B15R0.366 CCOC(=O)CCCOCCCCCCCl 7a_100000766143_100011215271 [0,1,0,0,0,0|1,0,0]=2 4706 B15R0.366 CCOC(=O)CCCOCCCCCCF 34a_100000732779_100009991533 [0,1,0,0,0,0|1,0,0]=2 4707 B15R0.366 CCOC(=O)CCCOCCCCCCF 7a_100000732779_100011215271 [0,1,0,0,0,0|1,0,0]=2 4708 B15R0.366 CCOC(=O)CCCOCCCCCCF 7a_100012001163_100015922095 [0,1,0,0,0,0|1,0,0]=2 4709 B15R0.366 CCOC(=O)CCCOCCCCCCN 34a_100000686447_100009991533 [0,1,0,0,0,0|1,0,0]=2 4710 B15R0.366 CCOC(=O)CCCOCCCCCCO 7a_100012001163_100000766143 [0,1,0,0,0,0|1,0,0]=2 4711 B15R0.366 CCOC(=O)CCCOCCCCCNC 34a_100000722520_100009991533 [0,1,0,0,0,0|1,0,0]=2 4712 B15R0.366 CCOC(=O)CCCOCCOCCNC 34a_100000228057_100009991533 [0,1,0,0,0,0|2,0,0]=3 4713 B15R0.366 CCOC(=O)CCCOCCOCCOC 34a_100011215163_100009991533 [0,1,0,0,0,0|2,0,0]=3 4714 B15R0.366 CCOC(=O)CCCOCCOCCOC 7a_100011215163_100011215271 [0,1,0,0,0,0|2,0,0]=3 4715 B15R0.366 CCOC(=O)CCCOCCOCCOC 7a_100012001163_100000695917 [0,1,0,0,0,0|2,0,0]=3 4716 B15R0.366 CCOC(=O)CCCSCCCCCC#N 62a_100009813376_100009991533 [0,1,0,0,0,0|1,0,1]=3 4717 B15R0.366 CCOC(=O)CCCSCCCCCC#N 62a_100009991533_100009813376 [0,1,0,0,0,0|1,0,1]=3 4718 B15R0.366 CCOC(=O)CCCSCCCCCC=O 62a_100000139337_100009991533 [0,1,0,0,0,0|1,0,1]=3 4719 B15R0.366 CCOC(=O)CCCSCCCCCC=O 62a_100009991533_100000139337 [0,1,0,0,0,0|1,0,1]=3 4720 B15R0.366 CCOC(=O)CCCSCCCCCCF 62a_100009991533_100015922095 [0,1,0,0,0,0|1,0,0]=2 4721 B15R0.366 CCOC(=O)CCCSCCCCCCF 62a_100015922095_100009991533 [0,1,0,0,0,0|1,0,0]=2 4722 B15R0.366 CCOC(=O)CCCSCCCCCCO 62a_100000766143_100009991533 [0,1,0,0,0,0|1,0,0]=2 4723 B15R0.366 CCOC(=O)CCCSCCCCCCO 62a_100009991533_100000766143 [0,1,0,0,0,0|1,0,0]=2 4724 B15R0.366 CCOC(=O)CCCSCCOCCOC 62a_100000695917_100009991533 [0,1,0,0,0,0|2,0,0]=3 4725 B15R0.366 CCOC(=O)CCCSCCOCCOC 62a_100009991533_100000695917 [0,1,0,0,0,0|2,0,0]=3 4726 B15R0.366 CCOC(=O)CCNCCCCCCCO 2230a_100011996573_100011206558 [0,1,0,0,0,0|1,0,0]=2 4727 B15R0.366 CCOC(=O)CCNCCCCCCCO 34a_100011996573_100000765890 [0,1,0,0,0,0|1,0,0]=2 4728 B15R0.366 CCOC(=O)CCNCCCOCCCO 2230a_100011310245_100011206558 [0,1,0,0,0,0|2,0,0]=3 4729 B15R0.366 CCOC(=O)CCNCCCOCCCO 34a_100011310245_100000765890 [0,1,0,0,0,0|2,0,0]=3 4730 B15R0.366 CCOC(=O)CCNCCCOCCOC 2230a_100000206027_100011206558 [0,1,0,0,0,0|2,0,0]=3 4731 B15R0.366 CCOC(=O)CCNCCCOCCOC 34a_100000206027_100000765890 [0,1,0,0,0,0|2,0,0]=3 4732 B15R0.366 CCOC(=O)CCOCCCCCCCBr 34a_100000760002_100000765890 [0,1,0,0,0,0|1,0,0]=2 4733 B15R0.366 CCOC(=O)CCOCCCCCCCBr 7a_100000760002_100011206558 [0,1,0,0,0,0|1,0,0]=2 4734 B15R0.366 CCOC(=O)CCOCCCCCCCN 34a_100011996573_100000765890 [0,1,0,0,0,0|1,0,0]=2 4735 B15R0.366 CCOC(=O)CCOCCCCCCOC 34a_200012092642_100000765890 [0,1,0,0,0,0|1,0,0]=2 4736 B15R0.366 CCOC(=O)CCOCCCCCCOC 7a_200012092642_100011206558 [0,1,0,0,0,0|1,0,0]=2 4737 B15R0.366 CCOC(=O)CCOCCCOCCCN 34a_100011310245_100000765890 [0,1,0,0,0,0|2,0,0]=3 4738 B15R0.366 CCOC(=O)CCOCCOCCOCF 34a_100010737887_100015361967 [0,1,0,0,0,0|3,0,0]=4 4739 B15R0.366 CCOC(=O)CCOCCOCCOCF 7a_100010737887_100015361967 [0,1,0,0,0,0|3,0,0]=4 4740 B15R0.366 CCOC(=O)CCSCCCCCCC#N 62a_100000765890_100009813337 [0,1,0,0,0,0|1,0,1]=3 4741 B15R0.366 CCOC(=O)CCSCCCCCCC#N 62a_100009813337_100000765890 [0,1,0,0,0,0|1,0,1]=3 4742 B15R0.366 CCOC(=O)CCSCCCCCCCO 62a_100000760002_100000765890 [0,1,0,0,0,0|1,0,0]=2 4743 B15R0.366 CCOC(=O)CCSCCCCCCCO 62a_100000765890_100000760002 [0,1,0,0,0,0|1,0,0]=2 4744 B15R0.366 CCOC(=O)CCSCCCCCCOC 62a_100000765890_100011998445 [0,1,0,0,0,0|1,0,0]=2 4745 B15R0.366 CCOC(=O)CCSCCCCCCOC 62a_100011998445_100000765890 [0,1,0,0,0,0|1,0,0]=2 4746 B15R0.366 CCOC(=O)CCSCCCOCCOC 62a_100000765890_100011216529 [0,1,0,0,0,0|2,0,0]=3 4747 B15R0.366 CCOC(=O)CCSCCCOCCOC 62a_100011216529_100000765890 [0,1,0,0,0,0|2,0,0]=3 4748 B15R0.366 CCOC(=O)CNCCCCCCCCO 2230a_102515433106_100000188475 [0,1,0,0,0,0|1,0,0]=2 4749 B15R0.366 CCOC(=O)CNCCCCCCCCO 34a_102515433106_100000188475 [0,1,0,0,0,0|1,0,0]=2 4750 B15R0.366 CCOC(=O)CNCCCCCCN=[N+]=[N-] 2230a_200000049180_100000188475 [0,1,0,0,0,0|3,0,0]=4 4751 B15R0.366 CCOC(=O)CNCCOCCOCCO 2230a_100011998139_100000188475 [0,1,0,0,0,0|3,0,0]=4 4752 B15R0.366 CCOC(=O)CNCCOCCOCCO 34a_100011998139_100000188475 [0,1,0,0,0,0|3,0,0]=4 4753 B15R0.366 CCOC(=O)COCCCCCCCCBr 34a_100009813846_100000188475 [0,1,0,0,0,0|1,0,0]=2 4754 B15R0.366 CCOC(=O)COCCCCCCCCBr 7a_100009813846_100000188475 [0,1,0,0,0,0|1,0,0]=2 4755 B15R0.366 CCOC(=O)COCCCCCCCCCl 34a_100000033203_100000188475 [0,1,0,0,0,0|1,0,0]=2 4756 B15R0.366 CCOC(=O)COCCCCCCCCCl 7a_100000033203_100000188475 [0,1,0,0,0,0|1,0,0]=2 4757 B15R0.366 CCOC(=O)COCCCCCCCCN 34a_102515433106_100000188475 [0,1,0,0,0,0|1,0,0]=2 4758 B15R0.366 CCOC(=O)COCCCCCNCCN 34a_103619048469_100000188475 [0,1,0,0,0,0|2,0,0]=3 4759 B15R0.366 CCOC(=O)COCCCNCCCCO 2230a_100000750430_100009893628 [0,1,0,0,0,0|2,0,0]=3 4760 B15R0.366 CCOC(=O)COCCCNCCCCO 34a_100000750430_100009893628 [0,1,0,0,0,0|2,0,0]=3 4761 B15R0.366 CCOC(=O)COCCCNCCCOC 34a_100150723488_100009893628 [0,1,0,0,0,0|2,0,0]=3 4762 B15R0.366 CCOC(=O)COCCCNCCCSC 2230a_100000749238_100009893628 [0,1,0,0,0,0|2,0,0]=3 4763 B15R0.366 CCOC(=O)COCCCNCCSCC 2230a_100000106463_100009893628 [0,1,0,0,0,0|2,0,0]=3 4764 B15R0.366 CCOC(=O)COCCCOCCCCBr 34a_100011216708_100009893628 [0,1,0,0,0,0|2,0,0]=3 4765 B15R0.366 CCOC(=O)COCCCOCCCCCl 34a_100000210776_100009893628 [0,1,0,0,0,0|2,0,0]=3 4766 B15R0.366 CCOC(=O)COCCCOCCCCCl 7a_100000210776_100009893628 [0,1,0,0,0,0|2,0,0]=3 4767 B15R0.366 CCOC(=O)COCCCOCCCCF 34a_100011995726_100009893628 [0,1,0,0,0,0|2,0,0]=3 4768 B15R0.366 CCOC(=O)COCCCOCCCCF 7a_100011995726_100009893628 [0,1,0,0,0,0|2,0,0]=3 4769 B15R0.366 CCOC(=O)COCCCOCCCCI 34a_200012148704_100009893628 [0,1,0,0,0,0|2,0,0]=3 4770 B15R0.366 CCOC(=O)COCCCOCCCCN 34a_100000750430_100009893628 [0,1,0,0,0,0|2,0,0]=3 4771 B15R0.366 CCOC(=O)COCCCOCCCNC 34a_100000213112_100009893628 [0,1,0,0,0,0|2,0,0]=3 4772 B15R0.366 CCOC(=O)COCCCOCCCOC 34a_100000740835_100009893628 [0,1,0,0,0,0|2,0,0]=3 4773 B15R0.366 CCOC(=O)COCCCOCCCOC 34a_200011215475_100000188475 [0,1,0,0,0,0|2,0,0]=3 4774 B15R0.366 CCOC(=O)COCCCOCCCOC 7a_200011215475_100000188475 [0,1,0,0,0,0|2,0,0]=3 4775 B15R0.366 CCOC(=O)COCCCOCCCSC 34a_100000690336_100009893628 [0,1,0,0,0,0|2,0,0]=3 4776 B15R0.366 CCOC(=O)COCCCOCCCSC 7a_100000690336_100009893628 [0,1,0,0,0,0|2,0,0]=3 4777 B15R0.366 CCOC(=O)COCCCOCCSCC 34a_100000212035_100009893628 [0,1,0,0,0,0|2,0,0]=3 4778 B15R0.366 CCOC(=O)COCCCOCCSCC 7a_100000212035_100009893628 [0,1,0,0,0,0|2,0,0]=3 4779 B15R0.366 CCOC(=O)COCCCSCCCC#N 62a_100000687738_100009893628 [0,1,0,0,0,0|2,0,1]=4 4780 B15R0.366 CCOC(=O)COCCCSCCCC#N 62a_100009893628_100000687738 [0,1,0,0,0,0|2,0,1]=4 4781 B15R0.366 CCOC(=O)COCCCSCCCC=O 62a_100009893628_200011292268 [0,1,0,0,0,0|2,0,1]=4 4782 B15R0.366 CCOC(=O)COCCCSCCCC=O 62a_200011292268_100009893628 [0,1,0,0,0,0|2,0,1]=4 4783 B15R0.366 CCOC(=O)COCCCSCCCCF 62a_100000729493_100009893628 [0,1,0,0,0,0|2,0,0]=3 4784 B15R0.366 CCOC(=O)COCCCSCCCCF 62a_100009893628_100000729493 [0,1,0,0,0,0|2,0,0]=3 4785 B15R0.366 CCOC(=O)COCCCSCCCCO 62a_100000210776_100009893628 [0,1,0,0,0,0|2,0,0]=3 4786 B15R0.366 CCOC(=O)COCCCSCCCCO 62a_100009893628_100000210776 [0,1,0,0,0,0|2,0,0]=3 4787 B15R0.366 CCOC(=O)COCCCSCCCOC 62a_100000709357_100009893628 [0,1,0,0,0,0|2,0,0]=3 4788 B15R0.366 CCOC(=O)COCCCSCCCOC 62a_100009893628_100000709357 [0,1,0,0,0,0|2,0,0]=3 4789 B15R0.366 CCOC(=O)COCCCSCCSCC 62a_100000757381_100009893628 [0,1,0,0,0,0|2,0,0]=3 4790 B15R0.366 CCOC(=O)COCCCSCCSCC 62a_100009893628_100000757381 [0,1,0,0,0,0|2,0,0]=3 4791 B15R0.366 CCOC(=O)COCCNCCCCCO 2230a_100000762737_100000088970 [0,1,0,0,0,0|2,0,0]=3 4792 B15R0.366 CCOC(=O)COCCNCCCCCO 34a_100000762737_100000088970 [0,1,0,0,0,0|2,0,0]=3 4793 B15R0.366 CCOC(=O)COCCNCCOCCO 2230a_100000211614_100000088970 [0,1,0,0,0,0|3,0,0]=4 4794 B15R0.366 CCOC(=O)COCCNCCOCCO 34a_100000211614_100000088970 [0,1,0,0,0,0|3,0,0]=4 4795 B15R0.366 CCOC(=O)COCCNCCSCCO 2230a_100011219999_100000088970 [0,1,0,0,0,0|3,0,0]=4 4796 B15R0.366 CCOC(=O)COCCOCCCCCBr 34a_100000746331_100000088970 [0,1,0,0,0,0|2,0,0]=3 4797 B15R0.366 CCOC(=O)COCCOCCCCCBr 7a_100000746331_100000088970 [0,1,0,0,0,0|2,0,0]=3 4798 B15R0.366 CCOC(=O)COCCOCCCCCCl 34a_100000746330_100000088970 [0,1,0,0,0,0|2,0,0]=3 4799 B15R0.366 CCOC(=O)COCCOCCCCCCl 7a_100000746330_100000088970 [0,1,0,0,0,0|2,0,0]=3 4800 B15R0.366 CCOC(=O)COCCOCCCCCI 34a_200012148887_100000088970 [0,1,0,0,0,0|2,0,0]=3 4801 B15R0.366 CCOC(=O)COCCOCCCCCI 7a_200012148887_100000088970 [0,1,0,0,0,0|2,0,0]=3 4802 B15R0.366 CCOC(=O)COCCOCCCCCN 34a_100000762737_100000088970 [0,1,0,0,0,0|2,0,0]=3 4803 B15R0.366 CCOC(=O)COCCOCCCCOC 34a_100000740925_100000088970 [0,1,0,0,0,0|2,0,0]=3 4804 B15R0.366 CCOC(=O)COCCOCCCCSC 34a_100011217163_100000088970 [0,1,0,0,0,0|2,0,0]=3 4805 B15R0.366 CCOC(=O)COCCOCCCCSC 7a_100011217163_100000088970 [0,1,0,0,0,0|2,0,0]=3 4806 B15R0.366 CCOC(=O)COCCOCCCSCC 34a_100011216438_100000088970 [0,1,0,0,0,0|2,0,0]=3 4807 B15R0.366 CCOC(=O)COCCOCCCSCC 7a_100011216438_100000088970 [0,1,0,0,0,0|2,0,0]=3 4808 B15R0.366 CCOC(=O)COCCOCCOCCBr 34a_100000692535_100000088970 [0,1,0,0,0,0|3,0,0]=4 4809 B15R0.366 CCOC(=O)COCCOCCOCCBr 34a_100010132937_100000188475 [0,1,0,0,0,0|3,0,0]=4 4810 B15R0.366 CCOC(=O)COCCOCCOCCBr 7a_100000692535_100000088970 [0,1,0,0,0,0|3,0,0]=4 4811 B15R0.366 CCOC(=O)COCCOCCOCCBr 7a_100010132937_100000188475 [0,1,0,0,0,0|3,0,0]=4 4812 B15R0.366 CCOC(=O)COCCOCCOCCCl 34a_100000032323_100000188475 [0,1,0,0,0,0|3,0,0]=4 4813 B15R0.366 CCOC(=O)COCCOCCOCCCl 34a_100011215305_100000088970 [0,1,0,0,0,0|3,0,0]=4 4814 B15R0.366 CCOC(=O)COCCOCCOCCCl 7a_100000032323_100000188475 [0,1,0,0,0,0|3,0,0]=4 4815 B15R0.366 CCOC(=O)COCCOCCOCCCl 7a_100011215305_100000088970 [0,1,0,0,0,0|3,0,0]=4 4816 B15R0.366 CCOC(=O)COCCOCCOCCF 34a_200015357709_100000088970 [0,1,0,0,0,0|3,0,0]=4 4817 B15R0.366 CCOC(=O)COCCOCCOCCF 7a_200015357709_100000088970 [0,1,0,0,0,0|3,0,0]=4 4818 B15R0.366 CCOC(=O)COCCOCCOCCI 34a_100012149058_100000088970 [0,1,0,0,0,0|3,0,0]=4 4819 B15R0.366 CCOC(=O)COCCOCCOCCI 7a_100012149058_100000088970 [0,1,0,0,0,0|3,0,0]=4 4820 B15R0.366 CCOC(=O)COCCOCCOCCN 34a_100000211614_100000088970 [0,1,0,0,0,0|3,0,0]=4 4821 B15R0.366 CCOC(=O)COCCOCCOCCN 34a_100011998139_100000188475 [0,1,0,0,0,0|3,0,0]=4 4822 B15R0.366 CCOC(=O)COCCSCCCCC#N 62a_100000088970_100000211819 [0,1,0,0,0,0|2,0,1]=4 4823 B15R0.366 CCOC(=O)COCCSCCCCC#N 62a_100011219923_100000088970 [0,1,0,0,0,0|2,0,1]=4 4824 B15R0.366 CCOC(=O)COCCSCCCCC=O 62a_100000088970_100000139335 [0,1,0,0,0,0|2,0,1]=4 4825 B15R0.366 CCOC(=O)COCCSCCCCC=O 62a_100000139335_100000088970 [0,1,0,0,0,0|2,0,1]=4 4826 B15R0.366 CCOC(=O)COCCSCCCCCF 62a_100000088970_100000729378 [0,1,0,0,0,0|2,0,0]=3 4827 B15R0.366 CCOC(=O)COCCSCCCCCF 62a_100000729378_100000088970 [0,1,0,0,0,0|2,0,0]=3 4828 B15R0.366 CCOC(=O)COCCSCCCCCO 62a_100000088970_100000746330 [0,1,0,0,0,0|2,0,0]=3 4829 B15R0.366 CCOC(=O)COCCSCCCCCO 62a_100000746330_100000088970 [0,1,0,0,0,0|2,0,0]=3 4830 B15R0.366 CCOC(=O)COCCSCCCCOC 62a_100000088970_100000730899 [0,1,0,0,0,0|2,0,0]=3 4831 B15R0.366 CCOC(=O)COCCSCCCCOC 62a_100000730899_100000088970 [0,1,0,0,0,0|2,0,0]=3 4832 B15R0.366 CCOC(=O)COCCSCCOCCO 62a_100000088970_100011215305 [0,1,0,0,0,0|3,0,0]=4 4833 B15R0.366 CCOC(=O)COCCSCCOCCO 62a_100011215305_100000088970 [0,1,0,0,0,0|3,0,0]=4 4834 B15R0.366 CCOC(=O)COCCSCOCCOC 62a_100000088970_100000231047 [0,1,0,0,0,0|3,0,0]=4 4835 B15R0.366 CCOC(=O)COCCSCOCCOC 62a_100000231047_100000088970 [0,1,0,0,0,0|3,0,0]=4 4836 B15R0.366 CCOC(=O)CSCCCCCCCCO 62a_100000033203_100000188475 [0,1,0,0,0,0|1,0,0]=2 4837 B15R0.366 CCOC(=O)CSCCCCCCCCO 62a_100000188475_100000033203 [0,1,0,0,0,0|1,0,0]=2 4838 B15R0.366 CCOC(=O)CSCCOCCCCC#N 7a_200000230590_100000211819 [0,1,0,0,0,0|2,0,1]=4 4839 B15R0.366 CCOC(=O)CSCCOCCCCC=O 7a_200000230590_100000139335 [0,1,0,0,0,0|2,0,1]=4 4840 B15R0.366 CCOC(=O)CSCCOCCCCCF 7a_200000230590_100000729378 [0,1,0,0,0,0|2,0,0]=3 4841 B15R0.366 CCOC(=O)CSCCOCCCCCO 7a_200000230590_100000746330 [0,1,0,0,0,0|2,0,0]=3 4842 B15R0.366 CCOC(=O)CSCCOCCCCOC 7a_200000230590_100000730899 [0,1,0,0,0,0|2,0,0]=3 4843 B15R0.366 CCOC(=O)CSCCOCCOCCO 62a_100000032323_100000188475 [0,1,0,0,0,0|3,0,0]=4 4844 B15R0.366 CCOC(=O)CSCCOCCOCCO 62a_100000188475_100000032323 [0,1,0,0,0,0|3,0,0]=4 4845 B15R0.366 CCOC(=O)CSCCOCCOCCO 7a_200000230590_100011215305 [0,1,0,0,0,0|3,0,0]=4 4846 B15R0.366 CCOC(=O)NCCOCCCCCCBr 7a_100011215345_200011445536 [0,1,0,0,0,0|2,0,0]=3 4847 B15R0.366 CCOC(=O)NCCOCCCCCCCl 7a_100000766143_200011445536 [0,1,0,0,0,0|2,0,0]=3 4848 B15R0.366 CCOC(=O)NCCOCCCCCCF 34a_100000158857_100015922095 [0,1,0,0,0,0|2,0,0]=3 4849 B15R0.366 CCOC(=O)NCCOCCCCCCF 7a_100000732779_200011445536 [0,1,0,0,0,0|2,0,0]=3 4850 B15R0.366 CCOC(=O)NCCOCCCCCCO 34a_100000158857_100000766143 [0,1,0,0,0,0|2,0,0]=3 4851 B15R0.366 CCOC(=O)NCCOCCOCCOC 34a_100000158857_100000695917 [0,1,0,0,0,0|3,0,0]=4 4852 B15R0.366 CCOC(=O)NCCOCCOCCOC 7a_100011215163_200011445536 [0,1,0,0,0,0|3,0,0]=4 4853 B15R0.366 CCOC(=O)NCCSCCCCCC#N 62a_100009813376_200011445536 [0,1,0,0,0,0|2,0,1]=4 4854 B15R0.366 CCOC(=O)NCCSCCCCCC=O 62a_100000139337_200011445536 [0,1,0,0,0,0|2,0,1]=4 4855 B15R0.366 CCOC(=O)NCCSCCCCCCF 62a_100015922095_200011445536 [0,1,0,0,0,0|2,0,0]=3 4856 B15R0.366 CCOC(=O)NCCSCCCCCCO 62a_100000766143_200011445536 [0,1,0,0,0,0|2,0,0]=3 4857 B15R0.366 CCOC(=O)NCCSCCOCCOC 62a_100000695917_200011445536 [0,1,0,0,0,0|3,0,0]=4 4858 B15R0.366 CCOC(=O)OCSCCCCCCC#N 62a_100009813337_100000075025 [0,1,0,0,0,0|2,0,1]=4 4859 B15R0.366 CCOC(=O)OCSCCCCCCCO 62a_100000760002_100000075025 [0,1,0,0,0,0|2,0,0]=3 4860 B15R0.366 CCOC(=O)OCSCCCCCCOC 62a_100011998445_100000075025 [0,1,0,0,0,0|2,0,0]=3 4861 B15R0.366 CCOC(=O)OCSCCCOCCOC 62a_100011216529_100000075025 [0,1,0,0,0,0|3,0,0]=4 4862 B15R0.366 CCOCCCCCCCCC(=O)OCC 34a_100121572206_100010175975 [0,1,0,0,0,0|0,0,0]=1 4863 B15R0.366 CCOCCCNCCCCC(=O)OCC 2230a_100000210961_100000750268 [0,1,0,0,0,0|1,0,0]=2 4864 B15R0.366 CCOCCCNCCCCC(=O)OCC 34a_100000210961_100000750268 [0,1,0,0,0,0|1,0,0]=2 4865 B15R0.366 CCOCCCNCCOCC(=O)OCC 2230a_100000210961_100000088970 [0,1,0,0,0,0|2,0,0]=3 4866 B15R0.366 CCOCCCNCCOCC(=O)OCC 34a_100000210961_100000088970 [0,1,0,0,0,0|2,0,0]=3 4867 B15R0.366 CCOCCCOCCCCC(=O)OCC 34a_100000757476_100000750268 [0,1,0,0,0,0|1,0,0]=2 4868 B15R0.366 CCOCCCOCCCCC(=O)OCC 7a_100000757476_100000750268 [0,1,0,0,0,0|1,0,0]=2 4869 B15R0.366 CCOCCCOCCOCC(=O)OCC 34a_100000757476_100000088970 [0,1,0,0,0,0|2,0,0]=3 4870 B15R0.366 CCOCCCOCCOCC(=O)OCC 7a_100000757476_100000088970 [0,1,0,0,0,0|2,0,0]=3 4871 B15R0.366 CCOCCCOCCSCC(=O)OCC 7a_200000230590_100012232248 [0,1,0,0,0,0|2,0,0]=3 4872 B15R0.366 CCOCCCSCCCCC(=O)OCC 62a_100000750268_100012232248 [0,1,0,0,0,0|1,0,0]=2 4873 B15R0.366 CCOCCCSCCCCC(=O)OCC 62a_100012232248_100000750268 [0,1,0,0,0,0|1,0,0]=2 4874 B15R0.366 CCOCCCSCCOCC(=O)OCC 62a_100000088970_100012232248 [0,1,0,0,0,0|2,0,0]=3 4875 B15R0.366 CCOCCCSCCOCC(=O)OCC 62a_100012232248_100000088970 [0,1,0,0,0,0|2,0,0]=3 4876 B15R0.366 CCOCCNCCCCCC(=O)OCC 2230a_102516460346_100000755133 [0,1,0,0,0,0|1,0,0]=2 4877 B15R0.366 CCOCCNCCCCCC(=O)OCC 34a_102516460346_100000755133 [0,1,0,0,0,0|1,0,0]=2 4878 B15R0.366 CCOCCNCCCOCC(=O)OCC 2230a_102516460346_100009893628 [0,1,0,0,0,0|2,0,0]=3 4879 B15R0.366 CCOCCNCCCOCC(=O)OCC 34a_102516460346_100009893628 [0,1,0,0,0,0|2,0,0]=3 4880 B15R0.366 CCOCCOCCCCCC(=O)OCC 34a_100000210136_100000755133 [0,1,0,0,0,0|1,0,0]=2 4881 B15R0.366 CCOCCOCCCCCC(=O)OCC 7a_100000210136_100000755133 [0,1,0,0,0,0|1,0,0]=2 4882 B15R0.366 CCOCCOCCCCCC(=O)OCC 7a_100011214988_100011215890 [0,1,0,0,0,0|1,0,0]=2 4883 B15R0.366 CCOCCOCCCOCC(=O)OCC 34a_100000210136_100009893628 [0,1,0,0,0,0|2,0,0]=3 4884 B15R0.366 CCOCCOCCCOCC(=O)OCC 7a_100000210136_100009893628 [0,1,0,0,0,0|2,0,0]=3 4885 B15R0.366 CCOCCOCCNCCC(=O)OCC 2230a_100102712874_100011206558 [0,1,0,0,0,0|2,0,0]=3 4886 B15R0.366 CCOCCOCCNCCC(=O)OCC 34a_100102712874_100000765890 [0,1,0,0,0,0|2,0,0]=3 4887 B15R0.366 CCOCCOCCOCCC(=O)OCC 34a_100000210240_100000765890 [0,1,0,0,0,0|2,0,0]=3 4888 B15R0.366 CCOCCOCCOCCC(=O)OCC 34a_100010737887_100000210202 [0,1,0,0,0,0|2,0,0]=3 4889 B15R0.366 CCOCCOCCOCCC(=O)OCC 7a_100000210240_100011206558 [0,1,0,0,0,0|2,0,0]=3 4890 B15R0.366 CCOCCOCCOCCC(=O)OCC 7a_100010737887_100000210202 [0,1,0,0,0,0|2,0,0]=3 4891 B15R0.366 CCOCCOCCSCCC(=O)OCC 62a_100000765890_100011211534 [0,1,0,0,0,0|2,0,0]=3 4892 B15R0.366 CCOCCOCCSCCC(=O)OCC 62a_100011211534_100000765890 [0,1,0,0,0,0|2,0,0]=3 4893 B15R0.366 CCOCCOCCSCOC(=O)OCC 62a_100011211534_100000075025 [0,1,0,0,0,0|3,0,0]=4 4894 B15R0.366 CCOCCSCCCCCC(=O)OCC 62a_100000210147_100000755133 [0,1,0,0,0,0|1,0,0]=2 4895 B15R0.366 CCOCCSCCCCCC(=O)OCC 62a_100000755133_100011215890 [0,1,0,0,0,0|1,0,0]=2 4896 B15R0.366 CCOCCSCCCOCC(=O)OCC 62a_100000210147_100009893628 [0,1,0,0,0,0|2,0,0]=3 4897 B15R0.366 CCOCCSCCCOCC(=O)OCC 62a_100009893628_100011215890 [0,1,0,0,0,0|2,0,0]=3 4898 B15R0.366 CCOCSCCCCCCC(=O)OCC 62a_100000739092_100009814379 [0,1,0,0,0,0|1,0,0]=2 4899 B15R0.366 CNNC(=O)CCCCCCCCCCO 22a_100016993582_200000016029 [0,1,0,0,0,0|2,0,0]=3 4900 B15R0.366 CNNC(=O)NCCCCCCCCCO 273464a_100000078944_100016993582 [0,1,0,0,0,0|3,0,0]=4 4901 B15R0.366 CNNC(=O)NCCCCCCCCCO 512a_100000078944_100016993582 [0,1,0,0,0,0|3,0,0]=4 4902 B15R0.366 CNNC(=O)NCCCCCCCCCO 512a_100016993582_100000078944 [0,1,0,0,0,0|3,0,0]=4 4903 B15R0.366 COCC(=O)CCCCCCCCCCO 1458a_100000210968_100009813290 [0,1,0,0,0,0|2,0,0]=3 4904 B15R0.366 COCC(=O)NCCCCCCCCCO 240690a_100000078944_100000210968 [0,1,0,0,0,0|3,0,0]=4 4905 B15R0.366 CSCC(=O)CCCCCCCCCCO 1458a_100000184570_100009813290 [0,1,0,0,0,0|2,0,0]=3 4906 B15R0.366 CSCC(=O)NCCCCCCCCCO 240690a_100000078944_100000184570 [0,1,0,0,0,0|3,0,0]=4 4907 B15R0.366 N#CCC(=O)CCCCCCCCCCO 1458a_100051588842_100009813290 [0,1,0,0,0,0|2,0,1]=4 4908 B15R0.366 NCCCCCCCCOCC(=O)NCO 34a_102515433106_100000185155 [0,1,0,0,0,0|3,0,0]=4 4909 B15R0.366 O=C(C=CBr)CCCCCCCCCCO 1458a_100016273825_100009813290 [0,1,0,0,0,0|2,0,1]=4 4910 B15R0.366 O=C(C=CCl)CCCCCCCCCCO 1458a_200016279998_100009813290 [0,1,0,0,0,0|2,0,1]=4 4911 B15R0.366 O=C(C=CI)CCCCCCCCCCO 1458a_100016256311_100009813290 [0,1,0,0,0,0|2,0,1]=4 4912 B15R0.366 O=C(CCO)CCCCCCCCCCO 1458a_100011216618_100009813290 [0,1,0,0,0,0|2,0,0]=3 4913 B15R0.366 O=C(CCO)NCCCCCCCCCO 240690a_100000078944_100011216618 [0,1,0,0,0,0|3,0,0]=4 4914 B15R0.366 O=C(CNCCCCCCCCO)NCO 2230a_102515433106_100000185155 [0,1,0,0,0,0|3,0,0]=4 4915 B15R0.366 O=C(CNCCCCCCCCO)NCO 34a_102515433106_100000185155 [0,1,0,0,0,0|3,0,0]=4 4916 B15R0.366 O=C(COCCCCCCCCBr)NCO 34a_100009813846_100000185155 [0,1,0,0,0,0|3,0,0]=4 4917 B15R0.366 O=C(COCCCCCCCCBr)NCO 7a_100009813846_100000185155 [0,1,0,0,0,0|3,0,0]=4 4918 B15R0.366 O=C(COCCCCCCCCCl)NCO 34a_100000033203_100000185155 [0,1,0,0,0,0|3,0,0]=4 4919 B15R0.366 O=C(COCCCCCCCCCl)NCO 7a_100000033203_100000185155 [0,1,0,0,0,0|3,0,0]=4 4920 B15R0.366 O=C(CSCCCCCCCCO)NCO 62a_100000033203_100000185155 [0,1,0,0,0,0|3,0,0]=4 4921 B15R0.366 O=C(CSCCCCCCCCO)NCO 62a_100000185155_100000033203 [0,1,0,0,0,0|3,0,0]=4 4922 B15R0.370 C#CCCCCCCC(=O)CC(=O)OCC 1458a_100000034748_100000188475 [0,1,0,0,0,0|0,0,3]=4 4923 B15R0.370 C#CCCCCCCC(=O)CC(=O)OCC 1458a_100000243816_100012276617 [0,1,0,0,0,0|0,0,3]=4 4924 B15R0.370 C#CCCCCCCN(C)CC(=O)OCC 2230a_100000220588_100012276617 [0,1,0,0,0,0|1,0,2]=4 4925 B15R0.370 C#CCCCCCOC(C)CC(=O)OCC 7a_100000766912_100009817359 [0,1,0,0,0,0|1,0,2]=4 4926 B15R0.370 C#CCCCCCO[C@H](C)CC(=O)OCC 7a_100009816390_100012094781 [0,1,0,0,0,0|1,0,2]=4 4927 B15R0.370 C#CCCCCCSC(C)CC(=O)OCC 62a_100009817359_100012094781 [0,1,0,0,0,0|1,0,2]=4 4928 B15R0.370 C#CCCCCCSC(C)CC(=O)OCC 62a_100012094781_100009817359 [0,1,0,0,0,0|1,0,2]=4 4929 B15R0.370 C#CCCCCNC[C@@H](O)CC(=O)OCC 34a_100000706060_100000688340 [0,1,0,0,0,0|1,0,2]=4 4930 B15R0.370 C#CCCCCOC[C@@H](O)CC(=O)OCC 34a_100000766709_100000688340 [0,1,0,0,0,0|1,0,2]=4 4931 B15R0.370 C#CCCCCOC[C@@H](O)CC(=O)OCC 7a_100000766709_100000688340 [0,1,0,0,0,0|1,0,2]=4 4932 B15R0.370 C#CCCCCSC[C@@H](O)CC(=O)OCC 62a_100000688340_100010269958 [0,1,0,0,0,0|1,0,2]=4 4933 B15R0.370 C#CCCCCSC[C@@H](O)CC(=O)OCC 62a_100010269958_100000688340 [0,1,0,0,0,0|1,0,2]=4 4934 B15R0.370 C=CCCCCCCC(=O)CC(=O)OCC 1458a_100000243816_100011215473 [0,1,0,0,0,0|0,0,3]=4 4935 B15R0.370 C=CCCCCCCC(=O)CC(=O)OCC 1458a_100011809334_100000188475 [0,1,0,0,0,0|0,0,3]=4 4936 B15R0.370 C=CCCCCCCN(C)CC(=O)OCC 2230a_100000220588_100011215473 [0,1,0,0,0,0|1,0,2]=4 4937 B15R0.370 C=CCCCCCOC(C)CC(=O)OCC 7a_100011216702_100009817359 [0,1,0,0,0,0|1,0,2]=4 4938 B15R0.370 C=CCCCCCO[C@H](C)CC(=O)OCC 7a_100009816390_100000700193 [0,1,0,0,0,0|1,0,2]=4 4939 B15R0.370 C=CCCCCCSC(C)CC(=O)OCC 62a_100000700193_100009817359 [0,1,0,0,0,0|1,0,2]=4 4940 B15R0.370 C=CCCCCCSC(C)CC(=O)OCC 62a_100009817359_100000700193 [0,1,0,0,0,0|1,0,2]=4 4941 B15R0.370 C=CCCCCNC[C@@H](O)CC(=O)OCC 34a_100000703577_100000688340 [0,1,0,0,0,0|1,0,2]=4 4942 B15R0.370 C=CCCCCOC[C@@H](O)CC(=O)OCC 34a_100000766645_100000688340 [0,1,0,0,0,0|1,0,2]=4 4943 B15R0.370 C=CCCCCOC[C@@H](O)CC(=O)OCC 7a_100000766645_100000688340 [0,1,0,0,0,0|1,0,2]=4 4944 B15R0.370 C=CCCCCSC[C@@H](O)CC(=O)OCC 62a_100000688340_100011215482 [0,1,0,0,0,0|1,0,2]=4 4945 B15R0.370 C=CCCCCSC[C@@H](O)CC(=O)OCC 62a_100011215482_100000688340 [0,1,0,0,0,0|1,0,2]=4 4946 B15R0.370 C=COC(=O)CC(=O)CCCCCCCC 1458a_100000210188_100000036128 [0,1,0,0,0,0|0,0,3]=4 4947 B15R0.370 C=COC(=O)CN(C)CCCCCCCC 2230a_100000207567_100000036128 [0,1,0,0,0,0|1,0,2]=4 4948 B15R0.370 C=COC(=O)CN(C)CCCCCCCC 269982a_100000207567_100000036128 [0,1,0,0,0,0|1,0,2]=4 4949 B15R0.370 CC/C=C/CCCOC(C)CC(=O)OCC 7a_100016287902_100009817359 [0,1,0,0,0,0|1,0,2]=4 4950 B15R0.370 CC/C=C\CCOC[C@@H](O)CC(=O)OCC 34a_100016288707_100000688340 [0,1,0,0,0,0|1,0,2]=4 4951 B15R0.370 CC/C=C\CCOC[C@@H](O)CC(=O)OCC 7a_100016288707_100000688340 [0,1,0,0,0,0|1,0,2]=4 4952 B15R0.370 CC/C=C\CCSC[C@@H](O)CC(=O)OCC 62a_100000688340_100015370543 [0,1,0,0,0,0|1,0,2]=4 4953 B15R0.370 CC/C=C\CCSC[C@@H](O)CC(=O)OCC 62a_100015370543_100000688340 [0,1,0,0,0,0|1,0,2]=4 4954 B15R0.370 CC=CCCCOC[C@@H](O)CC(=O)OCC 34a_100020645299_100000688340 [0,1,0,0,0,0|1,0,2]=4 4955 B15R0.370 CCC#CCCOC[C@@H](O)CC(=O)OCC 34a_100000036655_100000688340 [0,1,0,0,0,0|1,0,2]=4 4956 B15R0.370 CCC#CCCOC[C@@H](O)CC(=O)OCC 7a_100000036655_100000688340 [0,1,0,0,0,0|1,0,2]=4 4957 B15R0.370 CCC/C=C/COC[C@@H](O)CC(=O)OCC 34a_100016278788_100000688340 [0,1,0,0,0,0|1,0,2]=4 4958 B15R0.370 CCC/C=C/COC[C@@H](O)CC(=O)OCC 7a_100016278788_100000688340 [0,1,0,0,0,0|1,0,2]=4 4959 B15R0.370 CCCC#CCCOC(C)CC(=O)OCC 7a_100000042726_100009817359 [0,1,0,0,0,0|1,0,2]=4 4960 B15R0.370 CCCC#CCOC[C@@H](O)CC(=O)OCC 34a_100000034806_100000688340 [0,1,0,0,0,0|1,0,2]=4 4961 B15R0.370 CCCC#CCOC[C@@H](O)CC(=O)OCC 7a_100000034806_100000688340 [0,1,0,0,0,0|1,0,2]=4 4962 B15R0.370 CCCC(=O)CC(=O)CCCCCCCO 1458a_100011219782_100000747444 [0,1,0,0,0,0|2,0,1]=4 4963 B15R0.370 CCCC/C=C/COC(C)CC(=O)OCC 7a_200016272032_100009817359 [0,1,0,0,0,0|1,0,2]=4 4964 B15R0.370 CCCCC#CCOC(C)CC(=O)OCC 7a_200000034558_100009817359 [0,1,0,0,0,0|1,0,2]=4 4965 B15R0.370 CCCCC/C=C/CC(=O)CC(=O)OCC 1458a_100020675968_100000188475 [0,1,0,0,0,0|0,0,3]=4 4966 B15R0.370 CCCCCC#CCC(=O)CC(=O)OCC 1458a_100000243816_100009816472 [0,1,0,0,0,0|0,0,3]=4 4967 B15R0.370 CCCCCC#CCN(C)CC(=O)OCC 2230a_100000220588_100009816472 [0,1,0,0,0,0|1,0,2]=4 4968 B15R0.370 CCCCCCC=CC(=O)CC(=O)OCC 1458a_200015324643_100000188475 [0,1,0,0,0,0|0,0,3]=4 4969 B15R0.370 CCCCCCCCC(=O)CC(=O)CCC 1458a_100000210188_100000747444 [0,1,0,0,0,0|1,0,1]=3 4970 B15R0.370 CCCCCCCCC(=O)CC(=O)NCC 1458a_100000210188_100000183381 [0,1,0,0,0,0|1,0,1]=3 4971 B15R0.370 CCCCCCCCC(=O)CC(=O)NCO 1458a_100000210188_100000185155 [0,1,0,0,0,0|2,0,1]=4 4972 B15R0.370 CCCCCCCCC(=O)CC(=O)OCC 1458a_100000210188_100000188475 [0,1,0,0,0,0|0,0,1]=2 4973 B15R0.370 CCCCCCCCC(=O)CC(=O)OCC 1458a_100000243816_100000210759 [0,1,0,0,0,0|0,0,1]=2 4974 B15R0.370 CCCCCCCCC(=O)CS(=O)CCC 1458a_100011387404_100000210759 [0,1,0,0,0,0|2,0,1]=4 4975 B15R0.370 CCCCCCCCC(C)CN(C)CCC 270004a_100000747261_100011995885 [0,1,0,0,0,0|3,0,0]=4 4976 B15R0.370 CCCCCCCCN(C)CC(=O)CCC 2230a_100000207567_100000747444 [0,1,0,0,0,0|2,0,0]=3 4977 B15R0.370 CCCCCCCCN(C)CC(=O)CCC 269982a_100000207567_100000747444 [0,1,0,0,0,0|2,0,0]=3 4978 B15R0.370 CCCCCCCCN(C)CC(=O)NCC 2230a_100000207567_100000183381 [0,1,0,0,0,0|2,0,0]=3 4979 B15R0.370 CCCCCCCCN(C)CC(=O)NCC 2230a_100000741943_100000210759 [0,1,0,0,0,0|2,0,0]=3 4980 B15R0.370 CCCCCCCCN(C)CC(=O)NCC 269982a_100000207567_100000183381 [0,1,0,0,0,0|2,0,0]=3 4981 B15R0.370 CCCCCCCCN(C)CC(=O)NCC 269982a_100000741943_100000210759 [0,1,0,0,0,0|2,0,0]=3 4982 B15R0.370 CCCCCCCCN(C)CC(=O)NCO 2230a_100000207567_100000185155 [0,1,0,0,0,0|3,0,0]=4 4983 B15R0.370 CCCCCCCCN(C)CC(=O)NCO 269982a_100000207567_100000185155 [0,1,0,0,0,0|3,0,0]=4 4984 B15R0.370 CCCCCCCCN(C)CC(=O)OCC 2230a_100000207567_100000188475 [0,1,0,0,0,0|1,0,0]=2 4985 B15R0.370 CCCCCCCCN(C)CC(=O)OCC 2230a_100000220588_100000210759 [0,1,0,0,0,0|1,0,0]=2 4986 B15R0.370 CCCCCCCCN(C)CC(=O)OCC 269982a_100000207567_100000188475 [0,1,0,0,0,0|1,0,0]=2 4987 B15R0.370 CCCCCCCNC(=O)CC(=O)OCC 240690a_100000229938_100000243816 [0,1,0,0,0,0|1,0,1]=3 4988 B15R0.370 CCCCCCCNC(C)CC(=O)OCC 2230a_100000229938_100009817359 [0,1,0,0,0,0|1,0,0]=2 4989 B15R0.370 CCCCCCCOC(C)CC(=O)OCC 7a_100000210272_100009817359 [0,1,0,0,0,0|1,0,0]=2 4990 B15R0.370 CCCCCCCO[C@H](C)CC(=O)OCC 7a_100009816390_100000210614 [0,1,0,0,0,0|1,0,0]=2 4991 B15R0.370 CCCCCCCSC(C)CC(=O)OCC 62a_100000210614_100009817359 [0,1,0,0,0,0|1,0,0]=2 4992 B15R0.370 CCCCCCCSC(C)CC(=O)OCC 62a_100009817359_100000210316 [0,1,0,0,0,0|1,0,0]=2 4993 B15R0.370 CCCCCCCSC(C)OC(=O)OCC 62a_100000036008_100000210316 [0,1,0,0,0,0|2,0,0]=3 4994 B15R0.370 CCCCCCCSC(C)OC(=O)OCC 62a_100000210614_100000036008 [0,1,0,0,0,0|2,0,0]=3 4995 B15R0.370 CCCCCCNCC(=CC(=O)OCC)C 2230a_100000210581_100135422193 [0,1,0,0,0,0|1,0,2]=4 4996 B15R0.370 CCCCCCOCC(=CC(=O)OCC)C 34a_100000210259_100135422193 [0,1,0,0,0,0|1,0,2]=4 4997 B15R0.370 CCCCCCOCC(=CC(=O)OCC)C 7a_100000210259_100135422193 [0,1,0,0,0,0|1,0,2]=4 4998 B15R0.370 CCCCCCOCC(=O)NC(=O)OCC 7a_100000210259_100000010344 [0,1,0,0,0,0|2,0,1]=4 4999 B15R0.370 CCCCCCOC[C@@H](O)CC(=O)OCC 34a_100000210259_100000688340 [0,1,0,0,0,0|1,0,0]=2 5000 B15R0.370 CCCCCCOC[C@@H](O)CC(=O)OCC 7a_100000210259_100000688340 [0,1,0,0,0,0|1,0,0]=2 5001 B15R0.370 CCCCCCSCC(=CC(=O)OCC)C 62a_100000210314_100135422193 [0,1,0,0,0,0|1,0,2]=4 5002 B15R0.370 CCCCCCSCC(=CC(=O)OCC)C 62a_100135422193_100000210757 [0,1,0,0,0,0|1,0,2]=4 5003 B15R0.370 CCCCCCSCC(=O)CC(=O)OCC 62a_100000210311_100000210757 [0,1,0,0,0,0|1,0,1]=3 5004 B15R0.370 CCCCCCSCC(=O)CC(=O)OCC 62a_100000210314_100000210311 [0,1,0,0,0,0|1,0,1]=3 5005 B15R0.370 CCCCCCSCC(=O)NC(=O)OCC 62a_100000210314_100000010344 [0,1,0,0,0,0|2,0,1]=4 5006 B15R0.370 CCCCCCSC[C@@H](O)CC(=O)OCC 62a_100000210314_100000688340 [0,1,0,0,0,0|1,0,0]=2 5007 B15R0.370 CCCCCCSC[C@@H](O)CC(=O)OCC 62a_100000688340_100000210757 [0,1,0,0,0,0|1,0,0]=2 5008 B15R0.370 CCCCOCCOC(C)CC(=O)OCC 7a_100000210238_100009817359 [0,1,0,0,0,0|2,0,0]=3 5009 B15R0.370 CCCCOCCO[C@H](C)CC(=O)OCC 7a_100009816390_100000743108 [0,1,0,0,0,0|2,0,0]=3 5010 B15R0.370 CCCCOCCSC(C)CC(=O)OCC 62a_100000743108_100009817359 [0,1,0,0,0,0|2,0,0]=3 5011 B15R0.370 CCCCOCCSC(C)CC(=O)OCC 62a_100009817359_100000743108 [0,1,0,0,0,0|2,0,0]=3 5012 B15R0.370 CCCCOCCSC(C)OC(=O)OCC 62a_100000036008_100000743108 [0,1,0,0,0,0|3,0,0]=4 5013 B15R0.370 CCCCOCCSC(C)OC(=O)OCC 62a_100000743108_100000036008 [0,1,0,0,0,0|3,0,0]=4 5014 B15R0.370 CCCCOCSCC(=O)CC(=O)OCC 62a_100000210311_100011995733 [0,1,0,0,0,0|2,0,1]=4 5015 B15R0.370 CCCCOCSCC(=O)CC(=O)OCC 62a_100011995733_100000210311 [0,1,0,0,0,0|2,0,1]=4 5016 B15R0.370 CCCCOCSC[C@@H](O)CC(=O)OCC 62a_100000688340_100011995733 [0,1,0,0,0,0|2,0,0]=3 5017 B15R0.370 CCCCOCSC[C@@H](O)CC(=O)OCC 62a_100011995733_100000688340 [0,1,0,0,0,0|2,0,0]=3 5018 B15R0.370 CCCCSCCNC(=O)CC(=O)OCC 240690a_100025743550_100000243816 [0,1,0,0,0,0|2,0,1]=4 5019 B15R0.370 CCCCSCCNC(C)CC(=O)OCC 2230a_100025743550_100009817359 [0,1,0,0,0,0|2,0,0]=3 5020 B15R0.370 CCCCSCCOC(C)CC(=O)OCC 7a_200000230436_100009817359 [0,1,0,0,0,0|2,0,0]=3 5021 B15R0.370 CCCOCCCNC(=O)CC(=O)OCC 240690a_100011217757_100000243816 [0,1,0,0,0,0|2,0,1]=4 5022 B15R0.370 CCCOCCCNC(C)CC(=O)OCC 2230a_100011217757_100009817359 [0,1,0,0,0,0|2,0,0]=3 5023 B15R0.370 CCCOCCNC[C@@H](O)CC(=O)OCC 34a_100161115042_100000688340 [0,1,0,0,0,0|2,0,0]=3 5024 B15R0.370 CCCOCCOC[C@@H](O)CC(=O)OCC 34a_100000752267_100000688340 [0,1,0,0,0,0|2,0,0]=3 5025 B15R0.370 CCCOCCOC[C@@H](O)CC(=O)OCC 7a_100000752267_100000688340 [0,1,0,0,0,0|2,0,0]=3 5026 B15R0.370 CCCOCCSCC(=O)CC(=O)OCC 62a_100000210311_100011215938 [0,1,0,0,0,0|2,0,1]=4 5027 B15R0.370 CCCOCCSCC(=O)CC(=O)OCC 62a_100011215938_100000210311 [0,1,0,0,0,0|2,0,1]=4 5028 B15R0.370 CCCOCCSC[C@@H](O)CC(=O)OCC 62a_100000688340_100011215938 [0,1,0,0,0,0|2,0,0]=3 5029 B15R0.370 CCCOCCSC[C@@H](O)CC(=O)OCC 62a_100011215938_100000688340 [0,1,0,0,0,0|2,0,0]=3 5030 B15R0.370 CCCSCCOC[C@@H](O)CC(=O)OCC 34a_200000230433_100000688340 [0,1,0,0,0,0|2,0,0]=3 5031 B15R0.370 CCCSCCOC[C@@H](O)CC(=O)OCC 7a_200000230433_100000688340 [0,1,0,0,0,0|2,0,0]=3 5032 B15R0.370 CCNC(=O)CC(=O)CCCCCCCO 1458a_100011219782_100000183381 [0,1,0,0,0,0|2,0,1]=4 5033 B15R0.370 CCNC(=O)CN(C)CCCCCCCO 2230a_100000741943_100000760002 [0,1,0,0,0,0|3,0,0]=4 5034 B15R0.370 CCNC(=O)CN(C)CCCCCCCO 269982a_100000741943_100000760002 [0,1,0,0,0,0|3,0,0]=4 5035 B15R0.370 CCNC(=O)CN(C)CCCCCCOC 2230a_100000741943_100011998445 [0,1,0,0,0,0|3,0,0]=4 5036 B15R0.370 CCNC(=O)CN(C)CCCCCCOC 269982a_100000741943_100011998445 [0,1,0,0,0,0|3,0,0]=4 5037 B15R0.370 CCOC(=O)CC(=O)CCCCCCC#N 1458a_100000243816_100009813337 [0,1,0,0,0,0|1,0,2]=4 5038 B15R0.370 CCOC(=O)CC(=O)CCCCCCCO 1458a_100000243816_100000760002 [0,1,0,0,0,0|1,0,1]=3 5039 B15R0.370 CCOC(=O)CC(=O)CCCCCCCO 1458a_100011219782_100000188475 [0,1,0,0,0,0|1,0,1]=3 5040 B15R0.370 CCOC(=O)CC(=O)CCCCCCOC 1458a_100000243816_100011998445 [0,1,0,0,0,0|1,0,1]=3 5041 B15R0.370 CCOC(=O)CC(=O)CCCOCCOC 1458a_100000243816_100011216529 [0,1,0,0,0,0|2,0,1]=4 5042 B15R0.370 CCOC(=O)CC(=O)CSCCCCCF 62a_100000210311_100000729378 [0,1,0,0,0,0|2,0,1]=4 5043 B15R0.370 CCOC(=O)CC(=O)CSCCCCCF 62a_100000729378_100000210311 [0,1,0,0,0,0|2,0,1]=4 5044 B15R0.370 CCOC(=O)CC(=O)CSCCCCCO 62a_100000210311_100000746330 [0,1,0,0,0,0|2,0,1]=4 5045 B15R0.370 CCOC(=O)CC(=O)CSCCCCCO 62a_100000746330_100000210311 [0,1,0,0,0,0|2,0,1]=4 5046 B15R0.370 CCOC(=O)CC(=O)CSCCCCOC 62a_100000210311_100000730899 [0,1,0,0,0,0|2,0,1]=4 5047 B15R0.370 CCOC(=O)CC(=O)CSCCCCOC 62a_100000730899_100000210311 [0,1,0,0,0,0|2,0,1]=4 5048 B15R0.370 CCOC(=O)CC(=O)NCCCCCCO 240690a_100000686447_100000243816 [0,1,0,0,0,0|2,0,1]=4 5049 B15R0.370 CCOC(=O)CC(=O)NCCCCCOC 240690a_100000747528_100000243816 [0,1,0,0,0,0|2,0,1]=4 5050 B15R0.370 CCOC(=O)CC(C)NCCCCCCO 2230a_100000686447_100009817359 [0,1,0,0,0,0|2,0,0]=3 5051 B15R0.370 CCOC(=O)CC(C)NCCCCCOC 2230a_100000747528_100009817359 [0,1,0,0,0,0|2,0,0]=3 5052 B15R0.370 CCOC(=O)CC(C)NCCOCCOC 2230a_100000745349_100009817359 [0,1,0,0,0,0|3,0,0]=4 5053 B15R0.370 CCOC(=O)CC(C)OCCCCCCBr 7a_100011215345_100009817359 [0,1,0,0,0,0|2,0,0]=3 5054 B15R0.370 CCOC(=O)CC(C)OCCCCCCCl 7a_100000766143_100009817359 [0,1,0,0,0,0|2,0,0]=3 5055 B15R0.370 CCOC(=O)CC(C)OCCCCCCF 7a_100000732779_100009817359 [0,1,0,0,0,0|2,0,0]=3 5056 B15R0.370 CCOC(=O)CC(C)OCCOCCOC 7a_100011215163_100009817359 [0,1,0,0,0,0|3,0,0]=4 5057 B15R0.370 CCOC(=O)CC(C)SCCCCCC#N 62a_100009813376_100009817359 [0,1,0,0,0,0|2,0,1]=4 5058 B15R0.370 CCOC(=O)CC(C)SCCCCCC#N 62a_100009817359_100009813376 [0,1,0,0,0,0|2,0,1]=4 5059 B15R0.370 CCOC(=O)CC(C)SCCCCCC=O 62a_100000139337_100009817359 [0,1,0,0,0,0|2,0,1]=4 5060 B15R0.370 CCOC(=O)CC(C)SCCCCCC=O 62a_100009817359_100000139337 [0,1,0,0,0,0|2,0,1]=4 5061 B15R0.370 CCOC(=O)CC(C)SCCCCCCF 62a_100009817359_100015922095 [0,1,0,0,0,0|2,0,0]=3 5062 B15R0.370 CCOC(=O)CC(C)SCCCCCCF 62a_100015922095_100009817359 [0,1,0,0,0,0|2,0,0]=3 5063 B15R0.370 CCOC(=O)CC(C)SCCCCCCO 62a_100000766143_100009817359 [0,1,0,0,0,0|2,0,0]=3 5064 B15R0.370 CCOC(=O)CC(C)SCCCCCCO 62a_100009817359_100000766143 [0,1,0,0,0,0|2,0,0]=3 5065 B15R0.370 CCOC(=O)CC(C)SCCOCCOC 62a_100000695917_100009817359 [0,1,0,0,0,0|3,0,0]=4 5066 B15R0.370 CCOC(=O)CC(C)SCCOCCOC 62a_100009817359_100000695917 [0,1,0,0,0,0|3,0,0]=4 5067 B15R0.370 CCOC(=O)CN(C)CCCCCCC#N 2230a_100000220588_100009813337 [0,1,0,0,0,0|2,0,1]=4 5068 B15R0.370 CCOC(=O)CN(C)CCCCCCCO 2230a_100000220588_100000760002 [0,1,0,0,0,0|2,0,0]=3 5069 B15R0.370 CCOC(=O)CN(C)CCCCCCOC 2230a_100000220588_100011998445 [0,1,0,0,0,0|2,0,0]=3 5070 B15R0.370 CCOC(=O)CN(C)CCCOCCOC 2230a_100000220588_100011216529 [0,1,0,0,0,0|3,0,0]=4 5071 B15R0.370 CCOC(=O)C[C@@H](C)OCCCCCC#N 7a_100009816390_100009813376 [0,1,0,0,0,0|2,0,1]=4 5072 B15R0.370 CCOC(=O)C[C@@H](C)OCCCCCC=O 7a_100009816390_100000139337 [0,1,0,0,0,0|2,0,1]=4 5073 B15R0.370 CCOC(=O)C[C@@H](C)OCCCCCCF 7a_100009816390_100015922095 [0,1,0,0,0,0|2,0,0]=3 5074 B15R0.370 CCOC(=O)C[C@@H](C)OCCCCCCO 7a_100009816390_100000766143 [0,1,0,0,0,0|2,0,0]=3 5075 B15R0.370 CCOC(=O)C[C@@H](C)OCCOCCOC 7a_100009816390_100000695917 [0,1,0,0,0,0|3,0,0]=4 5076 B15R0.370 CCOC(=O)C[C@H](O)CNCCCCCO 34a_100000762737_100000688340 [0,1,0,0,0,0|2,0,0]=3 5077 B15R0.370 CCOC(=O)C[C@H](O)CNCCOCCO 34a_100000211614_100000688340 [0,1,0,0,0,0|3,0,0]=4 5078 B15R0.370 CCOC(=O)C[C@H](O)COCCCCCBr 34a_100000746331_100000688340 [0,1,0,0,0,0|2,0,0]=3 5079 B15R0.370 CCOC(=O)C[C@H](O)COCCCCCBr 7a_100000746331_100000688340 [0,1,0,0,0,0|2,0,0]=3 5080 B15R0.370 CCOC(=O)C[C@H](O)COCCCCCCl 34a_100000746330_100000688340 [0,1,0,0,0,0|2,0,0]=3 5081 B15R0.370 CCOC(=O)C[C@H](O)COCCCCCCl 7a_100000746330_100000688340 [0,1,0,0,0,0|2,0,0]=3 5082 B15R0.370 CCOC(=O)C[C@H](O)COCCCCCI 34a_200012148887_100000688340 [0,1,0,0,0,0|2,0,0]=3 5083 B15R0.370 CCOC(=O)C[C@H](O)COCCCCCI 7a_200012148887_100000688340 [0,1,0,0,0,0|2,0,0]=3 5084 B15R0.370 CCOC(=O)C[C@H](O)COCCCCCN 34a_100000762737_100000688340 [0,1,0,0,0,0|2,0,0]=3 5085 B15R0.370 CCOC(=O)C[C@H](O)COCCCCOC 34a_100000740925_100000688340 [0,1,0,0,0,0|2,0,0]=3 5086 B15R0.370 CCOC(=O)C[C@H](O)COCCCCSC 34a_100011217163_100000688340 [0,1,0,0,0,0|2,0,0]=3 5087 B15R0.370 CCOC(=O)C[C@H](O)COCCCCSC 7a_100011217163_100000688340 [0,1,0,0,0,0|2,0,0]=3 5088 B15R0.370 CCOC(=O)C[C@H](O)COCCCSCC 34a_100011216438_100000688340 [0,1,0,0,0,0|2,0,0]=3 5089 B15R0.370 CCOC(=O)C[C@H](O)COCCCSCC 7a_100011216438_100000688340 [0,1,0,0,0,0|2,0,0]=3 5090 B15R0.370 CCOC(=O)C[C@H](O)COCCOCCBr 34a_100000692535_100000688340 [0,1,0,0,0,0|3,0,0]=4 5091 B15R0.370 CCOC(=O)C[C@H](O)COCCOCCBr 7a_100000692535_100000688340 [0,1,0,0,0,0|3,0,0]=4 5092 B15R0.370 CCOC(=O)C[C@H](O)COCCOCCCl 34a_100011215305_100000688340 [0,1,0,0,0,0|3,0,0]=4 5093 B15R0.370 CCOC(=O)C[C@H](O)COCCOCCCl 7a_100011215305_100000688340 [0,1,0,0,0,0|3,0,0]=4 5094 B15R0.370 CCOC(=O)C[C@H](O)COCCOCCF 34a_200015357709_100000688340 [0,1,0,0,0,0|3,0,0]=4 5095 B15R0.370 CCOC(=O)C[C@H](O)COCCOCCF 7a_200015357709_100000688340 [0,1,0,0,0,0|3,0,0]=4 5096 B15R0.370 CCOC(=O)C[C@H](O)COCCOCCI 34a_100012149058_100000688340 [0,1,0,0,0,0|3,0,0]=4 5097 B15R0.370 CCOC(=O)C[C@H](O)COCCOCCI 7a_100012149058_100000688340 [0,1,0,0,0,0|3,0,0]=4 5098 B15R0.370 CCOC(=O)C[C@H](O)COCCOCCN 34a_100000211614_100000688340 [0,1,0,0,0,0|3,0,0]=4 5099 B15R0.370 CCOC(=O)C[C@H](O)CSCCCCC#N 62a_100000688340_100000211819 [0,1,0,0,0,0|2,0,1]=4 5100 B15R0.370 CCOC(=O)C[C@H](O)CSCCCCC#N 62a_100011219923_100000688340 [0,1,0,0,0,0|2,0,1]=4 5101 B15R0.370 CCOC(=O)C[C@H](O)CSCCCCC=O 62a_100000139335_100000688340 [0,1,0,0,0,0|2,0,1]=4 5102 B15R0.370 CCOC(=O)C[C@H](O)CSCCCCC=O 62a_100000688340_100000139335 [0,1,0,0,0,0|2,0,1]=4 5103 B15R0.370 CCOC(=O)C[C@H](O)CSCCCCCF 62a_100000688340_100000729378 [0,1,0,0,0,0|2,0,0]=3 5104 B15R0.370 CCOC(=O)C[C@H](O)CSCCCCCF 62a_100000729378_100000688340 [0,1,0,0,0,0|2,0,0]=3 5105 B15R0.370 CCOC(=O)C[C@H](O)CSCCCCCO 62a_100000688340_100000746330 [0,1,0,0,0,0|2,0,0]=3 5106 B15R0.370 CCOC(=O)C[C@H](O)CSCCCCCO 62a_100000746330_100000688340 [0,1,0,0,0,0|2,0,0]=3 5107 B15R0.370 CCOC(=O)C[C@H](O)CSCCCCOC 62a_100000688340_100000730899 [0,1,0,0,0,0|2,0,0]=3 5108 B15R0.370 CCOC(=O)C[C@H](O)CSCCCCOC 62a_100000730899_100000688340 [0,1,0,0,0,0|2,0,0]=3 5109 B15R0.370 CCOC(=O)C[C@H](O)CSCCOCCO 62a_100000688340_100011215305 [0,1,0,0,0,0|3,0,0]=4 5110 B15R0.370 CCOC(=O)C[C@H](O)CSCCOCCO 62a_100011215305_100000688340 [0,1,0,0,0,0|3,0,0]=4 5111 B15R0.370 CCOC(=O)C[C@H](O)CSCOCCOC 62a_100000231047_100000688340 [0,1,0,0,0,0|3,0,0]=4 5112 B15R0.370 CCOC(=O)C[C@H](O)CSCOCCOC 62a_100000688340_100000231047 [0,1,0,0,0,0|3,0,0]=4 5113 B15R0.370 CCOC(=O)OC(C)SCCCCCCF 62a_100000036008_100015922095 [0,1,0,0,0,0|3,0,0]=4 5114 B15R0.370 CCOC(=O)OC(C)SCCCCCCF 62a_100015922095_100000036008 [0,1,0,0,0,0|3,0,0]=4 5115 B15R0.370 CCOC(=O)OC(C)SCCCCCCO 62a_100000036008_100000766143 [0,1,0,0,0,0|3,0,0]=4 5116 B15R0.370 CCOC(=O)OC(C)SCCCCCCO 62a_100000766143_100000036008 [0,1,0,0,0,0|3,0,0]=4 5117 B15R0.370 CCOCCCNC[C@@H](O)CC(=O)OCC 34a_100000210961_100000688340 [0,1,0,0,0,0|2,0,0]=3 5118 B15R0.370 CCOCCCOC[C@@H](O)CC(=O)OCC 34a_100000757476_100000688340 [0,1,0,0,0,0|2,0,0]=3 5119 B15R0.370 CCOCCCOC[C@@H](O)CC(=O)OCC 7a_100000757476_100000688340 [0,1,0,0,0,0|2,0,0]=3 5120 B15R0.370 CCOCCCSCC(=O)CC(=O)OCC 62a_100000210311_100012232248 [0,1,0,0,0,0|2,0,1]=4 5121 B15R0.370 CCOCCCSCC(=O)CC(=O)OCC 62a_100012232248_100000210311 [0,1,0,0,0,0|2,0,1]=4 5122 B15R0.370 CCOCCCSC[C@@H](O)CC(=O)OCC 62a_100000688340_100012232248 [0,1,0,0,0,0|2,0,0]=3 5123 B15R0.370 CCOCCCSC[C@@H](O)CC(=O)OCC 62a_100012232248_100000688340 [0,1,0,0,0,0|2,0,0]=3 5124 B15R0.370 CCOCCOCCC(=O)CC(=O)OCC 1458a_100000243816_100011211534 [0,1,0,0,0,0|2,0,1]=4 5125 B15R0.370 CCOCCOCCN(C)CC(=O)OCC 2230a_100000220588_100011211534 [0,1,0,0,0,0|3,0,0]=4 5126 B15R0.384 C#CC(=O)CCCCCCCC(=O)OCC 1458a_100000211873_100009991516 [0,1,0,0,0,0|0,0,3]=4 5127 B15R0.384 C#CC(C)NCCCCCCC(=O)OCC 2230a_100000707721_100009814379 [0,1,0,0,0,0|1,0,2]=4 5128 B15R0.384 C#CC(C)NCCCCCCC(=O)OCC 34a_100000707721_100009814379 [0,1,0,0,0,0|1,0,2]=4 5129 B15R0.384 C#CC(C)SCCCCCCC(=O)OCC 62a_200000035995_100009814379 [0,1,0,0,0,0|1,0,2]=4 5130 B15R0.384 C#CC(O)CCCCCSCC(=O)OCC 62a_100000188475_200010408556 [0,1,0,0,0,0|1,0,2]=4 5131 B15R0.384 C#CC(O)CCCCCSCC(=O)OCC 62a_200010408556_100000188475 [0,1,0,0,0,0|1,0,2]=4 5132 B15R0.384 C#C[C@@H](C)OCCCCCCC(=O)OCC 34a_100009815206_100009814379 [0,1,0,0,0,0|1,0,2]=4 5133 B15R0.384 C#C[C@@H](C)OCCCCCCC(=O)OCC 7a_100009815206_100009814379 [0,1,0,0,0,0|1,0,2]=4 5134 B15R0.384 C=CC(=O)CCCCCCCC(=O)OCC 1458a_100000185746_100009991516 [0,1,0,0,0,0|0,0,3]=4 5135 B15R0.384 C=CC(C)COCCCCCC(=O)OCC 34a_100011215527_100000755133 [0,1,0,0,0,0|1,0,2]=4 5136 B15R0.384 C=CC(C)COCCCCCC(=O)OCC 7a_100011215527_100000755133 [0,1,0,0,0,0|1,0,2]=4 5137 B15R0.384 C=CC(C)OCCCCCCC(=O)OCC 34a_100000695699_100009814379 [0,1,0,0,0,0|1,0,2]=4 5138 B15R0.384 C=CC(C)SCCCCCCC(=O)OCC 62a_100011215867_100009814379 [0,1,0,0,0,0|1,0,2]=4 5139 B15R0.384 C=CC(O)COCCCCCC(=O)OCC 7a_100011214988_100000730141 [0,1,0,0,0,0|1,0,2]=4 5140 B15R0.384 C=CC(O)CSCCCCCC(=O)OCC 62a_100000730141_100000755133 [0,1,0,0,0,0|1,0,2]=4 5141 B15R0.384 C=CC(O)CSCCCCCC(=O)OCC 62a_100000755133_100000730141 [0,1,0,0,0,0|1,0,2]=4 5142 B15R0.384 C=C[C@H](N)COCCCCCC(=O)OCC 34a_100016989147_100000755133 [0,1,0,0,0,0|1,0,2]=4 5143 B15R0.384 CCC(C)CCCCCOCC(=O)NCO 7a_200000035636_100000185155 [0,1,0,0,0,0|3,0,0]=4 5144 B15R0.384 CCCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000210303 [0,1,0,0,0,0|2,0,1]=4 5145 B15R0.384 CCCC(=O)CCCCCCCC(=O)OC 1458a_100000211992_100010004213 [0,1,0,0,0,0|2,0,1]=4 5146 B15R0.384 CCCC(=O)COCCCCCC(C)CC 7a_200000035636_100000747444 [0,1,0,0,0,0|2,0,0]=3 5147 B15R0.384 CCNC(=O)CCCCCCCC(=O)OC 11a_100015525214_100000033222 [0,1,0,0,0,0|2,0,1]=4 5148 B15R0.384 CCNC(=O)CCCCCCCC(=O)OC 240690a_100015525214_100000033222 [0,1,0,0,0,0|2,0,1]=4 5149 B15R0.384 CCNC(=O)COCCCCCC(C)CC 7a_200000035636_100000183381 [0,1,0,0,0,0|2,0,0]=3 5150 B15R0.384 CCOC(=O)/C=C/COCCCC(C)CC 7a_100011216074_100016267167 [0,1,0,0,0,0|1,0,2]=4 5151 B15R0.384 CCOC(=O)CCCCC=NNC(C)CC 4a_100000718999_100012182868 [0,1,0,0,0,0|2,0,1]=4 5152 B15R0.384 CCOC(=O)CCCCCCCC(=O)CC 1458a_100000210414_100009991516 [0,1,0,0,0,0|0,0,1]=2 5153 B15R0.384 CCOC(=O)CCCCCCCC(=O)CO 1458a_100000210174_100009991516 [0,1,0,0,0,0|1,0,1]=3 5154 B15R0.384 CCOC(=O)CCCCCCCN(C)CC 2230a_100000225621_100009991516 [0,1,0,0,0,0|1,0,0]=2 5155 B15R0.384 CCOC(=O)CCCCCCCN(C)CC 269982a_100000225621_100009991516 [0,1,0,0,0,0|1,0,0]=2 5156 B15R0.384 CCOC(=O)CCCCCCNC(=O)CC 188690a_100000741137_100000210414 [0,1,0,0,0,0|1,0,1]=3 5157 B15R0.384 CCOC(=O)CCCCCCNC(=O)CO 188690a_100000741137_100000210174 [0,1,0,0,0,0|2,0,1]=4 5158 B15R0.384 CCOC(=O)CCCCCCNC(C)C#N 2230a_100000737613_100009814379 [0,1,0,0,0,0|2,0,1]=4 5159 B15R0.384 CCOC(=O)CCCCCCNC(C)CC 2230a_100000209981_100009814379 [0,1,0,0,0,0|1,0,0]=2 5160 B15R0.384 CCOC(=O)CCCCCCN[C@H](C)CO 2230a_100000737577_100009814379 [0,1,0,0,0,0|2,0,0]=3 5161 B15R0.384 CCOC(=O)CCCCCCOC(C)C#N 34a_100011218135_100009814379 [0,1,0,0,0,0|2,0,1]=4 5162 B15R0.384 CCOC(=O)CCCCCCOC(C)CC 7a_100000210228_100009814379 [0,1,0,0,0,0|1,0,0]=2 5163 B15R0.384 CCOC(=O)CCCCCCOC(C)CF 34a_100016041109_100009814379 [0,1,0,0,0,0|2,0,0]=3 5164 B15R0.384 CCOC(=O)CCCCCCOC(C)CF 7a_100016041109_100009814379 [0,1,0,0,0,0|2,0,0]=3 5165 B15R0.384 CCOC(=O)CCCCCCOC(C)CN 34a_100000210904_100009814379 [0,1,0,0,0,0|2,0,0]=3 5166 B15R0.384 CCOC(=O)CCCCCCSC(C)C#N 62a_100000703298_100009814379 [0,1,0,0,0,0|2,0,1]=4 5167 B15R0.384 CCOC(=O)CCCCCCSC(C)CC 62a_100000758301_100009814379 [0,1,0,0,0,0|1,0,0]=2 5168 B15R0.384 CCOC(=O)CCCCCCSC(C)CO 62a_100012180447_100009814379 [0,1,0,0,0,0|2,0,0]=3 5169 B15R0.384 CCOC(=O)CCCCCCSC(C)OC 62a_100009879195_100009814379 [0,1,0,0,0,0|2,0,0]=3 5170 B15R0.384 CCOC(=O)CCCCCCSC(F)C#N 62a_200000117898_100009814379 [0,1,0,0,0,0|2,0,1]=4 5171 B15R0.384 CCOC(=O)CCCCCCS[C@H](C)CO 62a_100016084084_100009814379 [0,1,0,0,0,0|2,0,0]=3 5172 B15R0.384 CCOC(=O)CCCCCNCC(=O)NC 2230a_100000693194_100000755133 [0,1,0,0,0,0|2,0,1]=4 5173 B15R0.384 CCOC(=O)CCCCCNCC(C)CC 2230a_100020588543_100000755133 [0,1,0,0,0,0|1,0,0]=2 5174 B15R0.384 CCOC(=O)CCCCCNCC(C)CO 34a_100000744482_100000755133 [0,1,0,0,0,0|2,0,0]=3 5175 B15R0.384 CCOC(=O)CCCCCNCC(O)CC 2230a_100011218483_100000755133 [0,1,0,0,0,0|1,0,0]=2 5176 B15R0.384 CCOC(=O)CCCCCNC[C@@H](C)OC 2230a_100020591295_100000755133 [0,1,0,0,0,0|2,0,0]=3 5177 B15R0.384 CCOC(=O)CCCCCNC[C@@H](F)CO 34a_100015665980_100000755133 [0,1,0,0,0,0|2,0,0]=3 5178 B15R0.384 CCOC(=O)CCCCCNC[C@H](O)CO 2230a_100020644852_100000755133 [0,1,0,0,0,0|2,0,0]=3 5179 B15R0.384 CCOC(=O)CCCCCOCC(=O)CC 34a_100000725409_100000755133 [0,1,0,0,0,0|1,0,1]=3 5180 B15R0.384 CCOC(=O)CCCCCOCC(=O)CC 7a_100011214988_100000747405 [0,1,0,0,0,0|1,0,1]=3 5181 B15R0.384 CCOC(=O)CCCCCOCC(=O)NC 34a_100000750040_100000755133 [0,1,0,0,0,0|2,0,1]=4 5182 B15R0.384 CCOC(=O)CCCCCOCC(=O)NC 7a_100011214988_100000183359 [0,1,0,0,0,0|2,0,1]=4 5183 B15R0.384 CCOC(=O)CCCCCOCC(=O)OC 7a_100011214988_100000747449 [0,1,0,0,0,0|2,0,1]=4 5184 B15R0.384 CCOC(=O)CCCCCOCC(C)CC 7a_100011214988_100000748023 [0,1,0,0,0,0|1,0,0]=2 5185 B15R0.384 CCOC(=O)CCCCCOCC(C)CN 34a_100000744482_100000755133 [0,1,0,0,0,0|2,0,0]=3 5186 B15R0.384 CCOC(=O)CCCCCOCC(C)OC 34a_100000690652_100000755133 [0,1,0,0,0,0|2,0,0]=3 5187 B15R0.384 CCOC(=O)CCCCCOCC(Cl)CCl 34a_100000033668_100000755133 [0,1,0,0,0,0|2,0,0]=3 5188 B15R0.384 CCOC(=O)CCCCCOCC(O)CC 7a_100011214988_100011218378 [0,1,0,0,0,0|1,0,0]=2 5189 B15R0.384 CCOC(=O)CCCCCOCC(O)CO 7a_100011214988_100011219619 [0,1,0,0,0,0|2,0,0]=3 5190 B15R0.384 CCOC(=O)CCCCCOC[C@@H](C)CC 7a_100009816381_100000755133 [0,1,0,0,0,0|1,0,0]=2 5191 B15R0.384 CCOC(=O)CCCCCOC[C@@H](C)CC 7a_100011214988_100009816398 [0,1,0,0,0,0|1,0,0]=2 5192 B15R0.384 CCOC(=O)CCCCCOC[C@@H](C)CO 7a_100011214988_100000059175 [0,1,0,0,0,0|2,0,0]=3 5193 B15R0.384 CCOC(=O)CCCCCOC[C@@H](O)CF 7a_100011214988_100015614560 [0,1,0,0,0,0|2,0,0]=3 5194 B15R0.384 CCOC(=O)CCCCCOC[C@@H](O)CO 7a_100011214988_100009815848 [0,1,0,0,0,0|2,0,0]=3 5195 B15R0.384 CCOC(=O)CCCCCOC[C@H](F)CN 34a_100015665980_100000755133 [0,1,0,0,0,0|2,0,0]=3 5196 B15R0.384 CCOC(=O)CCCCCSCC(=O)CC 62a_100000747405_100000755133 [0,1,0,0,0,0|1,0,1]=3 5197 B15R0.384 CCOC(=O)CCCCCSCC(=O)CC 62a_100000755133_100000747405 [0,1,0,0,0,0|1,0,1]=3 5198 B15R0.384 CCOC(=O)CCCCCSCC(=O)NC 62a_100000183359_100000755133 [0,1,0,0,0,0|2,0,1]=4 5199 B15R0.384 CCOC(=O)CCCCCSCC(=O)NC 62a_100000755133_100000183359 [0,1,0,0,0,0|2,0,1]=4 5200 B15R0.384 CCOC(=O)CCCCCSCC(=O)OC 62a_100000747449_100000755133 [0,1,0,0,0,0|2,0,1]=4 5201 B15R0.384 CCOC(=O)CCCCCSCC(=O)OC 62a_100000755133_100000747449 [0,1,0,0,0,0|2,0,1]=4 5202 B15R0.384 CCOC(=O)CCCCCSCC(C)CC 62a_100000748023_100000755133 [0,1,0,0,0,0|1,0,0]=2 5203 B15R0.384 CCOC(=O)CCCCCSCC(C)CC 62a_100000755133_100000748023 [0,1,0,0,0,0|1,0,0]=2 5204 B15R0.384 CCOC(=O)CCCCCSCC(O)CC 62a_100000755133_100011218378 [0,1,0,0,0,0|1,0,0]=2 5205 B15R0.384 CCOC(=O)CCCCCSCC(O)CC 62a_100011218378_100000755133 [0,1,0,0,0,0|1,0,0]=2 5206 B15R0.384 CCOC(=O)CCCCCSCC(O)CO 62a_100000755133_100011219619 [0,1,0,0,0,0|2,0,0]=3 5207 B15R0.384 CCOC(=O)CCCCCSCC(O)CO 62a_100011219619_100000755133 [0,1,0,0,0,0|2,0,0]=3 5208 B15R0.384 CCOC(=O)CCCCCSC[C@@H](C)CC 62a_100000755133_100009816398 [0,1,0,0,0,0|1,0,0]=2 5209 B15R0.384 CCOC(=O)CCCCCSC[C@@H](C)CC 62a_100009816398_100000755133 [0,1,0,0,0,0|1,0,0]=2 5210 B15R0.384 CCOC(=O)CCCCCSC[C@@H](C)CO 62a_100000059175_100000755133 [0,1,0,0,0,0|2,0,0]=3 5211 B15R0.384 CCOC(=O)CCCCCSC[C@@H](C)CO 62a_100000755133_100000059175 [0,1,0,0,0,0|2,0,0]=3 5212 B15R0.384 CCOC(=O)CCCCCSC[C@@H](O)CF 62a_100000755133_100015614560 [0,1,0,0,0,0|2,0,0]=3 5213 B15R0.384 CCOC(=O)CCCCCSC[C@@H](O)CF 62a_100015614560_100000755133 [0,1,0,0,0,0|2,0,0]=3 5214 B15R0.384 CCOC(=O)CCCCCSC[C@@H](O)CO 62a_100000755133_100009815848 [0,1,0,0,0,0|2,0,0]=3 5215 B15R0.384 CCOC(=O)CCCCCSC[C@@H](O)CO 62a_100009815848_100000755133 [0,1,0,0,0,0|2,0,0]=3 5216 B15R0.384 CCOC(=O)CCCCNCCC(=O)NC 2230a_100000738227_100000750268 [0,1,0,0,0,0|2,0,1]=4 5217 B15R0.384 CCOC(=O)CCCCNCCC(=O)NC 34a_100000738227_100000750268 [0,1,0,0,0,0|2,0,1]=4 5218 B15R0.384 CCOC(=O)CCCCNCCC(C)CC 2230a_100020591266_100000750268 [0,1,0,0,0,0|1,0,0]=2 5219 B15R0.384 CCOC(=O)CCCCNCCC(C)CO 2230a_106354213184_100000750268 [0,1,0,0,0,0|2,0,0]=3 5220 B15R0.384 CCOC(=O)CCCCNCCC(C)CO 34a_106354213184_100000750268 [0,1,0,0,0,0|2,0,0]=3 5221 B15R0.384 CCOC(=O)CCCCOCCC(=O)NC 34a_100000754576_100000750268 [0,1,0,0,0,0|2,0,1]=4 5222 B15R0.384 CCOC(=O)CCCCOCCC(C)CC 7a_100011215188_100000750268 [0,1,0,0,0,0|1,0,0]=2 5223 B15R0.384 CCOC(=O)CCCCOCCC(C)OC 7a_100000764861_100000750268 [0,1,0,0,0,0|2,0,0]=3 5224 B15R0.384 CCOC(=O)CCCCSCCC(=O)NC 62a_100000737683_100000750268 [0,1,0,0,0,0|2,0,1]=4 5225 B15R0.384 CCOC(=O)CCCCSCCC(=O)NC 62a_100000750268_100000737683 [0,1,0,0,0,0|2,0,1]=4 5226 B15R0.384 CCOC(=O)CCCCSCCC(=O)OC 62a_100000204255_100000750268 [0,1,0,0,0,0|2,0,1]=4 5227 B15R0.384 CCOC(=O)CCCCSCCC(=O)OC 62a_100000750268_100000204255 [0,1,0,0,0,0|2,0,1]=4 5228 B15R0.384 CCOC(=O)CCCNCCCC(=O)NC 2230a_100000740002_100009991533 [0,1,0,0,0,0|2,0,1]=4 5229 B15R0.384 CCOC(=O)CCCNCCCC(=O)NC 34a_100000740002_100009991533 [0,1,0,0,0,0|2,0,1]=4 5230 B15R0.384 CCOC(=O)CCCNCCNC(=O)CC 34a_100132302217_100009991533 [0,1,0,0,0,0|2,0,1]=4 5231 B15R0.384 CCOC(=O)CCCOCCCC(=O)NC 7a_100012001163_100000741757 [0,1,0,0,0,0|2,0,1]=4 5232 B15R0.384 CCOC(=O)CCCOCCCC(=O)OC 7a_100012001163_100011218270 [0,1,0,0,0,0|2,0,1]=4 5233 B15R0.384 CCOC(=O)CCCOCCCC(C)CC 7a_100011216074_100011215271 [0,1,0,0,0,0|1,0,0]=2 5234 B15R0.384 CCOC(=O)CCCOCCCN(C)CC 7a_100012001163_100015186262 [0,1,0,0,0,0|2,0,0]=3 5235 B15R0.384 CCOC(=O)CCCOCCC[C@@H](C)CN 34a_100160569302_100009991533 [0,1,0,0,0,0|2,0,0]=3 5236 B15R0.384 CCOC(=O)CCCOCCNC(=O)CC 34a_200000158885_100009991533 [0,1,0,0,0,0|2,0,1]=4 5237 B15R0.384 CCOC(=O)CCCOCCNC(=O)CC 7a_200000158885_100011215271 [0,1,0,0,0,0|2,0,1]=4 5238 B15R0.384 CCOC(=O)CCCOCCOC(=O)CC 7a_200000031056_100011215271 [0,1,0,0,0,0|2,0,1]=4 5239 B15R0.384 CCOC(=O)CCCSCCCC(=O)NC 62a_100000741757_100009991533 [0,1,0,0,0,0|2,0,1]=4 5240 B15R0.384 CCOC(=O)CCCSCCCC(=O)NC 62a_100009991533_100000741757 [0,1,0,0,0,0|2,0,1]=4 5241 B15R0.384 CCOC(=O)CCCSCCCC(=O)OC 62a_100009991533_100011218270 [0,1,0,0,0,0|2,0,1]=4 5242 B15R0.384 CCOC(=O)CCCSCCCC(=O)OC 62a_100011218270_100009991533 [0,1,0,0,0,0|2,0,1]=4 5243 B15R0.384 CCOC(=O)CCCSCCCN(C)CC 62a_100009991533_100015186262 [0,1,0,0,0,0|2,0,0]=3 5244 B15R0.384 CCOC(=O)CCOCCCCC(=O)OC 34a_100000059025_100000765890 [0,1,0,0,0,0|2,0,1]=4 5245 B15R0.384 CCOC(=O)CCOCCCCC(=O)OC 7a_100000059025_100011206558 [0,1,0,0,0,0|2,0,1]=4 5246 B15R0.384 CCOC(=O)CCSCCCCC(=O)OC 62a_100000204269_100000765890 [0,1,0,0,0,0|2,0,1]=4 5247 B15R0.384 CCOC(=O)CCSCCCCC(=O)OC 62a_100000765890_100000204269 [0,1,0,0,0,0|2,0,1]=4 5248 B15R0.384 CCOC(=O)COCCCCCC(=O)OC 34a_100000074720_100000188475 [0,1,0,0,0,0|2,0,1]=4 5249 B15R0.384 CCOC(=O)COCCCCCC(=O)OC 7a_100000074720_100000188475 [0,1,0,0,0,0|2,0,1]=4 5250 B15R0.384 CCOC(=O)COCCCCCC(C)CC 7a_200000035636_100000188475 [0,1,0,0,0,0|1,0,0]=2 5251 B15R0.384 CCOC(=O)COCCCNCC(C)CC 2230a_100020588543_100009893628 [0,1,0,0,0,0|2,0,0]=3 5252 B15R0.384 CCOC(=O)COCCCNCC(C)CO 34a_100000744482_100009893628 [0,1,0,0,0,0|3,0,0]=4 5253 B15R0.384 CCOC(=O)COCCCNCC(O)CC 2230a_100011218483_100009893628 [0,1,0,0,0,0|2,0,0]=3 5254 B15R0.384 CCOC(=O)COCCCNC[C@@H](C)OC 2230a_100020591295_100009893628 [0,1,0,0,0,0|3,0,0]=4 5255 B15R0.384 CCOC(=O)COCCCNC[C@@H](F)CO 34a_100015665980_100009893628 [0,1,0,0,0,0|3,0,0]=4 5256 B15R0.384 CCOC(=O)COCCCNC[C@H](O)CO 2230a_100020644852_100009893628 [0,1,0,0,0,0|3,0,0]=4 5257 B15R0.384 CCOC(=O)COCCCOCC(=O)CC 34a_100000725409_100009893628 [0,1,0,0,0,0|2,0,1]=4 5258 B15R0.384 CCOC(=O)COCCCOCC(C)CN 34a_100000744482_100009893628 [0,1,0,0,0,0|3,0,0]=4 5259 B15R0.384 CCOC(=O)COCCCOCC(C)OC 34a_100000690652_100009893628 [0,1,0,0,0,0|3,0,0]=4 5260 B15R0.384 CCOC(=O)COCCCOCC(Cl)CCl 34a_100000033668_100009893628 [0,1,0,0,0,0|3,0,0]=4 5261 B15R0.384 CCOC(=O)COCCCOC[C@@H](C)CC 7a_100009816381_100009893628 [0,1,0,0,0,0|2,0,0]=3 5262 B15R0.384 CCOC(=O)COCCCOC[C@H](F)CN 34a_100015665980_100009893628 [0,1,0,0,0,0|3,0,0]=4 5263 B15R0.384 CCOC(=O)COCCCSCC(=O)CC 62a_100000747405_100009893628 [0,1,0,0,0,0|2,0,1]=4 5264 B15R0.384 CCOC(=O)COCCCSCC(=O)CC 62a_100009893628_100000747405 [0,1,0,0,0,0|2,0,1]=4 5265 B15R0.384 CCOC(=O)COCCCSCC(C)CC 62a_100000748023_100009893628 [0,1,0,0,0,0|2,0,0]=3 5266 B15R0.384 CCOC(=O)COCCCSCC(C)CC 62a_100009893628_100000748023 [0,1,0,0,0,0|2,0,0]=3 5267 B15R0.384 CCOC(=O)COCCCSCC(O)CC 62a_100009893628_100011218378 [0,1,0,0,0,0|2,0,0]=3 5268 B15R0.384 CCOC(=O)COCCCSCC(O)CC 62a_100011218378_100009893628 [0,1,0,0,0,0|2,0,0]=3 5269 B15R0.384 CCOC(=O)COCCCSCC(O)CO 62a_100009893628_100011219619 [0,1,0,0,0,0|3,0,0]=4 5270 B15R0.384 CCOC(=O)COCCCSCC(O)CO 62a_100011219619_100009893628 [0,1,0,0,0,0|3,0,0]=4 5271 B15R0.384 CCOC(=O)COCCCSC[C@@H](C)CC 62a_100009816398_100009893628 [0,1,0,0,0,0|2,0,0]=3 5272 B15R0.384 CCOC(=O)COCCCSC[C@@H](C)CC 62a_100009893628_100009816398 [0,1,0,0,0,0|2,0,0]=3 5273 B15R0.384 CCOC(=O)COCCCSC[C@@H](C)CO 62a_100000059175_100009893628 [0,1,0,0,0,0|3,0,0]=4 5274 B15R0.384 CCOC(=O)COCCCSC[C@@H](C)CO 62a_100009893628_100000059175 [0,1,0,0,0,0|3,0,0]=4 5275 B15R0.384 CCOC(=O)COCCCSC[C@@H](O)CF 62a_100009893628_100015614560 [0,1,0,0,0,0|3,0,0]=4 5276 B15R0.384 CCOC(=O)COCCCSC[C@@H](O)CF 62a_100015614560_100009893628 [0,1,0,0,0,0|3,0,0]=4 5277 B15R0.384 CCOC(=O)COCCCSC[C@@H](O)CO 62a_100009815848_100009893628 [0,1,0,0,0,0|3,0,0]=4 5278 B15R0.384 CCOC(=O)COCCCSC[C@@H](O)CO 62a_100009893628_100009815848 [0,1,0,0,0,0|3,0,0]=4 5279 B15R0.384 CCOC(=O)COCCNCCC(C)CC 2230a_100020591266_100000088970 [0,1,0,0,0,0|2,0,0]=3 5280 B15R0.384 CCOC(=O)COCCNCCC(C)CO 2230a_106354213184_100000088970 [0,1,0,0,0,0|3,0,0]=4 5281 B15R0.384 CCOC(=O)COCCNCCC(C)CO 34a_106354213184_100000088970 [0,1,0,0,0,0|3,0,0]=4 5282 B15R0.384 CCOC(=O)COCCOCCC(C)CC 7a_100011215188_100000088970 [0,1,0,0,0,0|2,0,0]=3 5283 B15R0.384 CCOC(=O)COCCOCCC(C)OC 7a_100000764861_100000088970 [0,1,0,0,0,0|3,0,0]=4 5284 B15R0.384 CCOC(=O)CSCCCCCC(=O)OC 62a_100000188475_100009816466 [0,1,0,0,0,0|2,0,1]=4 5285 B15R0.384 CCOC(=O)CSCCCCCC(=O)OC 62a_100009816466_100000188475 [0,1,0,0,0,0|2,0,1]=4 5286 B15R0.384 CCOC(=O)NCCOCCCC(C)CC 7a_100011216074_200011445536 [0,1,0,0,0,0|2,0,0]=3 5287 B15R0.408 C#CCC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100000184674 [0,1,0,0,0,0|0,0,3]=4 5288 B15R0.408 C#CCC(=O)CCCCCCC(=O)OCC 1458a_100011220946_100009814379 [0,1,0,0,0,0|0,0,3]=4 5289 B15R0.408 C#CCC(C)OCCCCCC(=O)OCC 34a_100000685586_100000755133 [0,1,0,0,0,0|1,0,2]=4 5290 B15R0.408 C#CCC(C)OCCCCCC(=O)OCC 7a_100000685586_100000755133 [0,1,0,0,0,0|1,0,2]=4 5291 B15R0.408 C#CCN(C)CCCCCCC(=O)OCC 2230a_100000225692_100009814379 [0,1,0,0,0,0|1,0,2]=4 5292 B15R0.408 C#CCN(C)CCCCCCC(=O)OCC 34a_100000225692_100009814379 [0,1,0,0,0,0|1,0,2]=4 5293 B15R0.408 C/C=C/C(C)OCCCCCC(=O)OCC 34a_200102604097_100000755133 [0,1,0,0,0,0|1,0,2]=4 5294 B15R0.408 C=CCC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100000210623 [0,1,0,0,0,0|0,0,3]=4 5295 B15R0.408 C=CCC(=O)CCCCCCC(=O)OCC 1458a_100000210193_100009814379 [0,1,0,0,0,0|0,0,3]=4 5296 B15R0.408 C=CCC(C)COCCCCC(=O)OCC 34a_100009832082_100000750268 [0,1,0,0,0,0|1,0,2]=4 5297 B15R0.408 C=CCC(C)COCCCCC(=O)OCC 7a_100009832082_100000750268 [0,1,0,0,0,0|1,0,2]=4 5298 B15R0.408 C=CCN(C)CCCCCCC(=O)OCC 2230a_100000225617_100009814379 [0,1,0,0,0,0|1,0,2]=4 5299 B15R0.408 C=CCN(C)CCCCCCC(=O)OCC 269982a_100000225617_100009814379 [0,1,0,0,0,0|1,0,2]=4 5300 B15R0.408 C=CC[C@@H](C)OCCCCCC(=O)OCC 34a_100000731007_100000755133 [0,1,0,0,0,0|1,0,2]=4 5301 B15R0.408 C=CC[C@@H](C)OCCCCCC(=O)OCC 7a_100000731007_100000755133 [0,1,0,0,0,0|1,0,2]=4 5302 B15R0.408 C=CC[C@@H](N)COCCCCC(=O)OCC 34a_100020615467_100000750268 [0,1,0,0,0,0|1,0,2]=4 5303 B15R0.408 CC#CC(=O)CCCCCCC(=O)OCC 1458a_100000763181_100009814379 [0,1,0,0,0,0|0,0,3]=4 5304 B15R0.408 CC#CC(C)OCCCCCC(=O)OCC 34a_100011216543_100000755133 [0,1,0,0,0,0|1,0,2]=4 5305 B15R0.408 CC=CC(=O)CCCCCCC(=O)OCC 1458a_100000210699_100009814379 [0,1,0,0,0,0|0,0,3]=4 5306 B15R0.408 CCCC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100000210303 [0,1,0,0,0,0|0,0,1]=2 5307 B15R0.408 CCCC(=O)CCCCCCC(=O)OCC 1458a_100000211992_100009814379 [0,1,0,0,0,0|0,0,1]=2 5308 B15R0.408 CCCC(=O)COCCSCC(=O)OCC 7a_200000230590_100000747444 [0,1,0,0,0,0|2,0,1]=4 5309 B15R0.408 CCCC(=O)CSCCCCC(=O)OCC 62a_100000747444_100000750268 [0,1,0,0,0,0|1,0,1]=3 5310 B15R0.408 CCCC(=O)CSCCCCC(=O)OCC 62a_100000750268_100000747444 [0,1,0,0,0,0|1,0,1]=3 5311 B15R0.408 CCCC(=O)CSCCOCC(=O)OCC 62a_100000088970_100000747444 [0,1,0,0,0,0|2,0,1]=4 5312 B15R0.408 CCCC(=O)CSCCOCC(=O)OCC 62a_100000747444_100000088970 [0,1,0,0,0,0|2,0,1]=4 5313 B15R0.408 CCCC(=O)NCCCCCC(=O)OCC 188690a_100000062434_100000211992 [0,1,0,0,0,0|1,0,1]=3 5314 B15R0.408 CCCC(=O)OCOCCCC(C)CCC 34a_100011713154_100000034017 [0,1,0,0,0,0|3,0,0]=4 5315 B15R0.408 CCCC(=O)OCSCCCC(=O)OCC 62a_100009991533_100000034017 [0,1,0,0,0,0|2,0,1]=4 5316 B15R0.408 CCCC(C)CCCOCCC(=O)NCC 7a_100011713154_100000737597 [0,1,0,0,0,0|2,0,0]=3 5317 B15R0.408 CCCC(C)CCCOCCC(=O)OCC 34a_100011713154_100000765890 [0,1,0,0,0,0|1,0,0]=2 5318 B15R0.408 CCCC(C)CCCOCCC(=O)OCC 7a_100011713154_100011206558 [0,1,0,0,0,0|1,0,0]=2 5319 B15R0.408 CCCC(C)CCOC/C=C/C(=O)OCC 34a_100011217855_100016267167 [0,1,0,0,0,0|1,0,2]=4 5320 B15R0.408 CCCC(C)CCOC/C=C/C(=O)OCC 7a_100011217855_100016267167 [0,1,0,0,0,0|1,0,2]=4 5321 B15R0.408 CCCC(C)CCOCCCC(=O)OCC 34a_100011217855_100009991533 [0,1,0,0,0,0|1,0,0]=2 5322 B15R0.408 CCCC(C)CCOCCCC(=O)OCC 7a_100011217855_100011215271 [0,1,0,0,0,0|1,0,0]=2 5323 B15R0.408 CCCC(C)CCOCCNC(=O)OCC 7a_100011217855_200011445536 [0,1,0,0,0,0|2,0,0]=3 5324 B15R0.408 CCCC(C)COCCCCC(=O)OCC 34a_100000688023_100000750268 [0,1,0,0,0,0|1,0,0]=2 5325 B15R0.408 CCCC(C)COCCCCC(=O)OCC 7a_100000688023_100000750268 [0,1,0,0,0,0|1,0,0]=2 5326 B15R0.408 CCCC(C)COCCOCC(=O)OCC 34a_100000688023_100000088970 [0,1,0,0,0,0|2,0,0]=3 5327 B15R0.408 CCCC(C)COCCOCC(=O)OCC 7a_100000688023_100000088970 [0,1,0,0,0,0|2,0,0]=3 5328 B15R0.408 CCCC(C)COCCSCC(=O)OCC 7a_200000230590_100011216630 [0,1,0,0,0,0|2,0,0]=3 5329 B15R0.408 CCCC(C)CSCCCCC(=O)OCC 62a_100000750268_100011216630 [0,1,0,0,0,0|1,0,0]=2 5330 B15R0.408 CCCC(C)CSCCCCC(=O)OCC 62a_100011216630_100000750268 [0,1,0,0,0,0|1,0,0]=2 5331 B15R0.408 CCCC(C)CSCCOCC(=O)OCC 62a_100000088970_100011216630 [0,1,0,0,0,0|2,0,0]=3 5332 B15R0.408 CCCC(C)CSCCOCC(=O)OCC 62a_100011216630_100000088970 [0,1,0,0,0,0|2,0,0]=3 5333 B15R0.408 CCCC(C)NCCCCCC(=O)OCC 2230a_100000741246_100000755133 [0,1,0,0,0,0|1,0,0]=2 5334 B15R0.408 CCCC(C)NCCCOCC(=O)OCC 2230a_100000741246_100009893628 [0,1,0,0,0,0|2,0,0]=3 5335 B15R0.408 CCCC(C)OCCCCCC(=O)OCC 34a_100000764384_100000755133 [0,1,0,0,0,0|1,0,0]=2 5336 B15R0.408 CCCC(C)OCCCCCC(=O)OCC 7a_100000764384_100000755133 [0,1,0,0,0,0|1,0,0]=2 5337 B15R0.408 CCCC(C)OCCCCCC(=O)OCC 7a_100011214988_100000766640 [0,1,0,0,0,0|1,0,0]=2 5338 B15R0.408 CCCC(C)OCCCOCC(=O)OCC 34a_100000764384_100009893628 [0,1,0,0,0,0|2,0,0]=3 5339 B15R0.408 CCCC(C)OCCCOCC(=O)OCC 7a_100000764384_100009893628 [0,1,0,0,0,0|2,0,0]=3 5340 B15R0.408 CCCC(C)SCCCCCC(=O)OCC 62a_100000755133_100000766640 [0,1,0,0,0,0|1,0,0]=2 5341 B15R0.408 CCCC(C)SCCCCCC(=O)OCC 62a_100000766640_100000755133 [0,1,0,0,0,0|1,0,0]=2 5342 B15R0.408 CCCC(C)SCCCOCC(=O)OCC 62a_100000766640_100009893628 [0,1,0,0,0,0|2,0,0]=3 5343 B15R0.408 CCCC(C)SCCCOCC(=O)OCC 62a_100009893628_100000766640 [0,1,0,0,0,0|2,0,0]=3 5344 B15R0.408 CCCN(C)CCCCCCC(=O)OCC 2230a_100000747261_100009814379 [0,1,0,0,0,0|1,0,0]=2 5345 B15R0.408 CCCN(C)CCCCCCC(=O)OCC 269982a_100000747261_100009814379 [0,1,0,0,0,0|1,0,0]=2 5346 B15R0.408 CCC[C@H](N)CCOC/C=C/C(=O)OCC 34a_100015193777_100016267167 [0,1,0,0,0,0|1,0,2]=4 5347 B15R0.408 CCC[C@H](N)CCOCCCC(=O)OCC 34a_100015193777_100009991533 [0,1,0,0,0,0|1,0,0]=2 5348 B15R0.408 CCC[C@H](N)COCCCCC(=O)OCC 34a_100000732646_100000750268 [0,1,0,0,0,0|1,0,0]=2 5349 B15R0.408 CCC[C@H](N)COCCOCC(=O)OCC 34a_100000732646_100000088970 [0,1,0,0,0,0|2,0,0]=3 5350 B15R0.408 CCNC(=O)CCCCCCC(=O)OCC 11a_100015525214_100000031895 [0,1,0,0,0,0|1,0,1]=3 5351 B15R0.408 CCNC(=O)CCCCCCC(=O)OCC 240690a_100015525214_100000031895 [0,1,0,0,0,0|1,0,1]=3 5352 B15R0.408 CCNC(=O)CCCCCCC(=O)OCC 527a_100015525214_100000031895 [0,1,0,0,0,0|1,0,1]=3 5353 B15R0.408 CCNC(=O)CCNCCCC(=O)OCC 34a_100025743525_100009991533 [0,1,0,0,0,0|2,0,1]=4 5354 B15R0.408 CCNC(=O)CCOCCCC(=O)OCC 7a_100012001163_100000737597 [0,1,0,0,0,0|2,0,1]=4 5355 B15R0.408 CCNC(=O)CCSCCCC(=O)OCC 62a_100000737597_100009991533 [0,1,0,0,0,0|2,0,1]=4 5356 B15R0.408 CCNC(=O)CCSCCCC(=O)OCC 62a_100009991533_100000737597 [0,1,0,0,0,0|2,0,1]=4 5357 B15R0.408 CCNC(=O)CNCCCCC(=O)OCC 2230a_100016988866_100000750268 [0,1,0,0,0,0|2,0,1]=4 5358 B15R0.408 CCNC(=O)CSCCCCC(=O)OCC 62a_100000183381_100000750268 [0,1,0,0,0,0|2,0,1]=4 5359 B15R0.408 CCNC(=O)CSCCCCC(=O)OCC 62a_100000750268_100000183381 [0,1,0,0,0,0|2,0,1]=4 5360 B15R0.408 CCOC(=O)CCCCCCC(=O)CC#N 1458a_100000031895_100011214920 [0,1,0,0,0,0|1,0,2]=4 5361 B15R0.408 CCOC(=O)CCCCCCC(=O)CC#N 1458a_100051588842_100009814379 [0,1,0,0,0,0|1,0,2]=4 5362 B15R0.408 CCOC(=O)CCCCCCC(=O)CCF 1458a_100000031895_100011217306 [0,1,0,0,0,0|1,0,1]=3 5363 B15R0.408 CCOC(=O)CCCCCCC(=O)CCO 1458a_100000031895_100000211926 [0,1,0,0,0,0|1,0,1]=3 5364 B15R0.408 CCOC(=O)CCCCCCC(=O)CCO 1458a_100011216618_100009814379 [0,1,0,0,0,0|1,0,1]=3 5365 B15R0.408 CCOC(=O)CCCCCCC(=O)COC 1458a_100000210968_100009814379 [0,1,0,0,0,0|1,0,1]=3 5366 B15R0.408 CCOC(=O)CCCCCCC(=O)CSC 1458a_100000184570_100009814379 [0,1,0,0,0,0|1,0,1]=3 5367 B15R0.408 CCOC(=O)CCCCCCN(C)CC#N 2230a_100000748184_100009814379 [0,1,0,0,0,0|2,0,1]=4 5368 B15R0.408 CCOC(=O)CCCCCCN(C)CCO 2230a_100000210263_100009814379 [0,1,0,0,0,0|2,0,0]=3 5369 B15R0.408 CCOC(=O)CCCCCCN(C)CCO 269982a_100000210263_100009814379 [0,1,0,0,0,0|2,0,0]=3 5370 B15R0.408 CCOC(=O)CCCCCNC(=O)COC 188690a_100000062434_100000210968 [0,1,0,0,0,0|2,0,1]=4 5371 B15R0.408 CCOC(=O)CCCCCNC(=O)CSC 188690a_100000062434_100000184570 [0,1,0,0,0,0|2,0,1]=4 5372 B15R0.408 CCOC(=O)CCCCCN[C@@H](C)CC#N 2230a_100016994482_100000755133 [0,1,0,0,0,0|2,0,1]=4 5373 B15R0.408 CCOC(=O)CCCCCN[C@H](C)CCO 2230a_100000706166_100000755133 [0,1,0,0,0,0|2,0,0]=3 5374 B15R0.408 CCOC(=O)CCCCCN[C@H](C)CCO 34a_100000706166_100000755133 [0,1,0,0,0,0|2,0,0]=3 5375 B15R0.408 CCOC(=O)CCCCCN[C@H](C)COC 2230a_100000764878_100000755133 [0,1,0,0,0,0|2,0,0]=3 5376 B15R0.408 CCOC(=O)CCCCCOC(C)CC#N 7a_100011214988_100009813641 [0,1,0,0,0,0|2,0,1]=4 5377 B15R0.408 CCOC(=O)CCCCCOC(C)CCBr 34a_100012276601_100000755133 [0,1,0,0,0,0|2,0,0]=3 5378 B15R0.408 CCOC(=O)CCCCCOC(C)CCO 7a_100011214988_100009893172 [0,1,0,0,0,0|2,0,0]=3 5379 B15R0.408 CCOC(=O)CCCCCOC(C)COC 7a_100011214988_100000765312 [0,1,0,0,0,0|2,0,0]=3 5380 B15R0.408 CCOC(=O)CCCCCO[C@H](C)COC 34a_100011934205_100000755133 [0,1,0,0,0,0|2,0,0]=3 5381 B15R0.408 CCOC(=O)CCCCCSC(C)CC#N 62a_100000755133_100009813641 [0,1,0,0,0,0|2,0,1]=4 5382 B15R0.408 CCOC(=O)CCCCCSC(C)CC#N 62a_100009813641_100000755133 [0,1,0,0,0,0|2,0,1]=4 5383 B15R0.408 CCOC(=O)CCCCCSC(C)CCO 62a_100000755133_100009893172 [0,1,0,0,0,0|2,0,0]=3 5384 B15R0.408 CCOC(=O)CCCCCSC(C)CCO 62a_100009893172_100000755133 [0,1,0,0,0,0|2,0,0]=3 5385 B15R0.408 CCOC(=O)CCCCCSC(C)COC 62a_100000755133_100000765312 [0,1,0,0,0,0|2,0,0]=3 5386 B15R0.408 CCOC(=O)CCCCCSC(C)COC 62a_100000765312_100000755133 [0,1,0,0,0,0|2,0,0]=3 5387 B15R0.408 CCOC(=O)CCCCNCC(O)COC 2230a_100000756049_100000750268 [0,1,0,0,0,0|2,0,0]=3 5388 B15R0.408 CCOC(=O)CCCCNCC(O)COC 34a_100000756049_100000750268 [0,1,0,0,0,0|2,0,0]=3 5389 B15R0.408 CCOC(=O)CCCCOCC(C)CCN 34a_106354213184_100000750268 [0,1,0,0,0,0|2,0,0]=3 5390 B15R0.408 CCOC(=O)CCCCOCC(N)COC 34a_100000724102_100000750268 [0,1,0,0,0,0|2,0,0]=3 5391 B15R0.408 CCOC(=O)CCCCSCC(=O)OCC 62a_100000188475_100000750268 [0,1,0,0,0,0|2,0,1]=4 5392 B15R0.408 CCOC(=O)CCCCSCC(=O)OCC 62a_100000750268_100000188475 [0,1,0,0,0,0|2,0,1]=4 5393 B15R0.408 CCOC(=O)CCCCSCC(O)COC 62a_100000750268_100011215053 [0,1,0,0,0,0|2,0,0]=3 5394 B15R0.408 CCOC(=O)CCCCSCC(O)COC 62a_100011215053_100000750268 [0,1,0,0,0,0|2,0,0]=3 5395 B15R0.408 CCOC(=O)CCCCSC[C@@H](O)CC#N 62a_100000001066_100000750268 [0,1,0,0,0,0|2,0,1]=4 5396 B15R0.408 CCOC(=O)CCCCSC[C@@H](O)CC#N 62a_100000750268_100000001066 [0,1,0,0,0,0|2,0,1]=4 5397 B15R0.408 CCOC(=O)CCCOCCC(=O)OCC 7a_100012001163_100011206558 [0,1,0,0,0,0|2,0,1]=4 5398 B15R0.408 CCOC(=O)CCCSCCC(=O)OCC 62a_100000765890_100009991533 [0,1,0,0,0,0|2,0,1]=4 5399 B15R0.408 CCOC(=O)CCCSCCC(=O)OCC 62a_100009991533_100000765890 [0,1,0,0,0,0|2,0,1]=4 5400 B15R0.408 CCOC(=O)COCCCN[C@H](C)CCO 2230a_100000706166_100009893628 [0,1,0,0,0,0|3,0,0]=4 5401 B15R0.408 CCOC(=O)COCCCN[C@H](C)CCO 34a_100000706166_100009893628 [0,1,0,0,0,0|3,0,0]=4 5402 B15R0.408 CCOC(=O)COCCCN[C@H](C)COC 2230a_100000764878_100009893628 [0,1,0,0,0,0|3,0,0]=4 5403 B15R0.408 CCOC(=O)COCCCOC(C)CCBr 34a_100012276601_100009893628 [0,1,0,0,0,0|3,0,0]=4 5404 B15R0.408 CCOC(=O)COCCCO[C@H](C)COC 34a_100011934205_100009893628 [0,1,0,0,0,0|3,0,0]=4 5405 B15R0.408 CCOC(=O)COCCCSC(C)CCO 62a_100009893172_100009893628 [0,1,0,0,0,0|3,0,0]=4 5406 B15R0.408 CCOC(=O)COCCCSC(C)CCO 62a_100009893628_100009893172 [0,1,0,0,0,0|3,0,0]=4 5407 B15R0.408 CCOC(=O)COCCCSC(C)COC 62a_100000765312_100009893628 [0,1,0,0,0,0|3,0,0]=4 5408 B15R0.408 CCOC(=O)COCCCSC(C)COC 62a_100009893628_100000765312 [0,1,0,0,0,0|3,0,0]=4 5409 B15R0.408 CCOC(=O)COCCNCC(O)COC 2230a_100000756049_100000088970 [0,1,0,0,0,0|3,0,0]=4 5410 B15R0.408 CCOC(=O)COCCNCC(O)COC 34a_100000756049_100000088970 [0,1,0,0,0,0|3,0,0]=4 5411 B15R0.408 CCOC(=O)COCCOCC(C)CCN 34a_106354213184_100000088970 [0,1,0,0,0,0|3,0,0]=4 5412 B15R0.408 CCOC(=O)COCCOCC(N)COC 34a_100000724102_100000088970 [0,1,0,0,0,0|3,0,0]=4 5413 B15R0.408 CCOC(=O)COCCSCC(O)COC 62a_100000088970_100011215053 [0,1,0,0,0,0|3,0,0]=4 5414 B15R0.408 CCOC(=O)COCCSCC(O)COC 62a_100011215053_100000088970 [0,1,0,0,0,0|3,0,0]=4 5415 B15R0.408 CCOC(=O)CSCCOCC(O)COC 7a_200000230590_100011215053 [0,1,0,0,0,0|3,0,0]=4 5416 B15R0.1157 CCCCCCCCCCS(=O)(=O)NCC 270084a_100015525214_200011217601 [0,1,0,0,0,0|2,0,0]=3 5417 B15R0.1157 CCCCCCCCCCS(=O)(=O)NCC 274078a_100015525214_200011217601 [0,1,0,0,0,0|2,0,0]=3 5418 B15R0.1157 CCCCCCCCCNS(=O)(=O)CCC 270084a_100000212291_100000211391 [0,1,0,0,0,0|3,0,0]=4 5419 B15R0.1157 CCCCCCCCCNS(=O)(=O)CCC 274078a_100000212291_100000211391 [0,1,0,0,0,0|3,0,0]=4 5420 B15R0.1157 CCCCCCCCCNS(=O)(=O)CCC 40a_100000212291_100000054278 [0,1,0,0,0,0|3,0,0]=4 5421 B15R0.1157 CCCCCCCCSC[Si](C)(C)OCC 62a_100000210759_200000065227 [0,1,0,0,0,0|2,1,0]=4 5422 B15R0.1157 CCCCCCCCSC[Si](C)(C)OCC 62a_200000065227_100000210317 [0,1,0,0,0,0|2,1,0]=4 5423 B15R0.1157 CCCCCCNCCC[Si](C)(C)OCC 2230a_100000210581_100000070546 [0,1,0,0,0,0|2,1,0]=4 5424 B15R0.1157 CCCCCCOCCC[Si](C)(C)OCC 34a_100000210259_100000070546 [0,1,0,0,0,0|2,1,0]=4 5425 B15R0.1157 CCCCCCOCCC[Si](C)(C)OCC 7a_100000210259_100000070546 [0,1,0,0,0,0|2,1,0]=4 5426 B15R0.1157 CCCCCCSCCC[Si](C)(C)OCC 62a_100000070546_100000210757 [0,1,0,0,0,0|2,1,0]=4 5427 B15R0.1157 CCCCCCSCCC[Si](C)(C)OCC 62a_100000210314_100000070546 [0,1,0,0,0,0|2,1,0]=4 5428 B15R0.2002 C#CCCC(=O)CCCCCCCCCC 1458a_100000210375_100000753159 [0,1,0,0,0,0|1,0,1]=3 5429 B15R0.2002 C#CCCC(=O)CCCCCCCCCC 1458a_100000692101_100000210319 [0,1,0,0,0,0|1,0,1]=3 5430 B15R0.2002 C#CCCC(=O)CCCCCCCCCF 1458a_200009909015_100000753159 [0,1,0,0,0,0|2,0,1]=4 5431 B15R0.2002 C#CCCC(=O)CCCCCCCCCO 1458a_100000692101_100009813782 [0,1,0,0,0,0|2,0,1]=4 5432 B15R0.2002 C#CCCC(=O)CCOCCCCCCC 34a_100011064465_100000210614 [0,1,0,0,0,0|2,0,1]=4 5433 B15R0.2002 C#CCCC(=O)CCOCCCCCCC 7a_100011064465_100000210614 [0,1,0,0,0,0|2,0,1]=4 5434 B15R0.2002 C#CCCC(=O)COCCCCCCCC 1458a_100000759886_100000753159 [0,1,0,0,0,0|2,0,1]=4 5435 B15R0.2002 C#CCCC(=O)NCCCCCCCCC 11a_100000212291_100000692101 [0,1,0,0,0,0|2,0,1]=4 5436 B15R0.2002 C#CCCC(=O)NCCCCCCCCC 1626a_100000212291_100000692101 [0,1,0,0,0,0|2,0,1]=4 5437 B15R0.2002 C#CCCC(=O)NCCCCCCCCC 240690a_100000212291_100000692101 [0,1,0,0,0,0|2,0,1]=4 5438 B15R0.2002 C#CCCC(=O)NCCCCCCCCC 527a_100000212291_100000692101 [0,1,0,0,0,0|2,0,1]=4 5439 B15R0.2002 C#CCCCCCCCCC(=O)CCCC 1458a_100000029693_100000210211 [0,1,0,0,0,0|1,0,2]=4 5440 B15R0.2002 C#CCCCCCCCCC(=O)CCCF 1458a_100000029693_100011934791 [0,1,0,0,0,0|1,0,2]=4 5441 B15R0.2002 C#CCCCCCCCCC(=O)CCCO 1458a_100000029693_100011215043 [0,1,0,0,0,0|1,0,2]=4 5442 B15R0.2002 C#CCCCCCCCCC(=O)CCOC 1458a_100000029693_100000233755 [0,1,0,0,0,0|1,0,2]=4 5443 B15R0.2002 C#CCCCCCCCCC(=O)CCSC 1458a_100000029693_100000751147 [0,1,0,0,0,0|1,0,2]=4 5444 B15R0.2002 C#CCCCCCCCCC(=O)NCCC 11a_100020643023_100000029693 [0,1,0,0,0,0|1,0,2]=4 5445 B15R0.2002 C#CCCCCCCCCC(=O)NCCC 1626a_100020643023_100000029693 [0,1,0,0,0,0|1,0,2]=4 5446 B15R0.2002 C#CCCCCCCCCC(=O)NCCC 240690a_100020643023_100000029693 [0,1,0,0,0,0|1,0,2]=4 5447 B15R0.2002 C#CCCCCCCCCC(=O)NCCC 527a_100020643023_100000029693 [0,1,0,0,0,0|1,0,2]=4 5448 B15R0.2002 C#CCCCCCCCCC(=O)NCCF 11a_100000724931_100000029693 [0,1,0,0,0,0|1,0,2]=4 5449 B15R0.2002 C#CCCCCCCCCC(=O)NCCF 1626a_100000724931_100000029693 [0,1,0,0,0,0|1,0,2]=4 5450 B15R0.2002 C#CCCCCCCCCC(=O)NCCF 240690a_100000724931_100000029693 [0,1,0,0,0,0|1,0,2]=4 5451 B15R0.2002 C#CCCCCCCCCC(=O)NCCF 527a_100000724931_100000029693 [0,1,0,0,0,0|1,0,2]=4 5452 B15R0.2002 C#CCCCCCCCCC(=O)NCCO 240690a_100000210304_100000029693 [0,1,0,0,0,0|1,0,2]=4 5453 B15R0.2002 C#CCCCCCCCCC(=O)NCCO 527a_100000210304_100000029693 [0,1,0,0,0,0|1,0,2]=4 5454 B15R0.2002 C#CCCCCCCCCC(=O)NNCC 22a_100000756455_100000029693 [0,1,0,0,0,0|1,0,2]=4 5455 B15R0.2002 C#CCCCCCCOCC(=O)OCCC 34a_100011217361_200011215008 [0,1,0,0,0,0|1,0,2]=4 5456 B15R0.2002 C#CCCCCCCOCC(=O)OCCC 7a_100011217361_200011215008 [0,1,0,0,0,0|1,0,2]=4 5457 B15R0.2002 C#CCCCCCCSCC(=O)OCCC 62a_100012276617_200011215008 [0,1,0,0,0,0|1,0,2]=4 5458 B15R0.2002 C#CCCCCCCSCC(=O)OCCC 62a_200011215008_100012276617 [0,1,0,0,0,0|1,0,2]=4 5459 B15R0.2002 C#CCNC(=O)CCCCCCCCCC 11a_100000212058_100000210375 [0,1,0,0,0,0|1,0,1]=3 5460 B15R0.2002 C#CCNC(=O)CCCCCCCCCC 1626a_100000212058_100000210375 [0,1,0,0,0,0|1,0,1]=3 5461 B15R0.2002 C#CCNC(=O)CCCCCCCCCC 240690a_100000212058_100000210375 [0,1,0,0,0,0|1,0,1]=3 5462 B15R0.2002 C#CCNC(=O)CCCCCCCCCF 11a_100000212058_200009909015 [0,1,0,0,0,0|2,0,1]=4 5463 B15R0.2002 C#CCNC(=O)CCCCCCCCCF 240690a_100000212058_200009909015 [0,1,0,0,0,0|2,0,1]=4 5464 B15R0.2002 C#CCNC(=O)CCCCCCCCCF 527a_100000212058_200009909015 [0,1,0,0,0,0|2,0,1]=4 5465 B15R0.2002 C#CCNC(=O)CCCCCCCCCO 240690a_100000212058_100000032657 [0,1,0,0,0,0|2,0,1]=4 5466 B15R0.2002 C#CCNC(=O)CNCCCCCCCC 2230a_100000747989_100000210759 [0,1,0,0,0,0|2,0,1]=4 5467 B15R0.2002 C#CCNC(=O)CNCCCCCCCC 34a_100000747989_100000210759 [0,1,0,0,0,0|2,0,1]=4 5468 B15R0.2002 C#CCNC(=O)COCCCCCCCC 11a_100000212058_100000759886 [0,1,0,0,0,0|2,0,1]=4 5469 B15R0.2002 C#CCNC(=O)COCCCCCCCC 1626a_100000212058_100000759886 [0,1,0,0,0,0|2,0,1]=4 5470 B15R0.2002 C#CCNC(=O)COCCCCCCCC 240690a_100000212058_100000759886 [0,1,0,0,0,0|2,0,1]=4 5471 B15R0.2002 C#CCNC(=O)COCCCCCCCC 527a_100000212058_100000759886 [0,1,0,0,0,0|2,0,1]=4 5472 B15R0.2002 C#CCNC(=O)NCCCCCCCCC 2708a_100000212058_100000212291 [0,1,0,0,0,0|2,0,1]=4 5473 B15R0.2002 C#CCNC(=O)NCCCCCCCCC 2708a_100000212291_100000212058 [0,1,0,0,0,0|2,0,1]=4 5474 B15R0.2002 C#CCNC(=O)NCCCCCCCCC 273464a_100000212058_100000212291 [0,1,0,0,0,0|2,0,1]=4 5475 B15R0.2002 C#CCNC(=O)NCCCCCCCCC 273464a_100000212291_100000212058 [0,1,0,0,0,0|2,0,1]=4 5476 B15R0.2002 C#CCNC(=O)NCCCCCCCCC 512a_100000212058_100000212291 [0,1,0,0,0,0|2,0,1]=4 5477 B15R0.2002 C#CCNC(=O)NCCCCCCCCC 512a_100000212291_100000212058 [0,1,0,0,0,0|2,0,1]=4 5478 B15R0.2002 C#CCOC(C)CCCCCCCCCC 34a_100011215000_100000184674 [0,1,0,0,0,0|1,0,2]=4 5479 B15R0.2002 C#CCOC(C)CCCCCCCCCC 7a_100011215000_100000038162 [0,1,0,0,0,0|1,0,2]=4 5480 B15R0.2002 C/C=C/CC(=O)CCCCCCCCCF 1458a_200009909015_100102629194 [0,1,0,0,0,0|2,0,1]=4 5481 B15R0.2002 C/C=C/CC(=O)COCCCCCCCC 1458a_100000759886_100102629194 [0,1,0,0,0,0|2,0,1]=4 5482 B15R0.2002 C=C(CNCCCCCCCC)OCOC 34a_100000229939_100000042856 [0,1,0,0,0,0|2,0,0]=3 5483 B15R0.2002 C=C(CNCCCCCCCO)OCOC 34a_100011996573_100000042856 [0,1,0,0,0,0|3,0,0]=4 5484 B15R0.2002 C=C(CNCCCOCCCC)OCOC 34a_200000211371_100000042856 [0,1,0,0,0,0|3,0,0]=4 5485 B15R0.2002 C=C(COCCCCCCCBr)OCOC 34a_100000760002_100000042856 [0,1,0,0,0,0|3,0,0]=4 5486 B15R0.2002 C=C(COCCCCCCCC)OCOC 34a_100000210232_100000042856 [0,1,0,0,0,0|2,0,0]=3 5487 B15R0.2002 C=C(COCCCCCCCN)OCOC 34a_100011996573_100000042856 [0,1,0,0,0,0|3,0,0]=4 5488 B15R0.2002 C=C(COCCCCCCOC)OCOC 34a_200012092642_100000042856 [0,1,0,0,0,0|3,0,0]=4 5489 B15R0.2002 C=C(COCCCOCCCC)OCOC 34a_200011215613_100000042856 [0,1,0,0,0,0|3,0,0]=4 5490 B15R0.2002 C=C(COCCNCCCCC)OCOC 34a_100000224656_100000042856 [0,1,0,0,0,0|3,0,0]=4 5491 B15R0.2002 C=C(COCCOCCCCC)OCOC 34a_100011215259_100000042856 [0,1,0,0,0,0|3,0,0]=4 5492 B15R0.2002 C=C(CSCCCCCCCC)OCOC 62a_100000042856_100000210317 [0,1,0,0,0,0|2,0,0]=3 5493 B15R0.2002 C=C(CSCCCCCCCC)OCOC 62a_100000210759_100000042856 [0,1,0,0,0,0|2,0,0]=3 5494 B15R0.2002 C=C(CSCCCCCCCO)OCOC 62a_100000042856_100000760002 [0,1,0,0,0,0|3,0,0]=4 5495 B15R0.2002 C=C(CSCCCCCCCO)OCOC 62a_100000760002_100000042856 [0,1,0,0,0,0|3,0,0]=4 5496 B15R0.2002 C=C(CSCCCCCCOC)OCOC 62a_100000042856_100011998445 [0,1,0,0,0,0|3,0,0]=4 5497 B15R0.2002 C=C(CSCCCCCCOC)OCOC 62a_100011998445_100000042856 [0,1,0,0,0,0|3,0,0]=4 5498 B15R0.2002 C=CC=CC(=O)CCCCCCCCCC 1458a_100016291481_100000210319 [0,1,0,0,0,0|1,0,2]=4 5499 B15R0.2002 C=CCCC(=O)CCCCCCCCCF 1458a_200009909015_100000754431 [0,1,0,0,0,0|2,0,1]=4 5500 B15R0.2002 C=CCCC(=O)CCCCCCCCCO 1458a_100000749702_100009813782 [0,1,0,0,0,0|2,0,1]=4 5501 B15R0.2002 C=CCCC(=O)COCCCCCCCC 1458a_100000759886_100000754431 [0,1,0,0,0,0|2,0,1]=4 5502 B15R0.2002 C=CCCC(=O)NCCCCCCCCC 11a_100000212291_100000749702 [0,1,0,0,0,0|2,0,1]=4 5503 B15R0.2002 C=CCCC(=O)NCCCCCCCCC 1626a_100000212291_100000749702 [0,1,0,0,0,0|2,0,1]=4 5504 B15R0.2002 C=CCCC(=O)NCCCCCCCCC 240690a_100000212291_100000749702 [0,1,0,0,0,0|2,0,1]=4 5505 B15R0.2002 C=CCCC(=O)NCCCCCCCCC 527a_100000212291_100000749702 [0,1,0,0,0,0|2,0,1]=4 5506 B15R0.2002 C=CCCCCCCCCC(=O)C#CCC 1458a_100011827653_100011933949 [0,1,0,0,0,0|1,0,2]=4 5507 B15R0.2002 C=CCCCCCCCCC(=O)C=CCC 1458a_100000212282_100011933949 [0,1,0,0,0,0|1,0,2]=4 5508 B15R0.2002 C=CCCCCCCCCC(=O)CCCF 1458a_100000211349_100011934791 [0,1,0,0,0,0|1,0,2]=4 5509 B15R0.2002 C=CCCCCCCCCC(=O)CCCO 1458a_100000211349_100011215043 [0,1,0,0,0,0|1,0,2]=4 5510 B15R0.2002 C=CCCCCCCCCC(=O)CCOC 1458a_100000211349_100000233755 [0,1,0,0,0,0|1,0,2]=4 5511 B15R0.2002 C=CCCCCCCCCC(=O)CCOC 1458a_100000749529_100011933949 [0,1,0,0,0,0|1,0,2]=4 5512 B15R0.2002 C=CCCCCCCCCC(=O)CCSC 1458a_100000174002_100011933949 [0,1,0,0,0,0|1,0,2]=4 5513 B15R0.2002 C=CCCCCCCCCC(=O)CCSC 1458a_100000211349_100000751147 [0,1,0,0,0,0|1,0,2]=4 5514 B15R0.2002 C=CCCCCCCCCC(=O)COCC 1458a_100000211967_100011933949 [0,1,0,0,0,0|0,0,2]=3 5515 B15R0.2002 C=CCCCCCCCCC(=O)CSCC 1458a_100000230394_100011933949 [0,1,0,0,0,0|0,1,2]=4 5516 B15R0.2002 C=CCCCCCCCCC(=O)NCCC 11a_100020643023_100000211349 [0,1,0,0,0,0|1,0,2]=4 5517 B15R0.2002 C=CCCCCCCCCC(=O)NCCC 1626a_100020643023_100000211349 [0,1,0,0,0,0|1,0,2]=4 5518 B15R0.2002 C=CCCCCCCCCC(=O)NCCC 240690a_100020643023_100000211349 [0,1,0,0,0,0|1,0,2]=4 5519 B15R0.2002 C=CCCCCCCCCC(=O)NCCC 527a_100020643023_100000211349 [0,1,0,0,0,0|1,0,2]=4 5520 B15R0.2002 C=CCCCCCCCCC(=O)NCCF 11a_100000724931_100000211349 [0,1,0,0,0,0|1,0,2]=4 5521 B15R0.2002 C=CCCCCCCCCC(=O)NCCF 1626a_100000724931_100000211349 [0,1,0,0,0,0|1,0,2]=4 5522 B15R0.2002 C=CCCCCCCCCC(=O)NCCF 240690a_100000724931_100000211349 [0,1,0,0,0,0|1,0,2]=4 5523 B15R0.2002 C=CCCCCCCCCC(=O)NCCF 527a_100000724931_100000211349 [0,1,0,0,0,0|1,0,2]=4 5524 B15R0.2002 C=CCCCCCCCCC(=O)NCCO 240690a_100000210304_100000211349 [0,1,0,0,0,0|1,0,2]=4 5525 B15R0.2002 C=CCCCCCCCCC(=O)NCCO 527a_100000210304_100000211349 [0,1,0,0,0,0|1,0,2]=4 5526 B15R0.2002 C=CCCCCCCCCC(=O)NNCC 22a_100000756455_100000211349 [0,1,0,0,0,0|1,0,2]=4 5527 B15R0.2002 C=CCCCCCCOCC(=O)OCCC 34a_200011216477_200011215008 [0,1,0,0,0,0|1,0,2]=4 5528 B15R0.2002 C=CCCCCCCOCC(=O)OCCC 7a_200011216477_200011215008 [0,1,0,0,0,0|1,0,2]=4 5529 B15R0.2002 C=CCCCCCCSCC(=O)OCCC 62a_100011215473_200011215008 [0,1,0,0,0,0|1,0,2]=4 5530 B15R0.2002 C=CCCCCCCSCC(=O)OCCC 62a_200011215008_100011215473 [0,1,0,0,0,0|1,0,2]=4 5531 B15R0.2002 C=CCNC(=O)CCCCCCCCCC 1626a_100020586998_100000210375 [0,1,0,0,0,0|1,0,1]=3 5532 B15R0.2002 C=CCNC(=O)CCCCCCCCCC 240690a_100020586998_100000210375 [0,1,0,0,0,0|1,0,1]=3 5533 B15R0.2002 C=CCNC(=O)CCCCCCCCCF 240690a_100020586998_200009909015 [0,1,0,0,0,0|2,0,1]=4 5534 B15R0.2002 C=CCNC(=O)CCCCCCCCCF 527a_100020586998_200009909015 [0,1,0,0,0,0|2,0,1]=4 5535 B15R0.2002 C=CCNC(=O)CCCCCCCCCO 240690a_100020586998_100000032657 [0,1,0,0,0,0|2,0,1]=4 5536 B15R0.2002 C=CCNC(=O)CCNCCCCCCC 2230a_100000229938_100011222895 [0,1,0,0,0,0|2,0,1]=4 5537 B15R0.2002 C=CCNC(=O)CCOCCCCCCC 7a_100000210272_100011222895 [0,1,0,0,0,0|2,0,1]=4 5538 B15R0.2002 C=CCNC(=O)CCSCCCCCCC 62a_100000210614_100011222895 [0,1,0,0,0,0|2,0,1]=4 5539 B15R0.2002 C=CCNC(=O)CCSCCCCCCC 62a_100011222895_100000210316 [0,1,0,0,0,0|2,0,1]=4 5540 B15R0.2002 C=CCNC(=O)CNCCCCCCCC 2230a_100000229939_100000183597 [0,1,0,0,0,0|2,0,1]=4 5541 B15R0.2002 C=CCNC(=O)COCCCCCCCC 1626a_100020586998_100000759886 [0,1,0,0,0,0|2,0,1]=4 5542 B15R0.2002 C=CCNC(=O)COCCCCCCCC 240690a_100020586998_100000759886 [0,1,0,0,0,0|2,0,1]=4 5543 B15R0.2002 C=CCNC(=O)COCCCCCCCC 527a_100020586998_100000759886 [0,1,0,0,0,0|2,0,1]=4 5544 B15R0.2002 C=CCNC(=O)COCCCCCCCC 7a_100000210232_100000183597 [0,1,0,0,0,0|2,0,1]=4 5545 B15R0.2002 C=CCNC(=O)CSCCCCCCCC 62a_100000183597_100000210317 [0,1,0,0,0,0|2,0,1]=4 5546 B15R0.2002 C=CCNC(=O)CSCCCCCCCC 62a_100000210759_100000183597 [0,1,0,0,0,0|2,0,1]=4 5547 B15R0.2002 C=CCNC(=O)NCCCCCCCCC 2708a_100000212291_100020586998 [0,1,0,0,0,0|2,0,1]=4 5548 B15R0.2002 C=CCNC(=O)NCCCCCCCCC 273464a_100000212291_100020586998 [0,1,0,0,0,0|2,0,1]=4 5549 B15R0.2002 C=CCNC(=O)NCCCCCCCCC 273464a_100020586998_100000212291 [0,1,0,0,0,0|2,0,1]=4 5550 B15R0.2002 C=CCNC(=O)NCCCCCCCCC 512a_100000212291_100020586998 [0,1,0,0,0,0|2,0,1]=4 5551 B15R0.2002 C=CCNC(=O)NCCCCCCCCC 512a_100020586998_100000212291 [0,1,0,0,0,0|2,0,1]=4 5552 B15R0.2002 C=CCOC(=O)CNCCCCCCCC 2230a_100000229939_100000033060 [0,1,0,0,0,0|1,0,1]=3 5553 B15R0.2002 C=CCOC(=O)CNCCCCCCCC 34a_100000229939_100000033060 [0,1,0,0,0,0|1,0,1]=3 5554 B15R0.2002 C=CCOC(=O)CNCCCCCCCO 2230a_100011996573_100000033060 [0,1,0,0,0,0|2,0,1]=4 5555 B15R0.2002 C=CCOC(=O)CNCCCCCCCO 34a_100011996573_100000033060 [0,1,0,0,0,0|2,0,1]=4 5556 B15R0.2002 C=CCOC(=O)CNCCCOCCCC 2230a_200000211371_100000033060 [0,1,0,0,0,0|2,0,1]=4 5557 B15R0.2002 C=CCOC(=O)CNCCCOCCCC 34a_200000211371_100000033060 [0,1,0,0,0,0|2,0,1]=4 5558 B15R0.2002 C=CCOC(=O)COCCCCCCCBr 34a_100000760002_100000033060 [0,1,0,0,0,0|2,0,1]=4 5559 B15R0.2002 C=CCOC(=O)COCCCCCCCBr 7a_100000760002_100000033060 [0,1,0,0,0,0|2,0,1]=4 5560 B15R0.2002 C=CCOC(=O)COCCCCCCCC 34a_100000210232_100000033060 [0,1,0,0,0,0|1,0,1]=3 5561 B15R0.2002 C=CCOC(=O)COCCCCCCCC 7a_100000210232_100000033060 [0,1,0,0,0,0|1,0,1]=3 5562 B15R0.2002 C=CCOC(=O)COCCCCCCCN 34a_100011996573_100000033060 [0,1,0,0,0,0|2,0,1]=4 5563 B15R0.2002 C=CCOC(=O)COCCCCCCOC 34a_200012092642_100000033060 [0,1,0,0,0,0|2,0,1]=4 5564 B15R0.2002 C=CCOC(=O)COCCCCCCOC 7a_200012092642_100000033060 [0,1,0,0,0,0|2,0,1]=4 5565 B15R0.2002 C=CCOC(=O)COCCCOCCCC 34a_200011215613_100000033060 [0,1,0,0,0,0|2,0,1]=4 5566 B15R0.2002 C=CCOC(=O)COCCCOCCCC 7a_200011215613_100000033060 [0,1,0,0,0,0|2,0,1]=4 5567 B15R0.2002 C=CCOC(=O)COCCNCCCCC 34a_100000224656_100000033060 [0,1,0,0,0,0|2,0,1]=4 5568 B15R0.2002 C=CCOC(=O)COCCOCCCCC 34a_100011215259_100000033060 [0,1,0,0,0,0|2,0,1]=4 5569 B15R0.2002 C=CCOC(=O)COCCOCCCCC 7a_100011215259_100000033060 [0,1,0,0,0,0|2,0,1]=4 5570 B15R0.2002 C=CCOC(=O)CSCCCCCCCC 62a_100000033060_100000210317 [0,1,0,0,0,0|1,0,1]=3 5571 B15R0.2002 C=CCOC(=O)CSCCCCCCCC 62a_100000210759_100000033060 [0,1,0,0,0,0|1,0,1]=3 5572 B15R0.2002 C=CCOC(=O)CSCCCCCCCO 62a_100000033060_100000760002 [0,1,0,0,0,0|2,0,1]=4 5573 B15R0.2002 C=CCOC(=O)CSCCCCCCCO 62a_100000760002_100000033060 [0,1,0,0,0,0|2,0,1]=4 5574 B15R0.2002 C=CCOC(=O)CSCCCCCCOC 62a_100000033060_100011998445 [0,1,0,0,0,0|2,0,1]=4 5575 B15R0.2002 C=CCOC(=O)CSCCCCCCOC 62a_100011998445_100000033060 [0,1,0,0,0,0|2,0,1]=4 5576 B15R0.2002 CC#CCC(=O)CCCCCCCCCC 1458a_100000210375_100000748600 [0,1,0,0,0,0|1,0,1]=3 5577 B15R0.2002 CC#CCC(=O)CCCCCCCCCF 1458a_200009909015_100000748600 [0,1,0,0,0,0|2,0,1]=4 5578 B15R0.2002 CC#CCC(=O)COCCCCCCCC 1458a_100000759886_100000748600 [0,1,0,0,0,0|2,0,1]=4 5579 B15R0.2002 CC#CCCCCCCCC(=O)CCCC 1458a_100000066323_100000210211 [0,1,0,0,0,0|1,0,2]=4 5580 B15R0.2002 CC#CCCCCCCCC(=O)CCCF 1458a_100000066323_100011934791 [0,1,0,0,0,0|1,0,2]=4 5581 B15R0.2002 CC#CCCCCCCCC(=O)CCCO 1458a_100000066323_100011215043 [0,1,0,0,0,0|1,0,2]=4 5582 B15R0.2002 CC#CCCCCCCCC(=O)CCOC 1458a_100000066323_100000233755 [0,1,0,0,0,0|1,0,2]=4 5583 B15R0.2002 CC#CCCCCCCCC(=O)CCSC 1458a_100000066323_100000751147 [0,1,0,0,0,0|1,0,2]=4 5584 B15R0.2002 CC#CCCCCCCCC(=O)NCCC 11a_100020643023_100000066323 [0,1,0,0,0,0|1,0,2]=4 5585 B15R0.2002 CC#CCCCCCCCC(=O)NCCC 1626a_100020643023_100000066323 [0,1,0,0,0,0|1,0,2]=4 5586 B15R0.2002 CC#CCCCCCCCC(=O)NCCC 240690a_100020643023_100000066323 [0,1,0,0,0,0|1,0,2]=4 5587 B15R0.2002 CC#CCCCCCCCC(=O)NCCC 527a_100020643023_100000066323 [0,1,0,0,0,0|1,0,2]=4 5588 B15R0.2002 CC#CCCCCCCCC(=O)NCCF 11a_100000724931_100000066323 [0,1,0,0,0,0|1,0,2]=4 5589 B15R0.2002 CC#CCCCCCCCC(=O)NCCF 1626a_100000724931_100000066323 [0,1,0,0,0,0|1,0,2]=4 5590 B15R0.2002 CC#CCCCCCCCC(=O)NCCF 240690a_100000724931_100000066323 [0,1,0,0,0,0|1,0,2]=4 5591 B15R0.2002 CC#CCCCCCCCC(=O)NCCF 527a_100000724931_100000066323 [0,1,0,0,0,0|1,0,2]=4 5592 B15R0.2002 CC#CCCCCCCCC(=O)NCCO 240690a_100000210304_100000066323 [0,1,0,0,0,0|1,0,2]=4 5593 B15R0.2002 CC#CCCCCCCCC(=O)NCCO 527a_100000210304_100000066323 [0,1,0,0,0,0|1,0,2]=4 5594 B15R0.2002 CC/C=C\CCCCOCC(=O)OCCC 34a_100016287862_200011215008 [0,1,0,0,0,0|1,0,2]=4 5595 B15R0.2002 CC/C=C\CCCCOCC(=O)OCCC 7a_100016287862_200011215008 [0,1,0,0,0,0|1,0,2]=4 5596 B15R0.2002 CC=CCC(=O)CCCCCCCCCF 1458a_200009909015_100000070051 [0,1,0,0,0,0|2,0,1]=4 5597 B15R0.2002 CC=CCC(=O)CCCCCCCCCO 1458a_100121576822_100009813782 [0,1,0,0,0,0|2,0,1]=4 5598 B15R0.2002 CC=CCC(=O)COCCCCCCCC 1458a_100000759886_100000070051 [0,1,0,0,0,0|2,0,1]=4 5599 B15R0.2002 CC=CCC(=O)NCCCCCCCCC 11a_100000212291_100121576822 [0,1,0,0,0,0|2,0,1]=4 5600 B15R0.2002 CC=CCC(=O)NCCCCCCCCC 1626a_100000212291_100121576822 [0,1,0,0,0,0|2,0,1]=4 5601 B15R0.2002 CC=CCC(=O)NCCCCCCCCC 240690a_100000212291_100121576822 [0,1,0,0,0,0|2,0,1]=4 5602 B15R0.2002 CC=CCC(=O)NCCCCCCCCC 527a_100000212291_100121576822 [0,1,0,0,0,0|2,0,1]=4 5603 B15R0.2002 CCC#CC(=O)CCCCCCCCCC 1458a_100011827653_100000210319 [0,1,0,0,0,0|1,0,0]=2 5604 B15R0.2002 CCC#CC(=O)CCCCCCCCCO 1458a_100011827653_100009813782 [0,1,0,0,0,0|2,0,0]=3 5605 B15R0.2002 CCC#CCCCCCCC(=O)C#CCC 1458a_100011827653_200000036426 [0,1,0,0,0,0|1,0,2]=4 5606 B15R0.2002 CCC#CCCCCCCC(=O)C=CCC 1458a_100000212282_200000036426 [0,1,0,0,0,0|1,0,2]=4 5607 B15R0.2002 CCC#CCCCCCCC(=O)CCCC 1458a_100000210183_200000036426 [0,1,0,0,0,0|1,0,2]=4 5608 B15R0.2002 CCC#CCCCCCCC(=O)CCOC 1458a_100000749529_200000036426 [0,1,0,0,0,0|1,0,2]=4 5609 B15R0.2002 CCC#CCCCCCCC(=O)CCSC 1458a_100000174002_200000036426 [0,1,0,0,0,0|1,0,2]=4 5610 B15R0.2002 CCC#CCCCCCCC(=O)COCC 1458a_100000211967_200000036426 [0,1,0,0,0,0|0,0,2]=3 5611 B15R0.2002 CCC#CCCCCCCC(=O)CSCC 1458a_100000230394_200000036426 [0,1,0,0,0,0|0,1,2]=4 5612 B15R0.2002 CCC=CC(=O)CCCCCCCCCO 1458a_100000212282_100009813782 [0,1,0,0,0,0|2,0,0]=3 5613 B15R0.2002 CCC=CC(=O)NCCCCCCCCC 11a_100000212291_100000212282 [0,1,0,0,0,0|2,0,0]=3 5614 B15R0.2002 CCC=CC(=O)NCCCCCCCCC 1626a_100000212291_100000212282 [0,1,0,0,0,0|2,0,0]=3 5615 B15R0.2002 CCC=CC(=O)NCCCCCCCCC 240690a_100000212291_100000212282 [0,1,0,0,0,0|2,0,0]=3 5616 B15R0.2002 CCC=CC(=O)NCCCCCCCCO 240690a_102515433106_100000212282 [0,1,0,0,0,0|3,0,0]=4 5617 B15R0.2002 CCCC/C=C\CCOCC(=O)OCCC 34a_200016286491_200011215008 [0,1,0,0,0,0|1,0,2]=4 5618 B15R0.2002 CCCC/C=C\CCOCC(=O)OCCC 7a_200016286491_200011215008 [0,1,0,0,0,0|1,0,2]=4 5619 B15R0.2002 CCCCC#CCCOCC(=O)OCCC 34a_100000037610_200011215008 [0,1,0,0,0,0|1,0,2]=4 5620 B15R0.2002 CCCCC#CCCOCC(=O)OCCC 7a_100000037610_200011215008 [0,1,0,0,0,0|1,0,2]=4 5621 B15R0.2002 CCCCC(=O)CCCCCCCCCF 1458a_200009909015_100000210211 [0,1,0,0,0,0|2,0,0]=3 5622 B15R0.2002 CCCCC(=O)CCCCCCCCCO 1458a_100000210183_100009813782 [0,1,0,0,0,0|2,0,0]=3 5623 B15R0.2002 CCCCC(=O)NCCCCCCCCO 240690a_102515433106_100000210183 [0,1,0,0,0,0|3,0,0]=4 5624 B15R0.2002 CCCCC/C=C/COCC(=O)OCCC 34a_100016258190_200011215008 [0,1,0,0,0,0|1,0,2]=4 5625 B15R0.2002 CCCCC/C=C/COCC(=O)OCCC 7a_100016258190_200011215008 [0,1,0,0,0,0|1,0,2]=4 5626 B15R0.2002 CCCCCC#CCOCC(=O)OCCC 34a_200000033628_200011215008 [0,1,0,0,0,0|1,0,2]=4 5627 B15R0.2002 CCCCCC#CCOCC(=O)OCCC 7a_200000033628_200011215008 [0,1,0,0,0,0|1,0,2]=4 5628 B15R0.2002 CCCCCC#CCSCC(=O)OCCC 62a_100009816472_200011215008 [0,1,0,0,0,0|1,0,2]=4 5629 B15R0.2002 CCCCCC#CCSCC(=O)OCCC 62a_200011215008_100009816472 [0,1,0,0,0,0|1,0,2]=4 5630 B15R0.2002 CCCCCCCC=NNC(=O)COCC 4a_100000216846_100000210592 [0,1,0,0,0,0|2,0,1]=4 5631 B15R0.2002 CCCCCCCCC=CC(=O)CCCF 1458a_100015345288_100011934791 [0,1,0,0,0,0|1,0,2]=4 5632 B15R0.2002 CCCCCCCCC=CC(=O)CCCO 1458a_100015345288_100011215043 [0,1,0,0,0,0|1,0,2]=4 5633 B15R0.2002 CCCCCCCCC=CC(=O)CCOC 1458a_100015345288_100000233755 [0,1,0,0,0,0|1,0,2]=4 5634 B15R0.2002 CCCCCCCCC=CC(=O)CCSC 1458a_100015345288_100000751147 [0,1,0,0,0,0|1,0,2]=4 5635 B15R0.2002 CCCCCCCCC=CC(=O)NCCC 11a_100020643023_100015345288 [0,1,0,0,0,0|1,0,2]=4 5636 B15R0.2002 CCCCCCCCC=CC(=O)NCCC 1626a_100020643023_100015345288 [0,1,0,0,0,0|1,0,2]=4 5637 B15R0.2002 CCCCCCCCC=CC(=O)NCCC 240690a_100020643023_100015345288 [0,1,0,0,0,0|1,0,2]=4 5638 B15R0.2002 CCCCCCCCC=CC(=O)NCCF 11a_100000724931_100015345288 [0,1,0,0,0,0|1,0,2]=4 5639 B15R0.2002 CCCCCCCCC=CC(=O)NCCF 1626a_100000724931_100015345288 [0,1,0,0,0,0|1,0,2]=4 5640 B15R0.2002 CCCCCCCCC=CC(=O)NCCF 240690a_100000724931_100015345288 [0,1,0,0,0,0|1,0,2]=4 5641 B15R0.2002 CCCCCCCCC=CC(=O)NCCO 240690a_100000210304_100015345288 [0,1,0,0,0,0|1,0,2]=4 5642 B15R0.2002 CCCCCCCCC=CC(=O)NNCC 22a_100000756455_100015345288 [0,1,0,0,0,0|1,0,2]=4 5643 B15R0.2002 CCCCCCCCCCC(=NNCC)C 4a_100000756455_200011219864 [0,1,0,0,0,0|2,0,0]=3 5644 B15R0.2002 CCCCCCCCCCC(=O)C#CCO 1458a_100000049017_100000210319 [0,1,0,0,0,0|1,0,1]=3 5645 B15R0.2002 CCCCCCCCCCC(=O)C=COC 1458a_100016268678_100000210319 [0,1,0,0,0,0|1,0,1]=3 5646 B15R0.2002 CCCCCCCCCCC(=O)CCC#N 1458a_100000210375_100011215226 [0,1,0,0,0,0|1,0,1]=3 5647 B15R0.2002 CCCCCCCCCCC(=O)CCC#N 1458a_100011934036_100000210319 [0,1,0,0,0,0|1,0,1]=3 5648 B15R0.2002 CCCCCCCCCCC(=O)CCCF 1458a_100000210375_100011934791 [0,1,0,0,0,0|1,0,0]=2 5649 B15R0.2002 CCCCCCCCCCC(=O)CCCO 1458a_100000210375_100011215043 [0,1,0,0,0,0|1,0,0]=2 5650 B15R0.2002 CCCCCCCCCCC(=O)CCOC 1458a_100000210375_100000233755 [0,1,0,0,0,0|1,0,0]=2 5651 B15R0.2002 CCCCCCCCCCC(=O)CCOC 1458a_100000749529_100000210319 [0,1,0,0,0,0|1,0,0]=2 5652 B15R0.2002 CCCCCCCCCCC(=O)CCSC 1458a_100000174002_100000210319 [0,1,0,0,0,0|1,0,0]=2 5653 B15R0.2002 CCCCCCCCCCC(=O)CCSC 1458a_100000210375_100000751147 [0,1,0,0,0,0|1,0,0]=2 5654 B15R0.2002 CCCCCCCCCCC(=O)COCC 1458a_100000211967_100000210319 [0,1,0,0,0,0|0,0,0]=1 5655 B15R0.2002 CCCCCCCCCCC(=O)CSCC 1458a_100000230394_100000210319 [0,1,0,0,0,0|0,1,0]=2 5656 B15R0.2002 CCCCCCCCCCC(=O)NCC#N 1626a_100000734998_100000210375 [0,1,0,0,0,0|1,0,1]=3 5657 B15R0.2002 CCCCCCCCCCC(=O)NCCC 11a_100020643023_100000210375 [0,1,0,0,0,0|1,0,0]=2 5658 B15R0.2002 CCCCCCCCCCC(=O)NCCC 1626a_100020643023_100000210375 [0,1,0,0,0,0|1,0,0]=2 5659 B15R0.2002 CCCCCCCCCCC(=O)NCCC 240690a_100020643023_100000210375 [0,1,0,0,0,0|1,0,0]=2 5660 B15R0.2002 CCCCCCCCCCC(=O)NCCF 11a_100000724931_100000210375 [0,1,0,0,0,0|1,0,0]=2 5661 B15R0.2002 CCCCCCCCCCC(=O)NCCF 1626a_100000724931_100000210375 [0,1,0,0,0,0|1,0,0]=2 5662 B15R0.2002 CCCCCCCCCCC(=O)NCCF 240690a_100000724931_100000210375 [0,1,0,0,0,0|1,0,0]=2 5663 B15R0.2002 CCCCCCCCCCC(=O)NCCO 240690a_100000210304_100000210375 [0,1,0,0,0,0|1,0,0]=2 5664 B15R0.2002 CCCCCCCCCCC(=O)NNCC 22a_100000756455_100000210375 [0,1,0,0,0,0|1,0,0]=2 5665 B15R0.2002 CCCCCCCCCCC(C)NCCC 270004a_100020643023_200011219864 [0,1,0,0,0,0|2,0,1]=4 5666 B15R0.2002 CCCCCCCCCCC(C)NCCO 270004a_100000210304_200011219864 [0,1,0,0,0,0|2,0,1]=4 5667 B15R0.2002 CCCCCCCCCCC(C)OCC#N 7a_100011215000_100011215382 [0,1,0,0,0,0|1,0,2]=4 5668 B15R0.2002 CCCCCCCCCCC(C)OCC=O 34a_100011215000_200009817547 [0,1,0,0,0,0|1,0,2]=4 5669 B15R0.2002 CCCCCCCCCCC(C)OCC=O 7a_100011215000_200015260668 [0,1,0,0,0,0|1,0,2]=4 5670 B15R0.2002 CCCCCCCCCCC(C)OCCF 34a_100011215000_100011217306 [0,1,0,0,0,0|1,0,1]=3 5671 B15R0.2002 CCCCCCCCCCC(C)OCCF 7a_100011215000_100011217306 [0,1,0,0,0,0|1,0,1]=3 5672 B15R0.2002 CCCCCCCCCCC(C)OCCO 34a_100011215000_100000211926 [0,1,0,0,0,0|1,0,1]=3 5673 B15R0.2002 CCCCCCCCCCC(C)OCCO 7a_100011215000_100000211926 [0,1,0,0,0,0|1,0,1]=3 5674 B15R0.2002 CCCCCCCCCCN(C)CCCC 2230a_100000207549_100000210320 [0,1,0,0,0,0|3,0,0]=4 5675 B15R0.2002 CCCCCCCCCCN(C)CCCC 2230a_100000207566_100000210211 [0,1,0,0,0,0|3,0,0]=4 5676 B15R0.2002 CCCCCCCCCCN(C)CCCC 269982a_100000207549_100000210320 [0,1,0,0,0,0|3,0,0]=4 5677 B15R0.2002 CCCCCCCCCCN(C)CCCC 269982a_100000207566_100000210211 [0,1,0,0,0,0|3,0,0]=4 5678 B15R0.2002 CCCCCCCCCCN(C)CCCF 2230a_100000207566_100011934791 [0,1,0,0,0,0|3,0,0]=4 5679 B15R0.2002 CCCCCCCCCCN(C)CCCF 269982a_100000207566_100011934791 [0,1,0,0,0,0|3,0,0]=4 5680 B15R0.2002 CCCCCCCCCCN(C)CCCO 2230a_100000207566_100000230001 [0,1,0,0,0,0|3,0,0]=4 5681 B15R0.2002 CCCCCCCCCCN(C)CCCO 2230a_100000213112_100000210320 [0,1,0,0,0,0|3,0,0]=4 5682 B15R0.2002 CCCCCCCCCCN(C)CCCO 269982a_100000207566_100011215043 [0,1,0,0,0,0|3,0,0]=4 5683 B15R0.2002 CCCCCCCCCCN(C)CCCO 269982a_100000213112_100000210320 [0,1,0,0,0,0|3,0,0]=4 5684 B15R0.2002 CCCCCCCCCCN(C)CCOC 2230a_100000207566_100011201679 [0,1,0,0,0,0|3,0,0]=4 5685 B15R0.2002 CCCCCCCCCCN(C)CCOC 2230a_100000743101_100000210320 [0,1,0,0,0,0|3,0,0]=4 5686 B15R0.2002 CCCCCCCCCCN(C)CCOC 269982a_100000207566_100000233755 [0,1,0,0,0,0|3,0,0]=4 5687 B15R0.2002 CCCCCCCCCCN(C)CCOC 269982a_100000743101_100000210320 [0,1,0,0,0,0|3,0,0]=4 5688 B15R0.2002 CCCCCCCCCCN(C)CCSC 2230a_100000207566_100000751147 [0,1,0,0,0,0|3,0,0]=4 5689 B15R0.2002 CCCCCCCCCCN(C)CCSC 2230a_100000686725_100000210320 [0,1,0,0,0,0|3,0,0]=4 5690 B15R0.2002 CCCCCCCCCCN(C)CCSC 269982a_100000207566_100000212216 [0,1,0,0,0,0|3,0,0]=4 5691 B15R0.2002 CCCCCCCCCCN(C)CCSC 269982a_100000686725_100000210320 [0,1,0,0,0,0|3,0,0]=4 5692 B15R0.2002 CCCCCCCCCCN(C)COCC 269982a_100000207566_100000739092 [0,1,0,0,0,0|2,0,0]=3 5693 B15R0.2002 CCCCCCCCCNC(=O)C=COC 1626a_100000212291_100016268678 [0,1,0,0,0,0|2,0,1]=4 5694 B15R0.2002 CCCCCCCCCNC(=O)C=COC 240690a_100000212291_100016268678 [0,1,0,0,0,0|2,0,1]=4 5695 B15R0.2002 CCCCCCCCCNC(=O)CCC#N 11a_100000212291_100011934036 [0,1,0,0,0,0|2,0,1]=4 5696 B15R0.2002 CCCCCCCCCNC(=O)CCC#N 1626a_100000212291_100011934036 [0,1,0,0,0,0|2,0,1]=4 5697 B15R0.2002 CCCCCCCCCNC(=O)CCC#N 240690a_100000212291_100011934036 [0,1,0,0,0,0|2,0,1]=4 5698 B15R0.2002 CCCCCCCCCNC(=O)CCC#N 527a_100000212291_100011934036 [0,1,0,0,0,0|2,0,1]=4 5699 B15R0.2002 CCCCCCCCCNC(=O)CCCC 11a_100000212291_100000210183 [0,1,0,0,0,0|2,0,0]=3 5700 B15R0.2002 CCCCCCCCCNC(=O)CCCC 1626a_100000212291_100000210183 [0,1,0,0,0,0|2,0,0]=3 5701 B15R0.2002 CCCCCCCCCNC(=O)CCCC 240690a_100000212291_100000210183 [0,1,0,0,0,0|2,0,0]=3 5702 B15R0.2002 CCCCCCCCCNC(=O)CCCC 527a_100000212291_100000210183 [0,1,0,0,0,0|2,0,0]=3 5703 B15R0.2002 CCCCCCCCCNC(=O)CCOC 11a_100000212291_100000749529 [0,1,0,0,0,0|2,0,0]=3 5704 B15R0.2002 CCCCCCCCCNC(=O)CCOC 1626a_100000212291_100000749529 [0,1,0,0,0,0|2,0,0]=3 5705 B15R0.2002 CCCCCCCCCNC(=O)CCOC 240690a_100000212291_100000749529 [0,1,0,0,0,0|2,0,0]=3 5706 B15R0.2002 CCCCCCCCCNC(=O)CCOC 527a_100000212291_100000749529 [0,1,0,0,0,0|2,0,0]=3 5707 B15R0.2002 CCCCCCCCCNC(=O)CCSC 11a_100000212291_100000174002 [0,1,0,0,0,0|2,0,0]=3 5708 B15R0.2002 CCCCCCCCCNC(=O)CCSC 1626a_100000212291_100000174002 [0,1,0,0,0,0|2,0,0]=3 5709 B15R0.2002 CCCCCCCCCNC(=O)CCSC 240690a_100000212291_100000174002 [0,1,0,0,0,0|2,0,0]=3 5710 B15R0.2002 CCCCCCCCCNC(=O)CCSC 527a_100000212291_100000174002 [0,1,0,0,0,0|2,0,0]=3 5711 B15R0.2002 CCCCCCCCCNC(=O)COCC 11a_100000212291_100000211967 [0,1,0,0,0,0|1,0,0]=2 5712 B15R0.2002 CCCCCCCCCNC(=O)COCC 1626a_100000212291_100000211967 [0,1,0,0,0,0|1,0,0]=2 5713 B15R0.2002 CCCCCCCCCNC(=O)COCC 240690a_100000212291_100000211967 [0,1,0,0,0,0|1,0,0]=2 5714 B15R0.2002 CCCCCCCCCNC(=O)COCC 527a_100000212291_100000211967 [0,1,0,0,0,0|1,0,0]=2 5715 B15R0.2002 CCCCCCCCCNC(=O)CSCC 11a_100000212291_100000230394 [0,1,0,0,0,0|1,1,0]=3 5716 B15R0.2002 CCCCCCCCCNC(=O)CSCC 1626a_100000212291_100000230394 [0,1,0,0,0,0|1,1,0]=3 5717 B15R0.2002 CCCCCCCCCNC(=O)CSCC 240690a_100000212291_100000230394 [0,1,0,0,0,0|1,1,0]=3 5718 B15R0.2002 CCCCCCCCCNC(=O)CSCC 527a_100000212291_100000230394 [0,1,0,0,0,0|1,1,0]=3 5719 B15R0.2002 CCCCCCCCCNC(=O)NCC#N 2708a_100000734998_100000212291 [0,1,0,0,0,0|2,0,1]=4 5720 B15R0.2002 CCCCCCCCCNC(=O)NCC#N 273464a_100000212291_100000734998 [0,1,0,0,0,0|2,0,1]=4 5721 B15R0.2002 CCCCCCCCCNC(=O)NCC#N 273464a_100000734998_100000212291 [0,1,0,0,0,0|2,0,1]=4 5722 B15R0.2002 CCCCCCCCCNC(=O)NCC#N 512a_100000212291_100000734998 [0,1,0,0,0,0|2,0,1]=4 5723 B15R0.2002 CCCCCCCCCNC(=O)NCC#N 512a_100000734998_100000212291 [0,1,0,0,0,0|2,0,1]=4 5724 B15R0.2002 CCCCCCCCCNC(=O)NCCC 2708a_100000212291_100020643023 [0,1,0,0,0,0|2,0,0]=3 5725 B15R0.2002 CCCCCCCCCNC(=O)NCCC 2708a_100020643023_100000212291 [0,1,0,0,0,0|2,0,0]=3 5726 B15R0.2002 CCCCCCCCCNC(=O)NCCC 273464a_100000212291_100020643023 [0,1,0,0,0,0|2,0,0]=3 5727 B15R0.2002 CCCCCCCCCNC(=O)NCCC 273464a_100020643023_100000212291 [0,1,0,0,0,0|2,0,0]=3 5728 B15R0.2002 CCCCCCCCCNC(=O)NCCC 512a_100000212291_100020643023 [0,1,0,0,0,0|2,0,0]=3 5729 B15R0.2002 CCCCCCCCCNC(=O)NCCC 512a_100020643023_100000212291 [0,1,0,0,0,0|2,0,0]=3 5730 B15R0.2002 CCCCCCCCCNC(=O)NCCF 2708a_100000212291_100000724931 [0,1,0,0,0,0|2,0,0]=3 5731 B15R0.2002 CCCCCCCCCNC(=O)NCCF 273464a_100000212291_100000724931 [0,1,0,0,0,0|2,0,0]=3 5732 B15R0.2002 CCCCCCCCCNC(=O)NCCF 273464a_100000724931_100000212291 [0,1,0,0,0,0|2,0,0]=3 5733 B15R0.2002 CCCCCCCCCNC(=O)NCCF 512a_100000212291_100000724931 [0,1,0,0,0,0|2,0,0]=3 5734 B15R0.2002 CCCCCCCCCNC(=O)NCCO 2708a_100000212291_100000210304 [0,1,0,0,0,0|2,0,0]=3 5735 B15R0.2002 CCCCCCCCCNC(=O)NCCO 273464a_100000210304_100000212291 [0,1,0,0,0,0|2,0,0]=3 5736 B15R0.2002 CCCCCCCCCNC(=O)NCCO 273464a_100000212291_100000210304 [0,1,0,0,0,0|2,0,0]=3 5737 B15R0.2002 CCCCCCCCCNC(=O)NCCO 512a_100000212291_100000210304 [0,1,0,0,0,0|2,0,0]=3 5738 B15R0.2002 CCCCCCCCCNC(=O)NNCC 273464a_100000212291_100000756455 [0,1,0,0,0,0|2,0,0]=3 5739 B15R0.2002 CCCCCCCCCNC(=O)NNCC 512a_100000212291_100000756455 [0,1,0,0,0,0|2,0,0]=3 5740 B15R0.2002 CCCCCCCCCNC(=O)NNCC 512a_100000756455_100000212291 [0,1,0,0,0,0|2,0,0]=3 5741 B15R0.2002 CCCCCCCCCOC(C)COCC 34a_100000718985_100011214924 [0,1,0,0,0,0|2,0,1]=4 5742 B15R0.2002 CCCCCCCCCOC(C)COCC 7a_100000718985_100000210328 [0,1,0,0,0,0|2,0,1]=4 5743 B15R0.2002 CCCCCCCCNCC(=O)NCC#N 2230a_100000229939_100000736037 [0,1,0,0,0,0|2,0,1]=4 5744 B15R0.2002 CCCCCCCCNCC(=O)NCCC 2230a_100000174927_100000210759 [0,1,0,0,0,0|2,0,0]=3 5745 B15R0.2002 CCCCCCCCNCC(=O)NCCC 2230a_100000229939_100000183358 [0,1,0,0,0,0|2,0,0]=3 5746 B15R0.2002 CCCCCCCCNCC(=O)NCCC 34a_100000229939_100000183358 [0,1,0,0,0,0|2,0,0]=3 5747 B15R0.2002 CCCCCCCCNCC(=O)NCCF 2230a_100000725713_100000210759 [0,1,0,0,0,0|2,0,0]=3 5748 B15R0.2002 CCCCCCCCNCC(=O)OCCC 2230a_100000229939_200011215008 [0,1,0,0,0,0|1,0,0]=2 5749 B15R0.2002 CCCCCCCCNCC(=O)OCCC 34a_100000229939_200011215008 [0,1,0,0,0,0|1,0,0]=2 5750 B15R0.2002 CCCCCCCCNCC(C)OCCC 2230a_100015185124_100000210759 [0,1,0,0,0,0|2,0,1]=4 5751 B15R0.2002 CCCCCCCCNCC(C)OCCC 34a_100015185124_100000210759 [0,1,0,0,0,0|2,0,1]=4 5752 B15R0.2002 CCCCCCCCNCC(O)COCC 2230a_102515437182_100000210759 [0,1,0,0,0,0|1,0,2]=4 5753 B15R0.2002 CCCCCCCCNCC(O)COCC 34a_102515437182_100000210759 [0,1,0,0,0,0|1,0,2]=4 5754 B15R0.2002 CCCCCCCCOCC(=O)CCC#N 1458a_100000759886_100011215226 [0,1,0,0,0,0|2,0,1]=4 5755 B15R0.2002 CCCCCCCCOCC(=O)CCCC 1458a_100000759886_100000210211 [0,1,0,0,0,0|2,0,0]=3 5756 B15R0.2002 CCCCCCCCOCC(=O)CCCF 1458a_100000759886_100011934791 [0,1,0,0,0,0|2,0,0]=3 5757 B15R0.2002 CCCCCCCCOCC(=O)CCCO 1458a_100000759886_100011215043 [0,1,0,0,0,0|2,0,0]=3 5758 B15R0.2002 CCCCCCCCOCC(=O)CCOC 1458a_100000759886_100000233755 [0,1,0,0,0,0|2,0,0]=3 5759 B15R0.2002 CCCCCCCCOCC(=O)CCSC 1458a_100000759886_100000751147 [0,1,0,0,0,0|2,0,0]=3 5760 B15R0.2002 CCCCCCCCOCC(=O)NCC#N 1626a_100000734998_100000759886 [0,1,0,0,0,0|2,0,1]=4 5761 B15R0.2002 CCCCCCCCOCC(=O)NCC#N 527a_100000734998_100000759886 [0,1,0,0,0,0|2,0,1]=4 5762 B15R0.2002 CCCCCCCCOCC(=O)NCC#N 7a_100000210232_100000736037 [0,1,0,0,0,0|2,0,1]=4 5763 B15R0.2002 CCCCCCCCOCC(=O)NCCC 11a_100020643023_100000759886 [0,1,0,0,0,0|2,0,0]=3 5764 B15R0.2002 CCCCCCCCOCC(=O)NCCC 1626a_100020643023_100000759886 [0,1,0,0,0,0|2,0,0]=3 5765 B15R0.2002 CCCCCCCCOCC(=O)NCCC 240690a_100020643023_100000759886 [0,1,0,0,0,0|2,0,0]=3 5766 B15R0.2002 CCCCCCCCOCC(=O)NCCC 34a_100000210232_100000183358 [0,1,0,0,0,0|2,0,0]=3 5767 B15R0.2002 CCCCCCCCOCC(=O)NCCC 527a_100020643023_100000759886 [0,1,0,0,0,0|2,0,0]=3 5768 B15R0.2002 CCCCCCCCOCC(=O)NCCC 7a_100000210232_100000183358 [0,1,0,0,0,0|2,0,0]=3 5769 B15R0.2002 CCCCCCCCOCC(=O)NCCF 11a_100000724931_100000759886 [0,1,0,0,0,0|2,0,0]=3 5770 B15R0.2002 CCCCCCCCOCC(=O)NCCF 1626a_100000724931_100000759886 [0,1,0,0,0,0|2,0,0]=3 5771 B15R0.2002 CCCCCCCCOCC(=O)NCCF 240690a_100000724931_100000759886 [0,1,0,0,0,0|2,0,0]=3 5772 B15R0.2002 CCCCCCCCOCC(=O)NCCF 527a_100000724931_100000759886 [0,1,0,0,0,0|2,0,0]=3 5773 B15R0.2002 CCCCCCCCOCC(=O)NCCO 240690a_100000210304_100000759886 [0,1,0,0,0,0|2,0,0]=3 5774 B15R0.2002 CCCCCCCCOCC(=O)NCCO 527a_100000210304_100000759886 [0,1,0,0,0,0|2,0,0]=3 5775 B15R0.2002 CCCCCCCCOCC(=O)NNCC 22a_100000756455_100000759886 [0,1,0,0,0,0|2,0,0]=3 5776 B15R0.2002 CCCCCCCCOCC(=O)OCCC 34a_100000210232_200011215008 [0,1,0,0,0,0|1,0,0]=2 5777 B15R0.2002 CCCCCCCCOCC(=O)OCCC 7a_100000210232_200011215008 [0,1,0,0,0,0|1,0,0]=2 5778 B15R0.2002 CCCCCCCCOC[C@@H](C)OCOC 34a_100016172286_100000210759 [0,1,0,0,0,0|2,0,1]=4 5779 B15R0.2002 CCCCCCCCOC[C@@H](C)OCOC 7a_100016172286_100000210759 [0,1,0,0,0,0|2,0,1]=4 5780 B15R0.2002 CCCCCCCCSCC(=O)NCC#N 62a_100000210759_100000736037 [0,1,0,0,0,0|2,0,1]=4 5781 B15R0.2002 CCCCCCCCSCC(=O)NCC#N 62a_100000736037_100000210317 [0,1,0,0,0,0|2,0,1]=4 5782 B15R0.2002 CCCCCCCCSCC(=O)NCCC 62a_100000183358_100000210317 [0,1,0,0,0,0|2,0,0]=3 5783 B15R0.2002 CCCCCCCCSCC(=O)NCCC 62a_100000210759_100000183358 [0,1,0,0,0,0|2,0,0]=3 5784 B15R0.2002 CCCCCCCCSCC(=O)OCCC 62a_100000210759_200011215008 [0,1,0,0,0,0|1,0,0]=2 5785 B15R0.2002 CCCCCCCCSCC(=O)OCCC 62a_200011215008_100000210317 [0,1,0,0,0,0|1,0,0]=2 5786 B15R0.2002 CCCCCCCOCOC(=O)OCCC 34a_100000210272_200000139673 [0,1,0,0,0,0|2,0,0]=3 5787 B15R0.2002 CCCCCCCOCOC(=O)OCCC 7a_100000210272_200000139673 [0,1,0,0,0,0|2,0,0]=3 5788 B15R0.2002 CCCCCCCSCOC(=O)OCCC 62a_100000210614_200000139673 [0,1,0,0,0,0|2,0,0]=3 5789 B15R0.2002 CCCCCCNCCCC(=O)NCCC 2230a_100000210581_100011194427 [0,1,0,0,0,0|2,0,0]=3 5790 B15R0.2002 CCCCCCOCCCC(=O)NCCC 7a_100000210259_100011194427 [0,1,0,0,0,0|2,0,0]=3 5791 B15R0.2002 CCCCCCSCCCC(=O)NCCC 62a_100000210314_100011194427 [0,1,0,0,0,0|2,0,0]=3 5792 B15R0.2002 CCCCCCSCCCC(=O)NCCC 62a_100011194427_100000210757 [0,1,0,0,0,0|2,0,0]=3 5793 B15R0.2002 CCCCCNCCOCC(=O)NCCC 34a_100000224656_100000183358 [0,1,0,0,0,0|3,0,0]=4 5794 B15R0.2002 CCCCCNCCOCC(=O)OCCC 34a_100000224656_200011215008 [0,1,0,0,0,0|2,0,0]=3 5795 B15R0.2002 CCCCCOCCOCC(=O)NCCC 34a_100011215259_100000183358 [0,1,0,0,0,0|3,0,0]=4 5796 B15R0.2002 CCCCCOCCOCC(=O)NCCC 7a_100011215259_100000183358 [0,1,0,0,0,0|3,0,0]=4 5797 B15R0.2002 CCCCCOCCOCC(=O)OCCC 34a_100011215259_200011215008 [0,1,0,0,0,0|2,0,0]=3 5798 B15R0.2002 CCCCCOCCOCC(=O)OCCC 7a_100011215259_200011215008 [0,1,0,0,0,0|2,0,0]=3 5799 B15R0.2002 CCCCOCCCNCC(=O)NCCC 2230a_200000211371_100000183358 [0,1,0,0,0,0|3,0,0]=4 5800 B15R0.2002 CCCCOCCCNCC(=O)NCCC 34a_200000211371_100000183358 [0,1,0,0,0,0|3,0,0]=4 5801 B15R0.2002 CCCCOCCCNCC(=O)OCCC 2230a_200000211371_200011215008 [0,1,0,0,0,0|2,0,0]=3 5802 B15R0.2002 CCCCOCCCNCC(=O)OCCC 34a_200000211371_200011215008 [0,1,0,0,0,0|2,0,0]=3 5803 B15R0.2002 CCCCOCCCOCC(=O)NCCC 34a_200011215613_100000183358 [0,1,0,0,0,0|3,0,0]=4 5804 B15R0.2002 CCCCOCCCOCC(=O)NCCC 7a_200011215613_100000183358 [0,1,0,0,0,0|3,0,0]=4 5805 B15R0.2002 CCCCOCCCOCC(=O)OCCC 34a_200011215613_200011215008 [0,1,0,0,0,0|2,0,0]=3 5806 B15R0.2002 CCCCOCCCOCC(=O)OCCC 7a_200011215613_200011215008 [0,1,0,0,0,0|2,0,0]=3 5807 B15R0.2002 CCCCOCCOCOC(=O)OCCC 34a_100000210238_200000139673 [0,1,0,0,0,0|3,0,0]=4 5808 B15R0.2002 CCCCOCCOCOC(=O)OCCC 7a_100000210238_200000139673 [0,1,0,0,0,0|3,0,0]=4 5809 B15R0.2002 CCCCOCCSCOC(=O)OCCC 62a_100000743108_200000139673 [0,1,0,0,0,0|3,0,0]=4 5810 B15R0.2002 CCCCOCSCCCC(=O)NCCC 62a_100011194427_100011995733 [0,1,0,0,0,0|3,0,0]=4 5811 B15R0.2002 CCCCOCSCCCC(=O)NCCC 62a_100011995733_100011194427 [0,1,0,0,0,0|3,0,0]=4 5812 B15R0.2002 CCCCSCCOCOC(=O)OCCC 34a_200000230436_200000139673 [0,1,0,0,0,0|3,0,0]=4 5813 B15R0.2002 CCCCSCCOCOC(=O)OCCC 7a_200000230436_200000139673 [0,1,0,0,0,0|3,0,0]=4 5814 B15R0.2002 CCCNC(=O)CCCCCCCCCF 11a_100020643023_200009909015 [0,1,0,0,0,0|2,0,0]=3 5815 B15R0.2002 CCCNC(=O)CCCCCCCCCF 240690a_100020643023_200009909015 [0,1,0,0,0,0|2,0,0]=3 5816 B15R0.2002 CCCNC(=O)CCCCCCCCCF 527a_100020643023_200009909015 [0,1,0,0,0,0|2,0,0]=3 5817 B15R0.2002 CCCNC(=O)CCCCCCCCCO 240690a_100020643023_100000032657 [0,1,0,0,0,0|2,0,0]=3 5818 B15R0.2002 CCCNC(=O)CCCNCCCCCO 2230a_100000762737_100011194427 [0,1,0,0,0,0|3,0,0]=4 5819 B15R0.2002 CCCNC(=O)CCCNCCCOCC 2230a_100000210961_100011194427 [0,1,0,0,0,0|3,0,0]=4 5820 B15R0.2002 CCCNC(=O)CCCNCCOCCC 2230a_100161115042_100011194427 [0,1,0,0,0,0|3,0,0]=4 5821 B15R0.2002 CCCNC(=O)CCCNCCSCCC 2230a_100020603323_100011194427 [0,1,0,0,0,0|3,0,0]=4 5822 B15R0.2002 CCCNC(=O)CCCOCCCCCBr 7a_100000746331_100011194427 [0,1,0,0,0,0|3,0,0]=4 5823 B15R0.2002 CCCNC(=O)CCCOCCCCCCl 7a_100000746330_100011194427 [0,1,0,0,0,0|3,0,0]=4 5824 B15R0.2002 CCCNC(=O)CCCOCCCCCI 7a_200012148887_100011194427 [0,1,0,0,0,0|3,0,0]=4 5825 B15R0.2002 CCCNC(=O)CCCOCCCCSC 7a_100011217163_100011194427 [0,1,0,0,0,0|3,0,0]=4 5826 B15R0.2002 CCCNC(=O)CCCOCCCOCC 7a_100000757476_100011194427 [0,1,0,0,0,0|3,0,0]=4 5827 B15R0.2002 CCCNC(=O)CCCOCCCSCC 7a_100011216438_100011194427 [0,1,0,0,0,0|3,0,0]=4 5828 B15R0.2002 CCCNC(=O)CCCOCCOCCC 7a_100000752267_100011194427 [0,1,0,0,0,0|3,0,0]=4 5829 B15R0.2002 CCCNC(=O)CCCOCCSCCC 7a_200000230433_100011194427 [0,1,0,0,0,0|3,0,0]=4 5830 B15R0.2002 CCCNC(=O)CCCSCCCCCF 62a_100000729378_100011194427 [0,1,0,0,0,0|3,0,0]=4 5831 B15R0.2002 CCCNC(=O)CCCSCCCCCF 62a_100011194427_100000729378 [0,1,0,0,0,0|3,0,0]=4 5832 B15R0.2002 CCCNC(=O)CCCSCCCCCO 62a_100000746330_100011194427 [0,1,0,0,0,0|3,0,0]=4 5833 B15R0.2002 CCCNC(=O)CCCSCCCCCO 62a_100011194427_100000746330 [0,1,0,0,0,0|3,0,0]=4 5834 B15R0.2002 CCCNC(=O)CCCSCCCCOC 62a_100000730899_100011194427 [0,1,0,0,0,0|3,0,0]=4 5835 B15R0.2002 CCCNC(=O)CCCSCCCCOC 62a_100011194427_100000730899 [0,1,0,0,0,0|3,0,0]=4 5836 B15R0.2002 CCCNC(=O)CCCSCCCOCC 62a_100011194427_100012232248 [0,1,0,0,0,0|3,0,0]=4 5837 B15R0.2002 CCCNC(=O)CCCSCCCOCC 62a_100012232248_100011194427 [0,1,0,0,0,0|3,0,0]=4 5838 B15R0.2002 CCCNC(=O)CCCSCCOCCC 62a_100011194427_100011215938 [0,1,0,0,0,0|3,0,0]=4 5839 B15R0.2002 CCCNC(=O)CCCSCCOCCC 62a_100011215938_100011194427 [0,1,0,0,0,0|3,0,0]=4 5840 B15R0.2002 CCCNC(=O)CNCCCCCCCO 2230a_100000174927_100000760002 [0,1,0,0,0,0|3,0,0]=4 5841 B15R0.2002 CCCNC(=O)CNCCCCCCCO 2230a_100011996573_100000183358 [0,1,0,0,0,0|3,0,0]=4 5842 B15R0.2002 CCCNC(=O)CNCCCCCCCO 34a_100011996573_100000183358 [0,1,0,0,0,0|3,0,0]=4 5843 B15R0.2002 CCCNC(=O)CNCCCCCCOC 2230a_100000174927_100011998445 [0,1,0,0,0,0|3,0,0]=4 5844 B15R0.2002 CCCNC(=O)COCCCCCCCBr 34a_100000760002_100000183358 [0,1,0,0,0,0|3,0,0]=4 5845 B15R0.2002 CCCNC(=O)COCCCCCCCBr 7a_100000760002_100000183358 [0,1,0,0,0,0|3,0,0]=4 5846 B15R0.2002 CCCNC(=O)COCCCCCCCN 34a_100011996573_100000183358 [0,1,0,0,0,0|3,0,0]=4 5847 B15R0.2002 CCCNC(=O)COCCCCCCOC 34a_200012092642_100000183358 [0,1,0,0,0,0|3,0,0]=4 5848 B15R0.2002 CCCNC(=O)COCCCCCCOC 7a_200012092642_100000183358 [0,1,0,0,0,0|3,0,0]=4 5849 B15R0.2002 CCCNC(=O)CSCCCCCCCO 62a_100000183358_100000760002 [0,1,0,0,0,0|3,0,0]=4 5850 B15R0.2002 CCCNC(=O)CSCCCCCCCO 62a_100000760002_100000183358 [0,1,0,0,0,0|3,0,0]=4 5851 B15R0.2002 CCCNC(=O)CSCCCCCCOC 62a_100000183358_100011998445 [0,1,0,0,0,0|3,0,0]=4 5852 B15R0.2002 CCCNC(=O)CSCCCCCCOC 62a_100011998445_100000183358 [0,1,0,0,0,0|3,0,0]=4 5853 B15R0.2002 CCCNC(=O)NCCCCCCCCO 2708a_100020643023_102515433106 [0,1,0,0,0,0|3,0,0]=4 5854 B15R0.2002 CCCNC(=O)NCCCCCCCCO 2708a_102515433106_100020643023 [0,1,0,0,0,0|3,0,0]=4 5855 B15R0.2002 CCCNC(=O)NCCCCCCCCO 273464a_100020643023_102515433106 [0,1,0,0,0,0|3,0,0]=4 5856 B15R0.2002 CCCNC(=O)NCCCCCCCCO 273464a_102515433106_100020643023 [0,1,0,0,0,0|3,0,0]=4 5857 B15R0.2002 CCCNC(=O)NCCCCCCCCO 512a_100020643023_102515433106 [0,1,0,0,0,0|3,0,0]=4 5858 B15R0.2002 CCCNC(=O)NCCCCCCCCO 512a_102515433106_100020643023 [0,1,0,0,0,0|3,0,0]=4 5859 B15R0.2002 CCCOC(=O)CNCCCCCCCO 2230a_100011996573_200011215008 [0,1,0,0,0,0|2,0,0]=3 5860 B15R0.2002 CCCOC(=O)CNCCCCCCCO 34a_100011996573_200011215008 [0,1,0,0,0,0|2,0,0]=3 5861 B15R0.2002 CCCOC(=O)CNCCCOCCCO 2230a_100011310245_200011215008 [0,1,0,0,0,0|3,0,0]=4 5862 B15R0.2002 CCCOC(=O)CNCCCOCCCO 34a_100011310245_200011215008 [0,1,0,0,0,0|3,0,0]=4 5863 B15R0.2002 CCCOC(=O)CNCCCOCCOC 2230a_100000206027_200011215008 [0,1,0,0,0,0|3,0,0]=4 5864 B15R0.2002 CCCOC(=O)CNCCCOCCOC 34a_100000206027_200011215008 [0,1,0,0,0,0|3,0,0]=4 5865 B15R0.2002 CCCOC(=O)CNCCOCCOCC 2230a_100102712874_200011215008 [0,1,0,0,0,0|3,0,0]=4 5866 B15R0.2002 CCCOC(=O)CNCCOCCOCC 34a_100102712874_200011215008 [0,1,0,0,0,0|3,0,0]=4 5867 B15R0.2002 CCCOC(=O)COCCCCCCCBr 34a_100000760002_200011215008 [0,1,0,0,0,0|2,0,0]=3 5868 B15R0.2002 CCCOC(=O)COCCCCCCCBr 7a_100000760002_200011215008 [0,1,0,0,0,0|2,0,0]=3 5869 B15R0.2002 CCCOC(=O)COCCCCCCCN 34a_100011996573_200011215008 [0,1,0,0,0,0|2,0,0]=3 5870 B15R0.2002 CCCOC(=O)COCCCCCCOC 34a_200012092642_200011215008 [0,1,0,0,0,0|2,0,0]=3 5871 B15R0.2002 CCCOC(=O)COCCCCCCOC 7a_200012092642_200011215008 [0,1,0,0,0,0|2,0,0]=3 5872 B15R0.2002 CCCOC(=O)COCCCOCCCN 34a_100011310245_200011215008 [0,1,0,0,0,0|3,0,0]=4 5873 B15R0.2002 CCCOC(=O)COCCOCCOCC 34a_100000210240_200011215008 [0,1,0,0,0,0|3,0,0]=4 5874 B15R0.2002 CCCOC(=O)COCCOCCOCC 7a_100000210240_200011215008 [0,1,0,0,0,0|3,0,0]=4 5875 B15R0.2002 CCCOC(=O)CSCCCCCCC#N 62a_100009813337_200011215008 [0,1,0,0,0,0|2,0,1]=4 5876 B15R0.2002 CCCOC(=O)CSCCCCCCC#N 62a_200011215008_100009813337 [0,1,0,0,0,0|2,0,1]=4 5877 B15R0.2002 CCCOC(=O)CSCCCCCCCO 62a_100000760002_200011215008 [0,1,0,0,0,0|2,0,0]=3 5878 B15R0.2002 CCCOC(=O)CSCCCCCCCO 62a_200011215008_100000760002 [0,1,0,0,0,0|2,0,0]=3 5879 B15R0.2002 CCCOC(=O)CSCCCCCCOC 62a_100011998445_200011215008 [0,1,0,0,0,0|2,0,0]=3 5880 B15R0.2002 CCCOC(=O)CSCCCCCCOC 62a_200011215008_100011998445 [0,1,0,0,0,0|2,0,0]=3 5881 B15R0.2002 CCCOC(=O)CSCCCOCCOC 62a_100011216529_200011215008 [0,1,0,0,0,0|3,0,0]=4 5882 B15R0.2002 CCCOC(=O)CSCCCOCCOC 62a_200011215008_100011216529 [0,1,0,0,0,0|3,0,0]=4 5883 B15R0.2002 CCCOC(=O)CSCCOCCOCC 62a_100011211534_200011215008 [0,1,0,0,0,0|3,0,0]=4 5884 B15R0.2002 CCCOC(=O)CSCCOCCOCC 62a_200011215008_100011211534 [0,1,0,0,0,0|3,0,0]=4 5885 B15R0.2002 CCCOC(=O)OCNCCCCCCO 34a_100000686447_200000139673 [0,1,0,0,0,0|3,0,0]=4 5886 B15R0.2002 CCCOC(=O)OCNCCCCCOC 34a_100000747528_200000139673 [0,1,0,0,0,0|3,0,0]=4 5887 B15R0.2002 CCCOC(=O)OCOCCCCCCBr 34a_100011215345_200000139673 [0,1,0,0,0,0|3,0,0]=4 5888 B15R0.2002 CCCOC(=O)OCOCCCCCCBr 7a_100011215345_200000139673 [0,1,0,0,0,0|3,0,0]=4 5889 B15R0.2002 CCCOC(=O)OCOCCCCCCCl 34a_100000766143_200000139673 [0,1,0,0,0,0|3,0,0]=4 5890 B15R0.2002 CCCOC(=O)OCOCCCCCCCl 7a_100000766143_200000139673 [0,1,0,0,0,0|3,0,0]=4 5891 B15R0.2002 CCCOC(=O)OCOCCCCCCF 34a_100000732779_200000139673 [0,1,0,0,0,0|3,0,0]=4 5892 B15R0.2002 CCCOC(=O)OCOCCCCCCF 7a_100000732779_200000139673 [0,1,0,0,0,0|3,0,0]=4 5893 B15R0.2002 CCCOC(=O)OCOCCCCCCN 34a_100000686447_200000139673 [0,1,0,0,0,0|3,0,0]=4 5894 B15R0.2002 CCCOC(=O)OCOCCCCCNC 34a_100000722520_200000139673 [0,1,0,0,0,0|3,0,0]=4 5895 B15R0.2002 CCCOC(=O)OCSCCCCCCF 62a_100015922095_200000139673 [0,1,0,0,0,0|3,0,0]=4 5896 B15R0.2002 CCCOC(=O)OCSCCCCCCO 62a_100000766143_200000139673 [0,1,0,0,0,0|3,0,0]=4 5897 B15R0.2002 CCCOCCCNCOC(=O)OCCC 34a_100011217757_200000139673 [0,1,0,0,0,0|3,0,0]=4 5898 B15R0.2002 CCCOCCOCCNC(=O)COCC 11a_200011904461_100000211967 [0,1,0,0,0,0|3,0,0]=4 5899 B15R0.2002 CCCOCCOCCNC(=O)COCC 1626a_200011904461_100000211967 [0,1,0,0,0,0|3,0,0]=4 5900 B15R0.2002 CCCOCCOCCNC(=O)COCC 240690a_200011904461_100000211967 [0,1,0,0,0,0|3,0,0]=4 5901 B15R0.2002 CCNNC(=O)CCCCCCCCCF 22a_100000756455_200009909015 [0,1,0,0,0,0|2,0,0]=3 5902 B15R0.2002 CCNNC(=O)CCCCCCCCCO 22a_100000756455_100000032657 [0,1,0,0,0,0|2,0,0]=3 5903 B15R0.2002 CCNNC(=O)NCCCCCCCCO 273464a_102515433106_100000756455 [0,1,0,0,0,0|3,0,0]=4 5904 B15R0.2002 CCNNC(=O)NCCCCCCCCO 512a_100000756455_102515433106 [0,1,0,0,0,0|3,0,0]=4 5905 B15R0.2002 CCNNC(=O)NCCCCCCCCO 512a_102515433106_100000756455 [0,1,0,0,0,0|3,0,0]=4 5906 B15R0.2002 CCOCC(=O)CCCCCCCCCO 1458a_100000211967_100009813782 [0,1,0,0,0,0|1,0,0]=2 5907 B15R0.2002 CCOCC(=O)CCOCCOCCOC 1458a_100000211967_100013367474 [0,1,0,0,0,0|3,0,0]=4 5908 B15R0.2002 CCOCC(=O)NCCCCCCCCO 240690a_102515433106_100000211967 [0,1,0,0,0,0|2,0,0]=3 5909 B15R0.2002 CCSCC(=O)CCCCCCCCCO 1458a_100000230394_100009813782 [0,1,0,0,0,0|1,1,0]=3 5910 B15R0.2002 CCSCC(=O)NCCCCCCCCO 240690a_102515433106_100000230394 [0,1,0,0,0,0|2,1,0]=4 5911 B15R0.2002 COC=CC(=O)CCCCCCCCCO 1458a_100016268678_100009813782 [0,1,0,0,0,0|2,0,1]=4 5912 B15R0.2002 COCCC(=O)CCCCCCCCCF 1458a_200009909015_100000233755 [0,1,0,0,0,0|2,0,0]=3 5913 B15R0.2002 COCCC(=O)CCCCCCCCCO 1458a_100000749529_100009813782 [0,1,0,0,0,0|2,0,0]=3 5914 B15R0.2002 COCCC(=O)NCCCCCCCCO 240690a_102515433106_100000749529 [0,1,0,0,0,0|3,0,0]=4 5915 B15R0.2002 COCCCCCCNCC(=O)NCCF 2230a_100000725713_100011998445 [0,1,0,0,0,0|3,0,0]=4 5916 B15R0.2002 CSCCC(=O)CCCCCCCCCF 1458a_200009909015_100000751147 [0,1,0,0,0,0|2,0,0]=3 5917 B15R0.2002 CSCCC(=O)CCCCCCCCCO 1458a_100000174002_100009813782 [0,1,0,0,0,0|2,0,0]=3 5918 B15R0.2002 CSCCC(=O)NCCCCCCCCO 240690a_102515433106_100000174002 [0,1,0,0,0,0|3,0,0]=4 5919 B15R0.2002 N#CCCC(=O)CCCCCCCCCF 1458a_200009909015_100011215226 [0,1,0,0,0,0|2,0,1]=4 5920 B15R0.2002 N#CCCC(=O)CCCCCCCCCO 1458a_100011934036_100009813782 [0,1,0,0,0,0|2,0,1]=4 5921 B15R0.2002 N#CCNC(=O)CCCCCCCCCF 527a_100000734998_200009909015 [0,1,0,0,0,0|2,0,1]=4 5922 B15R0.2002 O=C(C#CCO)CCCCCCCCCO 1458a_100000049017_100009813782 [0,1,0,0,0,0|2,0,1]=4 5923 B15R0.2002 O=C(CCCCCCCCCF)NCCF 11a_100000724931_200009909015 [0,1,0,0,0,0|2,0,0]=3 5924 B15R0.2002 O=C(CCCCCCCCCF)NCCF 240690a_100000724931_200009909015 [0,1,0,0,0,0|2,0,0]=3 5925 B15R0.2002 O=C(CCCCCCCCCF)NCCF 527a_100000724931_200009909015 [0,1,0,0,0,0|2,0,0]=3 5926 B15R0.2002 O=C(CCCCCCCCCF)NCCO 240690a_100000210304_200009909015 [0,1,0,0,0,0|2,0,0]=3 5927 B15R0.2002 O=C(CCCCCCCCCF)NCCO 527a_100000210304_200009909015 [0,1,0,0,0,0|2,0,0]=3 5928 B15R0.2002 O=C(CCCCCCCCCO)NCCF 240690a_100000724931_100000032657 [0,1,0,0,0,0|2,0,0]=3 5929 B15R0.2002 O=C(CCCCCCCCCO)NCCO 240690a_100000210304_100000032657 [0,1,0,0,0,0|2,0,0]=3 5930 B15R0.2002 O=C(CCCF)CCCCCCCCCF 1458a_200009909015_100011934791 [0,1,0,0,0,0|2,0,0]=3 5931 B15R0.2002 O=C(CCCO)CCCCCCCCCF 1458a_200009909015_100011215043 [0,1,0,0,0,0|2,0,0]=3 5932 B15R0.2002 O=C(CNCCCCCCCO)NCCF 2230a_100000725713_100000760002 [0,1,0,0,0,0|3,0,0]=4 5933 B15R0.2002 O=C(NCCF)NCCCCCCCCO 2708a_102515433106_100000724931 [0,1,0,0,0,0|3,0,0]=4 5934 B15R0.2002 O=C(NCCF)NCCCCCCCCO 273464a_100000724931_102515433106 [0,1,0,0,0,0|3,0,0]=4 5935 B15R0.2002 O=C(NCCF)NCCCCCCCCO 273464a_102515433106_100000724931 [0,1,0,0,0,0|3,0,0]=4 5936 B15R0.2002 O=C(NCCF)NCCCCCCCCO 512a_102515433106_100000724931 [0,1,0,0,0,0|3,0,0]=4 5937 B15R0.2002 O=C(NCCO)NCCCCCCCCO 2708a_102515433106_100000210304 [0,1,0,0,0,0|3,0,0]=4 5938 B15R0.2002 O=C(NCCO)NCCCCCCCCO 273464a_100000210304_102515433106 [0,1,0,0,0,0|3,0,0]=4 5939 B15R0.2002 O=C(NCCO)NCCCCCCCCO 273464a_102515433106_100000210304 [0,1,0,0,0,0|3,0,0]=4 5940 B15R0.2002 O=C(NCCO)NCCCCCCCCO 512a_102515433106_100000210304 [0,1,0,0,0,0|3,0,0]=4 5941 B15R0.3222 C#CCCCCCCOC(C)C(=O)OCC 34a_100011217361_100011216346 [0,1,0,0,0,0|1,0,2]=4 5942 B15R0.3222 C#CCCCCCCOC(C)C(=O)OCC 7a_100011217361_100011216346 [0,1,0,0,0,0|1,0,2]=4 5943 B15R0.3222 C#CCCCCCCOC(F)C(=O)OCC 34a_100011217361_100000760018 [0,1,0,0,0,0|1,0,2]=4 5944 B15R0.3222 C#CCCCCCCOC(F)C(=O)OCC 7a_100011217361_100000040065 [0,1,0,0,0,0|1,0,2]=4 5945 B15R0.3222 C#CCCCCCCO[C@@H](C)C(=O)OCC 7a_100000751109_100012276617 [0,1,0,0,0,0|1,0,2]=4 5946 B15R0.3222 C#CCCCCCCSC(C)C(=O)OCC 62a_100011216346_100012276617 [0,1,0,0,0,0|1,0,2]=4 5947 B15R0.3222 C#CCCCCCCSC(C)C(=O)OCC 62a_100012276617_100011216346 [0,1,0,0,0,0|1,0,2]=4 5948 B15R0.3222 C#CCCCCCCSC(F)C(=O)OCC 62a_100000760018_100012276617 [0,1,0,0,0,0|1,0,2]=4 5949 B15R0.3222 C#CCCCCCCSC(F)C(=O)OCC 62a_100012276617_100000760018 [0,1,0,0,0,0|1,0,2]=4 5950 B15R0.3222 C=C(CNCCCCCCO)C(=O)OCC 34a_100000686447_100000755967 [0,1,0,0,0,0|2,0,1]=4 5951 B15R0.3222 C=C(CNCCCCCOC)C(=O)OCC 34a_100000747528_100000755967 [0,1,0,0,0,0|2,0,1]=4 5952 B15R0.3222 C=C(CNCCCOCCC)C(=O)OCC 34a_100011217757_100000755967 [0,1,0,0,0,0|2,0,1]=4 5953 B15R0.3222 C=C(COCCCCCCBr)C(=O)OCC 34a_100011215345_100000755967 [0,1,0,0,0,0|2,0,1]=4 5954 B15R0.3222 C=C(COCCCCCCBr)C(=O)OCC 7a_100011215345_100000755967 [0,1,0,0,0,0|2,0,1]=4 5955 B15R0.3222 C=C(COCCCCCCC)C(=O)OCC 34a_100000210272_100000755967 [0,1,0,0,0,0|1,0,1]=3 5956 B15R0.3222 C=C(COCCCCCCC)C(=O)OCC 7a_100000210272_100000755967 [0,1,0,0,0,0|1,0,1]=3 5957 B15R0.3222 C=C(COCCCCCCCl)C(=O)OCC 34a_100000766143_100000755967 [0,1,0,0,0,0|2,0,1]=4 5958 B15R0.3222 C=C(COCCCCCCCl)C(=O)OCC 7a_100000766143_100000755967 [0,1,0,0,0,0|2,0,1]=4 5959 B15R0.3222 C=C(COCCCCCCF)C(=O)OCC 34a_100000732779_100000755967 [0,1,0,0,0,0|2,0,1]=4 5960 B15R0.3222 C=C(COCCCCCCF)C(=O)OCC 7a_100000732779_100000755967 [0,1,0,0,0,0|2,0,1]=4 5961 B15R0.3222 C=C(COCCCCCCN)C(=O)OCC 34a_100000686447_100000755967 [0,1,0,0,0,0|2,0,1]=4 5962 B15R0.3222 C=C(COCCCCCNC)C(=O)OCC 34a_100000722520_100000755967 [0,1,0,0,0,0|2,0,1]=4 5963 B15R0.3222 C=C(COCCOCCCC)C(=O)OCC 34a_100000210238_100000755967 [0,1,0,0,0,0|2,0,1]=4 5964 B15R0.3222 C=C(COCCOCCCC)C(=O)OCC 7a_100000210238_100000755967 [0,1,0,0,0,0|2,0,1]=4 5965 B15R0.3222 C=C(COCCSCCCC)C(=O)OCC 34a_200000230436_100000755967 [0,1,0,0,0,0|2,0,1]=4 5966 B15R0.3222 C=C(COCCSCCCC)C(=O)OCC 7a_200000230436_100000755967 [0,1,0,0,0,0|2,0,1]=4 5967 B15R0.3222 C=C(CSCCCCCCC)C(=O)OCC 62a_100000210614_100000755967 [0,1,0,0,0,0|1,0,1]=3 5968 B15R0.3222 C=C(CSCCCCCCC)C(=O)OCC 62a_100000755967_100000210316 [0,1,0,0,0,0|1,0,1]=3 5969 B15R0.3222 C=C(CSCCCCCCF)C(=O)OCC 62a_100000755967_100015922095 [0,1,0,0,0,0|2,0,1]=4 5970 B15R0.3222 C=C(CSCCCCCCF)C(=O)OCC 62a_100015922095_100000755967 [0,1,0,0,0,0|2,0,1]=4 5971 B15R0.3222 C=C(CSCCCCCCO)C(=O)OCC 62a_100000755967_100000766143 [0,1,0,0,0,0|2,0,1]=4 5972 B15R0.3222 C=C(CSCCCCCCO)C(=O)OCC 62a_100000766143_100000755967 [0,1,0,0,0,0|2,0,1]=4 5973 B15R0.3222 C=C(CSCCOCCCC)C(=O)OCC 62a_100000743108_100000755967 [0,1,0,0,0,0|2,0,1]=4 5974 B15R0.3222 C=C(CSCCOCCCC)C(=O)OCC 62a_100000755967_100000743108 [0,1,0,0,0,0|2,0,1]=4 5975 B15R0.3222 C=CCCCCCCOC(C)C(=O)OCC 34a_200011216477_100011216346 [0,1,0,0,0,0|1,0,2]=4 5976 B15R0.3222 C=CCCCCCCOC(C)C(=O)OCC 7a_200011216477_100011216346 [0,1,0,0,0,0|1,0,2]=4 5977 B15R0.3222 C=CCCCCCCOC(F)C(=O)OCC 34a_200011216477_100000760018 [0,1,0,0,0,0|1,0,2]=4 5978 B15R0.3222 C=CCCCCCCOC(F)C(=O)OCC 7a_200011216477_100000040065 [0,1,0,0,0,0|1,0,2]=4 5979 B15R0.3222 C=CCCCCCCO[C@@H](C)C(=O)OCC 7a_100000751109_100011215473 [0,1,0,0,0,0|1,0,2]=4 5980 B15R0.3222 C=CCCCCCCSC(C)C(=O)OCC 62a_100011215473_100011216346 [0,1,0,0,0,0|1,0,2]=4 5981 B15R0.3222 C=CCCCCCCSC(C)C(=O)OCC 62a_100011216346_100011215473 [0,1,0,0,0,0|1,0,2]=4 5982 B15R0.3222 C=CCCCCCCSC(F)C(=O)OCC 62a_100000760018_100011215473 [0,1,0,0,0,0|1,0,2]=4 5983 B15R0.3222 C=CCCCCCCSC(F)C(=O)OCC 62a_100011215473_100000760018 [0,1,0,0,0,0|1,0,2]=4 5984 B15R0.3222 CC/C=C\CCCCOC(C)C(=O)OCC 34a_100016287862_100011216346 [0,1,0,0,0,0|1,0,2]=4 5985 B15R0.3222 CC/C=C\CCCCOC(C)C(=O)OCC 7a_100016287862_100011216346 [0,1,0,0,0,0|1,0,2]=4 5986 B15R0.3222 CC/C=C\CCCCOC(F)C(=O)OCC 34a_100016287862_100000760018 [0,1,0,0,0,0|1,0,2]=4 5987 B15R0.3222 CC/C=C\CCCCOC(F)C(=O)OCC 7a_100016287862_100000040065 [0,1,0,0,0,0|1,0,2]=4 5988 B15R0.3222 CC=CC(=O)N(C)CCCCCCCCC 11a_100000232482_100000210699 [0,1,0,0,0,0|2,0,1]=4 5989 B15R0.3222 CC=CC(=O)N(C)CCCCCCCCC 1626a_100000232482_100000210699 [0,1,0,0,0,0|2,0,1]=4 5990 B15R0.3222 CC=CC(=O)N(C)CCCCCCCCC 240690a_100000232482_100000210699 [0,1,0,0,0,0|2,0,1]=4 5991 B15R0.3222 CCCC/C=C\CCOC(C)C(=O)OCC 34a_200016286491_100011216346 [0,1,0,0,0,0|1,0,2]=4 5992 B15R0.3222 CCCC/C=C\CCOC(C)C(=O)OCC 7a_200016286491_100011216346 [0,1,0,0,0,0|1,0,2]=4 5993 B15R0.3222 CCCC/C=C\CCOC(F)C(=O)OCC 34a_200016286491_100000760018 [0,1,0,0,0,0|1,0,2]=4 5994 B15R0.3222 CCCC/C=C\CCOC(F)C(=O)OCC 7a_200016286491_100000040065 [0,1,0,0,0,0|1,0,2]=4 5995 B15R0.3222 CCCCC#CCCOC(C)C(=O)OCC 34a_100000037610_100011216346 [0,1,0,0,0,0|1,0,2]=4 5996 B15R0.3222 CCCCC#CCCOC(C)C(=O)OCC 7a_100000037610_100011216346 [0,1,0,0,0,0|1,0,2]=4 5997 B15R0.3222 CCCCC#CCCOC(F)C(=O)OCC 34a_100000037610_100000760018 [0,1,0,0,0,0|1,0,2]=4 5998 B15R0.3222 CCCCC#CCCOC(F)C(=O)OCC 7a_100000037610_100000040065 [0,1,0,0,0,0|1,0,2]=4 5999 B15R0.3222 CCCCC/C=C/COC(C)C(=O)OCC 34a_100016258190_100011216346 [0,1,0,0,0,0|1,0,2]=4 6000 B15R0.3222 CCCCC/C=C/COC(C)C(=O)OCC 7a_100016258190_100011216346 [0,1,0,0,0,0|1,0,2]=4 6001 B15R0.3222 CCCCC/C=C/COC(F)C(=O)OCC 34a_100016258190_100000760018 [0,1,0,0,0,0|1,0,2]=4 6002 B15R0.3222 CCCCC/C=C/COC(F)C(=O)OCC 7a_100016258190_100000040065 [0,1,0,0,0,0|1,0,2]=4 6003 B15R0.3222 CCCCCC#CCOC(C)C(=O)OCC 34a_200000033628_100011216346 [0,1,0,0,0,0|1,0,2]=4 6004 B15R0.3222 CCCCCC#CCOC(C)C(=O)OCC 7a_200000033628_100011216346 [0,1,0,0,0,0|1,0,2]=4 6005 B15R0.3222 CCCCCC#CCOC(F)C(=O)OCC 34a_200000033628_100000760018 [0,1,0,0,0,0|1,0,2]=4 6006 B15R0.3222 CCCCCC#CCOC(F)C(=O)OCC 7a_200000033628_100000040065 [0,1,0,0,0,0|1,0,2]=4 6007 B15R0.3222 CCCCCC#CCO[C@@H](C)C(=O)OCC 7a_100000751109_100009816472 [0,1,0,0,0,0|1,0,2]=4 6008 B15R0.3222 CCCCCC#CCSC(C)C(=O)OCC 62a_100009816472_100011216346 [0,1,0,0,0,0|1,0,2]=4 6009 B15R0.3222 CCCCCC#CCSC(C)C(=O)OCC 62a_100011216346_100009816472 [0,1,0,0,0,0|1,0,2]=4 6010 B15R0.3222 CCCCCC#CCSC(F)C(=O)OCC 62a_100000760018_100009816472 [0,1,0,0,0,0|1,0,2]=4 6011 B15R0.3222 CCCCCC#CCSC(F)C(=O)OCC 62a_100009816472_100000760018 [0,1,0,0,0,0|1,0,2]=4 6012 B15R0.3222 CCCCCCCCCC(=O)C(=O)NCC 1458a_200011297158_100000210670 [0,1,0,0,0,0|1,0,1]=3 6013 B15R0.3222 CCCCCCCCCC(=O)C(C)OCC 1458a_100000739345_100000210670 [0,1,0,0,0,0|1,0,2]=4 6014 B15R0.3222 CCCCCCCCCC(C)N(C)CCC 270004a_100000747261_100011215753 [0,1,0,0,0,0|3,0,0]=4 6015 B15R0.3222 CCCCCCCCCN(C)C(=O)CCC 11a_100000232482_100000211992 [0,1,0,0,0,0|2,0,0]=3 6016 B15R0.3222 CCCCCCCCCN(C)C(=O)CCC 1626a_100000232482_100000211992 [0,1,0,0,0,0|2,0,0]=3 6017 B15R0.3222 CCCCCCCCCN(C)C(=O)CCC 240690a_100000232482_100000211992 [0,1,0,0,0,0|2,0,0]=3 6018 B15R0.3222 CCCCCCCCCN(C)C(=O)CCC 527a_100000232482_100000211992 [0,1,0,0,0,0|2,0,0]=3 6019 B15R0.3222 CCCCCCCCCN(C)C(=O)CCO 240690a_100000232482_100011216618 [0,1,0,0,0,0|3,0,0]=4 6020 B15R0.3222 CCCCCCCCCN(C)C(=O)COC 11a_100000232482_100000210968 [0,1,0,0,0,0|3,0,0]=4 6021 B15R0.3222 CCCCCCCCCN(C)C(=O)COC 1626a_100000232482_100000210968 [0,1,0,0,0,0|3,0,0]=4 6022 B15R0.3222 CCCCCCCCCN(C)C(=O)COC 240690a_100000232482_100000210968 [0,1,0,0,0,0|3,0,0]=4 6023 B15R0.3222 CCCCCCCCCN(C)C(=O)COC 527a_100000232482_100000210968 [0,1,0,0,0,0|3,0,0]=4 6024 B15R0.3222 CCCCCCCCCN(C)C(=O)CSC 11a_100000232482_100000184570 [0,1,0,0,0,0|3,0,0]=4 6025 B15R0.3222 CCCCCCCCCN(C)C(=O)CSC 1626a_100000232482_100000184570 [0,1,0,0,0,0|3,0,0]=4 6026 B15R0.3222 CCCCCCCCCN(C)C(=O)CSC 240690a_100000232482_100000184570 [0,1,0,0,0,0|3,0,0]=4 6027 B15R0.3222 CCCCCCCCCN(C)C(=O)CSC 527a_100000232482_100000184570 [0,1,0,0,0,0|3,0,0]=4 6028 B15R0.3222 CCCCCCCCCN(C)C(=O)NCC 2708a_100015525214_100000232482 [0,1,0,0,0,0|2,0,0]=3 6029 B15R0.3222 CCCCCCCCCN(C)C(=O)NCC 273464a_100015525214_100000232482 [0,1,0,0,0,0|2,0,0]=3 6030 B15R0.3222 CCCCCCCCNC(=O)C(=O)NCC 1626a_100000229939_200011297158 [0,1,0,0,0,0|2,0,1]=4 6031 B15R0.3222 CCCCCCCCNC(=O)C(=O)NCC 240690a_100000229939_200011297158 [0,1,0,0,0,0|2,0,1]=4 6032 B15R0.3222 CCCCCCCCNC(=O)C(=O)NCC 527a_100000229939_200011297158 [0,1,0,0,0,0|2,0,1]=4 6033 B15R0.3222 CCCCCCCCNC(=O)C(=O)OCC 11a_100000229939_100014798877 [0,1,0,0,0,0|1,0,1]=3 6034 B15R0.3222 CCCCCCCCNC(=O)C(=O)OCC 1626a_100000229939_100014798877 [0,1,0,0,0,0|1,0,1]=3 6035 B15R0.3222 CCCCCCCCNC(=O)C(=O)OCC 240690a_100000229939_100014798877 [0,1,0,0,0,0|1,0,1]=3 6036 B15R0.3222 CCCCCCCCNC(C)C(=O)NCC 2230a_100000229939_100000230173 [0,1,0,0,0,0|2,0,0]=3 6037 B15R0.3222 CCCCCCCCNC(C)C(=O)NCC 2230a_100000736553_100000210759 [0,1,0,0,0,0|2,0,0]=3 6038 B15R0.3222 CCCCCCCCNC(C)C(=O)NCC 34a_100000229939_100000230173 [0,1,0,0,0,0|2,0,0]=3 6039 B15R0.3222 CCCCCCCCNC(C)C(=O)NCC 34a_100000736553_100000210759 [0,1,0,0,0,0|2,0,0]=3 6040 B15R0.3222 CCCCCCCCNC(C)C(=O)OCC 2230a_100000229939_100011215307 [0,1,0,0,0,0|1,0,0]=2 6041 B15R0.3222 CCCCCCCCNC(C)C(=O)OCC 34a_100000229939_100011216346 [0,1,0,0,0,0|1,0,0]=2 6042 B15R0.3222 CCCCCCCCNC(F)C(=O)OCC 2230a_100000229939_100000760018 [0,1,0,0,0,0|1,0,0]=2 6043 B15R0.3222 CCCCCCCCNC(F)C(=O)OCC 34a_100000229939_100000760018 [0,1,0,0,0,0|1,0,0]=2 6044 B15R0.3222 CCCCCCCCN[C@@H](C)C(=O)SCC 2230a_100103168634_100000210759 [0,1,0,0,0,0|1,1,0]=3 6045 B15R0.3222 CCCCCCCCOC(C)C(=O)NCC 34a_100000210232_100000230173 [0,1,0,0,0,0|2,0,0]=3 6046 B15R0.3222 CCCCCCCCOC(C)C(=O)NCC 7a_100000210232_100000230173 [0,1,0,0,0,0|2,0,0]=3 6047 B15R0.3222 CCCCCCCCOC(C)C(=O)OCC 34a_100000210232_100011216346 [0,1,0,0,0,0|1,0,0]=2 6048 B15R0.3222 CCCCCCCCOC(C)C(=O)OCC 7a_100000210232_100011216346 [0,1,0,0,0,0|1,0,0]=2 6049 B15R0.3222 CCCCCCCCOC(F)C(=O)OCC 34a_100000210232_100000760018 [0,1,0,0,0,0|1,0,0]=2 6050 B15R0.3222 CCCCCCCCOC(F)C(=O)OCC 7a_100000210232_100000040065 [0,1,0,0,0,0|1,0,0]=2 6051 B15R0.3222 CCCCCCCCO[C@@H](C)C(=O)OCC 7a_100000751109_100000210759 [0,1,0,0,0,0|1,0,0]=2 6052 B15R0.3222 CCCCCCCCSC(C)C(=O)NCC 62a_100000210759_100000230173 [0,1,0,0,0,0|2,0,0]=3 6053 B15R0.3222 CCCCCCCCSC(C)C(=O)NCC 62a_100000230173_100000210317 [0,1,0,0,0,0|2,0,0]=3 6054 B15R0.3222 CCCCCCCCSC(C)C(=O)OCC 62a_100000210759_100011216346 [0,1,0,0,0,0|1,0,0]=2 6055 B15R0.3222 CCCCCCCCSC(C)C(=O)OCC 62a_100011216346_100000210317 [0,1,0,0,0,0|1,0,0]=2 6056 B15R0.3222 CCCCCCCCSC(F)C(=O)OCC 62a_100000210759_100000760018 [0,1,0,0,0,0|1,0,0]=2 6057 B15R0.3222 CCCCCCCCSC(F)C(=O)OCC 62a_100000760018_100000210317 [0,1,0,0,0,0|1,0,0]=2 6058 B15R0.3222 CCCCCCCSCC(=O)C(=O)OCC 62a_100000210614_100000211299 [0,1,0,0,0,0|1,0,1]=3 6059 B15R0.3222 CCCCCCCSCC(=O)C(=O)OCC 62a_100000211299_100000210316 [0,1,0,0,0,0|1,0,1]=3 6060 B15R0.3222 CCCCCNCCOC(C)C(=O)NCC 34a_100000224656_100000230173 [0,1,0,0,0,0|3,0,0]=4 6061 B15R0.3222 CCCCCNCCOC(C)C(=O)OCC 34a_100000224656_100011216346 [0,1,0,0,0,0|2,0,0]=3 6062 B15R0.3222 CCCCCNCCOC(F)C(=O)OCC 34a_100000224656_100000760018 [0,1,0,0,0,0|2,0,0]=3 6063 B15R0.3222 CCCCCOCCOC(C)C(=O)NCC 34a_100011215259_100000230173 [0,1,0,0,0,0|3,0,0]=4 6064 B15R0.3222 CCCCCOCCOC(C)C(=O)NCC 7a_100011215259_100000230173 [0,1,0,0,0,0|3,0,0]=4 6065 B15R0.3222 CCCCCOCCOC(C)C(=O)OCC 34a_100011215259_100011216346 [0,1,0,0,0,0|2,0,0]=3 6066 B15R0.3222 CCCCCOCCOC(C)C(=O)OCC 7a_100011215259_100011216346 [0,1,0,0,0,0|2,0,0]=3 6067 B15R0.3222 CCCCCOCCOC(F)C(=O)OCC 34a_100011215259_100000760018 [0,1,0,0,0,0|2,0,0]=3 6068 B15R0.3222 CCCCCOCCOC(F)C(=O)OCC 7a_100011215259_100000040065 [0,1,0,0,0,0|2,0,0]=3 6069 B15R0.3222 CCCCOCCCNC(=O)C(=O)OCC 1626a_200000211371_100014798877 [0,1,0,0,0,0|2,0,1]=4 6070 B15R0.3222 CCCCOCCCNC(=O)C(=O)OCC 240690a_200000211371_100014798877 [0,1,0,0,0,0|2,0,1]=4 6071 B15R0.3222 CCCCOCCCNC(C)C(=O)NCC 2230a_200000211371_100000230173 [0,1,0,0,0,0|3,0,0]=4 6072 B15R0.3222 CCCCOCCCNC(C)C(=O)NCC 34a_200000211371_100000230173 [0,1,0,0,0,0|3,0,0]=4 6073 B15R0.3222 CCCCOCCCNC(C)C(=O)OCC 2230a_200000211371_100011215307 [0,1,0,0,0,0|2,0,0]=3 6074 B15R0.3222 CCCCOCCCNC(C)C(=O)OCC 34a_200000211371_100011216346 [0,1,0,0,0,0|2,0,0]=3 6075 B15R0.3222 CCCCOCCCNC(F)C(=O)OCC 2230a_200000211371_100000760018 [0,1,0,0,0,0|2,0,0]=3 6076 B15R0.3222 CCCCOCCCNC(F)C(=O)OCC 34a_200000211371_100000760018 [0,1,0,0,0,0|2,0,0]=3 6077 B15R0.3222 CCCCOCCCOC(C)C(=O)NCC 34a_200011215613_100000230173 [0,1,0,0,0,0|3,0,0]=4 6078 B15R0.3222 CCCCOCCCOC(C)C(=O)NCC 7a_200011215613_100000230173 [0,1,0,0,0,0|3,0,0]=4 6079 B15R0.3222 CCCCOCCCOC(C)C(=O)OCC 34a_200011215613_100011216346 [0,1,0,0,0,0|2,0,0]=3 6080 B15R0.3222 CCCCOCCCOC(C)C(=O)OCC 7a_200011215613_100011216346 [0,1,0,0,0,0|2,0,0]=3 6081 B15R0.3222 CCCCOCCCOC(F)C(=O)OCC 34a_200011215613_100000760018 [0,1,0,0,0,0|2,0,0]=3 6082 B15R0.3222 CCCCOCCCOC(F)C(=O)OCC 7a_200011215613_100000040065 [0,1,0,0,0,0|2,0,0]=3 6083 B15R0.3222 CCCCOCCSCC(=O)C(=O)OCC 62a_100000211299_100000743108 [0,1,0,0,0,0|2,0,1]=4 6084 B15R0.3222 CCCCOCCSCC(=O)C(=O)OCC 62a_100000743108_100000211299 [0,1,0,0,0,0|2,0,1]=4 6085 B15R0.3222 CCCSCCCCCC(=O)C(=O)OCC 62a_100000210303_100000068741 [0,1,0,0,0,0|1,0,1]=3 6086 B15R0.3222 CCNC(=O)C(=O)CCCCCCCCO 1458a_200011297158_100000033203 [0,1,0,0,0,0|2,0,1]=4 6087 B15R0.3222 CCNC(=O)C(C)NCCCCCCCO 2230a_100000736553_100000760002 [0,1,0,0,0,0|3,0,0]=4 6088 B15R0.3222 CCNC(=O)C(C)NCCCCCCCO 2230a_100011996573_100000230173 [0,1,0,0,0,0|3,0,0]=4 6089 B15R0.3222 CCNC(=O)C(C)NCCCCCCCO 34a_100000736553_100000760002 [0,1,0,0,0,0|3,0,0]=4 6090 B15R0.3222 CCNC(=O)C(C)NCCCCCCCO 34a_100011996573_100000230173 [0,1,0,0,0,0|3,0,0]=4 6091 B15R0.3222 CCNC(=O)C(C)NCCCCCCOC 2230a_100000736553_100011998445 [0,1,0,0,0,0|3,0,0]=4 6092 B15R0.3222 CCNC(=O)C(C)NCCCCCCOC 34a_100000736553_100011998445 [0,1,0,0,0,0|3,0,0]=4 6093 B15R0.3222 CCNC(=O)C(C)OCCCCCCCBr 34a_100000760002_100000230173 [0,1,0,0,0,0|3,0,0]=4 6094 B15R0.3222 CCNC(=O)C(C)OCCCCCCCBr 7a_100000760002_100000230173 [0,1,0,0,0,0|3,0,0]=4 6095 B15R0.3222 CCNC(=O)C(C)OCCCCCCCN 34a_100011996573_100000230173 [0,1,0,0,0,0|3,0,0]=4 6096 B15R0.3222 CCNC(=O)C(C)OCCCCCCOC 34a_200012092642_100000230173 [0,1,0,0,0,0|3,0,0]=4 6097 B15R0.3222 CCNC(=O)C(C)OCCCCCCOC 7a_200012092642_100000230173 [0,1,0,0,0,0|3,0,0]=4 6098 B15R0.3222 CCNC(=O)C(C)SCCCCCCCO 62a_100000230173_100000760002 [0,1,0,0,0,0|3,0,0]=4 6099 B15R0.3222 CCNC(=O)C(C)SCCCCCCCO 62a_100000760002_100000230173 [0,1,0,0,0,0|3,0,0]=4 6100 B15R0.3222 CCNC(=O)C(C)SCCCCCCOC 62a_100000230173_100011998445 [0,1,0,0,0,0|3,0,0]=4 6101 B15R0.3222 CCNC(=O)C(C)SCCCCCCOC 62a_100011998445_100000230173 [0,1,0,0,0,0|3,0,0]=4 6102 B15R0.3222 CCOC(=O)C(=O)CCCCCNCCO 2230a_100016997473_100000068741 [0,1,0,0,0,0|2,0,1]=4 6103 B15R0.3222 CCOC(=O)C(=O)CCCCCSCCF 62a_100011217306_100000068741 [0,1,0,0,0,0|2,0,1]=4 6104 B15R0.3222 CCOC(=O)C(=O)CCCCCSCCO 62a_100000211926_100000068741 [0,1,0,0,0,0|2,0,1]=4 6105 B15R0.3222 CCOC(=O)C(=O)CCCCCSCOC 62a_100000766300_100000068741 [0,1,0,0,0,0|2,0,1]=4 6106 B15R0.3222 CCOC(=O)C(=O)CCCCCSCSC 62a_100011218213_100000068741 [0,1,0,0,0,0|2,0,1]=4 6107 B15R0.3222 CCOC(=O)C(=O)CSCCCCCCF 62a_100000211299_100015922095 [0,1,0,0,0,0|2,0,1]=4 6108 B15R0.3222 CCOC(=O)C(=O)CSCCCCCCF 62a_100015922095_100000211299 [0,1,0,0,0,0|2,0,1]=4 6109 B15R0.3222 CCOC(=O)C(=O)CSCCCCCCO 62a_100000211299_100000766143 [0,1,0,0,0,0|2,0,1]=4 6110 B15R0.3222 CCOC(=O)C(=O)CSCCCCCCO 62a_100000766143_100000211299 [0,1,0,0,0,0|2,0,1]=4 6111 B15R0.3222 CCOC(=O)C(=O)NCCCCCCCO 240690a_100011996573_100014798877 [0,1,0,0,0,0|2,0,1]=4 6112 B15R0.3222 CCOC(=O)C(C)NCCCCCCCO 2230a_100011996573_100011215307 [0,1,0,0,0,0|2,0,0]=3 6113 B15R0.3222 CCOC(=O)C(C)NCCCCCCCO 34a_100011996573_100011216346 [0,1,0,0,0,0|2,0,0]=3 6114 B15R0.3222 CCOC(=O)C(C)NCCCOCCCO 2230a_100011310245_100011215307 [0,1,0,0,0,0|3,0,0]=4 6115 B15R0.3222 CCOC(=O)C(C)NCCCOCCCO 34a_100011310245_100011216346 [0,1,0,0,0,0|3,0,0]=4 6116 B15R0.3222 CCOC(=O)C(C)NCCCOCCOC 2230a_100000206027_100011215307 [0,1,0,0,0,0|3,0,0]=4 6117 B15R0.3222 CCOC(=O)C(C)NCCCOCCOC 34a_100000206027_100011216346 [0,1,0,0,0,0|3,0,0]=4 6118 B15R0.3222 CCOC(=O)C(C)OCCCCCCCBr 34a_100000760002_100011216346 [0,1,0,0,0,0|2,0,0]=3 6119 B15R0.3222 CCOC(=O)C(C)OCCCCCCCBr 7a_100000760002_100011216346 [0,1,0,0,0,0|2,0,0]=3 6120 B15R0.3222 CCOC(=O)C(C)OCCCCCCCN 34a_100011996573_100011216346 [0,1,0,0,0,0|2,0,0]=3 6121 B15R0.3222 CCOC(=O)C(C)OCCCCCCOC 34a_200012092642_100011216346 [0,1,0,0,0,0|2,0,0]=3 6122 B15R0.3222 CCOC(=O)C(C)OCCCCCCOC 7a_200012092642_100011216346 [0,1,0,0,0,0|2,0,0]=3 6123 B15R0.3222 CCOC(=O)C(C)OCCCOCCCN 34a_100011310245_100011216346 [0,1,0,0,0,0|3,0,0]=4 6124 B15R0.3222 CCOC(=O)C(C)SCCCCCCC#N 62a_100009813337_100011216346 [0,1,0,0,0,0|2,0,1]=4 6125 B15R0.3222 CCOC(=O)C(C)SCCCCCCC#N 62a_100011216346_100009813337 [0,1,0,0,0,0|2,0,1]=4 6126 B15R0.3222 CCOC(=O)C(C)SCCCCCCCO 62a_100000760002_100011216346 [0,1,0,0,0,0|2,0,0]=3 6127 B15R0.3222 CCOC(=O)C(C)SCCCCCCCO 62a_100011216346_100000760002 [0,1,0,0,0,0|2,0,0]=3 6128 B15R0.3222 CCOC(=O)C(C)SCCCCCCOC 62a_100011216346_100011998445 [0,1,0,0,0,0|2,0,0]=3 6129 B15R0.3222 CCOC(=O)C(C)SCCCCCCOC 62a_100011998445_100011216346 [0,1,0,0,0,0|2,0,0]=3 6130 B15R0.3222 CCOC(=O)C(C)SCCCOCCOC 62a_100011216346_100011216529 [0,1,0,0,0,0|3,0,0]=4 6131 B15R0.3222 CCOC(=O)C(C)SCCCOCCOC 62a_100011216529_100011216346 [0,1,0,0,0,0|3,0,0]=4 6132 B15R0.3222 CCOC(=O)C(F)NCCCCCCCO 2230a_100011996573_100000760018 [0,1,0,0,0,0|2,0,0]=3 6133 B15R0.3222 CCOC(=O)C(F)NCCCCCCCO 34a_100011996573_100000760018 [0,1,0,0,0,0|2,0,0]=3 6134 B15R0.3222 CCOC(=O)C(F)NCCCOCCCO 2230a_100011310245_100000760018 [0,1,0,0,0,0|3,0,0]=4 6135 B15R0.3222 CCOC(=O)C(F)NCCCOCCCO 34a_100011310245_100000760018 [0,1,0,0,0,0|3,0,0]=4 6136 B15R0.3222 CCOC(=O)C(F)NCCCOCCOC 2230a_100000206027_100000760018 [0,1,0,0,0,0|3,0,0]=4 6137 B15R0.3222 CCOC(=O)C(F)NCCCOCCOC 34a_100000206027_100000760018 [0,1,0,0,0,0|3,0,0]=4 6138 B15R0.3222 CCOC(=O)C(F)OCCCCCCCBr 34a_100000760002_100000760018 [0,1,0,0,0,0|2,0,0]=3 6139 B15R0.3222 CCOC(=O)C(F)OCCCCCCCBr 7a_100000760002_100000040065 [0,1,0,0,0,0|2,0,0]=3 6140 B15R0.3222 CCOC(=O)C(F)OCCCCCCCN 34a_100011996573_100000760018 [0,1,0,0,0,0|2,0,0]=3 6141 B15R0.3222 CCOC(=O)C(F)OCCCCCCOC 34a_200012092642_100000760018 [0,1,0,0,0,0|2,0,0]=3 6142 B15R0.3222 CCOC(=O)C(F)OCCCCCCOC 7a_200012092642_100000040065 [0,1,0,0,0,0|2,0,0]=3 6143 B15R0.3222 CCOC(=O)C(F)OCCCOCCCN 34a_100011310245_100000760018 [0,1,0,0,0,0|3,0,0]=4 6144 B15R0.3222 CCOC(=O)C(F)SCCCCCCC#N 62a_100000760018_100009813337 [0,1,0,0,0,0|2,0,1]=4 6145 B15R0.3222 CCOC(=O)C(F)SCCCCCCC#N 62a_100009813337_100000760018 [0,1,0,0,0,0|2,0,1]=4 6146 B15R0.3222 CCOC(=O)C(F)SCCCCCCCO 62a_100000760002_100000760018 [0,1,0,0,0,0|2,0,0]=3 6147 B15R0.3222 CCOC(=O)C(F)SCCCCCCCO 62a_100000760018_100000760002 [0,1,0,0,0,0|2,0,0]=3 6148 B15R0.3222 CCOC(=O)C(F)SCCCCCCOC 62a_100000760018_100011998445 [0,1,0,0,0,0|2,0,0]=3 6149 B15R0.3222 CCOC(=O)C(F)SCCCCCCOC 62a_100011998445_100000760018 [0,1,0,0,0,0|2,0,0]=3 6150 B15R0.3222 CCOC(=O)C(F)SCCCOCCOC 62a_100000760018_100011216529 [0,1,0,0,0,0|3,0,0]=4 6151 B15R0.3222 CCOC(=O)C(F)SCCCOCCOC 62a_100011216529_100000760018 [0,1,0,0,0,0|3,0,0]=4 6152 B15R0.3222 CCOC(=O)[C@H](C)OCCCCCCC#N 7a_100000751109_100009813337 [0,1,0,0,0,0|2,0,1]=4 6153 B15R0.3222 CCOC(=O)[C@H](C)OCCCCCCCO 7a_100000751109_100000760002 [0,1,0,0,0,0|2,0,0]=3 6154 B15R0.3222 CCOC(=O)[C@H](C)OCCCCCCOC 7a_100000751109_100011998445 [0,1,0,0,0,0|2,0,0]=3 6155 B15R0.3222 CCOC(=O)[C@H](C)OCCCOCCOC 7a_100000751109_100011216529 [0,1,0,0,0,0|3,0,0]=4 6156 B15R0.3222 CCOCCOCCNC(C)C(=O)OCC 2230a_100102712874_100011215307 [0,1,0,0,0,0|3,0,0]=4 6157 B15R0.3222 CCOCCOCCNC(C)C(=O)OCC 34a_100102712874_100011216346 [0,1,0,0,0,0|3,0,0]=4 6158 B15R0.3222 CCOCCOCCNC(F)C(=O)OCC 2230a_100102712874_100000760018 [0,1,0,0,0,0|3,0,0]=4 6159 B15R0.3222 CCOCCOCCNC(F)C(=O)OCC 34a_100102712874_100000760018 [0,1,0,0,0,0|3,0,0]=4 6160 B15R0.3222 CCOCCOCCOC(C)C(=O)OCC 34a_100000210240_100011216346 [0,1,0,0,0,0|3,0,0]=4 6161 B15R0.3222 CCOCCOCCOC(C)C(=O)OCC 7a_100000210240_100011216346 [0,1,0,0,0,0|3,0,0]=4 6162 B15R0.3222 CCOCCOCCOC(F)C(=O)OCC 34a_100000210240_100000760018 [0,1,0,0,0,0|3,0,0]=4 6163 B15R0.3222 CCOCCOCCOC(F)C(=O)OCC 7a_100000210240_100000040065 [0,1,0,0,0,0|3,0,0]=4 6164 B15R0.3222 CCOCCOCCO[C@@H](C)C(=O)OCC 7a_100000751109_100011211534 [0,1,0,0,0,0|3,0,0]=4 6165 B15R0.3222 CCOCCOCCSC(C)C(=O)OCC 62a_100011211534_100011216346 [0,1,0,0,0,0|3,0,0]=4 6166 B15R0.3222 CCOCCOCCSC(C)C(=O)OCC 62a_100011216346_100011211534 [0,1,0,0,0,0|3,0,0]=4 6167 B15R0.3222 CCOCCOCCSC(F)C(=O)OCC 62a_100000760018_100011211534 [0,1,0,0,0,0|3,0,0]=4 6168 B15R0.3222 CCOCCOCCSC(F)C(=O)OCC 62a_100011211534_100000760018 [0,1,0,0,0,0|3,0,0]=4 6169 B15R0.3222 CCSC(=O)[C@H](C)NCCCCCCCO 2230a_100103168634_100000760002 [0,1,0,0,0,0|2,1,0]=4 6170 B15R0.3222 CCSC(=O)[C@H](C)NCCCCCCOC 2230a_100103168634_100011998445 [0,1,0,0,0,0|2,1,0]=4 6171 B15R0.3228 CCCCCCCCCCN(CC)CCC 2230a_100000226822_100000210320 [0,1,0,0,0,0|3,0,0]=4 6172 B15R0.3228 CCCCCCCCCCN(CC)CCC 269982a_100000226822_100000210320 [0,1,0,0,0,0|3,0,0]=4 6173 B15R0.3228 CCCCCCCCNCC(CC)OCC 2230a_100015183923_100000210759 [0,1,0,0,0,0|2,0,1]=4 6174 B15R0.3228 CCCCCCCCNCC(CC)OCC 34a_100015183923_100000210759 [0,1,0,0,0,0|2,0,1]=4 6175 B15R1.106 C#CCCCCCCN1CCOC(=O)C1 2230a_100000131268_100012276617 [0,0,0,1,0,0|1,0,2]=4 6176 B15R1.106 C=CCCCCCCN1CCOC(=O)C1 2230a_100000131268_100011215473 [0,0,0,1,0,0|1,0,2]=4 6177 B15R1.106 CCCCCC#CCN1CCOC(=O)C1 2230a_100000131268_100009816472 [0,0,0,1,0,0|1,0,2]=4 6178 B15R1.106 CCCCCCCCN1CCC=C(C1)C 2230a_100000725631_100000210759 [0,0,0,1,0,0|3,0,0]=4 6179 B15R1.106 CCCCCCCCN1CCC=C(C1)C 269982a_100000725631_100000210759 [0,0,0,1,0,0|3,0,0]=4 6180 B15R1.106 CCCCCCCCN1CCC=C(C1)C 34a_100000725631_100000210759 [0,0,0,1,0,0|3,0,0]=4 6181 B15R1.106 CCCCCCCCN1CCNC(=O)C1 2230a_100000184651_100000210759 [0,0,0,1,0,0|2,0,0]=3 6182 B15R1.106 CCCCCCCCN1CCOC(=O)C1 2230a_100000131268_100000210759 [0,0,0,1,0,0|1,0,0]=2 6183 B15R1.106 CCCCCCCCN1CCOC(C1)C 2230a_100000729577_100000210759 [0,0,0,1,0,0|2,0,1]=4 6184 B15R1.106 CCCCCCCCN1CCOC(C1)C 269982a_100000729577_100000210759 [0,0,0,1,0,0|2,0,1]=4 6185 B15R1.106 CCCCCCCCN1CCOC(C1)C 34a_100000729577_100000210759 [0,0,0,1,0,0|2,0,1]=4 6186 B15R1.106 CCCCCCCCN1CCOC(C1)O 2230a_100000688207_100000210759 [0,0,0,1,0,0|1,0,2]=4 6187 B15R1.106 CCCCCCCCN1CCOC(C1)O 269982a_100000688207_100000210759 [0,0,0,1,0,0|1,0,2]=4 6188 B15R1.106 CCCCCCCNC1CCNC(=O)C1 2230a_100016994916_100000210681 [0,0,0,1,0,0|2,0,0]=3 6189 B15R1.106 CCCCCCCNC1CCNC(=O)C1 34a_100016994916_100000210614 [0,0,0,1,0,0|2,0,0]=3 6190 B15R1.106 CCCCCCCNC1CCOC(C1)C 270004a_100000229938_100000755752 [0,0,0,1,0,0|2,0,1]=4 6191 B15R1.106 CCCCCCCOC1CCCC(=O)C1 34a_100012613340_100000210614 [0,0,0,1,0,0|2,0,0]=3 6192 B15R1.106 CCCCCCCOC1CCOC(C1)C 34a_100011986385_100000210614 [0,0,0,1,0,0|2,0,1]=4 6193 B15R1.106 CCCCCCCOC1CCOC(C1)C 7a_100011986385_100000210614 [0,0,0,1,0,0|2,0,1]=4 6194 B15R1.106 CCCCCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000210614 [0,0,0,1,0,0|2,0,0]=3 6195 B15R1.106 CCCCCCOCC1CCCC(=O)N1 34a_200000102386_100000210314 [0,0,0,1,0,0|3,0,0]=4 6196 B15R1.106 CCCCCCOCC1CCNC(=O)C1 34a_100009886756_100000210314 [0,0,0,1,0,0|2,0,0]=3 6197 B15R1.106 CCCCNCCCN1CCNC(=O)C1 2230a_100000757908_100000210211 [0,0,0,1,0,0|3,0,0]=4 6198 B15R1.106 CCCCOCCNC1CCNC(=O)C1 2230a_100016994916_100000743108 [0,0,0,1,0,0|3,0,0]=4 6199 B15R1.106 CCCCOCCNC1CCNC(=O)C1 34a_100016994916_100000743108 [0,0,0,1,0,0|3,0,0]=4 6200 B15R1.106 CCCCOCCOC1CCCC(=O)C1 34a_100012613340_100000743108 [0,0,0,1,0,0|3,0,0]=4 6201 B15R1.106 CCCCOCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000743108 [0,0,0,1,0,0|3,0,0]=4 6202 B15R1.106 CCCCOCOCC1CCNC(=O)C1 34a_100009886756_100011995733 [0,0,0,1,0,0|3,0,0]=4 6203 B15R1.106 CCCOCCOCC1CCNC(=O)C1 34a_100009886756_100011215938 [0,0,0,1,0,0|3,0,0]=4 6204 B15R1.106 CCOCCCOCC1CCNC(=O)C1 34a_100009886756_100012232248 [0,0,0,1,0,0|3,0,0]=4 6205 B15R1.106 CCOCCOCCN1CCOC(=O)C1 2230a_100000131268_100011211534 [0,0,0,1,0,0|3,0,0]=4 6206 B15R1.106 COCCCCCCN1CCNC(=O)C1 2230a_100000184651_100011998445 [0,0,0,1,0,0|3,0,0]=4 6207 B15R1.106 COCCCCCCN1CCOC(=O)C1 2230a_100000131268_100011998445 [0,0,0,1,0,0|2,0,0]=3 6208 B15R1.106 COCCCCOCC1CCNC(=O)C1 34a_100009886756_100000755781 [0,0,0,1,0,0|3,0,0]=4 6209 B15R1.106 COCCOCCCN1CCOC(=O)C1 2230a_100000131268_100011216529 [0,0,0,1,0,0|3,0,0]=4 6210 B15R1.106 N#CCCCCCCN1CCOC(=O)C1 2230a_100000131268_100009813337 [0,0,0,1,0,0|2,0,1]=4 6211 B15R1.106 O=C1CC(CCN1)COCCCCCF 34a_100009886756_100000729378 [0,0,0,1,0,0|3,0,0]=4 6212 B15R1.106 O=C1CC(CCN1)COCCCCCO 34a_100009886756_100000746330 [0,0,0,1,0,0|3,0,0]=4 6213 B15R1.106 O=C1CC(CCN1)NCCCCCCF 2230a_100016994916_100015922095 [0,0,0,1,0,0|3,0,0]=4 6214 B15R1.106 O=C1CC(CCN1)NCCCCCCF 34a_100016994916_100015922095 [0,0,0,1,0,0|3,0,0]=4 6215 B15R1.106 O=C1CC(CCN1)NCCCCCCO 2230a_100016994916_100000766143 [0,0,0,1,0,0|3,0,0]=4 6216 B15R1.106 O=C1CC(CCN1)NCCCCCCO 34a_100016994916_100000766143 [0,0,0,1,0,0|3,0,0]=4 6217 B15R1.106 O=C1CCCC(C1)OCCCCCCF 34a_100012613340_100015922095 [0,0,0,1,0,0|3,0,0]=4 6218 B15R1.106 O=C1CCCC(C1)OCCCCCCO 34a_100012613340_100000766143 [0,0,0,1,0,0|3,0,0]=4 6219 B15R1.106 O=C1CN(CCN1)CCCCCCCO 2230a_100000184651_100000760002 [0,0,0,1,0,0|3,0,0]=4 6220 B15R1.106 O=C1CN(CCO1)CCCCCCCO 2230a_100000131268_100000760002 [0,0,0,1,0,0|2,0,0]=3 6221 B15R1.106 O=C1C[C@@H](CCN1)OCCCCCCF 34a_100015189427_100015922095 [0,0,0,1,0,0|3,0,0]=4 6222 B15R1.106 O=C1C[C@@H](CCN1)OCCCCCCO 34a_100015189427_100000766143 [0,0,0,1,0,0|3,0,0]=4 6223 B15R1.236 CCCCCCN1CCCC(C1)OCC 2230a_100000745229_100000210314 [0,0,0,1,0,0|2,0,1]=4 6224 B15R1.236 CCCCCCN1CCCC(C1)OCC 269982a_100000745229_100000210757 [0,0,0,1,0,0|2,0,1]=4 6225 B15R1.236 CCCCCCN1CCCC(C1)OCC 34a_100000745229_100000210314 [0,0,0,1,0,0|2,0,1]=4 6226 B15R1.528 CCCCCCCCCCN1CCCC1 2230a_100000188435_100000210320 [0,0,0,1,0,0|3,0,0]=4 6227 B15R1.528 CCCCCCCCCCN1CCCC1 269982a_100000188435_100000210320 [0,0,0,1,0,0|3,0,0]=4 6228 B15R1.528 CCCCCCCCCCc1ccco1 271570a_100000061613_100009814098 [0,0,0,1,0,0|1,0,2]=4 6229 B15R1.528 CCCCCCCCCCc1cnco1 271570a_100000061613_100020591547 [0,0,0,1,0,0|2,0,1]=4 6230 B15R1.528 CCCCCCCCCCc1ncco1 271570a_100000061613_100011787736 [0,0,0,1,0,0|1,0,2]=4 6231 B15R1.528 CCCCCCCCCOC1CCCO1 34a_100000085407_100011214924 [0,0,0,1,0,0|2,0,1]=4 6232 B15R1.528 CCCCCCCCNCC1=NCCN1 34a_100000229939_100000737910 [0,0,0,1,0,0|3,0,0]=4 6233 B15R1.528 CCCCCCCCNCC1CCCO1 2230a_100000229939_100000203698 [0,0,0,1,0,0|2,0,1]=4 6234 B15R1.528 CCCCCCCCNCC1OCCO1 2230a_100000036311_100000210759 [0,0,0,1,0,0|1,0,2]=4 6235 B15R1.528 CCCCCCCCNCC1OCCO1 2230a_100000229939_100000755774 [0,0,0,1,0,0|1,0,2]=4 6236 B15R1.528 CCCCCCCCNCC1OCCO1 34a_100000036311_100000210759 [0,0,0,1,0,0|1,0,2]=4 6237 B15R1.528 CCCCCCCCNCC1OCCO1 34a_100000229939_100000755774 [0,0,0,1,0,0|1,0,2]=4 6238 B15R1.528 CCCCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100000210759 [0,0,0,1,0,0|2,0,1]=4 6239 B15R1.528 CCCCCCCCNC[C@@H]1CCCO1 34a_100020590478_100000210759 [0,0,0,1,0,0|2,0,1]=4 6240 B15R1.528 CCCCCCCCOCC1=NCCN1 34a_100000210232_100000737910 [0,0,0,1,0,0|3,0,0]=4 6241 B15R1.528 CCCCCCCCOCC1=NCCN1 7a_100000210232_100000737910 [0,0,0,1,0,0|3,0,0]=4 6242 B15R1.528 CCCCCCCCOCC1CCCO1 34a_100000210270_100000210759 [0,0,0,1,0,0|2,0,1]=4 6243 B15R1.528 CCCCCCCCOCC1CCCO1 7a_100000210232_100000203698 [0,0,0,1,0,0|2,0,1]=4 6244 B15R1.528 CCCCCCCCOCC1CCCO1 7a_100000210270_100000210759 [0,0,0,1,0,0|2,0,1]=4 6245 B15R1.528 CCCCCCCCOCC1OCCO1 34a_100000087154_100000210759 [0,0,0,1,0,0|1,0,2]=4 6246 B15R1.528 CCCCCCCCOCC1OCCO1 34a_100000210232_100000755774 [0,0,0,1,0,0|1,0,2]=4 6247 B15R1.528 CCCCCCCCOCC1OCCO1 7a_100000210232_100000755774 [0,0,0,1,0,0|1,0,2]=4 6248 B15R1.528 CCCCCCCCSCC1=NCCN1 62a_100000210759_100000737910 [0,0,0,1,0,0|3,0,0]=4 6249 B15R1.528 CCCCCCCCSCC1=NCCN1 62a_100000737910_100000210317 [0,0,0,1,0,0|3,0,0]=4 6250 B15R1.528 CCCCCCCCSCC1CCCO1 62a_100000203698_100000210317 [0,0,0,1,0,0|2,0,1]=4 6251 B15R1.528 CCCCCCCCSCC1CCCO1 62a_100000210759_100000203698 [0,0,0,1,0,0|2,0,1]=4 6252 B15R1.528 CCCCCCCCSCC1OCCO1 62a_100000210759_100000755774 [0,0,0,1,0,0|1,0,2]=4 6253 B15R1.528 CCCCCCCCSCC1OCCO1 62a_100000755774_100000210317 [0,0,0,1,0,0|1,0,2]=4 6254 B15R1.528 CCCCCCCNCCC1OCCO1 2230a_100000034215_100000210681 [0,0,0,1,0,0|1,0,2]=4 6255 B15R1.528 CCCCCCCNCCC1OCCO1 2230a_100000229938_100000740749 [0,0,0,1,0,0|1,0,2]=4 6256 B15R1.528 CCCCCCCNCCC1OCCO1 34a_100000034215_100000210614 [0,0,0,1,0,0|1,0,2]=4 6257 B15R1.528 CCCCCCCOCCC1OCCO1 34a_100000210272_100000740749 [0,0,0,1,0,0|1,0,2]=4 6258 B15R1.528 CCCCCCCOCCC1OCCO1 7a_100000210272_100000740749 [0,0,0,1,0,0|1,0,2]=4 6259 B15R1.528 CCCCCCCSCCC1OCCO1 62a_100000210614_100000740749 [0,0,0,1,0,0|1,0,2]=4 6260 B15R1.528 CCCCCCNCCCC1OCCO1 2230a_100000210581_100000042513 [0,0,0,1,0,0|1,0,2]=4 6261 B15R1.528 CCCCCCOCCCC1OCCO1 34a_100000210259_100009861162 [0,0,0,1,0,0|1,0,2]=4 6262 B15R1.528 CCCCCCOCCCC1OCCO1 34a_100009871617_100000210314 [0,0,0,1,0,0|1,0,2]=4 6263 B15R1.528 CCCCCCOCCCC1OCCO1 7a_100000210259_100000042513 [0,0,0,1,0,0|1,0,2]=4 6264 B15R1.528 CCCCCCOCCCC1OCCO1 7a_100009871617_100000210314 [0,0,0,1,0,0|1,0,2]=4 6265 B15R1.528 CCCCCCSCCCC1OCCO1 62a_100000210314_100000042513 [0,0,0,1,0,0|1,0,2]=4 6266 B15R1.528 CCCCCNCCCCC1OCCO1 2230a_100000209983_100000034956 [0,0,0,1,0,0|1,0,2]=4 6267 B15R1.528 CCCCCOCCCCC1OCCO1 34a_100000210253_200009813554 [0,0,0,1,0,0|1,0,2]=4 6268 B15R1.528 CCCCCOCCCCC1OCCO1 7a_100000210253_100000034956 [0,0,0,1,0,0|1,0,2]=4 6269 B15R1.528 CCCCCSCCCCC1OCCO1 62a_100000210326_100000034956 [0,0,0,1,0,0|1,0,2]=4 6270 B15R1.603 CCCC1CCCC1NCC(=O)NCC 270004a_100016988866_100000723119 [0,0,0,1,0,0|2,0,0]=3 6271 B15R1.603 CCNC(=O)CCN1CCC[C@H]1COC 2230a_100020646714_100000737597 [0,0,0,1,0,0|3,0,0]=4 6272 B15R1.603 CCNC(=O)CCN1CCC[C@H]1COC 269982a_100020646714_100000737597 [0,0,0,1,0,0|3,0,0]=4 6273 B15R1.603 CCOC(=O)CCN1CCC[C@H]1COC 2230a_100020646714_100011206558 [0,0,0,1,0,0|2,0,0]=3 6274 B15R1.603 CCOC(=O)CCN1CCC[C@H]1COC 269982a_100020646714_100011206558 [0,0,0,1,0,0|2,0,0]=3 6275 B15R1.603 CCOC(=O)CCN1CCC[C@H]1COC 34a_100020646714_100000765890 [0,0,0,1,0,0|2,0,0]=3 6276 B15R1.768 C#CC1CCCCN1CCC(=O)OCC 2230a_200020621307_100011206558 [0,0,0,1,0,0|1,0,2]=4 6277 B15R1.768 C#CC1CCCCN1CCC(=O)OCC 269982a_200020621307_100011206558 [0,0,0,1,0,0|1,0,2]=4 6278 B15R1.768 C#CC1CCCCN1CCC(=O)OCC 34a_200020621307_100000765890 [0,0,0,1,0,0|1,0,2]=4 6279 B15R1.768 C=COC(=O)COC1CCCCC1CC 34a_100000210738_100000036128 [0,0,0,1,0,0|1,0,2]=4 6280 B15R1.768 CCC1CCCCC1OCC(=O)NCO 34a_100000210738_100000185155 [0,0,0,1,0,0|3,0,0]=4 6281 B15R1.768 CCC1CCCCC1OCC(=O)NCO 7a_100000210738_100000185155 [0,0,0,1,0,0|3,0,0]=4 6282 B15R1.768 CCCC(=O)COC1CCCCC1CC 7a_100000210738_100000747444 [0,0,0,1,0,0|2,0,0]=3 6283 B15R1.768 CCCC(=O)CO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000747444 [0,0,0,1,0,0|3,0,0]=4 6284 B15R1.768 CCCC(=O)NCC1CCCCN1CC 11a_100000754393_100000211992 [0,0,0,1,0,0|3,0,0]=4 6285 B15R1.768 CCCC(=O)NCC1CCCCN1CC 1626a_100000754393_100000211992 [0,0,0,1,0,0|3,0,0]=4 6286 B15R1.768 CCCC(=O)NCC1CCCCN1CC 240690a_100000754393_100000211992 [0,0,0,1,0,0|3,0,0]=4 6287 B15R1.768 CCCC(=O)NCC1CCCCN1CC 527a_100000754393_100000211992 [0,0,0,1,0,0|3,0,0]=4 6288 B15R1.768 CCCC(=O)OCN1CCCCC1CC 2230a_100000210034_100000034017 [0,0,0,1,0,0|3,0,0]=4 6289 B15R1.768 CCCC(=O)OCN1CCCCC1CC 269982a_100000210034_100000034017 [0,0,0,1,0,0|3,0,0]=4 6290 B15R1.768 CCCC(=O)OCN1CCCCC1CC 34a_100000210034_100000034017 [0,0,0,1,0,0|3,0,0]=4 6291 B15R1.768 CCNC(=O)CCN1CCCCC1CC 2230a_100000210034_100000737597 [0,0,0,1,0,0|2,0,0]=3 6292 B15R1.768 CCNC(=O)CCN1CCCCC1CC 269982a_100000210034_100000737597 [0,0,0,1,0,0|2,0,0]=3 6293 B15R1.768 CCNC(=O)CCN1CCCCC1CO 2230a_100000210821_100000737597 [0,0,0,1,0,0|3,0,0]=4 6294 B15R1.768 CCNC(=O)CCN1CCCCC1CO 269982a_100000210821_100000737597 [0,0,0,1,0,0|3,0,0]=4 6295 B15R1.768 CCNC(=O)CCN1CCOC[C@@H]1CC 2230a_100016988097_100000737597 [0,0,0,1,0,0|3,0,0]=4 6296 B15R1.768 CCNC(=O)CCN1CCOC[C@@H]1CC 269982a_100016988097_100000737597 [0,0,0,1,0,0|3,0,0]=4 6297 B15R1.768 CCNC(=O)CNC1CCCCC1CC 270004a_100016988866_100000757040 [0,0,0,1,0,0|2,0,0]=3 6298 B15R1.768 CCNC(=O)CNC1CCCCC1CO 270004a_100016988866_100009861125 [0,0,0,1,0,0|3,0,0]=4 6299 B15R1.768 CCNC(=O)CNC1CCCCC1OC 270004a_100016988866_100000740605 [0,0,0,1,0,0|3,0,0]=4 6300 B15R1.768 CCNC(=O)CNC1CCCCC1OC 34a_100011208099_100000183381 [0,0,0,1,0,0|3,0,0]=4 6301 B15R1.768 CCNC(=O)COC1CCCCC1CC 34a_100000210738_100000183381 [0,0,0,1,0,0|2,0,0]=3 6302 B15R1.768 CCNC(=O)COC1CCCCC1CC 7a_100000210738_100000183381 [0,0,0,1,0,0|2,0,0]=3 6303 B15R1.768 CCNC(=O)COC1CCCCC1CN 34a_100011216029_100000183381 [0,0,0,1,0,0|3,0,0]=4 6304 B15R1.768 CCNC(=O)CO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100000183381 [0,0,0,1,0,0|3,0,0]=4 6305 B15R1.768 CCNC(=O)CO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000183381 [0,0,0,1,0,0|3,0,0]=4 6306 B15R1.768 CCNC(=O)CO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000183381 [0,0,0,1,0,0|3,0,0]=4 6307 B15R1.768 CCNC(=O)NCC1CCCCN1CC 2708a_100000754393_100015525214 [0,0,0,1,0,0|3,0,0]=4 6308 B15R1.768 CCNC(=O)NCC1CCCCN1CC 2708a_100015525214_100000754393 [0,0,0,1,0,0|3,0,0]=4 6309 B15R1.768 CCNC(=O)NCC1CCCCN1CC 273464a_100000754393_100015525214 [0,0,0,1,0,0|3,0,0]=4 6310 B15R1.768 CCNC(=O)NCC1CCCCN1CC 273464a_100015525214_100000754393 [0,0,0,1,0,0|3,0,0]=4 6311 B15R1.768 CCNC(=O)NCC1CCCCN1CC 512a_100000754393_100015525214 [0,0,0,1,0,0|3,0,0]=4 6312 B15R1.768 CCNC(=O)NCC1CCCCN1CC 512a_100015525214_100000754393 [0,0,0,1,0,0|3,0,0]=4 6313 B15R1.768 CCOC(=O)CCN1CCCCC1C#N 34a_100016989756_100000765890 [0,0,0,1,0,0|2,0,1]=4 6314 B15R1.768 CCOC(=O)CCN1CCCCC1CC 2230a_100000210034_100011206558 [0,0,0,1,0,0|1,0,0]=2 6315 B15R1.768 CCOC(=O)CCN1CCCCC1CC 269982a_100000210034_100011206558 [0,0,0,1,0,0|1,0,0]=2 6316 B15R1.768 CCOC(=O)CCN1CCCCC1CC 34a_100000210034_100000765890 [0,0,0,1,0,0|1,0,0]=2 6317 B15R1.768 CCOC(=O)CCN1CCCCC1CO 2230a_100000210821_100011206558 [0,0,0,1,0,0|2,0,0]=3 6318 B15R1.768 CCOC(=O)CCN1CCCCC1CO 269982a_100000210821_100011206558 [0,0,0,1,0,0|2,0,0]=3 6319 B15R1.768 CCOC(=O)CCN1CCCCC1CO 34a_100000210821_100000765890 [0,0,0,1,0,0|2,0,0]=3 6320 B15R1.768 CCOC(=O)CCN1CCOC[C@@H]1CC 2230a_100016988097_100011206558 [0,0,0,1,0,0|2,0,0]=3 6321 B15R1.768 CCOC(=O)CCN1CCOC[C@@H]1CC 269982a_100016988097_100011206558 [0,0,0,1,0,0|2,0,0]=3 6322 B15R1.768 CCOC(=O)CCN1CCOC[C@@H]1CC 34a_100016988097_100000765890 [0,0,0,1,0,0|2,0,0]=3 6323 B15R1.768 CCOC(=O)CCN1CCOC[C@H]1CO 2230a_100000717676_100011206558 [0,0,0,1,0,0|3,0,0]=4 6324 B15R1.768 CCOC(=O)CCN1CCOC[C@H]1CO 269982a_100000717676_100011206558 [0,0,0,1,0,0|3,0,0]=4 6325 B15R1.768 CCOC(=O)CCN1CCOC[C@H]1CO 34a_100000717676_100000765890 [0,0,0,1,0,0|3,0,0]=4 6326 B15R1.768 CCOC(=O)CNC1CCCCC1OC 34a_100011208099_100000188475 [0,0,0,1,0,0|2,0,0]=3 6327 B15R1.768 CCOC(=O)CNC1CCOCC1CO 2230a_214813039666_100000188475 [0,0,0,1,0,0|3,0,0]=4 6328 B15R1.768 CCOC(=O)CNC1CCOCC1CO 34a_214813039666_100000188475 [0,0,0,1,0,0|3,0,0]=4 6329 B15R1.768 CCOC(=O)COC1CCCCC1CC 34a_100000210738_100000188475 [0,0,0,1,0,0|1,0,0]=2 6330 B15R1.768 CCOC(=O)COC1CCCCC1CC 7a_100000210738_100000188475 [0,0,0,1,0,0|1,0,0]=2 6331 B15R1.768 CCOC(=O)COC1CCCCC1CN 34a_100011216029_100000188475 [0,0,0,1,0,0|2,0,0]=3 6332 B15R1.768 CCOC(=O)CO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100000188475 [0,0,0,1,0,0|2,0,0]=3 6333 B15R1.768 CCOC(=O)CO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000188475 [0,0,0,1,0,0|2,0,0]=3 6334 B15R1.768 CCOC(=O)CO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000188475 [0,0,0,1,0,0|2,0,0]=3 6335 B15R1.778 C#CCC(=O)CCCCC1CCCCC1 1458a_200011215547_100000184674 [0,0,0,1,0,0|1,0,2]=4 6336 B15R1.778 C=CCC(=O)CCCCC1CCCCC1 1458a_200011215547_100000210623 [0,0,0,1,0,0|1,0,2]=4 6337 B15R1.778 C=COC(=O)CNCCC1CCCCC1 2230a_100000738074_100000036128 [0,0,0,1,0,0|1,0,2]=4 6338 B15R1.778 C=COC(=O)CNCCC1CCCCC1 34a_100000738074_100000036128 [0,0,0,1,0,0|1,0,2]=4 6339 B15R1.778 C=COC(=O)COCCC1CCCCC1 34a_100011217863_100000036128 [0,0,0,1,0,0|1,0,2]=4 6340 B15R1.778 C=COC(=O)CSCCC1CCCCC1 62a_100000036128_100012355289 [0,0,0,1,0,0|1,0,2]=4 6341 B15R1.778 C=COC(=O)CSCCC1CCCCC1 62a_100012355289_100000036128 [0,0,0,1,0,0|1,0,2]=4 6342 B15R1.778 CC=CC(=O)NCCCC1CCCCC1 11a_100011211642_100000210699 [0,0,0,1,0,0|2,0,1]=4 6343 B15R1.778 CC=CC(=O)NCCCC1CCCCC1 1626a_100011211642_100000210699 [0,0,0,1,0,0|2,0,1]=4 6344 B15R1.778 CC=CC(=O)NCCCC1CCCCC1 240690a_100011211642_100000210699 [0,0,0,1,0,0|2,0,1]=4 6345 B15R1.778 CCCC(=O)CCCCC1CCCCC1 1458a_200011215547_100000210303 [0,0,0,1,0,0|1,0,0]=2 6346 B15R1.778 CCCC(=O)CCCCN1CCCCC1 1458a_100000754417_100000210303 [0,0,0,1,0,0|2,0,0]=3 6347 B15R1.778 CCCC(=O)CCCOC1CCCCO1 1458a_100000211992_100000700653 [0,0,0,1,0,0|3,0,0]=4 6348 B15R1.778 CCCC(=O)CNCCC1CCCCC1 2230a_100000738074_100000747444 [0,0,0,1,0,0|2,0,0]=3 6349 B15R1.778 CCCC(=O)CNCCC1CCCCO1 2230a_100015183643_100000747444 [0,0,0,1,0,0|3,0,0]=4 6350 B15R1.778 CCCC(=O)CNCCC1CCOCC1 2230a_100000755988_100000747444 [0,0,0,1,0,0|3,0,0]=4 6351 B15R1.778 CCCC(=O)COCCC1CCCCC1 7a_100011217863_100000747444 [0,0,0,1,0,0|2,0,0]=3 6352 B15R1.778 CCCC(=O)COCCC1CCOCC1 7a_100011933979_100000747444 [0,0,0,1,0,0|3,0,0]=4 6353 B15R1.778 CCCC(=O)CSCCC1CCCCC1 62a_100000747444_100012355289 [0,0,0,1,0,0|2,0,0]=3 6354 B15R1.778 CCCC(=O)CSCCC1CCCCC1 62a_100012355289_100000747444 [0,0,0,1,0,0|2,0,0]=3 6355 B15R1.778 CCCC(=O)CSCCC1CCOCC1 62a_100000747444_100011934994 [0,0,0,1,0,0|3,0,0]=4 6356 B15R1.778 CCCC(=O)CSCCC1CCOCC1 62a_100011934994_100000747444 [0,0,0,1,0,0|3,0,0]=4 6357 B15R1.778 CCCC(=O)CSCCN1CCCCC1 62a_100000739454_100000747444 [0,0,0,1,0,0|3,0,0]=4 6358 B15R1.778 CCCC(=O)CSCCN1CCCCC1 62a_100000747444_100000739454 [0,0,0,1,0,0|3,0,0]=4 6359 B15R1.778 CCCC(=O)CSCOC1CCCCC1 62a_100000747444_100011935260 [0,0,0,1,0,0|3,0,0]=4 6360 B15R1.778 CCCC(=O)CSCOC1CCCCC1 62a_100011935260_100000747444 [0,0,0,1,0,0|3,0,0]=4 6361 B15R1.778 CCCC(=O)NCCCC1CCCCC1 11a_100011211642_100000211992 [0,0,0,1,0,0|2,0,0]=3 6362 B15R1.778 CCCC(=O)NCCCC1CCCCC1 1626a_100011211642_100000211992 [0,0,0,1,0,0|2,0,0]=3 6363 B15R1.778 CCCC(=O)NCCCC1CCCCC1 240690a_100011211642_100000211992 [0,0,0,1,0,0|2,0,0]=3 6364 B15R1.778 CCCC(=O)NCCCC1CCCCC1 527a_100011211642_100000211992 [0,0,0,1,0,0|2,0,0]=3 6365 B15R1.778 CCCC(=O)NCCCN1CCCCC1 240690a_100000204581_100000211992 [0,0,0,1,0,0|3,0,0]=4 6366 B15R1.778 CCCC(=O)NCCCN1CCCCC1 527a_100000204581_100000211992 [0,0,0,1,0,0|3,0,0]=4 6367 B15R1.778 CCCC(=O)NCCOC1CCCCC1 11a_100015206981_100000211992 [0,0,0,1,0,0|3,0,0]=4 6368 B15R1.778 CCCC(=O)NCCOC1CCCCC1 1626a_100015206981_100000211992 [0,0,0,1,0,0|3,0,0]=4 6369 B15R1.778 CCCC(=O)NCCOC1CCCCC1 240690a_100015206981_100000211992 [0,0,0,1,0,0|3,0,0]=4 6370 B15R1.778 CCCC(=O)NCCOC1CCCCC1 527a_100015206981_100000211992 [0,0,0,1,0,0|3,0,0]=4 6371 B15R1.778 CCCC(=O)OCNCC1CCCCC1 2230a_100000210473_100000034017 [0,0,0,1,0,0|3,0,0]=4 6372 B15R1.778 CCCC(=O)OCNCC1CCCCC1 34a_100000210473_100000034017 [0,0,0,1,0,0|3,0,0]=4 6373 B15R1.778 CCCC(=O)OCOCC1CCCCC1 34a_100000212181_100000034017 [0,0,0,1,0,0|3,0,0]=4 6374 B15R1.778 CCCC(=O)OCSCC1CCCCC1 62a_100000211423_100000034017 [0,0,0,1,0,0|3,0,0]=4 6375 B15R1.778 CCNC(=O)CCCCC1CCCCC1 11a_100015525214_200011215547 [0,0,0,1,0,0|1,0,0]=2 6376 B15R1.778 CCNC(=O)CCCCC1CCCCC1 240690a_100015525214_200011215547 [0,0,0,1,0,0|1,0,0]=2 6377 B15R1.778 CCNC(=O)CCCCC1CCCCC1 527a_100015525214_200011215547 [0,0,0,1,0,0|1,0,0]=2 6378 B15R1.778 CCNC(=O)CCCCN1CCCCC1 11a_100015525214_100000754417 [0,0,0,1,0,0|2,0,0]=3 6379 B15R1.778 CCNC(=O)CCCCN1CCCCC1 240690a_100015525214_100000754417 [0,0,0,1,0,0|2,0,0]=3 6380 B15R1.778 CCNC(=O)CCNCC1CCCCC1 2230a_100000210473_100000737597 [0,0,0,1,0,0|2,0,0]=3 6381 B15R1.778 CCNC(=O)CCNCC1CCCCC1 269862a_100025743525_100000211278 [0,0,0,1,0,0|2,0,0]=3 6382 B15R1.778 CCNC(=O)CCNCC1CCCCC1 34a_100025743525_100000211423 [0,0,0,1,0,0|2,0,0]=3 6383 B15R1.778 CCNC(=O)CCNCC1CCCCO1 2230a_100000174945_100000737597 [0,0,0,1,0,0|3,0,0]=4 6384 B15R1.778 CCNC(=O)CCNCC1CCCCO1 34a_100025743525_100000211543 [0,0,0,1,0,0|3,0,0]=4 6385 B15R1.778 CCNC(=O)CCNCC1CCCOC1 2230a_100000720124_100000737597 [0,0,0,1,0,0|3,0,0]=4 6386 B15R1.778 CCNC(=O)CCNCC1CCCOC1 34a_100025743525_100000741521 [0,0,0,1,0,0|3,0,0]=4 6387 B15R1.778 CCNC(=O)CCNCC1CCOCC1 2230a_100000746373_100000737597 [0,0,0,1,0,0|3,0,0]=4 6388 B15R1.778 CCNC(=O)CCNCC1CCOCC1 269862a_100025743525_100000749017 [0,0,0,1,0,0|3,0,0]=4 6389 B15R1.778 CCNC(=O)CCNCC1CCOCC1 34a_100025743525_100000754603 [0,0,0,1,0,0|3,0,0]=4 6390 B15R1.778 CCNC(=O)CCNCC1CCSCC1 2230a_100015188806_100000737597 [0,0,0,1,0,0|3,0,0]=4 6391 B15R1.778 CCNC(=O)CCNCC1CCSCC1 269862a_100025743525_100000067145 [0,0,0,1,0,0|3,0,0]=4 6392 B15R1.778 CCNC(=O)CCNCC1CCSCC1 270004a_100025743525_100000067145 [0,0,0,1,0,0|3,0,0]=4 6393 B15R1.778 CCNC(=O)CCOCC1CCCCC1 7a_100000212181_100000737597 [0,0,0,1,0,0|2,0,0]=3 6394 B15R1.778 CCNC(=O)CCOCC1CCCCO1 7a_100000211370_100000737597 [0,0,0,1,0,0|3,0,0]=4 6395 B15R1.778 CCNC(=O)CCOCC1CCSCC1 7a_100000070558_100000737597 [0,0,0,1,0,0|3,0,0]=4 6396 B15R1.778 CCNC(=O)CCSCC1CCCCC1 62a_100000211423_100000737597 [0,0,0,1,0,0|2,0,0]=3 6397 B15R1.778 CCNC(=O)CCSCC1CCCCC1 62a_100000737597_100000211423 [0,0,0,1,0,0|2,0,0]=3 6398 B15R1.778 CCNC(=O)CCSCC1CCCCO1 62a_100000211543_100000737597 [0,0,0,1,0,0|3,0,0]=4 6399 B15R1.778 CCNC(=O)CCSCC1CCCCO1 62a_100000737597_100000211543 [0,0,0,1,0,0|3,0,0]=4 6400 B15R1.778 CCNC(=O)CCSCC1CCCOC1 62a_100000737597_100000741521 [0,0,0,1,0,0|3,0,0]=4 6401 B15R1.778 CCNC(=O)CCSCC1CCCOC1 62a_100000741521_100000737597 [0,0,0,1,0,0|3,0,0]=4 6402 B15R1.778 CCNC(=O)CCSCC1CCOCC1 62a_100000737597_100000749018 [0,0,0,1,0,0|3,0,0]=4 6403 B15R1.778 CCNC(=O)CCSCC1CCOCC1 62a_100000754603_100000737597 [0,0,0,1,0,0|3,0,0]=4 6404 B15R1.778 CCNC(=O)CNCCC1CCCCC1 2230a_100000738074_100000183381 [0,0,0,1,0,0|2,0,0]=3 6405 B15R1.778 CCNC(=O)CNCCC1CCCCC1 2230a_100016988866_100012355289 [0,0,0,1,0,0|2,0,0]=3 6406 B15R1.778 CCNC(=O)CNCCC1CCCCC1 270004a_100016988866_100011713444 [0,0,0,1,0,0|2,0,0]=3 6407 B15R1.778 CCNC(=O)CNCCC1CCCCC1 34a_100000738074_100000183381 [0,0,0,1,0,0|2,0,0]=3 6408 B15R1.778 CCNC(=O)CNCCC1CCCCO1 2230a_100015183643_100000183381 [0,0,0,1,0,0|3,0,0]=4 6409 B15R1.778 CCNC(=O)CNCCC1CCCCO1 34a_100015183643_100000183381 [0,0,0,1,0,0|3,0,0]=4 6410 B15R1.778 CCNC(=O)CNCCC1CCOCC1 2230a_100000755988_100000183381 [0,0,0,1,0,0|3,0,0]=4 6411 B15R1.778 CCNC(=O)CNCCC1CCOCC1 2230a_100016988866_100011934994 [0,0,0,1,0,0|3,0,0]=4 6412 B15R1.778 CCNC(=O)CNCCC1CCOCC1 34a_100000755988_100000183381 [0,0,0,1,0,0|3,0,0]=4 6413 B15R1.778 CCNC(=O)CNCCN1CCCCC1 2230a_100016988866_100000739454 [0,0,0,1,0,0|3,0,0]=4 6414 B15R1.778 CCNC(=O)CNCOC1CCCCC1 2230a_100016988866_100011935260 [0,0,0,1,0,0|3,0,0]=4 6415 B15R1.778 CCNC(=O)COCCC1CCCCC1 34a_100011217863_100000183381 [0,0,0,1,0,0|2,0,0]=3 6416 B15R1.778 CCNC(=O)COCCC1CCCCC1 7a_100011217863_100000183381 [0,0,0,1,0,0|2,0,0]=3 6417 B15R1.778 CCNC(=O)COCCC1CCCCN1 34a_100000211664_100000183381 [0,0,0,1,0,0|3,0,0]=4 6418 B15R1.778 CCNC(=O)COCCC1CCCNC1 34a_100000752241_100000183381 [0,0,0,1,0,0|3,0,0]=4 6419 B15R1.778 CCNC(=O)COCCC1CCNCC1 34a_100015190746_100000183381 [0,0,0,1,0,0|3,0,0]=4 6420 B15R1.778 CCNC(=O)COCCC1CCOCC1 34a_100011933979_100000183381 [0,0,0,1,0,0|3,0,0]=4 6421 B15R1.778 CCNC(=O)COCCC1CCOCC1 7a_100011933979_100000183381 [0,0,0,1,0,0|3,0,0]=4 6422 B15R1.778 CCNC(=O)CSCCC1CCCCC1 62a_100000183381_100012355289 [0,0,0,1,0,0|2,0,0]=3 6423 B15R1.778 CCNC(=O)CSCCC1CCCCC1 62a_100012355289_100000183381 [0,0,0,1,0,0|2,0,0]=3 6424 B15R1.778 CCNC(=O)CSCCC1CCOCC1 62a_100000183381_100011934994 [0,0,0,1,0,0|3,0,0]=4 6425 B15R1.778 CCNC(=O)CSCCC1CCOCC1 62a_100011934994_100000183381 [0,0,0,1,0,0|3,0,0]=4 6426 B15R1.778 CCNC(=O)CSCCN1CCCCC1 62a_100000183381_100000739454 [0,0,0,1,0,0|3,0,0]=4 6427 B15R1.778 CCNC(=O)CSCCN1CCCCC1 62a_100000739454_100000183381 [0,0,0,1,0,0|3,0,0]=4 6428 B15R1.778 CCNC(=O)CSCOC1CCCCC1 62a_100000183381_100011935260 [0,0,0,1,0,0|3,0,0]=4 6429 B15R1.778 CCNC(=O)CSCOC1CCCCC1 62a_100011935260_100000183381 [0,0,0,1,0,0|3,0,0]=4 6430 B15R1.778 CCNC(=O)NCCCC1CCCCC1 2708a_100011211642_100015525214 [0,0,0,1,0,0|2,0,0]=3 6431 B15R1.778 CCNC(=O)NCCCC1CCCCC1 2708a_100015525214_100011211642 [0,0,0,1,0,0|2,0,0]=3 6432 B15R1.778 CCNC(=O)NCCCC1CCCCC1 273464a_100011211642_100015525214 [0,0,0,1,0,0|2,0,0]=3 6433 B15R1.778 CCNC(=O)NCCCC1CCCCC1 273464a_100015525214_100011211642 [0,0,0,1,0,0|2,0,0]=3 6434 B15R1.778 CCNC(=O)NCCCC1CCCCC1 512a_100011211642_100015525214 [0,0,0,1,0,0|2,0,0]=3 6435 B15R1.778 CCNC(=O)NCCCC1CCCCC1 512a_100015525214_100011211642 [0,0,0,1,0,0|2,0,0]=3 6436 B15R1.778 CCNC(=O)NCCCN1CCCCC1 2708a_100000204581_100015525214 [0,0,0,1,0,0|3,0,0]=4 6437 B15R1.778 CCNC(=O)NCCCN1CCCCC1 2708a_100015525214_100000204581 [0,0,0,1,0,0|3,0,0]=4 6438 B15R1.778 CCNC(=O)NCCCN1CCCCC1 273464a_100000204581_100015525214 [0,0,0,1,0,0|3,0,0]=4 6439 B15R1.778 CCNC(=O)NCCCN1CCCCC1 273464a_100015525214_100000204581 [0,0,0,1,0,0|3,0,0]=4 6440 B15R1.778 CCNC(=O)NCCOC1CCCCC1 2708a_100015206981_100015525214 [0,0,0,1,0,0|3,0,0]=4 6441 B15R1.778 CCNC(=O)NCCOC1CCCCC1 2708a_100015525214_100015206981 [0,0,0,1,0,0|3,0,0]=4 6442 B15R1.778 CCNC(=O)NCCOC1CCCCC1 273464a_100015206981_100015525214 [0,0,0,1,0,0|3,0,0]=4 6443 B15R1.778 CCNC(=O)NCCOC1CCCCC1 273464a_100015525214_100015206981 [0,0,0,1,0,0|3,0,0]=4 6444 B15R1.778 CCNC(=O)NCCOC1CCCCC1 512a_100015206981_100015525214 [0,0,0,1,0,0|3,0,0]=4 6445 B15R1.778 CCNC(=O)NCCOC1CCCCC1 512a_100015525214_100015206981 [0,0,0,1,0,0|3,0,0]=4 6446 B15R1.778 CCOC(=O)/C=C/CNC1CCCCC1 2230a_100000182618_100016267167 [0,0,0,1,0,0|1,0,2]=4 6447 B15R1.778 CCOC(=O)/C=C/CNC1CCCCC1 34a_100000182618_100016267167 [0,0,0,1,0,0|1,0,2]=4 6448 B15R1.778 CCOC(=O)/C=C/COC1CCCCC1 34a_100000210231_100016267167 [0,0,0,1,0,0|1,0,2]=4 6449 B15R1.778 CCOC(=O)/C=C/COC1CCCCC1 7a_100000210231_100016267167 [0,0,0,1,0,0|1,0,2]=4 6450 B15R1.778 CCOC(=O)/C=C/CSC1CCCCC1 62a_100000210327_100016267167 [0,0,0,1,0,0|1,0,2]=4 6451 B15R1.778 CCOC(=O)/C=C/CSC1CCCCC1 62a_100016267167_100000210327 [0,0,0,1,0,0|1,0,2]=4 6452 B15R1.778 CCOC(=O)C=NNCC1CCCCC1 4a_100000740227_100000742314 [0,0,0,1,0,0|2,0,1]=4 6453 B15R1.778 CCOC(=O)CCCCN1CC=CCC1 2230a_100000698166_100000750268 [0,0,0,1,0,0|1,0,2]=4 6454 B15R1.778 CCOC(=O)CCCCN1CC=CCC1 269982a_100000698166_100000750268 [0,0,0,1,0,0|1,0,2]=4 6455 B15R1.778 CCOC(=O)CCCCN1CC=CCC1 34a_100000698166_100000750268 [0,0,0,1,0,0|1,0,2]=4 6456 B15R1.778 CCOC(=O)CCCCN1CCCOC1 2230a_100000131196_100000750268 [0,0,0,1,0,0|2,0,0]=3 6457 B15R1.778 CCOC(=O)CCCCN1CCCOC1 269982a_100000131196_100000750268 [0,0,0,1,0,0|2,0,0]=3 6458 B15R1.778 CCOC(=O)CCCCN1CCCOC1 34a_100000131196_100000750268 [0,0,0,1,0,0|2,0,0]=3 6459 B15R1.778 CCOC(=O)CCCCN1CCOCC1 2230a_100015191051_100000750268 [0,0,0,1,0,0|2,0,0]=3 6460 B15R1.778 CCOC(=O)CCCCN1CCOCC1 269982a_100015191051_100000750268 [0,0,0,1,0,0|2,0,0]=3 6461 B15R1.778 CCOC(=O)CCCCN1CCOCC1 34a_100015191051_100000750268 [0,0,0,1,0,0|2,0,0]=3 6462 B15R1.778 CCOC(=O)CCCCN1CCSCC1 2230a_100000737611_100000750268 [0,0,0,1,0,0|2,0,0]=3 6463 B15R1.778 CCOC(=O)CCCCN1CCSCC1 269982a_100000737611_100000750268 [0,0,0,1,0,0|2,0,0]=3 6464 B15R1.778 CCOC(=O)CCCNC1CCCCC1 2230a_100000182618_100009991533 [0,0,0,1,0,0|1,0,0]=2 6465 B15R1.778 CCOC(=O)CCCNC1CCCCC1 34a_100000182618_100009991533 [0,0,0,1,0,0|1,0,0]=2 6466 B15R1.778 CCOC(=O)CCCNC1CCCOC1 2230a_100000719290_100009991533 [0,0,0,1,0,0|2,0,0]=3 6467 B15R1.778 CCOC(=O)CCCNC1CCCOC1 34a_100000719290_100009991533 [0,0,0,1,0,0|2,0,0]=3 6468 B15R1.778 CCOC(=O)CCCNC1CCOCC1 2230a_100000741149_100009991533 [0,0,0,1,0,0|2,0,0]=3 6469 B15R1.778 CCOC(=O)CCCNC1CCOCC1 34a_100000741149_100009991533 [0,0,0,1,0,0|2,0,0]=3 6470 B15R1.778 CCOC(=O)CCCNC1CCSCC1 2230a_100000748639_100009991533 [0,0,0,1,0,0|2,0,0]=3 6471 B15R1.778 CCOC(=O)CCCNC1CCSCC1 34a_100000748639_100009991533 [0,0,0,1,0,0|2,0,0]=3 6472 B15R1.778 CCOC(=O)CCCOC1C=CCCC1 34a_100011215024_100009991533 [0,0,0,1,0,0|1,0,2]=4 6473 B15R1.778 CCOC(=O)CCCOC1C=CCCC1 7a_100012001163_100000751183 [0,0,0,1,0,0|1,0,2]=4 6474 B15R1.778 CCOC(=O)CCCOC1CC=CCC1 34a_100000073881_100009991533 [0,0,0,1,0,0|1,0,2]=4 6475 B15R1.778 CCOC(=O)CCCOC1CCCCC1 34a_100000210231_100009991533 [0,0,0,1,0,0|1,0,0]=2 6476 B15R1.778 CCOC(=O)CCCOC1CCCCC1 7a_100000210231_100011215271 [0,0,0,1,0,0|1,0,0]=2 6477 B15R1.778 CCOC(=O)CCCOC1CCCCC1 7a_100012001163_100000210327 [0,0,0,1,0,0|1,0,0]=2 6478 B15R1.778 CCOC(=O)CCCOC1CCCCO1 34a_100000033831_100009991533 [0,0,0,1,0,0|2,0,0]=3 6479 B15R1.778 CCOC(=O)CCCOC1CCCOC1 34a_100000754041_100009991533 [0,0,0,1,0,0|2,0,0]=3 6480 B15R1.778 CCOC(=O)CCCOC1CCCOC1 7a_100012001163_100000693364 [0,0,0,1,0,0|2,0,0]=3 6481 B15R1.778 CCOC(=O)CCCOC1CCCSC1 7a_100015962668_100011215271 [0,0,0,1,0,0|2,0,0]=3 6482 B15R1.778 CCOC(=O)CCCOC1CCOCC1 34a_100000744328_100009991533 [0,0,0,1,0,0|2,0,0]=3 6483 B15R1.778 CCOC(=O)CCCOC1CCOCC1 7a_100012001163_100000686592 [0,0,0,1,0,0|2,0,0]=3 6484 B15R1.778 CCOC(=O)CCCOC1CCSCC1 34a_100000731022_100009991533 [0,0,0,1,0,0|2,0,0]=3 6485 B15R1.778 CCOC(=O)CCCOC1CCSCC1 7a_100000731022_100011215271 [0,0,0,1,0,0|2,0,0]=3 6486 B15R1.778 CCOC(=O)CCCOC1CCSCC1 7a_100012001163_100011500858 [0,0,0,1,0,0|2,0,0]=3 6487 B15R1.778 CCOC(=O)CCCSC1C=CCCC1 62a_100000751183_100009991533 [0,0,0,1,0,0|1,0,2]=4 6488 B15R1.778 CCOC(=O)CCCSC1C=CCCC1 62a_100009991533_100000751183 [0,0,0,1,0,0|1,0,2]=4 6489 B15R1.778 CCOC(=O)CCCSC1CCCCC1 62a_100000210327_100009991533 [0,0,0,1,0,0|1,0,0]=2 6490 B15R1.778 CCOC(=O)CCCSC1CCCCC1 62a_100009991533_100000210327 [0,0,0,1,0,0|1,0,0]=2 6491 B15R1.778 CCOC(=O)CCCSC1CCCOC1 62a_100009991533_100000693364 [0,0,0,1,0,0|2,0,0]=3 6492 B15R1.778 CCOC(=O)CCCSC1CCOCC1 62a_100009991533_100011324220 [0,0,0,1,0,0|2,0,0]=3 6493 B15R1.778 CCOC(=O)CCCSC1CCSCC1 62a_100009991533_100000069128 [0,0,0,1,0,0|2,0,0]=3 6494 B15R1.778 CCOC(=O)CCNCC1CCCCC1 2230a_100000210473_100011206558 [0,0,0,1,0,0|1,0,0]=2 6495 B15R1.778 CCOC(=O)CCNCC1CCCCC1 34a_100000210473_100000765890 [0,0,0,1,0,0|1,0,0]=2 6496 B15R1.778 CCOC(=O)CCNCC1CCCCO1 2230a_100000174945_100011206558 [0,0,0,1,0,0|2,0,0]=3 6497 B15R1.778 CCOC(=O)CCNCC1CCCCO1 34a_100000174945_100000765890 [0,0,0,1,0,0|2,0,0]=3 6498 B15R1.778 CCOC(=O)CCNCC1CCCOC1 2230a_100000720124_100011206558 [0,0,0,1,0,0|2,0,0]=3 6499 B15R1.778 CCOC(=O)CCNCC1CCCOC1 34a_100000720124_100000765890 [0,0,0,1,0,0|2,0,0]=3 6500 B15R1.778 CCOC(=O)CCNCC1CCOCC1 2230a_100000746373_100011206558 [0,0,0,1,0,0|2,0,0]=3 6501 B15R1.778 CCOC(=O)CCNCC1CCOCC1 34a_100000746373_100000765890 [0,0,0,1,0,0|2,0,0]=3 6502 B15R1.778 CCOC(=O)CCNCC1CCSCC1 2230a_100015188806_100011206558 [0,0,0,1,0,0|2,0,0]=3 6503 B15R1.778 CCOC(=O)CCNCC1CCSCC1 34a_100015188806_100000765890 [0,0,0,1,0,0|2,0,0]=3 6504 B15R1.778 CCOC(=O)CCNC[C@H]1COCCO1 2230a_100010981119_100011206558 [0,0,0,1,0,0|3,0,0]=4 6505 B15R1.778 CCOC(=O)CCNC[C@H]1COCCO1 34a_100010981119_100000765890 [0,0,0,1,0,0|3,0,0]=4 6506 B15R1.778 CCOC(=O)CCOCC1CC=CCC1 34a_100000210713_100000765890 [0,0,0,1,0,0|1,0,2]=4 6507 B15R1.778 CCOC(=O)CCOCC1CCCCC1 34a_100000212181_100000765890 [0,0,0,1,0,0|1,0,0]=2 6508 B15R1.778 CCOC(=O)CCOCC1CCCCC1 7a_100000212181_100011206558 [0,0,0,1,0,0|1,0,0]=2 6509 B15R1.778 CCOC(=O)CCOCC1CCCCN1 34a_100000210821_100000765890 [0,0,0,1,0,0|2,0,0]=3 6510 B15R1.778 CCOC(=O)CCOCC1CCCCO1 34a_100000211370_100000765890 [0,0,0,1,0,0|2,0,0]=3 6511 B15R1.778 CCOC(=O)CCOCC1CCCCO1 7a_100000211370_100011206558 [0,0,0,1,0,0|2,0,0]=3 6512 B15R1.778 CCOC(=O)CCOCC1CCCNC1 34a_100000211344_100000765890 [0,0,0,1,0,0|2,0,0]=3 6513 B15R1.778 CCOC(=O)CCOCC1CCCOC1 34a_100000741520_100000765890 [0,0,0,1,0,0|2,0,0]=3 6514 B15R1.778 CCOC(=O)CCOCC1CCNCC1 34a_100000738675_100000765890 [0,0,0,1,0,0|2,0,0]=3 6515 B15R1.778 CCOC(=O)CCOCC1CCOCC1 34a_100000749013_100000765890 [0,0,0,1,0,0|2,0,0]=3 6516 B15R1.778 CCOC(=O)CCOCC1CCSCC1 34a_100000070558_100000765890 [0,0,0,1,0,0|2,0,0]=3 6517 B15R1.778 CCOC(=O)CCOCC1CCSCC1 7a_100000070558_100011206558 [0,0,0,1,0,0|2,0,0]=3 6518 B15R1.778 CCOC(=O)CCOC[C@@H]1CNCCO1 34a_100015189573_100000765890 [0,0,0,1,0,0|3,0,0]=4 6519 B15R1.778 CCOC(=O)CCOC[C@@H]1COCCN1 34a_100000717676_100000765890 [0,0,0,1,0,0|3,0,0]=4 6520 B15R1.778 CCOC(=O)CCOC[C@H]1COCCO1 34a_100009875890_100000765890 [0,0,0,1,0,0|3,0,0]=4 6521 B15R1.778 CCOC(=O)CCSCC1CCCCC1 62a_100000211423_100000765890 [0,0,0,1,0,0|1,0,0]=2 6522 B15R1.778 CCOC(=O)CCSCC1CCCCC1 62a_100000765890_100000211423 [0,0,0,1,0,0|1,0,0]=2 6523 B15R1.778 CCOC(=O)CCSCC1CCCCO1 62a_100000211543_100000765890 [0,0,0,1,0,0|2,0,0]=3 6524 B15R1.778 CCOC(=O)CCSCC1CCCCO1 62a_100000765890_100000211543 [0,0,0,1,0,0|2,0,0]=3 6525 B15R1.778 CCOC(=O)CCSCC1CCCOC1 62a_100000741521_100000765890 [0,0,0,1,0,0|2,0,0]=3 6526 B15R1.778 CCOC(=O)CCSCC1CCCOC1 62a_100000765890_100000741521 [0,0,0,1,0,0|2,0,0]=3 6527 B15R1.778 CCOC(=O)CCSCC1CCOCC1 62a_100000754603_100000765890 [0,0,0,1,0,0|2,0,0]=3 6528 B15R1.778 CCOC(=O)CCSCC1CCOCC1 62a_100000765890_100000749018 [0,0,0,1,0,0|2,0,0]=3 6529 B15R1.778 CCOC(=O)CNCCC1=CCCCC1 2230a_100000212019_100000188475 [0,0,0,1,0,0|1,0,2]=4 6530 B15R1.778 CCOC(=O)CNCCC1=CCCCC1 34a_100000212019_100000188475 [0,0,0,1,0,0|1,0,2]=4 6531 B15R1.778 CCOC(=O)CNCCC1CCCCC1 2230a_100000738074_100000188475 [0,0,0,1,0,0|1,0,0]=2 6532 B15R1.778 CCOC(=O)CNCCC1CCCCC1 34a_100000738074_100000188475 [0,0,0,1,0,0|1,0,0]=2 6533 B15R1.778 CCOC(=O)CNCCC1CCCCO1 2230a_100015183643_100000188475 [0,0,0,1,0,0|2,0,0]=3 6534 B15R1.778 CCOC(=O)CNCCC1CCCCO1 34a_100015183643_100000188475 [0,0,0,1,0,0|2,0,0]=3 6535 B15R1.778 CCOC(=O)CNCCC1CCOCC1 2230a_100000755988_100000188475 [0,0,0,1,0,0|2,0,0]=3 6536 B15R1.778 CCOC(=O)CNCCC1CCOCC1 34a_100000755988_100000188475 [0,0,0,1,0,0|2,0,0]=3 6537 B15R1.778 CCOC(=O)CNCCN1CCSCC1 2230a_100000755026_100000188475 [0,0,0,1,0,0|3,0,0]=4 6538 B15R1.778 CCOC(=O)COCCC1CCCCC1 34a_100011217863_100000188475 [0,0,0,1,0,0|1,0,0]=2 6539 B15R1.778 CCOC(=O)COCCC1CCCCC1 7a_100011217863_100000188475 [0,0,0,1,0,0|1,0,0]=2 6540 B15R1.778 CCOC(=O)COCCC1CCCCN1 34a_100000211664_100000188475 [0,0,0,1,0,0|2,0,0]=3 6541 B15R1.778 CCOC(=O)COCCC1CCCNC1 34a_100000752241_100000188475 [0,0,0,1,0,0|2,0,0]=3 6542 B15R1.778 CCOC(=O)COCCC1CCNCC1 34a_100015190746_100000188475 [0,0,0,1,0,0|2,0,0]=3 6543 B15R1.778 CCOC(=O)COCCC1CCOCC1 34a_100011933979_100000188475 [0,0,0,1,0,0|2,0,0]=3 6544 B15R1.778 CCOC(=O)COCCC1CCOCC1 7a_100011933979_100000188475 [0,0,0,1,0,0|2,0,0]=3 6545 B15R1.778 CCOC(=O)COCCC1SCCCS1 34a_200011025297_100000188475 [0,0,0,1,0,0|3,0,0]=4 6546 B15R1.778 CCOC(=O)COCCC1SCCCS1 7a_200011025297_100000188475 [0,0,0,1,0,0|3,0,0]=4 6547 B15R1.778 CCOC(=O)COCCN1CCCOC1 2230a_100000131196_100000088970 [0,0,0,1,0,0|3,0,0]=4 6548 B15R1.778 CCOC(=O)COCCN1CCCOC1 269982a_100000131196_100000088970 [0,0,0,1,0,0|3,0,0]=4 6549 B15R1.778 CCOC(=O)COCCN1CCCOC1 34a_100000131196_100000088970 [0,0,0,1,0,0|3,0,0]=4 6550 B15R1.778 CCOC(=O)COCCN1CCOCC1 2230a_100015191051_100000088970 [0,0,0,1,0,0|3,0,0]=4 6551 B15R1.778 CCOC(=O)COCCN1CCOCC1 269982a_100015191051_100000088970 [0,0,0,1,0,0|3,0,0]=4 6552 B15R1.778 CCOC(=O)COCCN1CCOCC1 34a_100015191051_100000088970 [0,0,0,1,0,0|3,0,0]=4 6553 B15R1.778 CCOC(=O)COCCN1CCSCC1 2230a_100000737611_100000088970 [0,0,0,1,0,0|3,0,0]=4 6554 B15R1.778 CCOC(=O)COCCN1CCSCC1 269982a_100000737611_100000088970 [0,0,0,1,0,0|3,0,0]=4 6555 B15R1.778 CCOC(=O)COCCN1CCSCC1 7a_100000686052_100000188475 [0,0,0,1,0,0|3,0,0]=4 6556 B15R1.778 CCOC(=O)COCC[C@@H]1CNCCN1 34a_100016989929_100000188475 [0,0,0,1,0,0|3,0,0]=4 6557 B15R1.778 CCOC(=O)CSCCC1CCCCC1 62a_100000188475_100012355289 [0,0,0,1,0,0|1,0,0]=2 6558 B15R1.778 CCOC(=O)CSCCC1CCCCC1 62a_100012355289_100000188475 [0,0,0,1,0,0|1,0,0]=2 6559 B15R1.778 CCOC(=O)CSCCC1CCOCC1 62a_100000188475_100011934994 [0,0,0,1,0,0|2,0,0]=3 6560 B15R1.778 CCOC(=O)CSCCC1CCOCC1 62a_100011934994_100000188475 [0,0,0,1,0,0|2,0,0]=3 6561 B15R1.778 CCOC(=O)CSCCC1OCCCO1 62a_100000188475_100000764188 [0,0,0,1,0,0|3,0,0]=4 6562 B15R1.778 CCOC(=O)CSCCC1OCCCO1 62a_100000764188_100000188475 [0,0,0,1,0,0|3,0,0]=4 6563 B15R1.778 CCOC(=O)CSCCN1CCCCC1 62a_100000188475_100000739454 [0,0,0,1,0,0|2,0,0]=3 6564 B15R1.778 CCOC(=O)CSCCN1CCCCC1 62a_100000739454_100000188475 [0,0,0,1,0,0|2,0,0]=3 6565 B15R1.778 CCOC(=O)CSCCN1CCOCC1 62a_100000188475_100000211760 [0,0,0,1,0,0|3,0,0]=4 6566 B15R1.778 CCOC(=O)CSCOC1CCCCC1 62a_100000188475_100011935260 [0,0,0,1,0,0|2,0,0]=3 6567 B15R1.778 CCOC(=O)CSCOC1CCCCC1 62a_100011935260_100000188475 [0,0,0,1,0,0|2,0,0]=3 6568 B15R1.778 CCOC(=O)NCCOC1CCCCC1 34a_100000158857_100000210327 [0,0,0,1,0,0|2,0,0]=3 6569 B15R1.778 CCOC(=O)NCCOC1CCCCC1 7a_100000210231_200011445536 [0,0,0,1,0,0|2,0,0]=3 6570 B15R1.778 CCOC(=O)NCCOC1CCCOC1 34a_100000158857_100000693364 [0,0,0,1,0,0|3,0,0]=4 6571 B15R1.778 CCOC(=O)NCCOC1CCCSC1 7a_100015962668_200011445536 [0,0,0,1,0,0|3,0,0]=4 6572 B15R1.778 CCOC(=O)NCCOC1CCSCC1 34a_100000158857_100000069128 [0,0,0,1,0,0|3,0,0]=4 6573 B15R1.778 CCOC(=O)NCCOC1CCSCC1 7a_100000731022_200011445536 [0,0,0,1,0,0|3,0,0]=4 6574 B15R1.778 CCOC(=O)NCCSC1CCCCC1 62a_100000210327_200011445536 [0,0,0,1,0,0|2,0,0]=3 6575 B15R1.778 CCOC(=O)OCSCC1CCCCC1 62a_100000211423_100000075025 [0,0,0,1,0,0|2,0,0]=3 6576 B15R1.778 CCOC(=O)OCSCC1CCCCO1 62a_100000211543_100000075025 [0,0,0,1,0,0|3,0,0]=4 6577 B15R1.778 CCOC(=O)OCSCC1CCCOC1 62a_100000741521_100000075025 [0,0,0,1,0,0|3,0,0]=4 6578 B15R1.778 CCOC(=O)OCSCC1CCOCC1 62a_100000754603_100000075025 [0,0,0,1,0,0|3,0,0]=4 6579 B15R1.778 CNCC(=O)NCCCC1CCCCC1 2230a_106832991635_200000048884 [0,0,0,1,0,0|3,0,0]=4 6580 B15R1.778 CNCC(=O)NCCCC1CCCCC1 34a_100102657272_200000048884 [0,0,0,1,0,0|3,0,0]=4 6581 B15R1.778 CNCC(=O)NCCCC1CCCCC1 7a_106832991635_200000048884 [0,0,0,1,0,0|3,0,0]=4 6582 B15R1.778 CNNC(=O)CCCCC1CCCCC1 22a_100016993582_200011215547 [0,0,0,1,0,0|2,0,0]=3 6583 B15R1.778 CNNC(=O)CCCCN1CCCCC1 22a_100016993582_100000754417 [0,0,0,1,0,0|3,0,0]=4 6584 B15R1.778 CNNC(=O)NCCCC1CCCCC1 273464a_100011211642_100016993582 [0,0,0,1,0,0|3,0,0]=4 6585 B15R1.778 CNNC(=O)NCCCC1CCCCC1 512a_100011211642_100016993582 [0,0,0,1,0,0|3,0,0]=4 6586 B15R1.778 CNNC(=O)NCCCC1CCCCC1 512a_100016993582_100011211642 [0,0,0,1,0,0|3,0,0]=4 6587 B15R1.778 COCC(=O)NCCCC1CCCCC1 11a_100011211642_100000210968 [0,0,0,1,0,0|3,0,0]=4 6588 B15R1.778 COCC(=O)NCCCC1CCCCC1 1626a_100011211642_100000210968 [0,0,0,1,0,0|3,0,0]=4 6589 B15R1.778 COCC(=O)NCCCC1CCCCC1 240690a_100011211642_100000210968 [0,0,0,1,0,0|3,0,0]=4 6590 B15R1.778 COCC(=O)NCCCC1CCCCC1 34a_100138415774_200000048884 [0,0,0,1,0,0|3,0,0]=4 6591 B15R1.778 COCC(=O)NCCCC1CCCCC1 527a_100011211642_100000210968 [0,0,0,1,0,0|3,0,0]=4 6592 B15R1.778 CSCC(=O)NCCCC1CCCCC1 11a_100011211642_100000184570 [0,0,0,1,0,0|3,0,0]=4 6593 B15R1.778 CSCC(=O)NCCCC1CCCCC1 1626a_100011211642_100000184570 [0,0,0,1,0,0|3,0,0]=4 6594 B15R1.778 CSCC(=O)NCCCC1CCCCC1 240690a_100011211642_100000184570 [0,0,0,1,0,0|3,0,0]=4 6595 B15R1.778 CSCC(=O)NCCCC1CCCCC1 527a_100011211642_100000184570 [0,0,0,1,0,0|3,0,0]=4 6596 B15R1.778 CSCC(=O)NCCCC1CCCCC1 62a_200000048884_200000210301 [0,0,0,1,0,0|3,0,0]=4 6597 B15R1.778 CSCC(=O)NCCCC1CCCCC1 62a_200000210301_200000048884 [0,0,0,1,0,0|3,0,0]=4 6598 B15R1.778 N#CCC(=O)CCCCC1CCCCC1 1458a_200011215547_100011214920 [0,0,0,1,0,0|2,0,1]=4 6599 B15R1.778 O=C(CCF)CCCCC1CCCCC1 1458a_200011215547_100011217306 [0,0,0,1,0,0|2,0,0]=3 6600 B15R1.778 O=C(CCF)CCCCN1CCCCC1 1458a_100000754417_100011217306 [0,0,0,1,0,0|3,0,0]=4 6601 B15R1.778 O=C(CCO)CCCCC1CCCCC1 1458a_200011215547_100000211926 [0,0,0,1,0,0|2,0,0]=3 6602 B15R1.778 O=C(CCO)CCCCN1CCCCC1 1458a_100000754417_100000211926 [0,0,0,1,0,0|3,0,0]=4 6603 B15R1.778 O=C(CCO)NCCCC1CCCCC1 240690a_100011211642_100011216618 [0,0,0,1,0,0|3,0,0]=4 6604 B15R1.778 O=C(CNCCC1CCCCC1)NCO 2230a_100000738074_100000185155 [0,0,0,1,0,0|3,0,0]=4 6605 B15R1.778 O=C(CNCCC1CCCCC1)NCO 34a_100000738074_100000185155 [0,0,0,1,0,0|3,0,0]=4 6606 B15R1.778 O=C(COCCC1CCCCC1)NCO 34a_100011217863_100000185155 [0,0,0,1,0,0|3,0,0]=4 6607 B15R1.778 O=C(COCCC1CCCCC1)NCO 7a_100011217863_100000185155 [0,0,0,1,0,0|3,0,0]=4 6608 B15R1.778 O=C(CSCCC1CCCCC1)NCO 62a_100000185155_100012355289 [0,0,0,1,0,0|3,0,0]=4 6609 B15R1.778 O=C(CSCCC1CCCCC1)NCO 62a_100012355289_100000185155 [0,0,0,1,0,0|3,0,0]=4 6610 B15R1.778 [13CH3]SCC(=O)NCCCC1CCCCC1 62a_200000048884_200025704644 [0,0,0,1,0,0|3,0,0]=4 6611 B15R1.778 [13CH3]SCC(=O)NCCCC1CCCCC1 62a_200025704644_200000048884 [0,0,0,1,0,0|3,0,0]=4 6612 B15R1.795 C=COC(=O)CNCCCC1CCCC1 2230a_100000736752_100000036128 [0,0,0,1,0,0|1,0,2]=4 6613 B15R1.795 C=COC(=O)CNCCCC1CCCC1 34a_100000736752_100000036128 [0,0,0,1,0,0|1,0,2]=4 6614 B15R1.795 C=COC(=O)COCCCC1CCCC1 34a_100011215328_100000036128 [0,0,0,1,0,0|1,0,2]=4 6615 B15R1.795 C=COC(=O)CSCCCC1CCCC1 62a_100000036128_100011713738 [0,0,0,1,0,0|1,0,2]=4 6616 B15R1.795 C=COC(=O)CSCCCC1CCCC1 62a_100011713738_100000036128 [0,0,0,1,0,0|1,0,2]=4 6617 B15R1.795 CCCC(=O)CNCCCC1CCCC1 2230a_100000736752_100000747444 [0,0,0,1,0,0|2,0,0]=3 6618 B15R1.795 CCCC(=O)COCCCC1CCCC1 7a_100011215328_100000747444 [0,0,0,1,0,0|2,0,0]=3 6619 B15R1.795 CCCC(=O)COCCOC1CCCC1 7a_100000738311_100000747444 [0,0,0,1,0,0|3,0,0]=4 6620 B15R1.795 CCCC(=O)CSCCCC1CCCC1 62a_100000747444_100011713738 [0,0,0,1,0,0|2,0,0]=3 6621 B15R1.795 CCCC(=O)CSCCCC1CCCC1 62a_100011713738_100000747444 [0,0,0,1,0,0|2,0,0]=3 6622 B15R1.795 CCCC(=O)CSCCCN1CCCC1 62a_100000747444_100011445909 [0,0,0,1,0,0|3,0,0]=4 6623 B15R1.795 CCCC(=O)CSCCCN1CCCC1 62a_100016991639_100000747444 [0,0,0,1,0,0|3,0,0]=4 6624 B15R1.795 CCCC(=O)NCCCCN1CCCC1 1626a_100000740493_100000211992 [0,0,0,1,0,0|3,0,0]=4 6625 B15R1.795 CCCC(=O)NCCCCN1CCCC1 240690a_100000740493_100000211992 [0,0,0,1,0,0|3,0,0]=4 6626 B15R1.795 CCCC(=O)NCCCOC1CCCC1 11a_100000747560_100000211992 [0,0,0,1,0,0|3,0,0]=4 6627 B15R1.795 CCCC(=O)NCCCOC1CCCC1 1626a_100000747560_100000211992 [0,0,0,1,0,0|3,0,0]=4 6628 B15R1.795 CCCC(=O)NCCCOC1CCCC1 240690a_100000747560_100000211992 [0,0,0,1,0,0|3,0,0]=4 6629 B15R1.795 CCCC(=O)NCCCOC1CCCC1 527a_100000747560_100000211992 [0,0,0,1,0,0|3,0,0]=4 6630 B15R1.795 CCCC(=O)OCNCCC1CCCC1 2230a_100000739158_100000034017 [0,0,0,1,0,0|3,0,0]=4 6631 B15R1.795 CCCC(=O)OCNCCC1CCCC1 34a_100000739158_100000034017 [0,0,0,1,0,0|3,0,0]=4 6632 B15R1.795 CCCC(=O)OCOCCC1CCCC1 34a_100000749090_100000034017 [0,0,0,1,0,0|3,0,0]=4 6633 B15R1.795 CCCC(=O)OCSCCC1CCCC1 62a_100000760354_100000034017 [0,0,0,1,0,0|3,0,0]=4 6634 B15R1.795 CCNC(=O)CCNCCC1CCCC1 2230a_100000739158_100000737597 [0,0,0,1,0,0|2,0,0]=3 6635 B15R1.795 CCNC(=O)CCNCCC1CCCC1 34a_100025743525_100000760354 [0,0,0,1,0,0|2,0,0]=3 6636 B15R1.795 CCNC(=O)CCOCCC1CCCC1 7a_100000749090_100000737597 [0,0,0,1,0,0|2,0,0]=3 6637 B15R1.795 CCNC(=O)CCSCCC1CCCC1 62a_100000737597_100000760354 [0,0,0,1,0,0|2,0,0]=3 6638 B15R1.795 CCNC(=O)CCSCCC1CCCC1 62a_100000760354_100000737597 [0,0,0,1,0,0|2,0,0]=3 6639 B15R1.795 CCNC(=O)CCSCCN1CCCC1 62a_100000700749_100000737597 [0,0,0,1,0,0|3,0,0]=4 6640 B15R1.795 CCNC(=O)CCSCCN1CCCC1 62a_100000737597_100000004467 [0,0,0,1,0,0|3,0,0]=4 6641 B15R1.795 CCNC(=O)CNCCCC1CCCC1 2230a_100000736752_100000183381 [0,0,0,1,0,0|2,0,0]=3 6642 B15R1.795 CCNC(=O)CNCCCC1CCCC1 2230a_100016988866_100011713738 [0,0,0,1,0,0|2,0,0]=3 6643 B15R1.795 CCNC(=O)CNCCCC1CCCC1 34a_100000736752_100000183381 [0,0,0,1,0,0|2,0,0]=3 6644 B15R1.795 CCNC(=O)CNCCCN1CCCC1 2230a_100016988866_100011445909 [0,0,0,1,0,0|3,0,0]=4 6645 B15R1.795 CCNC(=O)CNCCOC1CCCC1 34a_100000741755_100000183381 [0,0,0,1,0,0|3,0,0]=4 6646 B15R1.795 CCNC(=O)COCCCC1CCCC1 34a_100011215328_100000183381 [0,0,0,1,0,0|2,0,0]=3 6647 B15R1.795 CCNC(=O)COCCCC1CCCC1 7a_100011215328_100000183381 [0,0,0,1,0,0|2,0,0]=3 6648 B15R1.795 CCNC(=O)COCCNC1CCCC1 34a_200000200444_100000183381 [0,0,0,1,0,0|3,0,0]=4 6649 B15R1.795 CCNC(=O)COCCOC1CCCC1 34a_100000738311_100000183381 [0,0,0,1,0,0|3,0,0]=4 6650 B15R1.795 CCNC(=O)COCCOC1CCCC1 7a_100000738311_100000183381 [0,0,0,1,0,0|3,0,0]=4 6651 B15R1.795 CCNC(=O)CSCCCC1CCCC1 62a_100000183381_100011713738 [0,0,0,1,0,0|2,0,0]=3 6652 B15R1.795 CCNC(=O)CSCCCC1CCCC1 62a_100011713738_100000183381 [0,0,0,1,0,0|2,0,0]=3 6653 B15R1.795 CCNC(=O)CSCCCN1CCCC1 62a_100000183381_100011445909 [0,0,0,1,0,0|3,0,0]=4 6654 B15R1.795 CCNC(=O)CSCCCN1CCCC1 62a_100016991639_100000183381 [0,0,0,1,0,0|3,0,0]=4 6655 B15R1.795 CCNC(=O)NCCCCN1CCCC1 2708a_100000740493_100015525214 [0,0,0,1,0,0|3,0,0]=4 6656 B15R1.795 CCNC(=O)NCCCCN1CCCC1 2708a_100015525214_100000740493 [0,0,0,1,0,0|3,0,0]=4 6657 B15R1.795 CCNC(=O)NCCCCN1CCCC1 273464a_100000740493_100015525214 [0,0,0,1,0,0|3,0,0]=4 6658 B15R1.795 CCNC(=O)NCCCCN1CCCC1 273464a_100015525214_100000740493 [0,0,0,1,0,0|3,0,0]=4 6659 B15R1.795 CCNC(=O)NCCCCN1CCCC1 512a_100000740493_100015525214 [0,0,0,1,0,0|3,0,0]=4 6660 B15R1.795 CCNC(=O)NCCCCN1CCCC1 512a_100015525214_100000740493 [0,0,0,1,0,0|3,0,0]=4 6661 B15R1.795 CCNC(=O)NCCCOC1CCCC1 2708a_100000747560_100015525214 [0,0,0,1,0,0|3,0,0]=4 6662 B15R1.795 CCNC(=O)NCCCOC1CCCC1 2708a_100015525214_100000747560 [0,0,0,1,0,0|3,0,0]=4 6663 B15R1.795 CCNC(=O)NCCCOC1CCCC1 273464a_100000747560_100015525214 [0,0,0,1,0,0|3,0,0]=4 6664 B15R1.795 CCNC(=O)NCCCOC1CCCC1 273464a_100015525214_100000747560 [0,0,0,1,0,0|3,0,0]=4 6665 B15R1.795 CCNC(=O)NCCCOC1CCCC1 512a_100000747560_100015525214 [0,0,0,1,0,0|3,0,0]=4 6666 B15R1.795 CCNC(=O)NCCCOC1CCCC1 512a_100015525214_100000747560 [0,0,0,1,0,0|3,0,0]=4 6667 B15R1.795 CCOC(=O)/C=C/CNCC1CCCC1 2230a_100000737975_100016267167 [0,0,0,1,0,0|1,0,2]=4 6668 B15R1.795 CCOC(=O)/C=C/CNCC1CCCC1 34a_100000737975_100016267167 [0,0,0,1,0,0|1,0,2]=4 6669 B15R1.795 CCOC(=O)/C=C/COCC1CCCC1 34a_100000742336_100016267167 [0,0,0,1,0,0|1,0,2]=4 6670 B15R1.795 CCOC(=O)/C=C/COCC1CCCC1 7a_100000742336_100016267167 [0,0,0,1,0,0|1,0,2]=4 6671 B15R1.795 CCOC(=O)/C=C/CSCC1CCCC1 62a_100000740388_100016267167 [0,0,0,1,0,0|1,0,2]=4 6672 B15R1.795 CCOC(=O)/C=C/CSCC1CCCC1 62a_100016267167_100000740388 [0,0,0,1,0,0|1,0,2]=4 6673 B15R1.795 CCOC(=O)CCCCCN1CC=CC1 269982a_100015195280_100000755133 [0,0,0,1,0,0|1,0,2]=4 6674 B15R1.795 CCOC(=O)CCCCCN1CCCC1 2230a_100000188435_100000755133 [0,0,0,1,0,0|1,0,0]=2 6675 B15R1.795 CCOC(=O)CCCCCN1CCCC1 269982a_100000188435_100000755133 [0,0,0,1,0,0|1,0,0]=2 6676 B15R1.795 CCOC(=O)CCCCCN1CCSC1 2230a_100011215254_100000755133 [0,0,0,1,0,0|2,0,0]=3 6677 B15R1.795 CCOC(=O)CCCCCN1CCSC1 269982a_100011215254_100000755133 [0,0,0,1,0,0|2,0,0]=3 6678 B15R1.795 CCOC(=O)CCCCNC1CC=CC1 2230a_100015188752_100000750268 [0,0,0,1,0,0|1,0,2]=4 6679 B15R1.795 CCOC(=O)CCCCNC1CCCC1 2230a_100000211070_100000750268 [0,0,0,1,0,0|1,0,0]=2 6680 B15R1.795 CCOC(=O)CCCCNC1CCCC1 34a_100000211070_100000750268 [0,0,0,1,0,0|1,0,0]=2 6681 B15R1.795 CCOC(=O)CCCCN[C@@H]1CCOC1 2230a_200015188469_100000750268 [0,0,0,1,0,0|2,0,0]=3 6682 B15R1.795 CCOC(=O)CCCCN[C@H]1CCOC1 2230a_100015188467_100000750268 [0,0,0,1,0,0|2,0,0]=3 6683 B15R1.795 CCOC(=O)CCCCN[C@H]1CCOC1 34a_100015188467_100000750268 [0,0,0,1,0,0|2,0,0]=3 6684 B15R1.795 CCOC(=O)CCCCOC1CCCC1 34a_100000210269_100000750268 [0,0,0,1,0,0|1,0,0]=2 6685 B15R1.795 CCOC(=O)CCCCOC1CCCC1 7a_100000210269_100000750268 [0,0,0,1,0,0|1,0,0]=2 6686 B15R1.795 CCOC(=O)CCCCOC1CCCO1 34a_100000085407_100000750268 [0,0,0,1,0,0|2,0,0]=3 6687 B15R1.795 CCOC(=O)CCCCOC1CCSC1 7a_100011232664_100000750268 [0,0,0,1,0,0|2,0,0]=3 6688 B15R1.795 CCOC(=O)CCCCO[C@H]1CCOC1 34a_100000717292_100000750268 [0,0,0,1,0,0|2,0,0]=3 6689 B15R1.795 CCOC(=O)CCCCSC1CCCC1 62a_100000750268_100000179811 [0,0,0,1,0,0|1,0,0]=2 6690 B15R1.795 CCOC(=O)CCCCSC1CCCC1 62a_100011217020_100000750268 [0,0,0,1,0,0|1,0,0]=2 6691 B15R1.795 CCOC(=O)CCCCSC1CCOC1 62a_100000750268_100000690089 [0,0,0,1,0,0|2,0,0]=3 6692 B15R1.795 CCOC(=O)CCCNCC1CCCC1 2230a_100000737975_100009991533 [0,0,0,1,0,0|1,0,0]=2 6693 B15R1.795 CCOC(=O)CCCNCC1CCCC1 34a_100000737975_100009991533 [0,0,0,1,0,0|1,0,0]=2 6694 B15R1.795 CCOC(=O)CCCNCC1CCOC1 2230a_100000737293_100009991533 [0,0,0,1,0,0|2,0,0]=3 6695 B15R1.795 CCOC(=O)CCCNCC1CCOC1 34a_100000737293_100009991533 [0,0,0,1,0,0|2,0,0]=3 6696 B15R1.795 CCOC(=O)CCCNCC1OCCO1 2230a_100000036311_100009991533 [0,0,0,1,0,0|3,0,0]=4 6697 B15R1.795 CCOC(=O)CCCNCC1OCCO1 34a_100000036311_100009991533 [0,0,0,1,0,0|3,0,0]=4 6698 B15R1.795 CCOC(=O)CCCNC[C@@H]1CCCO1 2230a_100020590478_100009991533 [0,0,0,1,0,0|2,0,0]=3 6699 B15R1.795 CCOC(=O)CCCNC[C@@H]1CCCO1 34a_100020590478_100009991533 [0,0,0,1,0,0|2,0,0]=3 6700 B15R1.795 CCOC(=O)CCCOCC1CC=CC1 34a_100000688395_100009991533 [0,0,0,1,0,0|1,0,2]=4 6701 B15R1.795 CCOC(=O)CCCOCC1CCCC1 34a_100000742336_100009991533 [0,0,0,1,0,0|1,0,0]=2 6702 B15R1.795 CCOC(=O)CCCOCC1CCCC1 7a_100000742336_100011215271 [0,0,0,1,0,0|1,0,0]=2 6703 B15R1.795 CCOC(=O)CCCOCC1CCCC1 7a_100012001163_100000740388 [0,0,0,1,0,0|1,0,0]=2 6704 B15R1.795 CCOC(=O)CCCOCC1CCCO1 34a_100000210270_100009991533 [0,0,0,1,0,0|2,0,0]=3 6705 B15R1.795 CCOC(=O)CCCOCC1CCCO1 7a_100000210270_100011215271 [0,0,0,1,0,0|2,0,0]=3 6706 B15R1.795 CCOC(=O)CCCOCC1CCCO1 7a_100012001163_100000203698 [0,0,0,1,0,0|2,0,0]=3 6707 B15R1.795 CCOC(=O)CCCOCC1CCNC1 34a_100000748654_100009991533 [0,0,0,1,0,0|2,0,0]=3 6708 B15R1.795 CCOC(=O)CCCOCC1CCOC1 34a_100000740260_100009991533 [0,0,0,1,0,0|2,0,0]=3 6709 B15R1.795 CCOC(=O)CCCOCC1CCOC1 7a_100012001163_100000702531 [0,0,0,1,0,0|2,0,0]=3 6710 B15R1.795 CCOC(=O)CCCOCC1COCO1 34a_100011216627_100009991533 [0,0,0,1,0,0|3,0,0]=4 6711 B15R1.795 CCOC(=O)CCCOCC1OCCO1 34a_100000087154_100009991533 [0,0,0,1,0,0|3,0,0]=4 6712 B15R1.795 CCOC(=O)CCCOCC1OCCO1 7a_100012001163_100000755774 [0,0,0,1,0,0|3,0,0]=4 6713 B15R1.795 CCOC(=O)CCCOC[C@H]1CCCN1 34a_100000745186_100009991533 [0,0,0,1,0,0|2,0,0]=3 6714 B15R1.795 CCOC(=O)CCCSCC1CCCC1 62a_100000740388_100009991533 [0,0,0,1,0,0|1,0,0]=2 6715 B15R1.795 CCOC(=O)CCCSCC1CCCC1 62a_100009991533_100000740388 [0,0,0,1,0,0|1,0,0]=2 6716 B15R1.795 CCOC(=O)CCCSCC1CCCO1 62a_100000203698_100009991533 [0,0,0,1,0,0|2,0,0]=3 6717 B15R1.795 CCOC(=O)CCCSCC1CCCO1 62a_100009991533_100000203698 [0,0,0,1,0,0|2,0,0]=3 6718 B15R1.795 CCOC(=O)CCCSCC1CCOC1 62a_100000702531_100009991533 [0,0,0,1,0,0|2,0,0]=3 6719 B15R1.795 CCOC(=O)CCCSCC1CCOC1 62a_100009991533_100000702531 [0,0,0,1,0,0|2,0,0]=3 6720 B15R1.795 CCOC(=O)CCCSCC1OCCO1 62a_100000755774_100009991533 [0,0,0,1,0,0|3,0,0]=4 6721 B15R1.795 CCOC(=O)CCCSCC1OCCO1 62a_100009991533_100000755774 [0,0,0,1,0,0|3,0,0]=4 6722 B15R1.795 CCOC(=O)CCNCCC1CCCC1 2230a_100000739158_100011206558 [0,0,0,1,0,0|1,0,0]=2 6723 B15R1.795 CCOC(=O)CCNCCC1CCCC1 34a_100000739158_100000765890 [0,0,0,1,0,0|1,0,0]=2 6724 B15R1.795 CCOC(=O)CCNCCC1OCCO1 2230a_100000034215_100011206558 [0,0,0,1,0,0|3,0,0]=4 6725 B15R1.795 CCOC(=O)CCNCCC1OCCO1 34a_100000034215_100000765890 [0,0,0,1,0,0|3,0,0]=4 6726 B15R1.795 CCOC(=O)CCOCCC1CCCC1 34a_100000749090_100000765890 [0,0,0,1,0,0|1,0,0]=2 6727 B15R1.795 CCOC(=O)CCOCCC1CCCC1 7a_100000749090_100011206558 [0,0,0,1,0,0|1,0,0]=2 6728 B15R1.795 CCOC(=O)CCOCCC1CCNC1 34a_100016987287_100000765890 [0,0,0,1,0,0|2,0,0]=3 6729 B15R1.795 CCOC(=O)CCOCCC1CCOC1 34a_100011879284_100000765890 [0,0,0,1,0,0|2,0,0]=3 6730 B15R1.795 CCOC(=O)CCSCCC1CCCC1 62a_100000760354_100000765890 [0,0,0,1,0,0|1,0,0]=2 6731 B15R1.795 CCOC(=O)CCSCCC1CCCC1 62a_100000765890_100000760354 [0,0,0,1,0,0|1,0,0]=2 6732 B15R1.795 CCOC(=O)CCSCCC1OCCO1 62a_100000765890_100000740749 [0,0,0,1,0,0|3,0,0]=4 6733 B15R1.795 CCOC(=O)CCSCCN1CCCC1 62a_100000700749_100000765890 [0,0,0,1,0,0|2,0,0]=3 6734 B15R1.795 CCOC(=O)CCSCCN1CCCC1 62a_100000765890_100000004467 [0,0,0,1,0,0|2,0,0]=3 6735 B15R1.795 CCOC(=O)CNCCCC1CCCC1 2230a_100000736752_100000188475 [0,0,0,1,0,0|1,0,0]=2 6736 B15R1.795 CCOC(=O)CNCCCC1CCCC1 34a_100000736752_100000188475 [0,0,0,1,0,0|1,0,0]=2 6737 B15R1.795 CCOC(=O)CNCCOC1CCCC1 34a_100000741755_100000188475 [0,0,0,1,0,0|2,0,0]=3 6738 B15R1.795 CCOC(=O)COCCCC1CCCC1 34a_100011215328_100000188475 [0,0,0,1,0,0|1,0,0]=2 6739 B15R1.795 CCOC(=O)COCCCC1CCCC1 7a_100011215328_100000188475 [0,0,0,1,0,0|1,0,0]=2 6740 B15R1.795 CCOC(=O)COCCCC1OCCO1 34a_100009871617_100000188475 [0,0,0,1,0,0|3,0,0]=4 6741 B15R1.795 CCOC(=O)COCCCC1OCCO1 7a_100009871617_100000188475 [0,0,0,1,0,0|3,0,0]=4 6742 B15R1.795 CCOC(=O)COCCCN1CCCC1 2230a_100000188435_100009893628 [0,0,0,1,0,0|2,0,0]=3 6743 B15R1.795 CCOC(=O)COCCCN1CCCC1 269982a_100000188435_100009893628 [0,0,0,1,0,0|2,0,0]=3 6744 B15R1.795 CCOC(=O)COCCCN1CCSC1 2230a_100011215254_100009893628 [0,0,0,1,0,0|3,0,0]=4 6745 B15R1.795 CCOC(=O)COCCCN1CCSC1 269982a_100011215254_100009893628 [0,0,0,1,0,0|3,0,0]=4 6746 B15R1.795 CCOC(=O)COCCNC1CCCC1 2230a_100000211070_100000088970 [0,0,0,1,0,0|2,0,0]=3 6747 B15R1.795 CCOC(=O)COCCNC1CCCC1 34a_100000211070_100000088970 [0,0,0,1,0,0|2,0,0]=3 6748 B15R1.795 CCOC(=O)COCCNC1CCCC1 34a_200000200444_100000188475 [0,0,0,1,0,0|2,0,0]=3 6749 B15R1.795 CCOC(=O)COCCN[C@@H]1CCOC1 2230a_200015188469_100000088970 [0,0,0,1,0,0|3,0,0]=4 6750 B15R1.795 CCOC(=O)COCCN[C@H]1CCOC1 2230a_100015188467_100000088970 [0,0,0,1,0,0|3,0,0]=4 6751 B15R1.795 CCOC(=O)COCCN[C@H]1CCOC1 34a_100015188467_100000088970 [0,0,0,1,0,0|3,0,0]=4 6752 B15R1.795 CCOC(=O)COCCOC1CCCC1 34a_100000210269_100000088970 [0,0,0,1,0,0|2,0,0]=3 6753 B15R1.795 CCOC(=O)COCCOC1CCCC1 34a_100000738311_100000188475 [0,0,0,1,0,0|2,0,0]=3 6754 B15R1.795 CCOC(=O)COCCOC1CCCC1 7a_100000210269_100000088970 [0,0,0,1,0,0|2,0,0]=3 6755 B15R1.795 CCOC(=O)COCCOC1CCCC1 7a_100000738311_100000188475 [0,0,0,1,0,0|2,0,0]=3 6756 B15R1.795 CCOC(=O)COCCOC1CCCO1 34a_100000085407_100000088970 [0,0,0,1,0,0|3,0,0]=4 6757 B15R1.795 CCOC(=O)COCCOC1CCSC1 7a_100011232664_100000088970 [0,0,0,1,0,0|3,0,0]=4 6758 B15R1.795 CCOC(=O)COCCO[C@H]1CCOC1 34a_100000717292_100000088970 [0,0,0,1,0,0|3,0,0]=4 6759 B15R1.795 CCOC(=O)COCCSC1CCCC1 62a_100000088970_100000179811 [0,0,0,1,0,0|2,0,0]=3 6760 B15R1.795 CCOC(=O)COCCSC1CCCC1 62a_100011217020_100000088970 [0,0,0,1,0,0|2,0,0]=3 6761 B15R1.795 CCOC(=O)COCCSC1CCOC1 62a_100000088970_100000690089 [0,0,0,1,0,0|3,0,0]=4 6762 B15R1.795 CCOC(=O)CSCCCC1CCCC1 62a_100000188475_100011713738 [0,0,0,1,0,0|1,0,0]=2 6763 B15R1.795 CCOC(=O)CSCCCC1CCCC1 62a_100011713738_100000188475 [0,0,0,1,0,0|1,0,0]=2 6764 B15R1.795 CCOC(=O)CSCCCC1OCCO1 62a_100000188475_100000042513 [0,0,0,1,0,0|3,0,0]=4 6765 B15R1.795 CCOC(=O)CSCCCN1CCCC1 62a_100000188475_100011445909 [0,0,0,1,0,0|2,0,0]=3 6766 B15R1.795 CCOC(=O)CSCCCN1CCCC1 62a_100016991639_100000188475 [0,0,0,1,0,0|2,0,0]=3 6767 B15R1.795 CCOC(=O)CSCCOC1CCCC1 7a_200000230590_100000179811 [0,0,0,1,0,0|2,0,0]=3 6768 B15R1.795 CCOC(=O)CSCCOC1CCOC1 7a_200000230590_100000731011 [0,0,0,1,0,0|3,0,0]=4 6769 B15R1.795 CCOC(=O)NCCOCC1CCCC1 34a_100000158857_100000740388 [0,0,0,1,0,0|2,0,0]=3 6770 B15R1.795 CCOC(=O)NCCOCC1CCCC1 7a_100000742336_200011445536 [0,0,0,1,0,0|2,0,0]=3 6771 B15R1.795 CCOC(=O)NCCOCC1CCCO1 7a_100000210270_200011445536 [0,0,0,1,0,0|3,0,0]=4 6772 B15R1.795 CCOC(=O)NCCOCC1CCOC1 34a_100000158857_100011261433 [0,0,0,1,0,0|3,0,0]=4 6773 B15R1.795 CCOC(=O)NCCSCC1CCCC1 62a_100000740388_200011445536 [0,0,0,1,0,0|2,0,0]=3 6774 B15R1.795 CCOC(=O)NCCSCC1CCCO1 62a_100000203698_200011445536 [0,0,0,1,0,0|3,0,0]=4 6775 B15R1.795 CCOC(=O)NCCSCC1CCOC1 62a_100000702531_200011445536 [0,0,0,1,0,0|3,0,0]=4 6776 B15R1.795 CCOC(=O)OCSCCC1CCCC1 62a_100000760354_100000075025 [0,0,0,1,0,0|2,0,0]=3 6777 B15R1.795 CCOC(=O)OCSCCN1CCCC1 62a_100000700749_100000075025 [0,0,0,1,0,0|3,0,0]=4 6778 B15R1.795 O=C(CNCCCC1CCCC1)NCO 2230a_100000736752_100000185155 [0,0,0,1,0,0|3,0,0]=4 6779 B15R1.795 O=C(CNCCCC1CCCC1)NCO 34a_100000736752_100000185155 [0,0,0,1,0,0|3,0,0]=4 6780 B15R1.795 O=C(COCCCC1CCCC1)NCO 34a_100011215328_100000185155 [0,0,0,1,0,0|3,0,0]=4 6781 B15R1.795 O=C(COCCCC1CCCC1)NCO 7a_100011215328_100000185155 [0,0,0,1,0,0|3,0,0]=4 6782 B15R1.795 O=C(CSCCCC1CCCC1)NCO 62a_100000185155_100011713738 [0,0,0,1,0,0|3,0,0]=4 6783 B15R1.795 O=C(CSCCCC1CCCC1)NCO 62a_100011713738_100000185155 [0,0,0,1,0,0|3,0,0]=4 6784 B15R1.804 CCCC(=O)CNCC1CCCN1CC 2230a_100000211693_100000747444 [0,0,0,1,0,0|3,0,0]=4 6785 B15R1.804 CCCC(=O)COC[C@H]1CCCN1CC 7a_100011739246_100000747444 [0,0,0,1,0,0|3,0,0]=4 6786 B15R1.804 CCNC(=O)CCNC1CCCC1CC 269862a_100025743525_100000749056 [0,0,0,1,0,0|2,0,0]=3 6787 B15R1.804 CCNC(=O)CCNC1CCCC1CC 270004a_100025743525_100000749056 [0,0,0,1,0,0|2,0,0]=3 6788 B15R1.804 CCNC(=O)CNCC1CCCN1CC 2230a_100000211693_100000183381 [0,0,0,1,0,0|3,0,0]=4 6789 B15R1.804 CCNC(=O)COC[C@H]1CCCN1CC 34a_100011739246_100000183381 [0,0,0,1,0,0|3,0,0]=4 6790 B15R1.804 CCNC(=O)COC[C@H]1CCCN1CC 7a_100011739246_100000183381 [0,0,0,1,0,0|3,0,0]=4 6791 B15R1.804 CCOC(=O)/C=C/CN1CCCC1CC 2230a_100000754278_100016267167 [0,0,0,1,0,0|1,0,2]=4 6792 B15R1.804 CCOC(=O)/C=C/CN1CCCC1CC 269982a_100000754278_100016267167 [0,0,0,1,0,0|1,0,2]=4 6793 B15R1.804 CCOC(=O)/C=C/CN1CCCC1CC 34a_100000754278_100016267167 [0,0,0,1,0,0|1,0,2]=4 6794 B15R1.804 CCOC(=O)CCCN1CC=CC1CC 2230a_100000730860_100009991533 [0,0,0,1,0,0|1,0,2]=4 6795 B15R1.804 CCOC(=O)CCCN1CC=CC1CC 269982a_100000730860_100009991533 [0,0,0,1,0,0|1,0,2]=4 6796 B15R1.804 CCOC(=O)CCCN1CC=CC1CC 34a_100000730860_100009991533 [0,0,0,1,0,0|1,0,2]=4 6797 B15R1.804 CCOC(=O)CCCN1CCCC1C#N 2230a_100000701862_100009991533 [0,0,0,1,0,0|2,0,1]=4 6798 B15R1.804 CCOC(=O)CCCN1CCCC1CC 2230a_100000754278_100009991533 [0,0,0,1,0,0|1,0,0]=2 6799 B15R1.804 CCOC(=O)CCCN1CCCC1CC 269982a_100000754278_100009991533 [0,0,0,1,0,0|1,0,0]=2 6800 B15R1.804 CCOC(=O)CCCN1CCCC1CC 34a_100000754278_100009991533 [0,0,0,1,0,0|1,0,0]=2 6801 B15R1.804 CCOC(=O)CCCN1CCC[C@@H]1C#N 2230a_106645074975_100009991533 [0,0,0,1,0,0|2,0,1]=4 6802 B15R1.804 CCOC(=O)CCCN1CCC[C@@H]1C#N 269982a_106645074975_100009991533 [0,0,0,1,0,0|2,0,1]=4 6803 B15R1.804 CCOC(=O)CCCN1CCC[C@@H]1CO 2230a_100000745186_100009991533 [0,0,0,1,0,0|2,0,0]=3 6804 B15R1.804 CCOC(=O)CCCN1CCC[C@@H]1CO 269982a_100000745186_100009991533 [0,0,0,1,0,0|2,0,0]=3 6805 B15R1.804 CCOC(=O)CCCN1CCC[C@@H]1CO 34a_100000745186_100009991533 [0,0,0,1,0,0|2,0,0]=3 6806 B15R1.804 CCOC(=O)CCO[C@@H]1CCC[C@H]1C#N 34a_100011907464_100000765890 [0,0,0,1,0,0|2,0,1]=4 6807 B15R1.804 CCOC(=O)CCO[C@@H]1CCC[C@H]1C#N 7a_100011907464_100011206558 [0,0,0,1,0,0|2,0,1]=4 6808 B15R1.804 CCOC(=O)CNCC1CCCN1CC 2230a_100000211693_100000188475 [0,0,0,1,0,0|2,0,0]=3 6809 B15R1.804 CCOC(=O)COC[C@H]1CCCN1CC 34a_100011739246_100000188475 [0,0,0,1,0,0|2,0,0]=3 6810 B15R1.804 CCOC(=O)COC[C@H]1CCCN1CC 7a_100011739246_100000188475 [0,0,0,1,0,0|2,0,0]=3 6811 B15R1.804 CCOC(=O)NCCN1CCCC1CC 269982a_100000754278_200011445536 [0,0,0,1,0,0|2,0,0]=3 6812 B15R1.804 CCOC(=O)NCCN1CCC[C@@H]1CO 269982a_100000745186_200011445536 [0,0,0,1,0,0|3,0,0]=4 6813 B15R1.843 C#CCCN1CCCCC1C(=O)OCC 2230a_100016990872_100000688953 [0,0,0,1,0,0|1,0,2]=4 6814 B15R1.843 C#CCCN1CCCCC1C(=O)OCC 269982a_100016990872_100000730999 [0,0,0,1,0,0|1,0,2]=4 6815 B15R1.843 C#CCOC1CCCCC1C(=O)OCC 7a_100000038711_100000038162 [0,0,0,1,0,0|1,0,2]=4 6816 B15R1.843 C/C=C/CN1CCCCC1C(=O)OCC 269982a_100016990872_100102629194 [0,0,0,1,0,0|1,0,2]=4 6817 B15R1.843 C=CCCN1CCCCC1C(=O)OCC 2230a_100016990872_100000754431 [0,0,0,1,0,0|1,0,2]=4 6818 B15R1.843 C=CCCN1CCCCC1C(=O)OCC 269982a_100016990872_100000754431 [0,0,0,1,0,0|1,0,2]=4 6819 B15R1.843 C=CCOC1CCCCC1C(=O)OCC 7a_100000038711_100015514636 [0,0,0,1,0,0|1,0,2]=4 6820 B15R1.843 CC#CCN1CCCCC1C(=O)OCC 2230a_100016990872_100000748600 [0,0,0,1,0,0|1,0,2]=4 6821 B15R1.843 CC=CCN1CCCCC1C(=O)OCC 2230a_100016990872_100000070051 [0,0,0,1,0,0|1,0,2]=4 6822 B15R1.843 CCCC(=O)N1CCCCC1CCCO 240690a_100011934581_100000211992 [0,0,0,1,0,0|3,0,0]=4 6823 B15R1.843 CCCC(=O)N1CCCCC1CCOC 11a_100015186528_100000211992 [0,0,0,1,0,0|3,0,0]=4 6824 B15R1.843 CCCC(=O)N1CCCCC1CCOC 1626a_100015186528_100000211992 [0,0,0,1,0,0|3,0,0]=4 6825 B15R1.843 CCCC(=O)N1CCCCC1CCOC 240690a_100015186528_100000211992 [0,0,0,1,0,0|3,0,0]=4 6826 B15R1.843 CCCC(=O)N1CCCCC1CCOC 527a_100015186528_100000211992 [0,0,0,1,0,0|3,0,0]=4 6827 B15R1.843 CCCCN1CCCCC1C(=O)OCC 2230a_100016990872_100000210211 [0,0,0,1,0,0|1,0,0]=2 6828 B15R1.843 CCCCN1CCCCC1C(=O)OCC 269982a_100016990872_100000210211 [0,0,0,1,0,0|1,0,0]=2 6829 B15R1.843 CCCCN1CCOC[C@H]1C(=O)OCC 2230a_100015229691_100000210211 [0,0,0,1,0,0|2,0,0]=3 6830 B15R1.843 CCCCN1CCOC[C@H]1C(=O)OCC 269982a_100015229691_100000210211 [0,0,0,1,0,0|2,0,0]=3 6831 B15R1.843 CCCCN1CCSCC1C(=O)OCC 2230a_100000735462_100000210211 [0,0,0,1,0,0|2,0,0]=3 6832 B15R1.843 CCCCN1CCSCC1C(=O)OCC 269982a_100000735462_100000210211 [0,0,0,1,0,0|2,0,0]=3 6833 B15R1.843 CCCOC1CCCCC1C(=O)OCC 7a_100000038711_100000210303 [0,0,0,1,0,0|1,0,0]=2 6834 B15R1.843 CCNC(=O)N1CCCCC1CCCO 2708a_100015525214_100011934581 [0,0,0,1,0,0|3,0,0]=4 6835 B15R1.843 CCNC(=O)N1CCCCC1CCCO 273464a_100015525214_100011934581 [0,0,0,1,0,0|3,0,0]=4 6836 B15R1.843 CCNC(=O)N1CCCCC1CCOC 2708a_100015525214_100015186528 [0,0,0,1,0,0|3,0,0]=4 6837 B15R1.843 CCNC(=O)N1CCCCC1CCOC 273464a_100015525214_100015186528 [0,0,0,1,0,0|3,0,0]=4 6838 B15R1.843 CCNN=C1CCCCC1C(=O)OCC 4a_100000756455_100000211989 [0,0,0,1,0,0|2,0,1]=4 6839 B15R1.843 CCOC(=O)C1CCCCC1OCC#N 7a_100000038711_100011215382 [0,0,0,1,0,0|2,0,1]=4 6840 B15R1.843 CCOC(=O)C1CCCCC1OCC=O 7a_100000038711_200015260668 [0,0,0,1,0,0|2,0,1]=4 6841 B15R1.843 CCOC(=O)C1CCCCC1OCCF 7a_100000038711_100011217306 [0,0,0,1,0,0|2,0,0]=3 6842 B15R1.843 CCOC(=O)C1CCCCC1OCCO 7a_100000038711_100000211926 [0,0,0,1,0,0|2,0,0]=3 6843 B15R1.843 CCOC(=O)C1CCCCN1CCC#N 2230a_100016990872_100011215226 [0,0,0,1,0,0|2,0,1]=4 6844 B15R1.843 CCOC(=O)C1CCCCN1CCC#N 269982a_100016990872_100011215226 [0,0,0,1,0,0|2,0,1]=4 6845 B15R1.843 CCOC(=O)C1CCCCN1CCCF 2230a_100016990872_100011934791 [0,0,0,1,0,0|2,0,0]=3 6846 B15R1.843 CCOC(=O)C1CCCCN1CCCF 269982a_100016990872_100011934791 [0,0,0,1,0,0|2,0,0]=3 6847 B15R1.843 CCOC(=O)C1CCCCN1CCCO 2230a_100016990872_100000230001 [0,0,0,1,0,0|2,0,0]=3 6848 B15R1.843 CCOC(=O)C1CCCCN1CCCO 269982a_100016990872_100011215043 [0,0,0,1,0,0|2,0,0]=3 6849 B15R1.843 CCOC(=O)C1CCCCN1CCOC 2230a_100016990872_100011201679 [0,0,0,1,0,0|2,0,0]=3 6850 B15R1.843 CCOC(=O)C1CCCCN1CCOC 269982a_100016990872_100000233755 [0,0,0,1,0,0|2,0,0]=3 6851 B15R1.843 CCOC(=O)C1CCCCN1CCSC 2230a_100016990872_100000751147 [0,0,0,1,0,0|2,0,0]=3 6852 B15R1.843 CCOC(=O)C1CCCCN1CCSC 269982a_100016990872_100000212216 [0,0,0,1,0,0|2,0,0]=3 6853 B15R1.843 CCOC(=O)C1CSCCN1CCCF 2230a_100000735462_100011934791 [0,0,0,1,0,0|3,0,0]=4 6854 B15R1.843 CCOC(=O)C1CSCCN1CCCF 269982a_100000735462_100011934791 [0,0,0,1,0,0|3,0,0]=4 6855 B15R1.843 CCOC(=O)C1CSCCN1CCCO 2230a_100000735462_100000230001 [0,0,0,1,0,0|3,0,0]=4 6856 B15R1.843 CCOC(=O)C1CSCCN1CCCO 269982a_100000735462_100011215043 [0,0,0,1,0,0|3,0,0]=4 6857 B15R1.843 CCOC(=O)C1CSCCN1CCOC 2230a_100000735462_100011201679 [0,0,0,1,0,0|3,0,0]=4 6858 B15R1.843 CCOC(=O)C1CSCCN1CCOC 269982a_100000735462_100000233755 [0,0,0,1,0,0|3,0,0]=4 6859 B15R1.843 CCOC(=O)C1CSCCN1CCSC 2230a_100000735462_100000751147 [0,0,0,1,0,0|3,0,0]=4 6860 B15R1.843 CCOC(=O)C1CSCCN1CCSC 269982a_100000735462_100000212216 [0,0,0,1,0,0|3,0,0]=4 6861 B15R1.843 CCOC(=O)[C@@H]1COCCN1CCCF 2230a_100015229691_100011934791 [0,0,0,1,0,0|3,0,0]=4 6862 B15R1.843 CCOC(=O)[C@@H]1COCCN1CCCF 269982a_100015229691_100011934791 [0,0,0,1,0,0|3,0,0]=4 6863 B15R1.843 CCOC(=O)[C@@H]1COCCN1CCCO 2230a_100015229691_100000230001 [0,0,0,1,0,0|3,0,0]=4 6864 B15R1.843 CCOC(=O)[C@@H]1COCCN1CCCO 269982a_100015229691_100011215043 [0,0,0,1,0,0|3,0,0]=4 6865 B15R1.843 CCOC(=O)[C@@H]1COCCN1CCOC 2230a_100015229691_100011201679 [0,0,0,1,0,0|3,0,0]=4 6866 B15R1.843 CCOC(=O)[C@@H]1COCCN1CCOC 269982a_100015229691_100000233755 [0,0,0,1,0,0|3,0,0]=4 6867 B15R1.843 CCOC(=O)[C@@H]1COCCN1CCSC 2230a_100015229691_100000751147 [0,0,0,1,0,0|3,0,0]=4 6868 B15R1.843 CCOC(=O)[C@@H]1COCCN1CCSC 269982a_100015229691_100000212216 [0,0,0,1,0,0|3,0,0]=4 6869 B15R1.843 CCOCN1CCCCC1C(=O)OCC 269982a_100016990872_100000739092 [0,0,0,1,0,0|2,0,0]=3 6870 B15R1.843 CCOCN1CCOC[C@H]1C(=O)OCC 269982a_100015229691_100000739092 [0,0,0,1,0,0|3,0,0]=4 6871 B15R1.843 CCOCN1CCSCC1C(=O)OCC 269982a_100000735462_100000739092 [0,0,0,1,0,0|3,0,0]=4 6872 B15R1.854 CCCCC1C=CCN1CC(=O)OCC 2230a_100015184376_100000188475 [0,0,0,1,0,0|1,0,2]=4 6873 B15R1.854 CCCCC1C=CCN1CC(=O)OCC 269982a_100015184376_100000188475 [0,0,0,1,0,0|1,0,2]=4 6874 B15R1.854 CCCCC1C=CCN1CC(=O)OCC 34a_100015184376_100000188475 [0,0,0,1,0,0|1,0,2]=4 6875 B15R1.854 CCNN=C1CCCC1CC(=O)OCC 4a_100000756455_100000033388 [0,0,0,1,0,0|2,0,1]=4 6876 B15R1.1137 CNC1CCCCCCCCCCC1=O 2230a_106832991635_200009990614 [0,0,0,1,0,0|2,0,0]=3 6877 B15R1.1137 CNC1CCCCCCCCCCC1=O 34a_100102657272_200009990614 [0,0,0,1,0,0|2,0,0]=3 6878 B15R1.1137 CNC1CCCCCCCCCCC1=O 7a_106832991635_200009990614 [0,0,0,1,0,0|2,0,0]=3 6879 B15R1.1137 COC1CCCCCCCCCCC1=O 34a_100138415774_200009990614 [0,0,0,1,0,0|2,0,0]=3 6880 B15R1.1137 CSC1CCCCCCCCCCC1=O 62a_200000210301_200009990614 [0,0,0,1,0,0|2,0,0]=3 6881 B15R1.1137 CSC1CCCCCCCCCCC1=O 62a_200009990614_200000210301 [0,0,0,1,0,0|2,0,0]=3 6882 B15R1.1137 [13CH3]SC1CCCCCCCCCCC1=O 62a_200009990614_200025704644 [0,0,0,1,0,0|2,0,0]=3 6883 B15R1.1137 [13CH3]SC1CCCCCCCCCCC1=O 62a_200025704644_200009990614 [0,0,0,1,0,0|2,0,0]=3 6884 B15R1.1168 CCCCCCCCCCN1CC(C1)C 2230a_100000702820_100000210320 [0,0,0,1,0,0|3,0,0]=4 6885 B15R1.1168 CCCCCCCCCCN1CC(C1)C 269982a_100000702820_100000210320 [0,0,0,1,0,0|3,0,0]=4 6886 B15R1.1168 CCCCCCCCCCN1CC(C1)C 34a_100000702820_100000210320 [0,0,0,1,0,0|3,0,0]=4 6887 B15R1.1176 CCCCCNCC1CCC(=CC1C)C 269862a_100000209983_100000075207 [0,0,0,1,0,0|3,0,0]=4 6888 B15R1.1251 CCOC(=O)CSC1CCCCCC1=O 62a_100000188475_100000243696 [0,0,0,1,0,0|2,0,1]=4 6889 B15R1.1251 CCOC(=O)CSC1CCCCCC1=O 62a_100000243696_100000188475 [0,0,0,1,0,0|2,0,1]=4 6890 B15R1.1252 CCCC(=O)CSCC1CCCCN1C 62a_100000747444_100015185383 [0,0,0,1,0,0|3,0,0]=4 6891 B15R1.1252 CCCC(=O)CSCC1CCCCN1C 62a_100015185383_100000747444 [0,0,0,1,0,0|3,0,0]=4 6892 B15R1.1252 CCCC(=O)NCCN1CCCCC1C 240690a_100000739827_100000211992 [0,0,0,1,0,0|3,0,0]=4 6893 B15R1.1252 CCCC(=O)NCCN1CCCCC1C 527a_100000739827_100000211992 [0,0,0,1,0,0|3,0,0]=4 6894 B15R1.1252 CCCC(=O)OCNC1CCCCC1C 2230a_100000211402_100000034017 [0,0,0,1,0,0|3,0,0]=4 6895 B15R1.1252 CCCC(=O)OCNC1CCCCC1C 34a_100000211402_100000034017 [0,0,0,1,0,0|3,0,0]=4 6896 B15R1.1252 CCCC(=O)OCOC1CCCCC1C 34a_100000211207_100000034017 [0,0,0,1,0,0|3,0,0]=4 6897 B15R1.1252 CCNC(=O)CCNC1CCCCC1C 2230a_100000211402_100000737597 [0,0,0,1,0,0|2,0,0]=3 6898 B15R1.1252 CCNC(=O)CCNC1CCCCC1C 269862a_100025743525_100000210921 [0,0,0,1,0,0|2,0,0]=3 6899 B15R1.1252 CCNC(=O)CCNC1CCCCC1C 270004a_100025743525_100000210921 [0,0,0,1,0,0|2,0,0]=3 6900 B15R1.1252 CCNC(=O)CCNC1CCCCC1F 34a_100025743525_100015423560 [0,0,0,1,0,0|3,0,0]=4 6901 B15R1.1252 CCNC(=O)CCNC1CCCCC1O 34a_100025743525_100000038908 [0,0,0,1,0,0|3,0,0]=4 6902 B15R1.1252 CCNC(=O)CCNC1CCNCC1C 270004a_100025743525_100000703950 [0,0,0,1,0,0|3,0,0]=4 6903 B15R1.1252 CCNC(=O)CCNC1CCOCC1C 270004a_100025743525_100000755695 [0,0,0,1,0,0|3,0,0]=4 6904 B15R1.1252 CCNC(=O)CCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000737597 [0,0,0,1,0,0|3,0,0]=4 6905 B15R1.1252 CCNC(=O)CCOC1CCCCC1C 7a_100000211207_100000737597 [0,0,0,1,0,0|2,0,0]=3 6906 B15R1.1252 CCNC(=O)CCOC1CCCCC1Cl 7a_100000038908_100000737597 [0,0,0,1,0,0|3,0,0]=4 6907 B15R1.1252 CCNC(=O)CCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000737597 [0,0,0,1,0,0|3,0,0]=4 6908 B15R1.1252 CCNC(=O)CCSC1CCCCC1F 62a_100000737597_100015423560 [0,0,0,1,0,0|3,0,0]=4 6909 B15R1.1252 CCNC(=O)CCSC1CCCCC1F 62a_100015423560_100000737597 [0,0,0,1,0,0|3,0,0]=4 6910 B15R1.1252 CCNC(=O)CCSC1CCCCC1O 62a_100000038908_100000737597 [0,0,0,1,0,0|3,0,0]=4 6911 B15R1.1252 CCNC(=O)CCSC1CCCCC1O 62a_100000737597_100000038908 [0,0,0,1,0,0|3,0,0]=4 6912 B15R1.1252 CCNC(=O)CNCC1CCCCC1O 34a_100011216029_100000183381 [0,0,0,1,0,0|3,0,0]=4 6913 B15R1.1252 CCNC(=O)CNCC1CCCCN1C 34a_100011228421_100000183381 [0,0,0,1,0,0|3,0,0]=4 6914 B15R1.1252 CCNC(=O)COCC1CCCCN1C 34a_100000225079_100000183381 [0,0,0,1,0,0|3,0,0]=4 6915 B15R1.1252 CCNC(=O)CSCC1CCCCN1C 62a_100000183381_100015185383 [0,0,0,1,0,0|3,0,0]=4 6916 B15R1.1252 CCNC(=O)CSCC1CCCCN1C 62a_100015185383_100000183381 [0,0,0,1,0,0|3,0,0]=4 6917 B15R1.1252 CCNC(=O)NCCN1CCCCC1C 2708a_100015525214_100000739827 [0,0,0,1,0,0|3,0,0]=4 6918 B15R1.1252 CCNC(=O)NCCN1CCCCC1C 273464a_100000739827_100015525214 [0,0,0,1,0,0|3,0,0]=4 6919 B15R1.1252 CCNC(=O)NCCN1CCCCC1C 273464a_100015525214_100000739827 [0,0,0,1,0,0|3,0,0]=4 6920 B15R1.1252 CCNC(=O)NCCN1CCCCC1C 512a_100000739827_100015525214 [0,0,0,1,0,0|3,0,0]=4 6921 B15R1.1252 CCNC(=O)NCCN1CCCCC1C 512a_100015525214_100000739827 [0,0,0,1,0,0|3,0,0]=4 6922 B15R1.1252 CCOC(=O)/C=C/CN1CCCCC1C 2230a_100000211376_100016267167 [0,0,0,1,0,0|1,0,2]=4 6923 B15R1.1252 CCOC(=O)/C=C/CN1CCCCC1C 269982a_100000211376_100016267167 [0,0,0,1,0,0|1,0,2]=4 6924 B15R1.1252 CCOC(=O)/C=C/CN1CCCCC1C 34a_100000211376_100016267167 [0,0,0,1,0,0|1,0,2]=4 6925 B15R1.1252 CCOC(=O)CCCN1CCCCC1C 2230a_100000211376_100009991533 [0,0,0,1,0,0|1,0,0]=2 6926 B15R1.1252 CCOC(=O)CCCN1CCCCC1C 269982a_100000211376_100009991533 [0,0,0,1,0,0|1,0,0]=2 6927 B15R1.1252 CCOC(=O)CCCN1CCCCC1C 34a_100000211376_100009991533 [0,0,0,1,0,0|1,0,0]=2 6928 B15R1.1252 CCOC(=O)CCCN1CCOC[C@@H]1C 2230a_100009815349_100009991533 [0,0,0,1,0,0|2,0,0]=3 6929 B15R1.1252 CCOC(=O)CCCN1CCOC[C@@H]1C 269982a_100009815349_100009991533 [0,0,0,1,0,0|2,0,0]=3 6930 B15R1.1252 CCOC(=O)CCCN1CCOC[C@@H]1C 34a_100009815349_100009991533 [0,0,0,1,0,0|2,0,0]=3 6931 B15R1.1252 CCOC(=O)CCNC1CCCCC1C 2230a_100000211402_100011206558 [0,0,0,1,0,0|1,0,0]=2 6932 B15R1.1252 CCOC(=O)CCNC1CCCCC1C 34a_100000211402_100000765890 [0,0,0,1,0,0|1,0,0]=2 6933 B15R1.1252 CCOC(=O)CCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100011206558 [0,0,0,1,0,0|2,0,0]=3 6934 B15R1.1252 CCOC(=O)CCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000765890 [0,0,0,1,0,0|2,0,0]=3 6935 B15R1.1252 CCOC(=O)CCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100011206558 [0,0,0,1,0,0|3,0,0]=4 6936 B15R1.1252 CCOC(=O)CCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_100011206558 [0,0,0,1,0,0|3,0,0]=4 6937 B15R1.1252 CCOC(=O)CCN[C@H]1CCOC[C@@H]1F 34a_100016994078_100000765890 [0,0,0,1,0,0|3,0,0]=4 6938 B15R1.1252 CCOC(=O)CCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100011206558 [0,0,0,1,0,0|3,0,0]=4 6939 B15R1.1252 CCOC(=O)CCOC1CCCCC1=O 34a_100011214950_100000765890 [0,0,0,1,0,0|2,0,1]=4 6940 B15R1.1252 CCOC(=O)CCOC1CCCCC1C 34a_100000211207_100000765890 [0,0,0,1,0,0|1,0,0]=2 6941 B15R1.1252 CCOC(=O)CCOC1CCCCC1C 7a_100000211207_100011206558 [0,0,0,1,0,0|1,0,0]=2 6942 B15R1.1252 CCOC(=O)CCOC1CCCCC1Cl 34a_100000038908_100000765890 [0,0,0,1,0,0|2,0,0]=3 6943 B15R1.1252 CCOC(=O)CCOC1CCCCC1Cl 7a_100000038908_100011206558 [0,0,0,1,0,0|2,0,0]=3 6944 B15R1.1252 CCOC(=O)CCOC1CCNCC1C 34a_100011998114_100000765890 [0,0,0,1,0,0|2,0,0]=3 6945 B15R1.1252 CCOC(=O)CCOC1CNCCC1C 34a_100000696640_100000765890 [0,0,0,1,0,0|2,0,0]=3 6946 B15R1.1252 CCOC(=O)CCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000765890 [0,0,0,1,0,0|2,0,0]=3 6947 B15R1.1252 CCOC(=O)CCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100011206558 [0,0,0,1,0,0|2,0,0]=3 6948 B15R1.1252 CCOC(=O)CCO[C@@H]1CCNC[C@@H]1F 34a_200016994291_100000765890 [0,0,0,1,0,0|3,0,0]=4 6949 B15R1.1252 CCOC(=O)CCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000765890 [0,0,0,1,0,0|2,0,0]=3 6950 B15R1.1252 CCOC(=O)CCO[C@H]1CCOC[C@@H]1N 34a_100015739063_100000765890 [0,0,0,1,0,0|3,0,0]=4 6951 B15R1.1252 CCOC(=O)CCO[C@H]1COCC[C@H]1N 34a_100016994285_100000765890 [0,0,0,1,0,0|3,0,0]=4 6952 B15R1.1252 CCOC(=O)CCSC1CCCCC1=O 62a_100000204591_100000765890 [0,0,0,1,0,0|2,0,1]=4 6953 B15R1.1252 CCOC(=O)CCSC1CCCCC1=O 62a_100000765890_100000204591 [0,0,0,1,0,0|2,0,1]=4 6954 B15R1.1252 CCOC(=O)CCSC1CCCCC1F 62a_100000765890_100015423560 [0,0,0,1,0,0|2,0,0]=3 6955 B15R1.1252 CCOC(=O)CCSC1CCCCC1F 62a_100015423560_100000765890 [0,0,0,1,0,0|2,0,0]=3 6956 B15R1.1252 CCOC(=O)CCSC1CCCCC1O 62a_100000038908_100000765890 [0,0,0,1,0,0|2,0,0]=3 6957 B15R1.1252 CCOC(=O)CCSC1CCCCC1O 62a_100000765890_100000038908 [0,0,0,1,0,0|2,0,0]=3 6958 B15R1.1252 CCOC(=O)CNCC1CCCCC1O 34a_100011216029_100000188475 [0,0,0,1,0,0|2,0,0]=3 6959 B15R1.1252 CCOC(=O)CNCC1CCCCN1C 34a_100011228421_100000188475 [0,0,0,1,0,0|2,0,0]=3 6960 B15R1.1252 CCOC(=O)COCC1CC=CCC1C 34a_100000211322_100000188475 [0,0,0,1,0,0|1,0,2]=4 6961 B15R1.1252 CCOC(=O)COCC1CCCCC1=O 34a_100009861125_100000188475 [0,0,0,1,0,0|2,0,1]=4 6962 B15R1.1252 CCOC(=O)COCC1CCCCC1=O 7a_100009861125_100000188475 [0,0,0,1,0,0|2,0,1]=4 6963 B15R1.1252 CCOC(=O)COCC1CCCCN1C 34a_100000225079_100000188475 [0,0,0,1,0,0|2,0,0]=3 6964 B15R1.1252 CCOC(=O)COCC1COCCC1N 34a_214813039666_100000188475 [0,0,0,1,0,0|3,0,0]=4 6965 B15R1.1252 CCOC(=O)COCC1COCCN1C 34a_100013547906_100000188475 [0,0,0,1,0,0|3,0,0]=4 6966 B15R1.1252 CCOC(=O)CSCC1CCCCN1C 62a_100000188475_100015185383 [0,0,0,1,0,0|2,0,0]=3 6967 B15R1.1252 CCOC(=O)CSCC1CCCCN1C 62a_100015185383_100000188475 [0,0,0,1,0,0|2,0,0]=3 6968 B15R1.1252 CCOC(=O)NCCN1CCCCC1C 269982a_100000211376_200011445536 [0,0,0,1,0,0|2,0,0]=3 6969 B15R1.1252 CCOC(=O)NCCN1CCOC[C@@H]1C 269982a_100009815349_200011445536 [0,0,0,1,0,0|3,0,0]=4 6970 B15R1.1252 CCOC(=O)OCSC1CCCCC1F 62a_100015423560_100000075025 [0,0,0,1,0,0|3,0,0]=4 6971 B15R1.1252 CCOC(=O)OCSC1CCCCC1O 62a_100000038908_100000075025 [0,0,0,1,0,0|3,0,0]=4 6972 B15R1.1263 CCOC(=O)CCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100000755133 [0,0,0,1,0,0|2,0,0]=3 6973 B15R1.1263 CCOC(=O)CCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100000755133 [0,0,0,1,0,0|2,0,0]=3 6974 B15R1.1263 CCOC(=O)CCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100000755133 [0,0,0,1,0,0|2,0,0]=3 6975 B15R1.1263 CCOC(=O)CCCCOCC1CC1C 34a_100000744939_100000750268 [0,0,0,1,0,0|1,0,0]=2 6976 B15R1.1263 CCOC(=O)CCCCOCC1CC1C 7a_100000744939_100000750268 [0,0,0,1,0,0|1,0,0]=2 6977 B15R1.1263 CCOC(=O)COCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100009893628 [0,0,0,1,0,0|3,0,0]=4 6978 B15R1.1263 CCOC(=O)COCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100009893628 [0,0,0,1,0,0|3,0,0]=4 6979 B15R1.1263 CCOC(=O)COCCCN[C@@H]1C[C@H]1F 34a_100025746932_100009893628 [0,0,0,1,0,0|3,0,0]=4 6980 B15R1.1263 CCOC(=O)COCCOCC1CC1C 34a_100000744939_100000088970 [0,0,0,1,0,0|2,0,0]=3 6981 B15R1.1263 CCOC(=O)COCCOCC1CC1C 7a_100000744939_100000088970 [0,0,0,1,0,0|2,0,0]=3 6982 B15R1.1264 CCOC(=O)CCCCCCN1CCC1 269982a_100000754969_100009814379 [0,0,0,1,0,0|1,0,0]=2 6983 B15R1.1264 CCOC(=O)CCCCCNC1CCC1 2230a_100000749019_100000755133 [0,0,0,1,0,0|1,0,0]=2 6984 B15R1.1264 CCOC(=O)CCCCCNC1CCC1 34a_100000749019_100000755133 [0,0,0,1,0,0|1,0,0]=2 6985 B15R1.1264 CCOC(=O)CCCCCNC1COC1 2230a_100016991112_100000755133 [0,0,0,1,0,0|2,0,0]=3 6986 B15R1.1264 CCOC(=O)CCCCCOC1CCC1 34a_100000748187_100000755133 [0,0,0,1,0,0|1,0,0]=2 6987 B15R1.1264 CCOC(=O)CCCCCOC1COC1 7a_100011214988_100009818527 [0,0,0,1,0,0|2,0,0]=3 6988 B15R1.1264 CCOC(=O)CCCCCOC1CSC1 7a_100000072292_100000755133 [0,0,0,1,0,0|2,0,0]=3 6989 B15R1.1264 CCOC(=O)CCCCCSC1CCC1 62a_100000755133_100000749161 [0,0,0,1,0,0|1,0,0]=2 6990 B15R1.1264 CCOC(=O)CCCCCSC1COC1 62a_100000755133_100009818527 [0,0,0,1,0,0|2,0,0]=3 6991 B15R1.1264 CCOC(=O)CCCCNCC1CCC1 2230a_100000738700_100000750268 [0,0,0,1,0,0|1,0,0]=2 6992 B15R1.1264 CCOC(=O)CCCCNCC1CCC1 34a_100000738700_100000750268 [0,0,0,1,0,0|1,0,0]=2 6993 B15R1.1264 CCOC(=O)CCCCNCC1COC1 2230a_100015281925_100000750268 [0,0,0,1,0,0|2,0,0]=3 6994 B15R1.1264 CCOC(=O)CCCCNCC1COC1 34a_100015281925_100000750268 [0,0,0,1,0,0|2,0,0]=3 6995 B15R1.1264 CCOC(=O)CCCCNC[C@@H]1CCO1 2230a_100020831831_100000750268 [0,0,0,1,0,0|2,0,0]=3 6996 B15R1.1264 CCOC(=O)CCCCNC[C@@H]1CCO1 34a_100020831831_100000750268 [0,0,0,1,0,0|2,0,0]=3 6997 B15R1.1264 CCOC(=O)CCCCOCC1CCC1 34a_100000760304_100000750268 [0,0,0,1,0,0|1,0,0]=2 6998 B15R1.1264 CCOC(=O)CCCCOCC1CCO1 34a_100000039022_100000750268 [0,0,0,1,0,0|2,0,0]=3 6999 B15R1.1264 CCOC(=O)CCCCOCC1CNC1 34a_100016987283_100000750268 [0,0,0,1,0,0|2,0,0]=3 7000 B15R1.1264 CCOC(=O)CCCCOCC1COC1 34a_100000060846_100000750268 [0,0,0,1,0,0|2,0,0]=3 7001 B15R1.1264 CCOC(=O)CCCCSCC1CCC1 62a_100000750268_100000763275 [0,0,0,1,0,0|1,0,0]=2 7002 B15R1.1264 CCOC(=O)CCCCSCC1CCC1 62a_100000763275_100000750268 [0,0,0,1,0,0|1,0,0]=2 7003 B15R1.1264 CCOC(=O)CCCCSCC1CCO1 62a_100000103362_100000750268 [0,0,0,1,0,0|2,0,0]=3 7004 B15R1.1264 CCOC(=O)CCCCSCC1CCO1 62a_100000750268_100000103362 [0,0,0,1,0,0|2,0,0]=3 7005 B15R1.1264 CCOC(=O)CCCCSCC1COC1 62a_100000750268_100010264016 [0,0,0,1,0,0|2,0,0]=3 7006 B15R1.1264 CCOC(=O)CCCCSCC1COC1 62a_100010264016_100000750268 [0,0,0,1,0,0|2,0,0]=3 7007 B15R1.1264 CCOC(=O)CCCOCCC1COC1 34a_100009855314_100009991533 [0,0,0,1,0,0|2,0,0]=3 7008 B15R1.1264 CCOC(=O)COCCCNC1CCC1 2230a_100000749019_100009893628 [0,0,0,1,0,0|2,0,0]=3 7009 B15R1.1264 CCOC(=O)COCCCNC1CCC1 34a_100000749019_100009893628 [0,0,0,1,0,0|2,0,0]=3 7010 B15R1.1264 CCOC(=O)COCCCNC1COC1 2230a_100016991112_100009893628 [0,0,0,1,0,0|3,0,0]=4 7011 B15R1.1264 CCOC(=O)COCCCOC1CCC1 34a_100000748187_100009893628 [0,0,0,1,0,0|2,0,0]=3 7012 B15R1.1264 CCOC(=O)COCCCOC1CSC1 7a_100000072292_100009893628 [0,0,0,1,0,0|3,0,0]=4 7013 B15R1.1264 CCOC(=O)COCCCSC1CCC1 62a_100009893628_100000749161 [0,0,0,1,0,0|2,0,0]=3 7014 B15R1.1264 CCOC(=O)COCCCSC1COC1 62a_100009893628_100009818527 [0,0,0,1,0,0|3,0,0]=4 7015 B15R1.1264 CCOC(=O)COCCNCC1CCC1 2230a_100000738700_100000088970 [0,0,0,1,0,0|2,0,0]=3 7016 B15R1.1264 CCOC(=O)COCCNCC1CCC1 34a_100000738700_100000088970 [0,0,0,1,0,0|2,0,0]=3 7017 B15R1.1264 CCOC(=O)COCCNCC1COC1 2230a_100015281925_100000088970 [0,0,0,1,0,0|3,0,0]=4 7018 B15R1.1264 CCOC(=O)COCCNCC1COC1 34a_100015281925_100000088970 [0,0,0,1,0,0|3,0,0]=4 7019 B15R1.1264 CCOC(=O)COCCNC[C@@H]1CCO1 2230a_100020831831_100000088970 [0,0,0,1,0,0|3,0,0]=4 7020 B15R1.1264 CCOC(=O)COCCNC[C@@H]1CCO1 34a_100020831831_100000088970 [0,0,0,1,0,0|3,0,0]=4 7021 B15R1.1264 CCOC(=O)COCCOCC1CCC1 34a_100000760304_100000088970 [0,0,0,1,0,0|2,0,0]=3 7022 B15R1.1264 CCOC(=O)COCCOCC1CCO1 34a_100000039022_100000088970 [0,0,0,1,0,0|3,0,0]=4 7023 B15R1.1264 CCOC(=O)COCCOCC1CNC1 34a_100016987283_100000088970 [0,0,0,1,0,0|3,0,0]=4 7024 B15R1.1264 CCOC(=O)COCCOCC1COC1 34a_100000060846_100000088970 [0,0,0,1,0,0|3,0,0]=4 7025 B15R1.1264 CCOC(=O)COCCSCC1CCC1 62a_100000088970_100000763275 [0,0,0,1,0,0|2,0,0]=3 7026 B15R1.1264 CCOC(=O)COCCSCC1CCC1 62a_100000763275_100000088970 [0,0,0,1,0,0|2,0,0]=3 7027 B15R1.1264 CCOC(=O)COCCSCC1CCO1 62a_100000088970_100000103362 [0,0,0,1,0,0|3,0,0]=4 7028 B15R1.1264 CCOC(=O)COCCSCC1CCO1 62a_100000103362_100000088970 [0,0,0,1,0,0|3,0,0]=4 7029 B15R1.1264 CCOC(=O)COCCSCC1COC1 62a_100000088970_100010264016 [0,0,0,1,0,0|3,0,0]=4 7030 B15R1.1264 CCOC(=O)COCCSCC1COC1 62a_100010264016_100000088970 [0,0,0,1,0,0|3,0,0]=4 7031 B15R1.1264 CCOC(=O)CSCCOCC1CCC1 7a_200000230590_100000763275 [0,0,0,1,0,0|2,0,0]=3 7032 B15R1.1264 CCOC(=O)CSCCOCC1CCO1 7a_200000230590_100000103362 [0,0,0,1,0,0|3,0,0]=4 7033 B15R1.1264 CCOC(=O)CSCCOCC1COC1 7a_200000230590_100010264016 [0,0,0,1,0,0|3,0,0]=4 7034 B15R1.1950 CCCCCCCN1CCNC(=O)CC1 2230a_100000698595_100000210681 [0,0,0,1,0,0|2,0,0]=3 7035 B15R1.1950 CCCCCCCN1CCNC(=O)CC1 269982a_100000698595_100000210681 [0,0,0,1,0,0|2,0,0]=3 7036 B15R1.1950 CCCCOCCN1CCNC(=O)CC1 2230a_100000698595_100000743108 [0,0,0,1,0,0|3,0,0]=4 7037 B15R1.1950 CCCCOCCN1CCNC(=O)CC1 269982a_100000698595_100000743108 [0,0,0,1,0,0|3,0,0]=4 7038 B15R1.1950 O=C1CCN(CCN1)CCCCCCF 2230a_100000698595_100015922095 [0,0,0,1,0,0|3,0,0]=4 7039 B15R1.1950 O=C1CCN(CCN1)CCCCCCF 269982a_100000698595_100015922095 [0,0,0,1,0,0|3,0,0]=4 7040 B15R1.1950 O=C1CCN(CCN1)CCCCCCO 2230a_100000698595_100000766143 [0,0,0,1,0,0|3,0,0]=4 7041 B15R1.1950 O=C1CCN(CCN1)CCCCCCO 269982a_100000698595_100000766143 [0,0,0,1,0,0|3,0,0]=4 7042 B15R1.2461 C=COC(=O)CNCC1CCCCCC1 2230a_100015204231_100000036128 [0,0,0,1,0,0|1,0,2]=4 7043 B15R1.2461 C=COC(=O)CNCC1CCCCCC1 34a_100015204231_100000036128 [0,0,0,1,0,0|1,0,2]=4 7044 B15R1.2461 C=COC(=O)COCC1CCCCCC1 34a_100000699130_100000036128 [0,0,0,1,0,0|1,0,2]=4 7045 B15R1.2461 C=COC(=O)CSCC1CCCCCC1 62a_100000036128_200000696569 [0,0,0,1,0,0|1,0,2]=4 7046 B15R1.2461 C=COC(=O)CSCC1CCCCCC1 62a_200000696569_100000036128 [0,0,0,1,0,0|1,0,2]=4 7047 B15R1.2461 CC=CC(=O)NCCC1CCCCCC1 11a_100011532351_100000210699 [0,0,0,1,0,0|2,0,1]=4 7048 B15R1.2461 CC=CC(=O)NCCC1CCCCCC1 1626a_100011532351_100000210699 [0,0,0,1,0,0|2,0,1]=4 7049 B15R1.2461 CC=CC(=O)NCCC1CCCCCC1 240690a_100011532351_100000210699 [0,0,0,1,0,0|2,0,1]=4 7050 B15R1.2461 CCCC(=O)CNCC1CCCCCC1 2230a_100015204231_100000747444 [0,0,0,1,0,0|2,0,0]=3 7051 B15R1.2461 CCCC(=O)COCC1CCCCCC1 7a_100000699130_100000747444 [0,0,0,1,0,0|2,0,0]=3 7052 B15R1.2461 CCCC(=O)CSCC1CCCCCC1 62a_100000747444_200000696569 [0,0,0,1,0,0|2,0,0]=3 7053 B15R1.2461 CCCC(=O)CSCC1CCCCCC1 62a_200000696569_100000747444 [0,0,0,1,0,0|2,0,0]=3 7054 B15R1.2461 CCCC(=O)NCCC1CCCCCC1 11a_100011532351_100000211992 [0,0,0,1,0,0|2,0,0]=3 7055 B15R1.2461 CCCC(=O)NCCC1CCCCCC1 1626a_100011532351_100000211992 [0,0,0,1,0,0|2,0,0]=3 7056 B15R1.2461 CCCC(=O)NCCC1CCCCCC1 240690a_100011532351_100000211992 [0,0,0,1,0,0|2,0,0]=3 7057 B15R1.2461 CCCC(=O)NCCC1CCCCCC1 527a_100011532351_100000211992 [0,0,0,1,0,0|2,0,0]=3 7058 B15R1.2461 CCCC(=O)NCCN1CCCCCC1 11a_100000738142_100000211992 [0,0,0,1,0,0|3,0,0]=4 7059 B15R1.2461 CCCC(=O)NCCN1CCCCCC1 240690a_100000738142_100000211992 [0,0,0,1,0,0|3,0,0]=4 7060 B15R1.2461 CCCC(=O)NCCN1CCCCCC1 527a_100000738142_100000211992 [0,0,0,1,0,0|3,0,0]=4 7061 B15R1.2461 CCCC(=O)OCNC1CCCCCC1 2230a_100000210984_100000034017 [0,0,0,1,0,0|3,0,0]=4 7062 B15R1.2461 CCCC(=O)OCNC1CCCCCC1 34a_100000210984_100000034017 [0,0,0,1,0,0|3,0,0]=4 7063 B15R1.2461 CCCC(=O)OCOC1CCCCCC1 34a_100000210887_100000034017 [0,0,0,1,0,0|3,0,0]=4 7064 B15R1.2461 CCCC(=O)OCSC1CCCCCC1 62a_100011217769_100000034017 [0,0,0,1,0,0|3,0,0]=4 7065 B15R1.2461 CCNC(=O)CCNC1CCCCCC1 2230a_100000210984_100000737597 [0,0,0,1,0,0|2,0,0]=3 7066 B15R1.2461 CCNC(=O)CCNC1CCCCCC1 270004a_100025743525_100000210131 [0,0,0,1,0,0|2,0,0]=3 7067 B15R1.2461 CCNC(=O)CCNC1CCCCCC1 34a_100025743525_100011217769 [0,0,0,1,0,0|2,0,0]=3 7068 B15R1.2461 CCNC(=O)CCNC1CCCNCC1 270004a_100025743525_100015187895 [0,0,0,1,0,0|3,0,0]=4 7069 B15R1.2461 CCNC(=O)CCOC1CCCCCC1 7a_100000210887_100000737597 [0,0,0,1,0,0|2,0,0]=3 7070 B15R1.2461 CCNC(=O)CCSC1CCCCCC1 62a_100000737597_100011217769 [0,0,0,1,0,0|2,0,0]=3 7071 B15R1.2461 CCNC(=O)CCSC1CCCCCC1 62a_100011217769_100000737597 [0,0,0,1,0,0|2,0,0]=3 7072 B15R1.2461 CCNC(=O)CNCC1CCCCCC1 2230a_100015204231_100000183381 [0,0,0,1,0,0|2,0,0]=3 7073 B15R1.2461 CCNC(=O)CNCC1CCCCCC1 2230a_100016988866_200000696569 [0,0,0,1,0,0|2,0,0]=3 7074 B15R1.2461 CCNC(=O)CNCC1CCCCCC1 34a_100015204231_100000183381 [0,0,0,1,0,0|2,0,0]=3 7075 B15R1.2461 CCNC(=O)COCC1CCCCCC1 34a_100000699130_100000183381 [0,0,0,1,0,0|2,0,0]=3 7076 B15R1.2461 CCNC(=O)COCC1CCCCCC1 7a_100000699130_100000183381 [0,0,0,1,0,0|2,0,0]=3 7077 B15R1.2461 CCNC(=O)CSCC1CCCCCC1 62a_100000183381_200000696569 [0,0,0,1,0,0|2,0,0]=3 7078 B15R1.2461 CCNC(=O)CSCC1CCCCCC1 62a_200000696569_100000183381 [0,0,0,1,0,0|2,0,0]=3 7079 B15R1.2461 CCNC(=O)NCCC1CCCCCC1 2708a_100011532351_100015525214 [0,0,0,1,0,0|2,0,0]=3 7080 B15R1.2461 CCNC(=O)NCCC1CCCCCC1 2708a_100015525214_100011532351 [0,0,0,1,0,0|2,0,0]=3 7081 B15R1.2461 CCNC(=O)NCCC1CCCCCC1 273464a_100011532351_100015525214 [0,0,0,1,0,0|2,0,0]=3 7082 B15R1.2461 CCNC(=O)NCCC1CCCCCC1 273464a_100015525214_100011532351 [0,0,0,1,0,0|2,0,0]=3 7083 B15R1.2461 CCNC(=O)NCCC1CCCCCC1 512a_100015525214_100011532351 [0,0,0,1,0,0|2,0,0]=3 7084 B15R1.2461 CCNC(=O)NCCN1CCCCCC1 2708a_100015525214_100000738142 [0,0,0,1,0,0|3,0,0]=4 7085 B15R1.2461 CCNC(=O)NCCN1CCCCCC1 273464a_100000738142_100015525214 [0,0,0,1,0,0|3,0,0]=4 7086 B15R1.2461 CCNC(=O)NCCN1CCCCCC1 273464a_100015525214_100000738142 [0,0,0,1,0,0|3,0,0]=4 7087 B15R1.2461 CCNC(=O)NCCN1CCCCCC1 512a_100000738142_100015525214 [0,0,0,1,0,0|3,0,0]=4 7088 B15R1.2461 CCOC(=O)/C=C/CN1CCCCCC1 2230a_100000185865_100016267167 [0,0,0,1,0,0|1,0,2]=4 7089 B15R1.2461 CCOC(=O)/C=C/CN1CCCCCC1 269982a_100000185865_100016267167 [0,0,0,1,0,0|1,0,2]=4 7090 B15R1.2461 CCOC(=O)/C=C/CN1CCCCCC1 34a_100000185865_100016267167 [0,0,0,1,0,0|1,0,2]=4 7091 B15R1.2461 CCOC(=O)CCCN1CCCCCC1 2230a_100000185865_100009991533 [0,0,0,1,0,0|1,0,0]=2 7092 B15R1.2461 CCOC(=O)CCCN1CCCCCC1 269982a_100000185865_100009991533 [0,0,0,1,0,0|1,0,0]=2 7093 B15R1.2461 CCOC(=O)CCCN1CCCCCC1 34a_100000185865_100009991533 [0,0,0,1,0,0|1,0,0]=2 7094 B15R1.2461 CCOC(=O)CCCN1CCCOCC1 2230a_100000685342_100009991533 [0,0,0,1,0,0|2,0,0]=3 7095 B15R1.2461 CCOC(=O)CCCN1CCCOCC1 269982a_100000685342_100009991533 [0,0,0,1,0,0|2,0,0]=3 7096 B15R1.2461 CCOC(=O)CCCN1CCCOCC1 34a_100000685342_100009991533 [0,0,0,1,0,0|2,0,0]=3 7097 B15R1.2461 CCOC(=O)CCNC1CCCCCC1 2230a_100000210984_100011206558 [0,0,0,1,0,0|1,0,0]=2 7098 B15R1.2461 CCOC(=O)CCNC1CCCCCC1 34a_100000210984_100000765890 [0,0,0,1,0,0|1,0,0]=2 7099 B15R1.2461 CCOC(=O)CCOC1CCCCCC1 34a_100000210887_100000765890 [0,0,0,1,0,0|1,0,0]=2 7100 B15R1.2461 CCOC(=O)CCOC1CCCCCC1 7a_100000210887_100011206558 [0,0,0,1,0,0|1,0,0]=2 7101 B15R1.2461 CCOC(=O)CCSC1CCCCCC1 62a_100000765890_100011217769 [0,0,0,1,0,0|1,0,0]=2 7102 B15R1.2461 CCOC(=O)CCSC1CCCCCC1 62a_100011217769_100000765890 [0,0,0,1,0,0|1,0,0]=2 7103 B15R1.2461 CCOC(=O)CNCC1CCCCCC1 2230a_100015204231_100000188475 [0,0,0,1,0,0|1,0,0]=2 7104 B15R1.2461 CCOC(=O)CNCC1CCCCCC1 34a_100015204231_100000188475 [0,0,0,1,0,0|1,0,0]=2 7105 B15R1.2461 CCOC(=O)COCC1CCCCCC1 34a_100000699130_100000188475 [0,0,0,1,0,0|1,0,0]=2 7106 B15R1.2461 CCOC(=O)COCC1CCCCCC1 7a_100000699130_100000188475 [0,0,0,1,0,0|1,0,0]=2 7107 B15R1.2461 CCOC(=O)COCC1CNCCOC1 34a_100103147999_100000188475 [0,0,0,1,0,0|3,0,0]=4 7108 B15R1.2461 CCOC(=O)CSCC1CCCCCC1 62a_100000188475_200000696569 [0,0,0,1,0,0|1,0,0]=2 7109 B15R1.2461 CCOC(=O)CSCC1CCCCCC1 62a_200000696569_100000188475 [0,0,0,1,0,0|1,0,0]=2 7110 B15R1.2461 CCOC(=O)NCCN1CCCCCC1 269982a_100000185865_200011445536 [0,0,0,1,0,0|2,0,0]=3 7111 B15R1.2461 CCOC(=O)NCCN1CCCOCC1 269982a_100000685342_200011445536 [0,0,0,1,0,0|3,0,0]=4 7112 B15R1.2461 CCOC(=O)OCSC1CCCCCC1 62a_100011217769_100000075025 [0,0,0,1,0,0|2,0,0]=3 7113 B15R1.2461 CNNC(=O)NCCC1CCCCCC1 273464a_100011532351_100016993582 [0,0,0,1,0,0|3,0,0]=4 7114 B15R1.2461 CNNC(=O)NCCC1CCCCCC1 512a_100016993582_100011532351 [0,0,0,1,0,0|3,0,0]=4 7115 B15R1.2461 COCC(=O)NCCC1CCCCCC1 11a_100011532351_100000210968 [0,0,0,1,0,0|3,0,0]=4 7116 B15R1.2461 COCC(=O)NCCC1CCCCCC1 1626a_100011532351_100000210968 [0,0,0,1,0,0|3,0,0]=4 7117 B15R1.2461 COCC(=O)NCCC1CCCCCC1 240690a_100011532351_100000210968 [0,0,0,1,0,0|3,0,0]=4 7118 B15R1.2461 COCC(=O)NCCC1CCCCCC1 527a_100011532351_100000210968 [0,0,0,1,0,0|3,0,0]=4 7119 B15R1.2461 CSCC(=O)NCCC1CCCCCC1 11a_100011532351_100000184570 [0,0,0,1,0,0|3,0,0]=4 7120 B15R1.2461 CSCC(=O)NCCC1CCCCCC1 1626a_100011532351_100000184570 [0,0,0,1,0,0|3,0,0]=4 7121 B15R1.2461 CSCC(=O)NCCC1CCCCCC1 240690a_100011532351_100000184570 [0,0,0,1,0,0|3,0,0]=4 7122 B15R1.2461 CSCC(=O)NCCC1CCCCCC1 527a_100011532351_100000184570 [0,0,0,1,0,0|3,0,0]=4 7123 B15R1.2461 O=C(CCO)NCCC1CCCCCC1 240690a_100011532351_100011216618 [0,0,0,1,0,0|3,0,0]=4 7124 B15R1.2461 O=C(CNCC1CCCCCC1)NCO 2230a_100015204231_100000185155 [0,0,0,1,0,0|3,0,0]=4 7125 B15R1.2461 O=C(CNCC1CCCCCC1)NCO 34a_100015204231_100000185155 [0,0,0,1,0,0|3,0,0]=4 7126 B15R1.2461 O=C(COCC1CCCCCC1)NCO 34a_100000699130_100000185155 [0,0,0,1,0,0|3,0,0]=4 7127 B15R1.2461 O=C(COCC1CCCCCC1)NCO 7a_100000699130_100000185155 [0,0,0,1,0,0|3,0,0]=4 7128 B15R1.2461 O=C(CSCC1CCCCCC1)NCO 62a_100000185155_200000696569 [0,0,0,1,0,0|3,0,0]=4 7129 B15R1.2461 O=C(CSCC1CCCCCC1)NCO 62a_200000696569_100000185155 [0,0,0,1,0,0|3,0,0]=4 7130 B15R1.3515 C#CCCCCCCOC1CCOC1=O 34a_100011217361_100000211211 [0,0,0,1,0,0|1,0,2]=4 7131 B15R1.3515 C#CCCCCCCOC1CCOC1=O 7a_100011217361_100000211211 [0,0,0,1,0,0|1,0,2]=4 7132 B15R1.3515 C#CCCCCCCSC1CCOC1=O 62a_100000211211_100012276617 [0,0,0,1,0,0|1,0,2]=4 7133 B15R1.3515 C#CCCCCCCSC1CCOC1=O 62a_100012276617_100000211211 [0,0,0,1,0,0|1,0,2]=4 7134 B15R1.3515 C=CCCCCCCOC1CCOC1=O 34a_200011216477_100000211211 [0,0,0,1,0,0|1,0,2]=4 7135 B15R1.3515 C=CCCCCCCOC1CCOC1=O 7a_200011216477_100000211211 [0,0,0,1,0,0|1,0,2]=4 7136 B15R1.3515 C=CCCCCCCSC1CCOC1=O 62a_100000211211_100011215473 [0,0,0,1,0,0|1,0,2]=4 7137 B15R1.3515 C=CCCCCCCSC1CCOC1=O 62a_100011215473_100000211211 [0,0,0,1,0,0|1,0,2]=4 7138 B15R1.3515 CC/C=C\CCCCOC1CCOC1=O 34a_100016287862_100000211211 [0,0,0,1,0,0|1,0,2]=4 7139 B15R1.3515 CC/C=C\CCCCOC1CCOC1=O 7a_100016287862_100000211211 [0,0,0,1,0,0|1,0,2]=4 7140 B15R1.3515 CCCC/C=C\CCOC1CCOC1=O 34a_200016286491_100000211211 [0,0,0,1,0,0|1,0,2]=4 7141 B15R1.3515 CCCC/C=C\CCOC1CCOC1=O 7a_200016286491_100000211211 [0,0,0,1,0,0|1,0,2]=4 7142 B15R1.3515 CCCCC#CCCOC1CCOC1=O 34a_100000037610_100000211211 [0,0,0,1,0,0|1,0,2]=4 7143 B15R1.3515 CCCCC#CCCOC1CCOC1=O 7a_100000037610_100000211211 [0,0,0,1,0,0|1,0,2]=4 7144 B15R1.3515 CCCCC/C=C/COC1CCOC1=O 34a_100016258190_100000211211 [0,0,0,1,0,0|1,0,2]=4 7145 B15R1.3515 CCCCC/C=C/COC1CCOC1=O 7a_100016258190_100000211211 [0,0,0,1,0,0|1,0,2]=4 7146 B15R1.3515 CCCCCC#CCOC1CCOC1=O 34a_200000033628_100000211211 [0,0,0,1,0,0|1,0,2]=4 7147 B15R1.3515 CCCCCC#CCOC1CCOC1=O 7a_200000033628_100000211211 [0,0,0,1,0,0|1,0,2]=4 7148 B15R1.3515 CCCCCC#CCSC1CCOC1=O 62a_100000211211_100009816472 [0,0,0,1,0,0|1,0,2]=4 7149 B15R1.3515 CCCCCC#CCSC1CCOC1=O 62a_100009816472_100000211211 [0,0,0,1,0,0|1,0,2]=4 7150 B15R1.3515 CCCCCCCCNC1CCCC1=O 2230a_100000229939_100000211823 [0,0,0,1,0,0|2,0,0]=3 7151 B15R1.3515 CCCCCCCCNC1CCCC1=O 34a_100000229939_100000709159 [0,0,0,1,0,0|2,0,0]=3 7152 B15R1.3515 CCCCCCCCNC1CCNC1=O 2230a_100016995588_100000210759 [0,0,0,1,0,0|2,0,0]=3 7153 B15R1.3515 CCCCCCCCNC1CCNC1=O 34a_100016995588_100000210759 [0,0,0,1,0,0|2,0,0]=3 7154 B15R1.3515 CCCCCCCCNC1CCOC1=O 2230a_100000229939_100000211211 [0,0,0,1,0,0|1,0,0]=2 7155 B15R1.3515 CCCCCCCCNC1CCOC1=O 34a_100000229939_100000211211 [0,0,0,1,0,0|1,0,0]=2 7156 B15R1.3515 CCCCCCCCNC1CCOC1C 270004a_100000229939_100000691750 [0,0,0,1,0,0|2,0,1]=4 7157 B15R1.3515 CCCCCCCCN[C@@H]1CONC1=O 2230a_100000765999_100000210759 [0,0,0,1,0,0|3,0,0]=4 7158 B15R1.3515 CCCCCCCCN[C@@H]1CONC1=O 34a_100000765999_100000210759 [0,0,0,1,0,0|3,0,0]=4 7159 B15R1.3515 CCCCCCCCOC1CCCC1=O 34a_100000210232_100000709159 [0,0,0,1,0,0|2,0,0]=3 7160 B15R1.3515 CCCCCCCCOC1CCCC1=O 34a_200000719330_100000210759 [0,0,0,1,0,0|2,0,0]=3 7161 B15R1.3515 CCCCCCCCOC1CCCC1=O 7a_100000210232_100000211823 [0,0,0,1,0,0|2,0,0]=3 7162 B15R1.3515 CCCCCCCCOC1CCOC1=O 34a_100000210232_100000211211 [0,0,0,1,0,0|1,0,0]=2 7163 B15R1.3515 CCCCCCCCOC1CCOC1=O 7a_100000210232_100000211211 [0,0,0,1,0,0|1,0,0]=2 7164 B15R1.3515 CCCCCCCCO[C@H]1CCNC1=O 34a_100000688343_100000210759 [0,0,0,1,0,0|2,0,0]=3 7165 B15R1.3515 CCCCCCCCSC1CCCC1=O 62a_100000210759_100000211823 [0,0,0,1,0,0|2,0,0]=3 7166 B15R1.3515 CCCCCCCCSC1CCCC1=O 62a_100000211823_100000210317 [0,0,0,1,0,0|2,0,0]=3 7167 B15R1.3515 CCCCCCCCSC1CCOC1=O 62a_100000210759_100000211211 [0,0,0,1,0,0|1,0,0]=2 7168 B15R1.3515 CCCCCCCCSC1CCOC1=O 62a_100000211211_100000210317 [0,0,0,1,0,0|1,0,0]=2 7169 B15R1.3515 CCCCCCCOCC1CCNC1=O 34a_100000133458_100000210614 [0,0,0,1,0,0|2,0,0]=3 7170 B15R1.3515 CCCCCCCSCN1CCCC1=O 62a_100000026320_100000210316 [0,0,0,1,0,0|3,0,0]=4 7171 B15R1.3515 CCCCCCCSCN1CCCC1=O 62a_100000210614_100000026320 [0,0,0,1,0,0|3,0,0]=4 7172 B15R1.3515 CCCCCCNCCN1CCCC1=O 2230a_100000210581_100000739059 [0,0,0,1,0,0|3,0,0]=4 7173 B15R1.3515 CCCCCCNCCN1CCCC1=O 2230a_100011200922_100000210314 [0,0,0,1,0,0|3,0,0]=4 7174 B15R1.3515 CCCCCCNCCN1CCNC1=O 2230a_100000210581_100000090651 [0,0,0,1,0,0|3,0,0]=4 7175 B15R1.3515 CCCCCCNCCN1CCNC1=O 2230a_100011207550_100000210314 [0,0,0,1,0,0|3,0,0]=4 7176 B15R1.3515 CCCCCCOCCN1CCCC1=O 34a_100000210259_100000739059 [0,0,0,1,0,0|3,0,0]=4 7177 B15R1.3515 CCCCCCOCCN1CCCC1=O 34a_100000211209_100000210314 [0,0,0,1,0,0|3,0,0]=4 7178 B15R1.3515 CCCCCCOCCN1CCCC1=O 7a_100000210259_100000739059 [0,0,0,1,0,0|3,0,0]=4 7179 B15R1.3515 CCCCCCOCCN1CCCC1=O 7a_100000211209_100000210314 [0,0,0,1,0,0|3,0,0]=4 7180 B15R1.3515 CCCCCCOCCN1CCNC1=O 34a_100000216532_100000210314 [0,0,0,1,0,0|3,0,0]=4 7181 B15R1.3515 CCCCCCOCCN1CCNC1=O 7a_100000210259_100000090651 [0,0,0,1,0,0|3,0,0]=4 7182 B15R1.3515 CCCCCCSCCN1CCCC1=O 62a_100000210314_100000739059 [0,0,0,1,0,0|3,0,0]=4 7183 B15R1.3515 CCCCCCSCCN1CCCC1=O 62a_100000739059_100000210757 [0,0,0,1,0,0|3,0,0]=4 7184 B15R1.3515 CCCCCCSCCN1CCNC1=O 62a_100000090651_100000210757 [0,0,0,1,0,0|3,0,0]=4 7185 B15R1.3515 CCCCCCSCCN1CCNC1=O 62a_100000210314_100000090651 [0,0,0,1,0,0|3,0,0]=4 7186 B15R1.3515 CCCCCNCCCN1CCCC1=O 2230a_100000210347_100000210326 [0,0,0,1,0,0|3,0,0]=4 7187 B15R1.3515 CCCCCNCCCN1CCCC1=O 34a_100000210347_100000718602 [0,0,0,1,0,0|3,0,0]=4 7188 B15R1.3515 CCCCCNCCOC1CCCC1=O 34a_100000224656_100000709159 [0,0,0,1,0,0|3,0,0]=4 7189 B15R1.3515 CCCCCNCCOC1CCOC1=O 34a_100000224656_100000211211 [0,0,0,1,0,0|2,0,0]=3 7190 B15R1.3515 CCCCCOCCCN1CCCC1=O 34a_100011216539_100000718602 [0,0,0,1,0,0|3,0,0]=4 7191 B15R1.3515 CCCCCOCCCN1CCCC1=O 7a_100011216539_100000210326 [0,0,0,1,0,0|3,0,0]=4 7192 B15R1.3515 CCCCCOCCOC1CCCC1=O 34a_100011215259_100000709159 [0,0,0,1,0,0|3,0,0]=4 7193 B15R1.3515 CCCCCOCCOC1CCCC1=O 7a_100011215259_100000211823 [0,0,0,1,0,0|3,0,0]=4 7194 B15R1.3515 CCCCCOCCOC1CCOC1=O 34a_100011215259_100000211211 [0,0,0,1,0,0|2,0,0]=3 7195 B15R1.3515 CCCCCOCCOC1CCOC1=O 7a_100011215259_100000211211 [0,0,0,1,0,0|2,0,0]=3 7196 B15R1.3515 CCCCOCCCNC1CCCC1=O 2230a_200000211371_100000211823 [0,0,0,1,0,0|3,0,0]=4 7197 B15R1.3515 CCCCOCCCNC1CCCC1=O 34a_200000211371_100000709159 [0,0,0,1,0,0|3,0,0]=4 7198 B15R1.3515 CCCCOCCCNC1CCOC1=O 2230a_200000211371_100000211211 [0,0,0,1,0,0|2,0,0]=3 7199 B15R1.3515 CCCCOCCCNC1CCOC1=O 34a_200000211371_100000211211 [0,0,0,1,0,0|2,0,0]=3 7200 B15R1.3515 CCCCOCCCOC1CCCC1=O 34a_200011215613_100000709159 [0,0,0,1,0,0|3,0,0]=4 7201 B15R1.3515 CCCCOCCCOC1CCCC1=O 7a_200011215613_100000211823 [0,0,0,1,0,0|3,0,0]=4 7202 B15R1.3515 CCCCOCCCOC1CCOC1=O 34a_200011215613_100000211211 [0,0,0,1,0,0|2,0,0]=3 7203 B15R1.3515 CCCCOCCCOC1CCOC1=O 7a_200011215613_100000211211 [0,0,0,1,0,0|2,0,0]=3 7204 B15R1.3515 CCCCOCCOCC1CCNC1=O 34a_100000133458_100000743108 [0,0,0,1,0,0|3,0,0]=4 7205 B15R1.3515 CCOCCOCCNC1CCOC1=O 2230a_100102712874_100000211211 [0,0,0,1,0,0|3,0,0]=4 7206 B15R1.3515 CCOCCOCCNC1CCOC1=O 34a_100102712874_100000211211 [0,0,0,1,0,0|3,0,0]=4 7207 B15R1.3515 CCOCCOCCOC1CCOC1=O 34a_100000210240_100000211211 [0,0,0,1,0,0|3,0,0]=4 7208 B15R1.3515 CCOCCOCCOC1CCOC1=O 7a_100000210240_100000211211 [0,0,0,1,0,0|3,0,0]=4 7209 B15R1.3515 CCOCCOCCSC1CCOC1=O 62a_100000211211_100011211534 [0,0,0,1,0,0|3,0,0]=4 7210 B15R1.3515 CCOCCOCCSC1CCOC1=O 62a_100011211534_100000211211 [0,0,0,1,0,0|3,0,0]=4 7211 B15R1.3515 COCCCCCCNC1CCNC1=O 2230a_100016995588_100011998445 [0,0,0,1,0,0|3,0,0]=4 7212 B15R1.3515 COCCCCCCNC1CCNC1=O 34a_100016995588_100011998445 [0,0,0,1,0,0|3,0,0]=4 7213 B15R1.3515 COCCCCCCOC1CCCC1=O 34a_200000719330_100011998445 [0,0,0,1,0,0|3,0,0]=4 7214 B15R1.3515 COCCCCCCOC1CCCC1=O 34a_200012092642_100000709159 [0,0,0,1,0,0|3,0,0]=4 7215 B15R1.3515 COCCCCCCOC1CCCC1=O 7a_200012092642_100000211823 [0,0,0,1,0,0|3,0,0]=4 7216 B15R1.3515 COCCCCCCOC1CCOC1=O 34a_200012092642_100000211211 [0,0,0,1,0,0|2,0,0]=3 7217 B15R1.3515 COCCCCCCOC1CCOC1=O 7a_200012092642_100000211211 [0,0,0,1,0,0|2,0,0]=3 7218 B15R1.3515 COCCCCCCO[C@H]1CCNC1=O 34a_100000688343_100011998445 [0,0,0,1,0,0|3,0,0]=4 7219 B15R1.3515 COCCCCCCSC1CCCC1=O 62a_100000211823_100011998445 [0,0,0,1,0,0|3,0,0]=4 7220 B15R1.3515 COCCCCCCSC1CCCC1=O 62a_100011998445_100000211823 [0,0,0,1,0,0|3,0,0]=4 7221 B15R1.3515 COCCCCCCSC1CCOC1=O 62a_100000211211_100011998445 [0,0,0,1,0,0|2,0,0]=3 7222 B15R1.3515 COCCCCCCSC1CCOC1=O 62a_100011998445_100000211211 [0,0,0,1,0,0|2,0,0]=3 7223 B15R1.3515 COCCOCCCNC1CCOC1=O 2230a_100000206027_100000211211 [0,0,0,1,0,0|3,0,0]=4 7224 B15R1.3515 COCCOCCCNC1CCOC1=O 34a_100000206027_100000211211 [0,0,0,1,0,0|3,0,0]=4 7225 B15R1.3515 COCCOCCCSC1CCOC1=O 62a_100000211211_100011216529 [0,0,0,1,0,0|3,0,0]=4 7226 B15R1.3515 COCCOCCCSC1CCOC1=O 62a_100011216529_100000211211 [0,0,0,1,0,0|3,0,0]=4 7227 B15R1.3515 N#CCCCCCCSC1CCOC1=O 62a_100000211211_100009813337 [0,0,0,1,0,0|2,0,1]=4 7228 B15R1.3515 N#CCCCCCCSC1CCOC1=O 62a_100009813337_100000211211 [0,0,0,1,0,0|2,0,1]=4 7229 B15R1.3515 NCCCCCCCOC1CCCC1=O 34a_100011996573_100000709159 [0,0,0,1,0,0|3,0,0]=4 7230 B15R1.3515 NCCCCCCCOC1CCOC1=O 34a_100011996573_100000211211 [0,0,0,1,0,0|2,0,0]=3 7231 B15R1.3515 NCCCOCCCOC1CCOC1=O 34a_100011310245_100000211211 [0,0,0,1,0,0|3,0,0]=4 7232 B15R1.3515 O=C1CCCC1NCCCCCCCO 2230a_100011996573_100000211823 [0,0,0,1,0,0|3,0,0]=4 7233 B15R1.3515 O=C1CCCC1NCCCCCCCO 34a_100011996573_100000709159 [0,0,0,1,0,0|3,0,0]=4 7234 B15R1.3515 O=C1CCCC1OCCCCCCCBr 34a_100000760002_100000709159 [0,0,0,1,0,0|3,0,0]=4 7235 B15R1.3515 O=C1CCCC1OCCCCCCCBr 7a_100000760002_100000211823 [0,0,0,1,0,0|3,0,0]=4 7236 B15R1.3515 O=C1CCCC1OCCCCCCCO 34a_200000719330_100000760002 [0,0,0,1,0,0|3,0,0]=4 7237 B15R1.3515 O=C1CCCC1SCCCCCCCO 62a_100000211823_100000760002 [0,0,0,1,0,0|3,0,0]=4 7238 B15R1.3515 O=C1CCCC1SCCCCCCCO 62a_100000760002_100000211823 [0,0,0,1,0,0|3,0,0]=4 7239 B15R1.3515 O=C1NCCC1COCCCCCCF 34a_100000133458_100015922095 [0,0,0,1,0,0|3,0,0]=4 7240 B15R1.3515 O=C1NCCC1COCCCCCCO 34a_100000133458_100000766143 [0,0,0,1,0,0|3,0,0]=4 7241 B15R1.3515 O=C1NCCC1NCCCCCCCO 2230a_100016995588_100000760002 [0,0,0,1,0,0|3,0,0]=4 7242 B15R1.3515 O=C1NCCC1NCCCCCCCO 34a_100016995588_100000760002 [0,0,0,1,0,0|3,0,0]=4 7243 B15R1.3515 O=C1NCC[C@@H]1OCCCCCCCO 34a_100000688343_100000760002 [0,0,0,1,0,0|3,0,0]=4 7244 B15R1.3515 O=C1OCCC1NCCCCCCCO 2230a_100011996573_100000211211 [0,0,0,1,0,0|2,0,0]=3 7245 B15R1.3515 O=C1OCCC1NCCCCCCCO 34a_100011996573_100000211211 [0,0,0,1,0,0|2,0,0]=3 7246 B15R1.3515 O=C1OCCC1NCCCOCCCO 2230a_100011310245_100000211211 [0,0,0,1,0,0|3,0,0]=4 7247 B15R1.3515 O=C1OCCC1NCCCOCCCO 34a_100011310245_100000211211 [0,0,0,1,0,0|3,0,0]=4 7248 B15R1.3515 O=C1OCCC1OCCCCCCCBr 34a_100000760002_100000211211 [0,0,0,1,0,0|2,0,0]=3 7249 B15R1.3515 O=C1OCCC1OCCCCCCCBr 7a_100000760002_100000211211 [0,0,0,1,0,0|2,0,0]=3 7250 B15R1.3515 O=C1OCCC1SCCCCCCCO 62a_100000211211_100000760002 [0,0,0,1,0,0|2,0,0]=3 7251 B15R1.3515 O=C1OCCC1SCCCCCCCO 62a_100000760002_100000211211 [0,0,0,1,0,0|2,0,0]=3 7252 B15R1.3857 CCCC(=O)COCCC1CCCN1C 7a_100011215177_100000747444 [0,0,0,1,0,0|3,0,0]=4 7253 B15R1.3857 CCCC(=O)CSCCC1CCCN1C 62a_100000005710_100000747444 [0,0,0,1,0,0|3,0,0]=4 7254 B15R1.3857 CCCC(=O)CSCCC1CCCN1C 62a_100000747444_100000005710 [0,0,0,1,0,0|3,0,0]=4 7255 B15R1.3857 CCNC(=O)CNCCC1CCCN1C 2230a_100016988866_100000005710 [0,0,0,1,0,0|3,0,0]=4 7256 B15R1.3857 CCNC(=O)COCCC1CCCN1C 34a_100011215177_100000183381 [0,0,0,1,0,0|3,0,0]=4 7257 B15R1.3857 CCNC(=O)COCCC1CCCN1C 7a_100011215177_100000183381 [0,0,0,1,0,0|3,0,0]=4 7258 B15R1.3857 CCNC(=O)CSCCC1CCCN1C 62a_100000005710_100000183381 [0,0,0,1,0,0|3,0,0]=4 7259 B15R1.3857 CCNC(=O)CSCCC1CCCN1C 62a_100000183381_100000005710 [0,0,0,1,0,0|3,0,0]=4 7260 B15R1.3857 CCOC(=O)/C=C/COC1CCCC1C 34a_100011216460_100016267167 [0,0,0,1,0,0|1,0,2]=4 7261 B15R1.3857 CCOC(=O)/C=C/COC1CCCC1C 7a_100011216460_100016267167 [0,0,0,1,0,0|1,0,2]=4 7262 B15R1.3857 CCOC(=O)CCCCN1CCC[C@@H]1C 2230a_100020605311_100000750268 [0,0,0,1,0,0|1,0,0]=2 7263 B15R1.3857 CCOC(=O)CCCCN1CCC[C@@H]1C 269982a_100020605311_100000750268 [0,0,0,1,0,0|1,0,0]=2 7264 B15R1.3857 CCOC(=O)CCCCN1CCC[C@H]1C 2230a_100015189458_100000750268 [0,0,0,1,0,0|1,0,0]=2 7265 B15R1.3857 CCOC(=O)CCCCN1CCC[C@H]1C 269982a_100015189458_100000750268 [0,0,0,1,0,0|1,0,0]=2 7266 B15R1.3857 CCOC(=O)CCCCN1CCC[C@H]1C 34a_100015189458_100000750268 [0,0,0,1,0,0|1,0,0]=2 7267 B15R1.3857 CCOC(=O)CCCCN1CCSC1C 2230a_200011216479_100000750268 [0,0,0,1,0,0|2,0,0]=3 7268 B15R1.3857 CCOC(=O)CCCCN1CCSC1C 269982a_200011216479_100000750268 [0,0,0,1,0,0|2,0,0]=3 7269 B15R1.3857 CCOC(=O)CCCCN1CCSC1C 34a_200011216479_100000750268 [0,0,0,1,0,0|2,0,0]=3 7270 B15R1.3857 CCOC(=O)CCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100009991533 [0,0,0,1,0,0|3,0,0]=4 7271 B15R1.3857 CCOC(=O)CCCOC1CCCC1=O 34a_200000719330_100009991533 [0,0,0,1,0,0|2,0,1]=4 7272 B15R1.3857 CCOC(=O)CCCOC1CCCC1=O 7a_100012001163_100000211823 [0,0,0,1,0,0|2,0,1]=4 7273 B15R1.3857 CCOC(=O)CCCOC1CCCC1C 34a_100011216460_100009991533 [0,0,0,1,0,0|1,0,0]=2 7274 B15R1.3857 CCOC(=O)CCCOC1CCCC1C 7a_100011216460_100011215271 [0,0,0,1,0,0|1,0,0]=2 7275 B15R1.3857 CCOC(=O)CCCOC1COCC1O 7a_100012001163_200000725654 [0,0,0,1,0,0|3,0,0]=4 7276 B15R1.3857 CCOC(=O)CCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100009991533 [0,0,0,1,0,0|2,0,0]=3 7277 B15R1.3857 CCOC(=O)CCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100009991533 [0,0,0,1,0,0|2,0,0]=3 7278 B15R1.3857 CCOC(=O)CCCO[C@H]1CNC[C@H]1C 34a_200015306588_100009991533 [0,0,0,1,0,0|2,0,0]=3 7279 B15R1.3857 CCOC(=O)CCCO[C@H]1COC[C@@H]1N 34a_100015191717_100009991533 [0,0,0,1,0,0|3,0,0]=4 7280 B15R1.3857 CCOC(=O)CCCSC1CCCC1=O 62a_100000211823_100009991533 [0,0,0,1,0,0|2,0,1]=4 7281 B15R1.3857 CCOC(=O)CCCSC1CCCC1=O 62a_100009991533_100000211823 [0,0,0,1,0,0|2,0,1]=4 7282 B15R1.3857 CCOC(=O)CCCSC1COCC1O 62a_100009991533_200000725654 [0,0,0,1,0,0|3,0,0]=4 7283 B15R1.3857 CCOC(=O)CCCSC1COCC1O 62a_200000725654_100009991533 [0,0,0,1,0,0|3,0,0]=4 7284 B15R1.3857 CCOC(=O)CCCS[C@@H]1CCC[C@H]1O 62a_100009991533_200016002552 [0,0,0,1,0,0|2,0,0]=3 7285 B15R1.3857 CCOC(=O)CCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100009991533 [0,0,0,1,0,0|2,0,0]=3 7286 B15R1.3857 CCOC(=O)CCOCC1CCCN1C 34a_100000743107_100000765890 [0,0,0,1,0,0|2,0,0]=3 7287 B15R1.3857 CCOC(=O)COCCC1CCCN1C 34a_100011215177_100000188475 [0,0,0,1,0,0|2,0,0]=3 7288 B15R1.3857 CCOC(=O)COCCC1CCCN1C 7a_100011215177_100000188475 [0,0,0,1,0,0|2,0,0]=3 7289 B15R1.3857 CCOC(=O)COCCN1CCC[C@@H]1C 2230a_100020605311_100000088970 [0,0,0,1,0,0|2,0,0]=3 7290 B15R1.3857 CCOC(=O)COCCN1CCC[C@@H]1C 269982a_100020605311_100000088970 [0,0,0,1,0,0|2,0,0]=3 7291 B15R1.3857 CCOC(=O)COCCN1CCC[C@H]1C 2230a_100015189458_100000088970 [0,0,0,1,0,0|2,0,0]=3 7292 B15R1.3857 CCOC(=O)COCCN1CCC[C@H]1C 269982a_100015189458_100000088970 [0,0,0,1,0,0|2,0,0]=3 7293 B15R1.3857 CCOC(=O)COCCN1CCC[C@H]1C 34a_100015189458_100000088970 [0,0,0,1,0,0|2,0,0]=3 7294 B15R1.3857 CCOC(=O)COCCN1CCSC1C 2230a_200011216479_100000088970 [0,0,0,1,0,0|3,0,0]=4 7295 B15R1.3857 CCOC(=O)COCCN1CCSC1C 269982a_200011216479_100000088970 [0,0,0,1,0,0|3,0,0]=4 7296 B15R1.3857 CCOC(=O)COCCN1CCSC1C 34a_200011216479_100000088970 [0,0,0,1,0,0|3,0,0]=4 7297 B15R1.3857 CCOC(=O)CSCCC1CCCN1C 62a_100000005710_100000188475 [0,0,0,1,0,0|2,0,0]=3 7298 B15R1.3857 CCOC(=O)CSCCC1CCCN1C 62a_100000188475_100000005710 [0,0,0,1,0,0|2,0,0]=3 7299 B15R1.3857 CCOC(=O)NCCOC1CCCC1C 7a_100011216460_200011445536 [0,0,0,1,0,0|2,0,0]=3 7300 B15R1.3857 CCOC(=O)NCCS[C@@H]1CCC[C@H]1O 62a_200016002552_200011445536 [0,0,0,1,0,0|3,0,0]=4 7301 B15R1.3865 CCOC(=O)CCCCCN1CCC1C 269982a_100000755817_100000755133 [0,0,0,1,0,0|1,0,0]=2 7302 B15R1.3865 CCOC(=O)CCCCCN1CCC1C 34a_100000755817_100000755133 [0,0,0,1,0,0|1,0,0]=2 7303 B15R1.3865 CCOC(=O)CCCCSC1CCC1=O 62a_100000750268_100009892977 [0,0,0,1,0,0|2,0,1]=4 7304 B15R1.3865 CCOC(=O)CCCCSC1CCC1=O 62a_100009892977_100000750268 [0,0,0,1,0,0|2,0,1]=4 7305 B15R1.3865 CCOC(=O)CCSCCC1CCC1=O 62a_100000765890_200016118888 [0,0,0,1,0,0|2,0,1]=4 7306 B15R1.3865 CCOC(=O)CCSCCC1CCC1=O 62a_200016118888_100000765890 [0,0,0,1,0,0|2,0,1]=4 7307 B15R1.3865 CCOC(=O)COCCCN1CCC1C 269982a_100000755817_100009893628 [0,0,0,1,0,0|2,0,0]=3 7308 B15R1.3865 CCOC(=O)COCCCN1CCC1C 34a_100000755817_100009893628 [0,0,0,1,0,0|2,0,0]=3 7309 B15R1.3870 CCOC(=O)CCCN1CCC1COC 2230a_100015195929_100009991533 [0,0,0,1,0,0|2,0,0]=3 7310 B15R1.3870 CCOC(=O)CCCN1CCC1COC 269982a_100015195929_100009991533 [0,0,0,1,0,0|2,0,0]=3 7311 B15R1.3870 CCOC(=O)CCCN1CCC1COC 34a_100015195929_100009991533 [0,0,0,1,0,0|2,0,0]=3 7312 B15R1.3870 CCOC(=O)NCCN1CCC1COC 269982a_100015195929_200011445536 [0,0,0,1,0,0|3,0,0]=4 7313 B15R1.3873 CCNC1CCCCCCCCCCC1 2230a_100011194316_100000210202 [0,0,0,1,0,0|2,0,1]=4 7314 B15R1.3873 CCNC1CCCCCCCCCCC1 270004a_100015525214_100000210130 [0,0,0,1,0,0|2,0,1]=4 7315 B15R1.3873 CCNC1CCCCCCCCCCC1 34a_100011194316_100000210202 [0,0,0,1,0,0|2,0,1]=4 7316 B15R1.3873 CCOC1CCCCCCCCCCC1 34a_100000211378_100000210202 [0,0,0,1,0,0|1,0,1]=3 7317 B15R1.3873 CCOC1CCCCCCCCCCC1 7a_100000211378_100000210202 [0,0,0,1,0,0|1,0,1]=3 7318 B15R1.3873 FCOC1CCCCCCCCCCC1 34a_100000211378_100015361967 [0,0,0,1,0,0|2,0,1]=4 7319 B15R1.3873 FCOC1CCCCCCCCCCC1 7a_100000211378_100015361967 [0,0,0,1,0,0|2,0,1]=4 7320 B15R1.3880 C#CCN1CCCCC1CC(=O)OCC 2230a_100116209990_100000038162 [0,0,0,1,0,0|1,0,2]=4 7321 B15R1.3880 C=CCN1CCCCC1CC(=O)OCC 2230a_100116209990_100000210623 [0,0,0,1,0,0|1,0,2]=4 7322 B15R1.3880 C=CCN1CCCCC1CC(=O)OCC 269982a_100116209990_100000210623 [0,0,0,1,0,0|1,0,2]=4 7323 B15R1.3880 C=COC(=O)CN1CCCCC1CCC 2230a_100000701414_100000036128 [0,0,0,1,0,0|1,0,2]=4 7324 B15R1.3880 C=COC(=O)CN1CCCCC1CCC 269982a_100000701414_100000036128 [0,0,0,1,0,0|1,0,2]=4 7325 B15R1.3880 C=COC(=O)CN1CCCCC1CCC 34a_100000701414_100000036128 [0,0,0,1,0,0|1,0,2]=4 7326 B15R1.3880 CCCC(=O)CN1CCCCC1CCC 2230a_100000701414_100000747444 [0,0,0,1,0,0|2,0,0]=3 7327 B15R1.3880 CCCC(=O)CN1CCCCC1CCC 269982a_100000701414_100000747444 [0,0,0,1,0,0|2,0,0]=3 7328 B15R1.3880 CCCC(=O)CN1CCCCC1CCO 2230a_100000211664_100000747444 [0,0,0,1,0,0|3,0,0]=4 7329 B15R1.3880 CCCC(=O)CN1CCCCC1CCO 269982a_100000211664_100000747444 [0,0,0,1,0,0|3,0,0]=4 7330 B15R1.3880 CCCC(=O)CN1CCCCC1COC 2230a_100015184032_100000747444 [0,0,0,1,0,0|3,0,0]=4 7331 B15R1.3880 CCCC(=O)CN1CCCCC1COC 269982a_100015184032_100000747444 [0,0,0,1,0,0|3,0,0]=4 7332 B15R1.3880 CCCC(=O)CN1CCOCC1CCC 2230a_102495339903_100000747444 [0,0,0,1,0,0|3,0,0]=4 7333 B15R1.3880 CCCC(=O)CN1CCOCC1CCC 269982a_102495339903_100000747444 [0,0,0,1,0,0|3,0,0]=4 7334 B15R1.3880 CCCC1CCCCN1CC(=O)NCC 2230a_100000701414_100000183381 [0,0,0,1,0,0|2,0,0]=3 7335 B15R1.3880 CCCC1CCCCN1CC(=O)NCC 269982a_100000701414_100000183381 [0,0,0,1,0,0|2,0,0]=3 7336 B15R1.3880 CCCC1CCCCN1CC(=O)NCC 34a_100000701414_100000183381 [0,0,0,1,0,0|2,0,0]=3 7337 B15R1.3880 CCCC1CCCCN1CC(=O)NCO 2230a_100000701414_100000185155 [0,0,0,1,0,0|3,0,0]=4 7338 B15R1.3880 CCCC1CCCCN1CC(=O)NCO 269982a_100000701414_100000185155 [0,0,0,1,0,0|3,0,0]=4 7339 B15R1.3880 CCCC1CCCCN1CC(=O)NCO 34a_100000701414_100000185155 [0,0,0,1,0,0|3,0,0]=4 7340 B15R1.3880 CCCC1CCCCN1CC(=O)OCC 2230a_100000701414_100000188475 [0,0,0,1,0,0|1,0,0]=2 7341 B15R1.3880 CCCC1CCCCN1CC(=O)OCC 269982a_100000701414_100000188475 [0,0,0,1,0,0|1,0,0]=2 7342 B15R1.3880 CCCC1CCCCN1CC(=O)OCC 34a_100000701414_100000188475 [0,0,0,1,0,0|1,0,0]=2 7343 B15R1.3880 CCCC1COCCN1CC(=O)NCC 2230a_102495339903_100000183381 [0,0,0,1,0,0|3,0,0]=4 7344 B15R1.3880 CCCC1COCCN1CC(=O)NCC 269982a_102495339903_100000183381 [0,0,0,1,0,0|3,0,0]=4 7345 B15R1.3880 CCCC1COCCN1CC(=O)NCC 34a_102495339903_100000183381 [0,0,0,1,0,0|3,0,0]=4 7346 B15R1.3880 CCCC1COCCN1CC(=O)OCC 2230a_102495339903_100000188475 [0,0,0,1,0,0|2,0,0]=3 7347 B15R1.3880 CCCC1COCCN1CC(=O)OCC 269982a_102495339903_100000188475 [0,0,0,1,0,0|2,0,0]=3 7348 B15R1.3880 CCCC1COCCN1CC(=O)OCC 34a_102495339903_100000188475 [0,0,0,1,0,0|2,0,0]=3 7349 B15R1.3880 CCCN1CCCCC1CC(=O)OCC 2230a_100116209990_100000210303 [0,0,0,1,0,0|1,0,0]=2 7350 B15R1.3880 CCCN1CCCCC1CC(=O)OCC 269982a_100116209990_100000210303 [0,0,0,1,0,0|1,0,0]=2 7351 B15R1.3880 CCNC(=O)CN1CCCCC1CCO 2230a_100000211664_100000183381 [0,0,0,1,0,0|3,0,0]=4 7352 B15R1.3880 CCNC(=O)CN1CCCCC1CCO 269982a_100000211664_100000183381 [0,0,0,1,0,0|3,0,0]=4 7353 B15R1.3880 CCNC(=O)CN1CCCCC1CCO 34a_100000211664_100000183381 [0,0,0,1,0,0|3,0,0]=4 7354 B15R1.3880 CCNC(=O)CN1CCCCC1COC 2230a_100015184032_100000183381 [0,0,0,1,0,0|3,0,0]=4 7355 B15R1.3880 CCNC(=O)CN1CCCCC1COC 269982a_100015184032_100000183381 [0,0,0,1,0,0|3,0,0]=4 7356 B15R1.3880 CCNC(=O)CN1CCCCC1COC 34a_100015184032_100000183381 [0,0,0,1,0,0|3,0,0]=4 7357 B15R1.3880 CCOC(=O)CC1CCCCN1CC#N 2230a_100116209990_100011215382 [0,0,0,1,0,0|2,0,1]=4 7358 B15R1.3880 CCOC(=O)CC1CCCCN1CC#N 269982a_100116209990_100011214920 [0,0,0,1,0,0|2,0,1]=4 7359 B15R1.3880 CCOC(=O)CC1CCCCN1CC=O 2230a_100116209990_200015260668 [0,0,0,1,0,0|2,0,1]=4 7360 B15R1.3880 CCOC(=O)CC1CCCCN1CC=O 269982a_100116209990_200015260668 [0,0,0,1,0,0|2,0,1]=4 7361 B15R1.3880 CCOC(=O)CC1CCCCN1CCF 2230a_100116209990_100011217306 [0,0,0,1,0,0|2,0,0]=3 7362 B15R1.3880 CCOC(=O)CC1CCCCN1CCF 269982a_100116209990_100011217306 [0,0,0,1,0,0|2,0,0]=3 7363 B15R1.3880 CCOC(=O)CC1CCCCN1CCO 2230a_100116209990_100000211926 [0,0,0,1,0,0|2,0,0]=3 7364 B15R1.3880 CCOC(=O)CC1CCCCN1CCO 269982a_100116209990_100000211926 [0,0,0,1,0,0|2,0,0]=3 7365 B15R1.3880 CCOC(=O)CC1CCCCN1COC 2230a_100116209990_100000766300 [0,0,0,1,0,0|2,0,0]=3 7366 B15R1.3880 CCOC(=O)CC1CCCCN1COC 269982a_100116209990_100000766300 [0,0,0,1,0,0|2,0,0]=3 7367 B15R1.3880 CCOC(=O)CC1CCCCN1CSC 2230a_100116209990_100011218213 [0,0,0,1,0,0|2,0,0]=3 7368 B15R1.3880 CCOC(=O)CC1CCCCN1CSC 269982a_100116209990_100011218213 [0,0,0,1,0,0|2,0,0]=3 7369 B15R1.3880 CCOC(=O)CN1CCCCC1CC#N 2230a_100000133382_100000188475 [0,0,0,1,0,0|2,0,1]=4 7370 B15R1.3880 CCOC(=O)CN1CCCCC1CC#N 34a_100000133382_100000188475 [0,0,0,1,0,0|2,0,1]=4 7371 B15R1.3880 CCOC(=O)CN1CCCCC1CCO 2230a_100000211664_100000188475 [0,0,0,1,0,0|2,0,0]=3 7372 B15R1.3880 CCOC(=O)CN1CCCCC1CCO 269982a_100000211664_100000188475 [0,0,0,1,0,0|2,0,0]=3 7373 B15R1.3880 CCOC(=O)CN1CCCCC1CCO 34a_100000211664_100000188475 [0,0,0,1,0,0|2,0,0]=3 7374 B15R1.3880 CCOC(=O)CN1CCCCC1COC 2230a_100015184032_100000188475 [0,0,0,1,0,0|2,0,0]=3 7375 B15R1.3880 CCOC(=O)CN1CCCCC1COC 269982a_100015184032_100000188475 [0,0,0,1,0,0|2,0,0]=3 7376 B15R1.3880 CCOC(=O)CN1CCCCC1COC 34a_100015184032_100000188475 [0,0,0,1,0,0|2,0,0]=3 7377 B15R1.3880 CCOC(=O)CN1CCOC[C@@H]1COC 2230a_100016989928_100000188475 [0,0,0,1,0,0|3,0,0]=4 7378 B15R1.3880 CCOC(=O)CN1CCOC[C@@H]1COC 269982a_100016989928_100000188475 [0,0,0,1,0,0|3,0,0]=4 7379 B15R1.3880 CCOC(=O)CN1CCOC[C@@H]1COC 34a_100016989928_100000188475 [0,0,0,1,0,0|3,0,0]=4 7380 B15R1.4163 CCCCCCCN1CC[C@@H](C1)OCC 2230a_100011787710_100000210681 [0,0,0,1,0,0|2,0,1]=4 7381 B15R1.4163 CCCCCCCN1CC[C@@H](C1)OCC 269982a_100011787710_100000210681 [0,0,0,1,0,0|2,0,1]=4 7382 B15R1.4163 CCCCCCCN1CC[C@@H](C1)OCC 34a_100011787710_100000210614 [0,0,0,1,0,0|2,0,1]=4 7383 B15R1.6333 CCCCCCCCN1CC(C1)OCC 269982a_100000732654_100000210759 [0,0,0,1,0,0|2,0,1]=4 7384 B15R1.6333 CCCCCCCCN1CC(C1)OCC 34a_100000732654_100000210759 [0,0,0,1,0,0|2,0,1]=4 7385 B15R1.9209 C#CCCCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100000731252 [0,0,0,1,0,0|1,0,2]=4 7386 B15R1.9209 C#CCCCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100011215417 [0,0,0,1,0,0|1,0,2]=4 7387 B15R1.9209 C#CCCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100000688953 [0,0,0,1,0,0|1,0,2]=4 7388 B15R1.9209 C/C=C/CO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100102629194 [0,0,0,1,0,0|1,0,2]=4 7389 B15R1.9209 C=CCCCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100011713584 [0,0,0,1,0,0|1,0,2]=4 7390 B15R1.9209 C=CCCCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100000757094 [0,0,0,1,0,0|1,0,2]=4 7391 B15R1.9209 C=CCCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100000754431 [0,0,0,1,0,0|1,0,2]=4 7392 B15R1.9209 CC#CCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100000748600 [0,0,0,1,0,0|1,0,2]=4 7393 B15R1.9209 CC/C=C\CN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100103147603 [0,0,0,1,0,0|1,0,2]=4 7394 B15R1.9209 CC/C=C\CN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100103147603 [0,0,0,1,0,0|1,0,2]=4 7395 B15R1.9209 CC=CCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100000070051 [0,0,0,1,0,0|1,0,2]=4 7396 B15R1.9209 CCC#CCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100009813939 [0,0,0,1,0,0|1,0,2]=4 7397 B15R1.9209 CCCCCC1CCCC1N(C)CCC 270004a_100000747261_200000198059 [0,0,0,1,0,0|3,0,0]=4 7398 B15R1.9209 CCCCCN1CCC[C@H]1C(=O)NCC 2230a_100020641767_100000210326 [0,0,0,1,0,0|2,0,0]=3 7399 B15R1.9209 CCCCCN1CCC[C@H]1C(=O)NCC 269982a_100020641767_100000210215 [0,0,0,1,0,0|2,0,0]=3 7400 B15R1.9209 CCCCCN1CCC[C@H]1C(=O)NCC 34a_100020641767_100000718602 [0,0,0,1,0,0|2,0,0]=3 7401 B15R1.9209 CCCCCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100000210326 [0,0,0,1,0,0|1,0,0]=2 7402 B15R1.9209 CCCCCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100000210215 [0,0,0,1,0,0|1,0,0]=2 7403 B15R1.9209 CCCCCN1CSC[C@H]1C(=O)OCC 269982a_100016989239_100000210215 [0,0,0,1,0,0|2,0,0]=3 7404 B15R1.9209 CCCCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100000210211 [0,0,0,1,0,0|1,0,0]=2 7405 B15R1.9209 CCCNN=C1CCCC1C(=O)OCC 4a_100000740057_100000183750 [0,0,0,1,0,0|2,0,1]=4 7406 B15R1.9209 CCNC(=O)[C@@H]1CCCN1CCCCF 2230a_100020641767_100000729493 [0,0,0,1,0,0|3,0,0]=4 7407 B15R1.9209 CCNC(=O)[C@@H]1CCCN1CCCCF 269982a_100020641767_100000729493 [0,0,0,1,0,0|3,0,0]=4 7408 B15R1.9209 CCNC(=O)[C@@H]1CCCN1CCCCF 34a_100020641767_100000729493 [0,0,0,1,0,0|3,0,0]=4 7409 B15R1.9209 CCNC(=O)[C@@H]1CCCN1CCCCO 2230a_100020641767_100000210776 [0,0,0,1,0,0|3,0,0]=4 7410 B15R1.9209 CCNC(=O)[C@@H]1CCCN1CCCCO 269982a_100020641767_100000210776 [0,0,0,1,0,0|3,0,0]=4 7411 B15R1.9209 CCNC(=O)[C@@H]1CCCN1CCCCO 34a_100020641767_100011216708 [0,0,0,1,0,0|3,0,0]=4 7412 B15R1.9209 CCNC(=O)[C@@H]1CCCN1CCCOC 2230a_100020641767_100000740836 [0,0,0,1,0,0|3,0,0]=4 7413 B15R1.9209 CCNC(=O)[C@@H]1CCCN1CCCOC 269982a_100020641767_100000740836 [0,0,0,1,0,0|3,0,0]=4 7414 B15R1.9209 CCNC(=O)[C@@H]1CCCN1CCCOC 34a_100020641767_100000740836 [0,0,0,1,0,0|3,0,0]=4 7415 B15R1.9209 CCNC(=O)[C@@H]1CCCN1CCOCC 2230a_100020641767_100011215890 [0,0,0,1,0,0|3,0,0]=4 7416 B15R1.9209 CCNC(=O)[C@@H]1CCCN1CCOCC 269982a_100020641767_100011215890 [0,0,0,1,0,0|3,0,0]=4 7417 B15R1.9209 CCNC(=O)[C@@H]1CCCN1CCOCC 34a_100020641767_100000210147 [0,0,0,1,0,0|3,0,0]=4 7418 B15R1.9209 CCNC(=O)[C@@H]1CCCN1CCSCC 2230a_100020641767_100000757381 [0,0,0,1,0,0|3,0,0]=4 7419 B15R1.9209 CCNC(=O)[C@@H]1CCCN1CCSCC 269982a_100020641767_100000757381 [0,0,0,1,0,0|3,0,0]=4 7420 B15R1.9209 CCNC(=O)[C@@H]1CCCN1CCSCC 34a_100020641767_100000757381 [0,0,0,1,0,0|3,0,0]=4 7421 B15R1.9209 CCOC(=O)[C@@H]1CCCN1CCCC#N 2230a_100000703725_100000687738 [0,0,0,1,0,0|2,0,1]=4 7422 B15R1.9209 CCOC(=O)[C@@H]1CCCN1CCCC#N 269982a_100000703725_100000687738 [0,0,0,1,0,0|2,0,1]=4 7423 B15R1.9209 CCOC(=O)[C@@H]1CCCN1CCCC=O 2230a_100000703725_200011292268 [0,0,0,1,0,0|2,0,1]=4 7424 B15R1.9209 CCOC(=O)[C@@H]1CCCN1CCCC=O 269982a_100000703725_200011292268 [0,0,0,1,0,0|2,0,1]=4 7425 B15R1.9209 CCOC(=O)[C@@H]1CCCN1CCCCF 2230a_100000703725_100000729493 [0,0,0,1,0,0|2,0,0]=3 7426 B15R1.9209 CCOC(=O)[C@@H]1CCCN1CCCCF 269982a_100000703725_100000729493 [0,0,0,1,0,0|2,0,0]=3 7427 B15R1.9209 CCOC(=O)[C@@H]1CCCN1CCCCO 2230a_100000703725_100000210776 [0,0,0,1,0,0|2,0,0]=3 7428 B15R1.9209 CCOC(=O)[C@@H]1CCCN1CCCCO 269982a_100000703725_100000210776 [0,0,0,1,0,0|2,0,0]=3 7429 B15R1.9209 CCOC(=O)[C@@H]1CCCN1CCCOC 2230a_100000703725_100000740836 [0,0,0,1,0,0|2,0,0]=3 7430 B15R1.9209 CCOC(=O)[C@@H]1CCCN1CCCOC 269982a_100000703725_100000740836 [0,0,0,1,0,0|2,0,0]=3 7431 B15R1.9209 CCOC(=O)[C@@H]1CCCN1CCSCC 2230a_100000703725_100000757381 [0,0,0,1,0,0|2,0,0]=3 7432 B15R1.9209 CCOC(=O)[C@@H]1CCCN1CCSCC 269982a_100000703725_100000757381 [0,0,0,1,0,0|2,0,0]=3 7433 B15R1.9209 CCOC(=O)[C@@H]1CCC[C@@H]1OCCC#N 7a_200015395474_100000184422 [0,0,0,1,0,0|2,0,1]=4 7434 B15R1.9209 CCOC(=O)[C@@H]1CCC[C@@H]1OCCCF 7a_200015395474_100011934791 [0,0,0,1,0,0|2,0,0]=3 7435 B15R1.9209 CCOC(=O)[C@@H]1CCC[C@@H]1OCCCO 7a_200015395474_100011215043 [0,0,0,1,0,0|2,0,0]=3 7436 B15R1.9209 CCOC(=O)[C@@H]1CCC[C@@H]1OCCOC 7a_200015395474_100000233755 [0,0,0,1,0,0|2,0,0]=3 7437 B15R1.9209 CCOC(=O)[C@@H]1CCC[C@@H]1OCCSC 7a_200015395474_100000212216 [0,0,0,1,0,0|2,0,0]=3 7438 B15R1.9209 CCOC(=O)[C@@H]1CSCN1CCCCF 269982a_100016989239_100000729493 [0,0,0,1,0,0|3,0,0]=4 7439 B15R1.9209 CCOC(=O)[C@@H]1CSCN1CCCCO 269982a_100016989239_100000210776 [0,0,0,1,0,0|3,0,0]=4 7440 B15R1.9209 CCOC(=O)[C@@H]1CSCN1CCCOC 269982a_100016989239_100000740836 [0,0,0,1,0,0|3,0,0]=4 7441 B15R1.9209 CCOC(=O)[C@@H]1CSCN1CCSCC 269982a_100016989239_100000757381 [0,0,0,1,0,0|3,0,0]=4 7442 B15R1.9209 CCOCCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100011215890 [0,0,0,1,0,0|2,0,0]=3 7443 B15R1.9209 CCOCCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100011215890 [0,0,0,1,0,0|2,0,0]=3 7444 B15R1.9209 CCOCCN1CSC[C@H]1C(=O)OCC 269982a_100016989239_100011215890 [0,0,0,1,0,0|3,0,0]=4 7445 B15R1.9497 CCCCCCN1CCNC(=O)C1CC 2230a_100000187962_100000210314 [0,0,0,1,0,0|3,0,0]=4 7446 B15R1.9497 CCCCCCN1CCNC(=O)C1CC 269982a_100000187962_100000210757 [0,0,0,1,0,0|3,0,0]=4 7447 B15R1.9497 CCCCCCN1CCNC(=O)C1CC 34a_100000187962_100000210314 [0,0,0,1,0,0|3,0,0]=4 7448 B15R1.10366 C=COC(=O)CNC1CCCCCCC1 2230a_100000211152_100000036128 [0,0,0,1,0,0|1,0,2]=4 7449 B15R1.10366 C=COC(=O)CNC1CCCCCCC1 34a_100000211152_100000036128 [0,0,0,1,0,0|1,0,2]=4 7450 B15R1.10366 C=COC(=O)COC1CCCCCCC1 34a_100000210054_100000036128 [0,0,0,1,0,0|1,0,2]=4 7451 B15R1.10366 CCCC(=O)CCN1CCCCCCC1 1458a_200015187237_100000210303 [0,0,0,1,0,0|2,0,0]=3 7452 B15R1.10366 CCCC(=O)CNC1CCCCCCC1 2230a_100000211152_100000747444 [0,0,0,1,0,0|2,0,0]=3 7453 B15R1.10366 CCCC(=O)COC1CCCCCCC1 7a_100000210054_100000747444 [0,0,0,1,0,0|2,0,0]=3 7454 B15R1.10366 CCCC(=O)OCN1CCCCCCC1 2230a_100000211400_100000034017 [0,0,0,1,0,0|3,0,0]=4 7455 B15R1.10366 CCCC(=O)OCN1CCCCCCC1 269982a_100000211400_100000034017 [0,0,0,1,0,0|3,0,0]=4 7456 B15R1.10366 CCCC(=O)OCN1CCCCCCC1 34a_100000211400_100000034017 [0,0,0,1,0,0|3,0,0]=4 7457 B15R1.10366 CCNC(=O)CCN1CCCCCCC1 2230a_100000211400_100000737597 [0,0,0,1,0,0|2,0,0]=3 7458 B15R1.10366 CCNC(=O)CCN1CCCCCCC1 240690a_100015525214_200015187237 [0,0,0,1,0,0|2,0,0]=3 7459 B15R1.10366 CCNC(=O)CCN1CCCCCCC1 269982a_100000211400_100000737597 [0,0,0,1,0,0|2,0,0]=3 7460 B15R1.10366 CCNC(=O)CNC1CCCCCCC1 2230a_100000211152_100000183381 [0,0,0,1,0,0|2,0,0]=3 7461 B15R1.10366 CCNC(=O)CNC1CCCCCCC1 270004a_100016988866_100000210524 [0,0,0,1,0,0|2,0,0]=3 7462 B15R1.10366 CCNC(=O)CNC1CCCCCCC1 34a_100000211152_100000183381 [0,0,0,1,0,0|2,0,0]=3 7463 B15R1.10366 CCNC(=O)COC1CCCCCCC1 34a_100000210054_100000183381 [0,0,0,1,0,0|2,0,0]=3 7464 B15R1.10366 CCNC(=O)COC1CCCCCCC1 7a_100000210054_100000183381 [0,0,0,1,0,0|2,0,0]=3 7465 B15R1.10366 CCOC(=O)CCN1CCCCCCC1 2230a_100000211400_100011206558 [0,0,0,1,0,0|1,0,0]=2 7466 B15R1.10366 CCOC(=O)CCN1CCCCCCC1 269982a_100000211400_100011206558 [0,0,0,1,0,0|1,0,0]=2 7467 B15R1.10366 CCOC(=O)CCN1CCCCCCC1 34a_100000211400_100000765890 [0,0,0,1,0,0|1,0,0]=2 7468 B15R1.10366 CCOC(=O)CNC1CCCCCCC1 2230a_100000211152_100000188475 [0,0,0,1,0,0|1,0,0]=2 7469 B15R1.10366 CCOC(=O)CNC1CCCCCCC1 34a_100000211152_100000188475 [0,0,0,1,0,0|1,0,0]=2 7470 B15R1.10366 CCOC(=O)COC1C=CCCCCC1 34a_100000688657_100000188475 [0,0,0,1,0,0|1,0,2]=4 7471 B15R1.10366 CCOC(=O)COC1CC/C=C\CCC1 34a_100016989180_100000188475 [0,0,0,1,0,0|1,0,2]=4 7472 B15R1.10366 CCOC(=O)COC1CCCCCCC1 34a_100000210054_100000188475 [0,0,0,1,0,0|1,0,0]=2 7473 B15R1.10366 CCOC(=O)COC1CCCCCCC1 7a_100000210054_100000188475 [0,0,0,1,0,0|1,0,0]=2 7474 B15R1.10366 CCOC(=O)CSC1CC/C=C\CCC1 62a_100000188475_100021000466 [0,0,0,1,0,0|1,0,2]=4 7475 B15R1.10366 CCOC(=O)CSC1CC/C=C\CCC1 62a_100021000466_100000188475 [0,0,0,1,0,0|1,0,2]=4 7476 B15R1.10366 CNNC(=O)CCN1CCCCCCC1 22a_100016993582_200015187237 [0,0,0,1,0,0|3,0,0]=4 7477 B15R1.10366 O=C(CCF)CCN1CCCCCCC1 1458a_200015187237_100011217306 [0,0,0,1,0,0|3,0,0]=4 7478 B15R1.10366 O=C(CCO)CCN1CCCCCCC1 1458a_200015187237_100000211926 [0,0,0,1,0,0|3,0,0]=4 7479 B15R1.10366 O=C(CNC1CCCCCCC1)NCO 2230a_100000211152_100000185155 [0,0,0,1,0,0|3,0,0]=4 7480 B15R1.10366 O=C(CNC1CCCCCCC1)NCO 34a_100000211152_100000185155 [0,0,0,1,0,0|3,0,0]=4 7481 B15R1.10366 O=C(COC1CCCCCCC1)NCO 34a_100000210054_100000185155 [0,0,0,1,0,0|3,0,0]=4 7482 B15R1.10366 O=C(COC1CCCCCCC1)NCO 7a_100000210054_100000185155 [0,0,0,1,0,0|3,0,0]=4 7483 B15R1.10442 CCOC(=O)CCCCC=NNC1CC1 4a_100000701032_100012182868 [0,0,0,1,0,0|2,0,1]=4 7484 B15R1.10442 CCOC(=O)CCCCCCNC1CC1 34a_100000212008_100009814379 [0,0,0,1,0,0|1,0,0]=2 7485 B15R1.10442 CCOC(=O)CCCCCNCC1CC1 2230a_100000735609_100000755133 [0,0,0,1,0,0|1,0,0]=2 7486 B15R1.10442 CCOC(=O)CCCCCNCC1CC1 34a_100000735609_100000755133 [0,0,0,1,0,0|1,0,0]=2 7487 B15R1.10442 CCOC(=O)CCCCCOCC1CC1 34a_100000211283_100000755133 [0,0,0,1,0,0|1,0,0]=2 7488 B15R1.10442 CCOC(=O)CCCCCOCC1CC1 7a_100011214988_100000742324 [0,0,0,1,0,0|1,0,0]=2 7489 B15R1.10442 CCOC(=O)CCCCCOCC1CO1 7a_100011214988_102125554688 [0,0,0,1,0,0|2,0,0]=3 7490 B15R1.10442 CCOC(=O)CCCCCOCC1CS1 7a_100011214988_100000031435 [0,0,0,1,0,0|2,0,0]=3 7491 B15R1.10442 CCOC(=O)CCCCCOC[C@@H]1CO1 34a_100000757423_100000755133 [0,0,0,1,0,0|2,0,0]=3 7492 B15R1.10442 CCOC(=O)CCCCCOC[C@@H]1CO1 7a_100011214988_100000745022 [0,0,0,1,0,0|2,0,0]=3 7493 B15R1.10442 CCOC(=O)CCCCCSCC1CC1 62a_100000755133_100000742324 [0,0,0,1,0,0|1,0,0]=2 7494 B15R1.10442 CCOC(=O)CCCCCSCC1CC1 62a_100000756562_100000755133 [0,0,0,1,0,0|1,0,0]=2 7495 B15R1.10442 CCOC(=O)CCCCCSCC1CO1 62a_100000755133_102125554688 [0,0,0,1,0,0|2,0,0]=3 7496 B15R1.10442 CCOC(=O)CCCCCSCC1CO1 62a_102125554688_100000755133 [0,0,0,1,0,0|2,0,0]=3 7497 B15R1.10442 CCOC(=O)CCCCCSCC1CS1 62a_100000031435_100000755133 [0,0,0,1,0,0|2,0,0]=3 7498 B15R1.10442 CCOC(=O)CCCCCSCC1CS1 62a_100000755133_100000031435 [0,0,0,1,0,0|2,0,0]=3 7499 B15R1.10442 CCOC(=O)CCCCCSC[C@@H]1CO1 62a_100000745022_100000755133 [0,0,0,1,0,0|2,0,0]=3 7500 B15R1.10442 CCOC(=O)CCCCCSC[C@@H]1CO1 62a_100000755133_100000745022 [0,0,0,1,0,0|2,0,0]=3 7501 B15R1.10442 CCOC(=O)CCCCNCCC1CC1 34a_100000764129_100000750268 [0,0,0,1,0,0|1,0,0]=2 7502 B15R1.10442 CCOC(=O)CCCCOCCC1CC1 34a_100000754188_100000750268 [0,0,0,1,0,0|1,0,0]=2 7503 B15R1.10442 CCOC(=O)CCCCOCCC1CC1 7a_100000754188_100000750268 [0,0,0,1,0,0|1,0,0]=2 7504 B15R1.10442 CCOC(=O)CCCCOCC[C@@H]1CO1 34a_100009820653_100000750268 [0,0,0,1,0,0|2,0,0]=3 7505 B15R1.10442 CCOC(=O)CCCCSCCC1CC1 62a_100000750268_100000764125 [0,0,0,1,0,0|1,0,0]=2 7506 B15R1.10442 CCOC(=O)CCCCSCCC1CC1 62a_100000764125_100000750268 [0,0,0,1,0,0|1,0,0]=2 7507 B15R1.10442 CCOC(=O)CCCCSCCC1CO1 62a_100000732470_100000750268 [0,0,0,1,0,0|2,0,0]=3 7508 B15R1.10442 CCOC(=O)CCCCSCCC1CO1 62a_100000750268_100000732470 [0,0,0,1,0,0|2,0,0]=3 7509 B15R1.10442 CCOC(=O)CCCOCC#CC1CC1 34a_100000083941_100009991533 [0,0,0,1,0,0|1,0,2]=4 7510 B15R1.10442 CCOC(=O)CCCOCC#CC1CC1 7a_100000083941_100011215271 [0,0,0,1,0,0|1,0,2]=4 7511 B15R1.10442 CCOC(=O)CCCOCC#CC1CC1 7a_100012001163_100009895102 [0,0,0,1,0,0|1,0,2]=4 7512 B15R1.10442 CCOC(=O)CCCOCCCC1CO1 7a_100012001163_100000733510 [0,0,0,1,0,0|2,0,0]=3 7513 B15R1.10442 CCOC(=O)CCCOCCNC1CC1 34a_100000738766_100009991533 [0,0,0,1,0,0|2,0,0]=3 7514 B15R1.10442 CCOC(=O)CCCSCC#CC1CC1 62a_100009895102_100009991533 [0,0,0,1,0,0|1,0,2]=4 7515 B15R1.10442 CCOC(=O)CCCSCC#CC1CC1 62a_100009991533_100009895102 [0,0,0,1,0,0|1,0,2]=4 7516 B15R1.10442 CCOC(=O)CCCSCCCC1CO1 62a_100000733510_100009991533 [0,0,0,1,0,0|2,0,0]=3 7517 B15R1.10442 CCOC(=O)CCCSCCCC1CO1 62a_100009991533_100000733510 [0,0,0,1,0,0|2,0,0]=3 7518 B15R1.10442 CCOC(=O)COCCCNCC1CC1 2230a_100000735609_100009893628 [0,0,0,1,0,0|2,0,0]=3 7519 B15R1.10442 CCOC(=O)COCCCNCC1CC1 34a_100000735609_100009893628 [0,0,0,1,0,0|2,0,0]=3 7520 B15R1.10442 CCOC(=O)COCCCOCC1CC1 34a_100000211283_100009893628 [0,0,0,1,0,0|2,0,0]=3 7521 B15R1.10442 CCOC(=O)COCCCOC[C@@H]1CO1 34a_100000757423_100009893628 [0,0,0,1,0,0|3,0,0]=4 7522 B15R1.10442 CCOC(=O)COCCCSCC1CC1 62a_100000756562_100009893628 [0,0,0,1,0,0|2,0,0]=3 7523 B15R1.10442 CCOC(=O)COCCCSCC1CC1 62a_100009893628_100000742324 [0,0,0,1,0,0|2,0,0]=3 7524 B15R1.10442 CCOC(=O)COCCCSCC1CO1 62a_100009893628_102125554688 [0,0,0,1,0,0|3,0,0]=4 7525 B15R1.10442 CCOC(=O)COCCCSCC1CO1 62a_102125554688_100009893628 [0,0,0,1,0,0|3,0,0]=4 7526 B15R1.10442 CCOC(=O)COCCCSCC1CS1 62a_100000031435_100009893628 [0,0,0,1,0,0|3,0,0]=4 7527 B15R1.10442 CCOC(=O)COCCCSCC1CS1 62a_100009893628_100000031435 [0,0,0,1,0,0|3,0,0]=4 7528 B15R1.10442 CCOC(=O)COCCCSC[C@@H]1CO1 62a_100000745022_100009893628 [0,0,0,1,0,0|3,0,0]=4 7529 B15R1.10442 CCOC(=O)COCCCSC[C@@H]1CO1 62a_100009893628_100000745022 [0,0,0,1,0,0|3,0,0]=4 7530 B15R1.10442 CCOC(=O)COCCNCCC1CC1 34a_100000764129_100000088970 [0,0,0,1,0,0|2,0,0]=3 7531 B15R1.10442 CCOC(=O)COCCOCCC1CC1 34a_100000754188_100000088970 [0,0,0,1,0,0|2,0,0]=3 7532 B15R1.10442 CCOC(=O)COCCOCCC1CC1 7a_100000754188_100000088970 [0,0,0,1,0,0|2,0,0]=3 7533 B15R1.10442 CCOC(=O)COCCOCC[C@@H]1CO1 34a_100009820653_100000088970 [0,0,0,1,0,0|3,0,0]=4 7534 B15R1.10442 CCOC(=O)COCCSCCC1CC1 62a_100000088970_100000764125 [0,0,0,1,0,0|2,0,0]=3 7535 B15R1.10442 CCOC(=O)COCCSCCC1CC1 62a_100000764125_100000088970 [0,0,0,1,0,0|2,0,0]=3 7536 B15R1.10442 CCOC(=O)COCCSCCC1CO1 62a_100000088970_100000732470 [0,0,0,1,0,0|3,0,0]=4 7537 B15R1.10442 CCOC(=O)COCCSCCC1CO1 62a_100000732470_100000088970 [0,0,0,1,0,0|3,0,0]=4 7538 B15R1.10442 CCOC(=O)CSCCOCCC1CC1 7a_200000230590_100000764125 [0,0,0,1,0,0|2,0,0]=3 7539 B15R1.10442 CCOC(=O)CSCCOCCC1CO1 7a_200000230590_100000732470 [0,0,0,1,0,0|3,0,0]=4 7540 B15R1.10442 CCOC(=O)NCCOCCCC1CO1 34a_100000158857_100000733510 [0,0,0,1,0,0|3,0,0]=4 7541 B15R1.10442 CCOC(=O)NCCSCCCC1CO1 62a_100000733510_200011445536 [0,0,0,1,0,0|3,0,0]=4 7542 B15R1.10705 C=COC(=O)CN1CCCCCCCC1 2230a_100000039187_100000036128 [0,0,0,1,0,0|1,0,2]=4 7543 B15R1.10705 C=COC(=O)CN1CCCCCCCC1 269982a_100000039187_100000036128 [0,0,0,1,0,0|1,0,2]=4 7544 B15R1.10705 C=COC(=O)CN1CCCCCCCC1 34a_100000039187_100000036128 [0,0,0,1,0,0|1,0,2]=4 7545 B15R1.10705 CCCC(=O)CN1CCCCCCCC1 2230a_100000039187_100000747444 [0,0,0,1,0,0|2,0,0]=3 7546 B15R1.10705 CCCC(=O)CN1CCCCCCCC1 269982a_100000039187_100000747444 [0,0,0,1,0,0|2,0,0]=3 7547 B15R1.10705 CCNC(=O)CN1CCCCCCCC1 2230a_100000039187_100000183381 [0,0,0,1,0,0|2,0,0]=3 7548 B15R1.10705 CCNC(=O)CN1CCCCCCCC1 269982a_100000039187_100000183381 [0,0,0,1,0,0|2,0,0]=3 7549 B15R1.10705 CCNC(=O)CN1CCCCCCCC1 34a_100000039187_100000183381 [0,0,0,1,0,0|2,0,0]=3 7550 B15R1.10705 CCOC(=O)CN1CCCCCCCC1 2230a_100000039187_100000188475 [0,0,0,1,0,0|1,0,0]=2 7551 B15R1.10705 CCOC(=O)CN1CCCCCCCC1 269982a_100000039187_100000188475 [0,0,0,1,0,0|1,0,0]=2 7552 B15R1.10705 CCOC(=O)CN1CCCCCCCC1 34a_100000039187_100000188475 [0,0,0,1,0,0|1,0,0]=2 7553 B15R1.10705 O=C(CN1CCCCCCCC1)NCO 2230a_100000039187_100000185155 [0,0,0,1,0,0|3,0,0]=4 7554 B15R1.10705 O=C(CN1CCCCCCCC1)NCO 269982a_100000039187_100000185155 [0,0,0,1,0,0|3,0,0]=4 7555 B15R1.10705 O=C(CN1CCCCCCCC1)NCO 34a_100000039187_100000185155 [0,0,0,1,0,0|3,0,0]=4 7556 B15R1.12171 C=CCCCCCCCCC(=O)C1CC1 1458a_100000210395_100011933949 [0,0,0,1,0,0|1,0,2]=4 7557 B15R1.12171 CCC#CCCCCCCC(=O)C1CC1 1458a_100000210395_200000036426 [0,0,0,1,0,0|1,0,2]=4 7558 B15R1.12171 CCCCCCCCCCC(=O)C1CC1 1458a_100000210395_100000210319 [0,0,0,1,0,0|1,0,0]=2 7559 B15R1.12171 CCCCCCCCCCC(=O)C1CO1 1458a_100000701028_100000210319 [0,0,0,1,0,0|2,0,0]=3 7560 B15R1.12171 CCCCCCCCCCN(C)C1CC1 2230a_100000226674_100000210320 [0,0,0,1,0,0|3,0,0]=4 7561 B15R1.12171 CCCCCCCCCCN(C)C1CC1 269982a_100000207566_100000211595 [0,0,0,1,0,0|3,0,0]=4 7562 B15R1.12171 CCCCCCCCCCN(C)C1CC1 269982a_100000226674_100000210320 [0,0,0,1,0,0|3,0,0]=4 7563 B15R1.12171 CCCCCCCCCNC(=O)C1CC1 11a_100000212291_100000210395 [0,0,0,1,0,0|2,0,0]=3 7564 B15R1.12171 CCCCCCCCCNC(=O)C1CC1 1626a_100000212291_100000210395 [0,0,0,1,0,0|2,0,0]=3 7565 B15R1.12171 CCCCCCCCCNC(=O)C1CC1 240690a_100000212291_100000210395 [0,0,0,1,0,0|2,0,0]=3 7566 B15R1.12171 CCCCCCCCCNC(=O)C1CC1 527a_100000212291_100000210395 [0,0,0,1,0,0|2,0,0]=3 7567 B15R1.12171 CCCCCCCCCNC(=O)C1CO1 11a_100000212291_100000701028 [0,0,0,1,0,0|3,0,0]=4 7568 B15R1.12171 CCCCCCCCCNC(=O)C1CO1 1626a_100000212291_100000701028 [0,0,0,1,0,0|3,0,0]=4 7569 B15R1.12171 CCCCCCCCCNC(=O)C1CO1 240690a_100000212291_100000701028 [0,0,0,1,0,0|3,0,0]=4 7570 B15R1.12171 CCCCCCCCCNC(=O)C1CO1 527a_100000212291_100000701028 [0,0,0,1,0,0|3,0,0]=4 7571 B15R1.12171 CCCCCCCCNCC(=O)C1CC1 2230a_100000229939_100000746382 [0,0,0,1,0,0|2,0,0]=3 7572 B15R1.12171 CCCCCCCCNCC(=O)C1CC1 34a_100000229939_100000746382 [0,0,0,1,0,0|2,0,0]=3 7573 B15R1.12171 CCCCCCCCOCC(=O)C1CC1 34a_100000210232_100000746382 [0,0,0,1,0,0|2,0,0]=3 7574 B15R1.12171 CCCCCCCCOCC(=O)C1CC1 34a_100000686663_100000210759 [0,0,0,1,0,0|2,0,0]=3 7575 B15R1.12171 CCCCCCCCOCC(=O)C1CC1 7a_100000210232_100000746382 [0,0,0,1,0,0|2,0,0]=3 7576 B15R1.12171 CCCCCCCCSCC(=O)C1CC1 62a_100000210759_100000746382 [0,0,0,1,0,0|2,0,0]=3 7577 B15R1.12171 CCCCCCCCSCC(=O)C1CC1 62a_100000746382_100000210317 [0,0,0,1,0,0|2,0,0]=3 7578 B15R1.12171 CCCCCCCNCOC(=O)C1CC1 2230a_100000229938_100000140896 [0,0,0,1,0,0|3,0,0]=4 7579 B15R1.12171 CCCCCCCOCOC(=O)C1CC1 34a_100000210272_100000140896 [0,0,0,1,0,0|3,0,0]=4 7580 B15R1.12171 CCCCCCCSCOC(=O)C1CC1 62a_100000140896_100000210316 [0,0,0,1,0,0|3,0,0]=4 7581 B15R1.12171 CCCCCCCSCOC(=O)C1CC1 62a_100000210614_100000140896 [0,0,0,1,0,0|3,0,0]=4 7582 B15R1.12171 CCCCCNCCOCC(=O)C1CC1 34a_100000224656_100000746382 [0,0,0,1,0,0|3,0,0]=4 7583 B15R1.12171 CCCCCOCCOCC(=O)C1CC1 34a_100011215259_100000746382 [0,0,0,1,0,0|3,0,0]=4 7584 B15R1.12171 CCCCCOCCOCC(=O)C1CC1 7a_100011215259_100000746382 [0,0,0,1,0,0|3,0,0]=4 7585 B15R1.12171 CCCCOCCCNCC(=O)C1CC1 2230a_200000211371_100000746382 [0,0,0,1,0,0|3,0,0]=4 7586 B15R1.12171 CCCCOCCCNCC(=O)C1CC1 34a_200000211371_100000746382 [0,0,0,1,0,0|3,0,0]=4 7587 B15R1.12171 CCCCOCCCOCC(=O)C1CC1 34a_200011215613_100000746382 [0,0,0,1,0,0|3,0,0]=4 7588 B15R1.12171 CCCCOCCCOCC(=O)C1CC1 7a_200011215613_100000746382 [0,0,0,1,0,0|3,0,0]=4 7589 B15R1.12171 COCCCCCCOCC(=O)C1CC1 34a_100000686663_100011998445 [0,0,0,1,0,0|3,0,0]=4 7590 B15R1.12171 COCCCCCCOCC(=O)C1CC1 34a_200012092642_100000746382 [0,0,0,1,0,0|3,0,0]=4 7591 B15R1.12171 COCCCCCCOCC(=O)C1CC1 7a_200012092642_100000746382 [0,0,0,1,0,0|3,0,0]=4 7592 B15R1.12171 COCCCCCCSCC(=O)C1CC1 62a_100000746382_100011998445 [0,0,0,1,0,0|3,0,0]=4 7593 B15R1.12171 COCCCCCCSCC(=O)C1CC1 62a_100011998445_100000746382 [0,0,0,1,0,0|3,0,0]=4 7594 B15R1.12171 NCCCCCCCOCC(=O)C1CC1 34a_100011996573_100000746382 [0,0,0,1,0,0|3,0,0]=4 7595 B15R1.12171 O=C(CCCCCCCCCO)C1CC1 1458a_100000210395_100009813782 [0,0,0,1,0,0|2,0,0]=3 7596 B15R1.12171 O=C(CCCCCCCCCO)C1CO1 1458a_100000701028_100009813782 [0,0,0,1,0,0|3,0,0]=4 7597 B15R1.12171 O=C(CNCCCCCCCO)C1CC1 2230a_100011996573_100000746382 [0,0,0,1,0,0|3,0,0]=4 7598 B15R1.12171 O=C(CNCCCCCCCO)C1CC1 34a_100011996573_100000746382 [0,0,0,1,0,0|3,0,0]=4 7599 B15R1.12171 O=C(COCCCCCCCBr)C1CC1 34a_100000760002_100000746382 [0,0,0,1,0,0|3,0,0]=4 7600 B15R1.12171 O=C(COCCCCCCCBr)C1CC1 7a_100000760002_100000746382 [0,0,0,1,0,0|3,0,0]=4 7601 B15R1.12171 O=C(COCCCCCCCO)C1CC1 34a_100000686663_100000760002 [0,0,0,1,0,0|3,0,0]=4 7602 B15R1.12171 O=C(CSCCCCCCCO)C1CC1 62a_100000746382_100000760002 [0,0,0,1,0,0|3,0,0]=4 7603 B15R1.12171 O=C(CSCCCCCCCO)C1CC1 62a_100000760002_100000746382 [0,0,0,1,0,0|3,0,0]=4 7604 B15R1.12171 O=C(NCCCCCCCCO)C1CC1 240690a_102515433106_100000210395 [0,0,0,1,0,0|3,0,0]=4 7605 B12R0.1 CC#CC(=O)CCCCCCCC 1458a_100000763181_100000210759 [2,0,0,0,0,0|1,0,1]=4 7606 B12R0.1 CC=CC(=O)CCCCCCCC 1458a_100000210699_100000210759 [2,0,0,0,0,0|1,0,1]=4 7607 B12R0.1 CCCC(=O)CCCCCCCO 1458a_100000211992_100000760002 [2,0,0,0,0,0|2,0,0]=4 7608 B12R0.1 CCCC(=O)CCCCCCCO 1458a_100011219782_100000210303 [2,0,0,0,0,0|2,0,0]=4 7609 B12R0.1 CCCC(=O)CCCCCCOC 1458a_100000211992_100011998445 [2,0,0,0,0,0|2,0,0]=4 7610 B12R0.1 CCCCCCCCC(=O)CCC 1458a_100000210188_100000210303 [2,0,0,0,0,0|1,0,0]=3 7611 B12R0.1 CCCCCCCCC(=O)CCC 1458a_100000211992_100000210759 [2,0,0,0,0,0|1,0,0]=3 7612 B12R0.1 CCCCCCCCC(=O)CCF 1458a_100000210188_100011217306 [2,0,0,0,0,0|2,0,0]=4 7613 B12R0.1 CCCCCCCCC(=O)CCO 1458a_100000210188_100000211926 [2,0,0,0,0,0|2,0,0]=4 7614 B12R0.1 CCCCCCCCC(=O)CCO 1458a_100011216618_100000210759 [2,0,0,0,0,0|2,0,0]=4 7615 B12R0.1 CCCCCCCCC(=O)COC 1458a_100000210968_100000210759 [2,0,0,0,0,0|2,0,0]=4 7616 B12R0.1 CCCCCCCCC(=O)CSC 1458a_100000184570_100000210759 [2,0,0,0,0,0|2,0,0]=4 7617 B12R0.1 CCCCCCCCC(=O)NCC 11a_100015525214_100000210188 [2,0,0,0,0,0|1,0,0]=3 7618 B12R0.1 CCCCCCCCC(=O)NCC 240690a_100015525214_100000210188 [2,0,0,0,0,0|1,0,0]=3 7619 B12R0.1 CCCCCCCCC(=O)NCC 527a_100015525214_100000210188 [2,0,0,0,0,0|1,0,0]=3 7620 B12R0.1 CCCCCCCCC(=O)NNC 22a_100016993582_100000210188 [2,0,0,0,0,0|2,0,0]=4 7621 B12R0.1 CCCCCCCCC(C)OCC 34a_100000210740_100000210202 [2,0,0,0,0,0|1,0,1]=4 7622 B12R0.1 CCCCCCCCC(C)OCC 7a_100000210740_100000210202 [2,0,0,0,0,0|1,0,1]=4 7623 B12R0.1 CCCCCCCNC(=O)CCC 11a_100000229938_100000211992 [2,0,0,0,0,0|2,0,0]=4 7624 B12R0.1 CCCCCCCNC(=O)CCC 1626a_100000229938_100000211992 [2,0,0,0,0,0|2,0,0]=4 7625 B12R0.1 CCCCCCCNC(=O)CCC 240690a_100000229938_100000211992 [2,0,0,0,0,0|2,0,0]=4 7626 B12R0.1 CCCCCCCNC(=O)CCC 527a_100000229938_100000211992 [2,0,0,0,0,0|2,0,0]=4 7627 B12R0.1 CCCCCCCNC(=O)NCC 2708a_100000229938_100015525214 [2,0,0,0,0,0|2,0,0]=4 7628 B12R0.1 CCCCCCCNC(=O)NCC 2708a_100015525214_100000229938 [2,0,0,0,0,0|2,0,0]=4 7629 B12R0.1 CCCCCCCNC(=O)NCC 273464a_100000229938_100015525214 [2,0,0,0,0,0|2,0,0]=4 7630 B12R0.1 CCCCCCCNC(=O)NCC 273464a_100015525214_100000229938 [2,0,0,0,0,0|2,0,0]=4 7631 B12R0.1 CCCCCCCNC(=O)NCC 512a_100000229938_100015525214 [2,0,0,0,0,0|2,0,0]=4 7632 B12R0.1 CCCCCCCNC(=O)NCC 512a_100015525214_100000229938 [2,0,0,0,0,0|2,0,0]=4 7633 B12R0.1 CCCCCCNCC(=O)CCC 2230a_100000210581_100000747444 [2,0,0,0,0,0|2,0,0]=4 7634 B12R0.1 CCCCCCNCC(=O)NCC 2230a_100000210581_100000183381 [2,0,0,0,0,0|2,0,0]=4 7635 B12R0.1 CCCCCCNCC(=O)NCC 2230a_100016988866_100000210314 [2,0,0,0,0,0|2,0,0]=4 7636 B12R0.1 CCCCCCNCC(=O)OCC 2230a_100000210581_100000188475 [2,0,0,0,0,0|1,0,0]=3 7637 B12R0.1 CCCCCCOCC(=O)CCC 7a_100000210259_100000747444 [2,0,0,0,0,0|2,0,0]=4 7638 B12R0.1 CCCCCCOCC(=O)NCC 34a_100000210259_100000183381 [2,0,0,0,0,0|2,0,0]=4 7639 B12R0.1 CCCCCCOCC(=O)NCC 7a_100000210259_100000183381 [2,0,0,0,0,0|2,0,0]=4 7640 B12R0.1 CCCCCCOCC(=O)OCC 34a_100000210259_100000188475 [2,0,0,0,0,0|1,0,0]=3 7641 B12R0.1 CCCCCCOCC(=O)OCC 7a_100000210259_100000188475 [2,0,0,0,0,0|1,0,0]=3 7642 B12R0.1 CCCCCCSCC(=O)CCC 62a_100000210314_100000747444 [2,0,0,0,0,0|2,0,0]=4 7643 B12R0.1 CCCCCCSCC(=O)CCC 62a_100000747444_100000210757 [2,0,0,0,0,0|2,0,0]=4 7644 B12R0.1 CCCCCCSCC(=O)NCC 62a_100000183381_100000210757 [2,0,0,0,0,0|2,0,0]=4 7645 B12R0.1 CCCCCCSCC(=O)NCC 62a_100000210314_100000183381 [2,0,0,0,0,0|2,0,0]=4 7646 B12R0.1 CCCCCCSCC(=O)OCC 62a_100000188475_100000210757 [2,0,0,0,0,0|1,0,0]=3 7647 B12R0.1 CCCCCCSCC(=O)OCC 62a_100000210314_100000188475 [2,0,0,0,0,0|1,0,0]=3 7648 B12R0.1 CCCCCNCCC(=O)NCC 2230a_100000209983_100000737597 [2,0,0,0,0,0|2,0,0]=4 7649 B12R0.1 CCCCCNCCC(=O)NCC 34a_100025743525_100000718602 [2,0,0,0,0,0|2,0,0]=4 7650 B12R0.1 CCCCCNCCC(=O)OCC 2230a_100000209983_100011206558 [2,0,0,0,0,0|1,0,0]=3 7651 B12R0.1 CCCCCOCCC(=O)NCC 7a_100000210253_100000737597 [2,0,0,0,0,0|2,0,0]=4 7652 B12R0.1 CCCCCOCCC(=O)OCC 34a_100000210253_100000765890 [2,0,0,0,0,0|1,0,0]=3 7653 B12R0.1 CCCCCOCCC(=O)OCC 7a_100000210253_100011206558 [2,0,0,0,0,0|1,0,0]=3 7654 B12R0.1 CCCCCSCCC(=O)NCC 62a_100000210326_100000737597 [2,0,0,0,0,0|2,0,0]=4 7655 B12R0.1 CCCCCSCCC(=O)NCC 62a_100000737597_100000210326 [2,0,0,0,0,0|2,0,0]=4 7656 B12R0.1 CCCCCSCCC(=O)OCC 62a_100000210326_100000765890 [2,0,0,0,0,0|1,0,0]=3 7657 B12R0.1 CCCCCSCCC(=O)OCC 62a_100000765890_100000210326 [2,0,0,0,0,0|1,0,0]=3 7658 B12R0.1 CCCCCSCOC(=O)OCC 62a_100000210326_100000075025 [2,0,0,0,0,0|2,0,0]=4 7659 B12R0.1 CCCCNCCCC(=O)OCC 2230a_100000102301_100009991533 [2,0,0,0,0,0|1,0,0]=3 7660 B12R0.1 CCCCNCCCC(=O)OCC 7a_106832991798_100011215271 [2,0,0,0,0,0|1,0,0]=3 7661 B12R0.1 CCCCNCCNC(=O)OCC 7a_106832991798_200011445536 [2,0,0,0,0,0|2,0,0]=4 7662 B12R0.1 CCCCOCCCC(=O)OCC 34a_100000210227_100009991533 [2,0,0,0,0,0|1,0,0]=3 7663 B12R0.1 CCCCOCCCC(=O)OCC 7a_100000210227_100011215271 [2,0,0,0,0,0|1,0,0]=3 7664 B12R0.1 CCCCOCCCC(=O)OCC 7a_100012001163_100000210211 [2,0,0,0,0,0|1,0,0]=3 7665 B12R0.1 CCCCOCCNC(=O)OCC 34a_100000158857_100000210210 [2,0,0,0,0,0|2,0,0]=4 7666 B12R0.1 CCCCOCCNC(=O)OCC 7a_100000210227_200011445536 [2,0,0,0,0,0|2,0,0]=4 7667 B12R0.1 CCCCOCSCC(=O)OCC 62a_100000188475_100011995733 [2,0,0,0,0,0|2,0,0]=4 7668 B12R0.1 CCCCOCSCC(=O)OCC 62a_100011995733_100000188475 [2,0,0,0,0,0|2,0,0]=4 7669 B12R0.1 CCCCSCCCC(=O)OCC 62a_100000210211_100009991533 [2,0,0,0,0,0|1,0,0]=3 7670 B12R0.1 CCCCSCCCC(=O)OCC 62a_100009991533_100000210210 [2,0,0,0,0,0|1,0,0]=3 7671 B12R0.1 CCCCSCCNC(=O)OCC 62a_100000210211_200011445536 [2,0,0,0,0,0|2,0,0]=4 7672 B12R0.1 CCCOCCCCC(=O)OCC 34a_100000210258_100000750268 [2,0,0,0,0,0|1,0,0]=3 7673 B12R0.1 CCCOCCNCC(=O)OCC 2230a_100161115042_100000188475 [2,0,0,0,0,0|2,0,0]=4 7674 B12R0.1 CCCOCCNCC(=O)OCC 34a_100161115042_100000188475 [2,0,0,0,0,0|2,0,0]=4 7675 B12R0.1 CCCOCCOCC(=O)OCC 34a_100000210258_100000088970 [2,0,0,0,0,0|2,0,0]=4 7676 B12R0.1 CCCOCCOCC(=O)OCC 34a_100000752267_100000188475 [2,0,0,0,0,0|2,0,0]=4 7677 B12R0.1 CCCOCCOCC(=O)OCC 7a_100000752267_100000188475 [2,0,0,0,0,0|2,0,0]=4 7678 B12R0.1 CCCOCCSCC(=O)OCC 62a_100000188475_100011215938 [2,0,0,0,0,0|2,0,0]=4 7679 B12R0.1 CCCOCCSCC(=O)OCC 62a_100011215938_100000188475 [2,0,0,0,0,0|2,0,0]=4 7680 B12R0.1 CCCOCCSCC(=O)OCC 7a_200000230590_100000210303 [2,0,0,0,0,0|2,0,0]=4 7681 B12R0.1 CCCSCCCCC(=O)OCC 62a_100000210303_100000750268 [2,0,0,0,0,0|1,0,0]=3 7682 B12R0.1 CCCSCCCCC(=O)OCC 62a_100000750268_100000210303 [2,0,0,0,0,0|1,0,0]=3 7683 B12R0.1 CCCSCCNCC(=O)OCC 2230a_100020603323_100000188475 [2,0,0,0,0,0|2,0,0]=4 7684 B12R0.1 CCCSCCOCC(=O)OCC 34a_200000230433_100000188475 [2,0,0,0,0,0|2,0,0]=4 7685 B12R0.1 CCCSCCOCC(=O)OCC 62a_100000088970_100000210303 [2,0,0,0,0,0|2,0,0]=4 7686 B12R0.1 CCCSCCOCC(=O)OCC 62a_100000210303_100000088970 [2,0,0,0,0,0|2,0,0]=4 7687 B12R0.1 CCCSCCOCC(=O)OCC 7a_200000230433_100000188475 [2,0,0,0,0,0|2,0,0]=4 7688 B12R0.1 CCNC(=O)CCCCCCCO 240690a_100015525214_100011219782 [2,0,0,0,0,0|2,0,0]=4 7689 B12R0.1 CCNCCCCCC(=O)OCC 2230a_100015525214_100000755133 [2,0,0,0,0,0|1,0,0]=3 7690 B12R0.1 CCNCCCOCC(=O)OCC 2230a_100015525214_100009893628 [2,0,0,0,0,0|2,0,0]=4 7691 B12R0.1 CCOC(=O)CCCCCCNC 2230a_106832991635_100009814379 [2,0,0,0,0,0|1,0,0]=3 7692 B12R0.1 CCOC(=O)CCCCCCNC 34a_100102657272_100009814379 [2,0,0,0,0,0|1,0,0]=3 7693 B12R0.1 CCOC(=O)CCCCCCNC 7a_106832991635_100009814379 [2,0,0,0,0,0|1,0,0]=3 7694 B12R0.1 CCOC(=O)CCCCCCOC 34a_100138415774_100009814379 [2,0,0,0,0,0|1,0,0]=3 7695 B12R0.1 CCOC(=O)CCCCCCSC 62a_200000210301_100009814379 [2,0,0,0,0,0|1,0,0]=3 7696 B12R0.1 CCOC(=O)CCCCCCS[13CH3] 62a_200025704644_100009814379 [2,0,0,0,0,0|1,0,0]=3 7697 B12R0.1 CCOC(=O)CCCCCOCF 7a_100011214988_100015361967 [2,0,0,0,0,0|2,0,0]=4 7698 B12R0.1 CCOC(=O)CCCCCSCC 62a_100000210202_100000755133 [2,0,0,0,0,0|1,0,0]=3 7699 B12R0.1 CCOC(=O)CCCCCSCC 62a_100000755133_100000210202 [2,0,0,0,0,0|1,0,0]=3 7700 B12R0.1 CCOC(=O)CCCCCSCF 62a_100000755133_100015361967 [2,0,0,0,0,0|2,0,0]=4 7701 B12R0.1 CCOC(=O)CCCCCSCF 62a_100015361967_100000755133 [2,0,0,0,0,0|2,0,0]=4 7702 B12R0.1 CCOC(=O)CCCCNCCF 34a_100000724931_100000750268 [2,0,0,0,0,0|2,0,0]=4 7703 B12R0.1 CCOC(=O)CCCCNCCO 2230a_100016997473_100000750268 [2,0,0,0,0,0|2,0,0]=4 7704 B12R0.1 CCOC(=O)CCCCNCCO 34a_100016990907_100000750268 [2,0,0,0,0,0|2,0,0]=4 7705 B12R0.1 CCOC(=O)CCCCOCCBr 34a_100000211926_100000750268 [2,0,0,0,0,0|2,0,0]=4 7706 B12R0.1 CCOC(=O)CCCCOCCN 34a_100000210304_100000750268 [2,0,0,0,0,0|2,0,0]=4 7707 B12R0.1 CCOC(=O)CCCCSCCF 62a_100000750268_100011217306 [2,0,0,0,0,0|2,0,0]=4 7708 B12R0.1 CCOC(=O)CCCCSCCF 62a_100011217306_100000750268 [2,0,0,0,0,0|2,0,0]=4 7709 B12R0.1 CCOC(=O)CCCCSCCO 62a_100000211926_100000750268 [2,0,0,0,0,0|2,0,0]=4 7710 B12R0.1 CCOC(=O)CCCCSCCO 62a_100000750268_100000211926 [2,0,0,0,0,0|2,0,0]=4 7711 B12R0.1 CCOC(=O)CCCCSCOC 62a_100000750268_100000766300 [2,0,0,0,0,0|2,0,0]=4 7712 B12R0.1 CCOC(=O)CCCCSCOC 62a_100000766300_100000750268 [2,0,0,0,0,0|2,0,0]=4 7713 B12R0.1 CCOC(=O)CCCCSCSC 62a_100000750268_100011218213 [2,0,0,0,0,0|2,0,0]=4 7714 B12R0.1 CCOC(=O)CCCCSCSC 62a_100011218213_100000750268 [2,0,0,0,0,0|2,0,0]=4 7715 B12R0.1 CCOC(=O)CCCNCCCF 2230a_100015189416_100009991533 [2,0,0,0,0,0|2,0,0]=4 7716 B12R0.1 CCOC(=O)CCCNCCCF 34a_100015189416_100009991533 [2,0,0,0,0,0|2,0,0]=4 7717 B12R0.1 CCOC(=O)CCCNCCOC 2230a_100000209980_100009991533 [2,0,0,0,0,0|2,0,0]=4 7718 B12R0.1 CCOC(=O)CCCNCCSC 2230a_100020590264_100009991533 [2,0,0,0,0,0|2,0,0]=4 7719 B12R0.1 CCOC(=O)CCCOCCCBr 34a_100011217188_100009991533 [2,0,0,0,0,0|2,0,0]=4 7720 B12R0.1 CCOC(=O)CCCOCCCCl 34a_100000230001_100009991533 [2,0,0,0,0,0|2,0,0]=4 7721 B12R0.1 CCOC(=O)CCCOCCCF 34a_100000759539_100009991533 [2,0,0,0,0,0|2,0,0]=4 7722 B12R0.1 CCOC(=O)CCCOCCCF 7a_100012001163_100011934791 [2,0,0,0,0,0|2,0,0]=4 7723 B12R0.1 CCOC(=O)CCCOCCCN 34a_100000182051_100009991533 [2,0,0,0,0,0|2,0,0]=4 7724 B12R0.1 CCOC(=O)CCCOCCCO 7a_100012001163_100011215043 [2,0,0,0,0,0|2,0,0]=4 7725 B12R0.1 CCOC(=O)CCCOCCOC 34a_100000210237_100009991533 [2,0,0,0,0,0|2,0,0]=4 7726 B12R0.1 CCOC(=O)CCCOCCOC 7a_100012001163_100000233755 [2,0,0,0,0,0|2,0,0]=4 7727 B12R0.1 CCOC(=O)CCCOCCSC 34a_100000230434_100009991533 [2,0,0,0,0,0|2,0,0]=4 7728 B12R0.1 CCOC(=O)CCCOCCSC 7a_100000230434_100011215271 [2,0,0,0,0,0|2,0,0]=4 7729 B12R0.1 CCOC(=O)CCCOCCSC 7a_100012001163_100000212216 [2,0,0,0,0,0|2,0,0]=4 7730 B12R0.1 CCOC(=O)CCCSCCCF 62a_100009991533_100011934791 [2,0,0,0,0,0|2,0,0]=4 7731 B12R0.1 CCOC(=O)CCCSCCCF 62a_100011934791_100009991533 [2,0,0,0,0,0|2,0,0]=4 7732 B12R0.1 CCOC(=O)CCCSCCCO 62a_100009991533_100011215043 [2,0,0,0,0,0|2,0,0]=4 7733 B12R0.1 CCOC(=O)CCCSCCCO 62a_100011215043_100009991533 [2,0,0,0,0,0|2,0,0]=4 7734 B12R0.1 CCOC(=O)CCCSCCOC 62a_100000233755_100009991533 [2,0,0,0,0,0|2,0,0]=4 7735 B12R0.1 CCOC(=O)CCCSCCOC 62a_100009991533_100000233755 [2,0,0,0,0,0|2,0,0]=4 7736 B12R0.1 CCOC(=O)CCCSCCSC 62a_100000212216_100009991533 [2,0,0,0,0,0|2,0,0]=4 7737 B12R0.1 CCOC(=O)CCCSCCSC 62a_100009991533_100000751147 [2,0,0,0,0,0|2,0,0]=4 7738 B12R0.1 CCOC(=O)CCNCCCCO 2230a_100000750430_100011206558 [2,0,0,0,0,0|2,0,0]=4 7739 B12R0.1 CCOC(=O)CCNCCCCO 34a_100000750430_100000765890 [2,0,0,0,0,0|2,0,0]=4 7740 B12R0.1 CCOC(=O)CCNCCCOC 34a_100150723488_100000765890 [2,0,0,0,0,0|2,0,0]=4 7741 B12R0.1 CCOC(=O)CCNCCCSC 2230a_100000749238_100011206558 [2,0,0,0,0,0|2,0,0]=4 7742 B12R0.1 CCOC(=O)CCNCCSCC 2230a_100000106463_100011206558 [2,0,0,0,0,0|2,0,0]=4 7743 B12R0.1 CCOC(=O)CCOCCCCBr 34a_100011216708_100000765890 [2,0,0,0,0,0|2,0,0]=4 7744 B12R0.1 CCOC(=O)CCOCCCCCl 34a_100000210776_100000765890 [2,0,0,0,0,0|2,0,0]=4 7745 B12R0.1 CCOC(=O)CCOCCCCCl 7a_100000210776_100011206558 [2,0,0,0,0,0|2,0,0]=4 7746 B12R0.1 CCOC(=O)CCOCCCCF 34a_100011995726_100000765890 [2,0,0,0,0,0|2,0,0]=4 7747 B12R0.1 CCOC(=O)CCOCCCCF 7a_100011995726_100011206558 [2,0,0,0,0,0|2,0,0]=4 7748 B12R0.1 CCOC(=O)CCOCCCCI 34a_200012148704_100000765890 [2,0,0,0,0,0|2,0,0]=4 7749 B12R0.1 CCOC(=O)CCOCCCCN 34a_100000750430_100000765890 [2,0,0,0,0,0|2,0,0]=4 7750 B12R0.1 CCOC(=O)CCOCCCNC 34a_100000213112_100000765890 [2,0,0,0,0,0|2,0,0]=4 7751 B12R0.1 CCOC(=O)CCOCCCOC 34a_100000740835_100000765890 [2,0,0,0,0,0|2,0,0]=4 7752 B12R0.1 CCOC(=O)CCOCCCSC 34a_100000690336_100000765890 [2,0,0,0,0,0|2,0,0]=4 7753 B12R0.1 CCOC(=O)CCOCCCSC 7a_100000690336_100011206558 [2,0,0,0,0,0|2,0,0]=4 7754 B12R0.1 CCOC(=O)CCOCCSCC 34a_100000212035_100000765890 [2,0,0,0,0,0|2,0,0]=4 7755 B12R0.1 CCOC(=O)CCOCCSCC 7a_100000212035_100011206558 [2,0,0,0,0,0|2,0,0]=4 7756 B12R0.1 CCOC(=O)CCSCCCCF 62a_100000729493_100000765890 [2,0,0,0,0,0|2,0,0]=4 7757 B12R0.1 CCOC(=O)CCSCCCCF 62a_100000765890_100000729493 [2,0,0,0,0,0|2,0,0]=4 7758 B12R0.1 CCOC(=O)CCSCCCCO 62a_100000210776_100000765890 [2,0,0,0,0,0|2,0,0]=4 7759 B12R0.1 CCOC(=O)CCSCCCCO 62a_100000765890_100000210776 [2,0,0,0,0,0|2,0,0]=4 7760 B12R0.1 CCOC(=O)CCSCCCOC 62a_100000709357_100000765890 [2,0,0,0,0,0|2,0,0]=4 7761 B12R0.1 CCOC(=O)CCSCCCOC 62a_100000765890_100000709357 [2,0,0,0,0,0|2,0,0]=4 7762 B12R0.1 CCOC(=O)CCSCCSCC 62a_100000757381_100000765890 [2,0,0,0,0,0|2,0,0]=4 7763 B12R0.1 CCOC(=O)CCSCCSCC 62a_100000765890_100000757381 [2,0,0,0,0,0|2,0,0]=4 7764 B12R0.1 CCOC(=O)CNCCCCCO 2230a_100000762737_100000188475 [2,0,0,0,0,0|2,0,0]=4 7765 B12R0.1 CCOC(=O)CNCCCCCO 34a_100000762737_100000188475 [2,0,0,0,0,0|2,0,0]=4 7766 B12R0.1 CCOC(=O)COCCCCCBr 34a_100000746331_100000188475 [2,0,0,0,0,0|2,0,0]=4 7767 B12R0.1 CCOC(=O)COCCCCCBr 7a_100000746331_100000188475 [2,0,0,0,0,0|2,0,0]=4 7768 B12R0.1 CCOC(=O)COCCCCCCl 34a_100000746330_100000188475 [2,0,0,0,0,0|2,0,0]=4 7769 B12R0.1 CCOC(=O)COCCCCCCl 7a_100000746330_100000188475 [2,0,0,0,0,0|2,0,0]=4 7770 B12R0.1 CCOC(=O)COCCCCCI 34a_200012148887_100000188475 [2,0,0,0,0,0|2,0,0]=4 7771 B12R0.1 CCOC(=O)COCCCCCI 7a_200012148887_100000188475 [2,0,0,0,0,0|2,0,0]=4 7772 B12R0.1 CCOC(=O)COCCCCCN 34a_100000762737_100000188475 [2,0,0,0,0,0|2,0,0]=4 7773 B12R0.1 CCOC(=O)COCCCCOC 34a_100000740925_100000188475 [2,0,0,0,0,0|2,0,0]=4 7774 B12R0.1 CCOC(=O)COCCCCSC 34a_100011217163_100000188475 [2,0,0,0,0,0|2,0,0]=4 7775 B12R0.1 CCOC(=O)COCCCCSC 7a_100011217163_100000188475 [2,0,0,0,0,0|2,0,0]=4 7776 B12R0.1 CCOC(=O)COCCCSCC 34a_100011216438_100000188475 [2,0,0,0,0,0|2,0,0]=4 7777 B12R0.1 CCOC(=O)COCCCSCC 62a_100000210202_100009893628 [2,0,0,0,0,0|2,0,0]=4 7778 B12R0.1 CCOC(=O)COCCCSCC 62a_100009893628_100000210202 [2,0,0,0,0,0|2,0,0]=4 7779 B12R0.1 CCOC(=O)COCCCSCC 7a_100011216438_100000188475 [2,0,0,0,0,0|2,0,0]=4 7780 B12R0.1 CCOC(=O)CSCCCCCF 62a_100000188475_100000729378 [2,0,0,0,0,0|2,0,0]=4 7781 B12R0.1 CCOC(=O)CSCCCCCF 62a_100000729378_100000188475 [2,0,0,0,0,0|2,0,0]=4 7782 B12R0.1 CCOC(=O)CSCCCCCO 62a_100000188475_100000746330 [2,0,0,0,0,0|2,0,0]=4 7783 B12R0.1 CCOC(=O)CSCCCCCO 62a_100000746330_100000188475 [2,0,0,0,0,0|2,0,0]=4 7784 B12R0.1 CCOC(=O)CSCCCCOC 62a_100000188475_100000730899 [2,0,0,0,0,0|2,0,0]=4 7785 B12R0.1 CCOC(=O)CSCCCCOC 62a_100000730899_100000188475 [2,0,0,0,0,0|2,0,0]=4 7786 B12R0.1 CCOCCCCCC(=O)OCC 34a_100121572206_100000755133 [2,0,0,0,0,0|1,0,0]=3 7787 B12R0.1 CCOCCCCCC(=O)OCC 7a_100011214988_100000210202 [2,0,0,0,0,0|1,0,0]=3 7788 B12R0.1 CCOCCCNCC(=O)OCC 2230a_100000210961_100000188475 [2,0,0,0,0,0|2,0,0]=4 7789 B12R0.1 CCOCCCNCC(=O)OCC 34a_100000210961_100000188475 [2,0,0,0,0,0|2,0,0]=4 7790 B12R0.1 CCOCCCOCC(=O)OCC 34a_100000757476_100000188475 [2,0,0,0,0,0|2,0,0]=4 7791 B12R0.1 CCOCCCOCC(=O)OCC 34a_100121572206_100009893628 [2,0,0,0,0,0|2,0,0]=4 7792 B12R0.1 CCOCCCOCC(=O)OCC 7a_100000757476_100000188475 [2,0,0,0,0,0|2,0,0]=4 7793 B12R0.1 CCOCCCSCC(=O)OCC 62a_100000188475_100012232248 [2,0,0,0,0,0|2,0,0]=4 7794 B12R0.1 CCOCCCSCC(=O)OCC 62a_100012232248_100000188475 [2,0,0,0,0,0|2,0,0]=4 7795 B12R0.1 CCOCCNCCC(=O)OCC 2230a_102516460346_100011206558 [2,0,0,0,0,0|2,0,0]=4 7796 B12R0.1 CCOCCNCCC(=O)OCC 34a_102516460346_100000765890 [2,0,0,0,0,0|2,0,0]=4 7797 B12R0.1 CCOCCOCCC(=O)OCC 34a_100000210136_100000765890 [2,0,0,0,0,0|2,0,0]=4 7798 B12R0.1 CCOCCOCCC(=O)OCC 7a_100000210136_100011206558 [2,0,0,0,0,0|2,0,0]=4 7799 B12R0.1 CCOCCSCCC(=O)OCC 62a_100000210147_100000765890 [2,0,0,0,0,0|2,0,0]=4 7800 B12R0.1 CCOCCSCCC(=O)OCC 62a_100000765890_100011215890 [2,0,0,0,0,0|2,0,0]=4 7801 B12R0.1 CCOCSCCCC(=O)OCC 62a_100000739092_100009991533 [2,0,0,0,0,0|2,0,0]=4 7802 B12R0.1 CCOCSCCCC(=O)OCC 62a_100009991533_100000739092 [2,0,0,0,0,0|2,0,0]=4 7803 B12R0.5 C#CCCCCCCCCOCC 34a_100000065265_100000210202 [2,0,0,0,0,0|0,0,2]=4 7804 B12R0.5 C#CCCCCCCCCOCC 7a_100000065265_100000210202 [2,0,0,0,0,0|0,0,2]=4 7805 B12R0.5 C/C=C/CCOCCCCCCC 34a_100016278192_100000210614 [2,0,0,0,0,0|1,0,1]=4 7806 B12R0.5 C/C=C/CNCCCCCCCC 34a_100000229939_100102629194 [2,0,0,0,0,0|1,0,1]=4 7807 B12R0.5 C/C=C/COCCCCCCCC 34a_100000210232_100102629194 [2,0,0,0,0,0|1,0,1]=4 7808 B12R0.5 C/C=C/COCCCCCCCC 34a_100016270725_100000210759 [2,0,0,0,0,0|1,0,1]=4 7809 B12R0.5 C/C=C/COCCCCCCCC 7a_100000210232_100102629194 [2,0,0,0,0,0|1,0,1]=4 7810 B12R0.5 C/C=C/CSCCCCCCCC 62a_100000210759_100102629194 [2,0,0,0,0,0|1,0,1]=4 7811 B12R0.5 C/C=C/CSCCCCCCCC 62a_100102629194_100000210317 [2,0,0,0,0,0|1,0,1]=4 7812 B12R0.5 C=CCCCCCCCCOCC 34a_100011215194_100000210202 [2,0,0,0,0,0|0,0,2]=4 7813 B12R0.5 C=CCCCCCCCCOCC 34a_100121572206_100011933949 [2,0,0,0,0,0|0,0,2]=4 7814 B12R0.5 C=CCCCCCCCCOCC 7a_100011215194_100000210202 [2,0,0,0,0,0|0,0,2]=4 7815 B12R0.5 CC/C=C/CCCOCCCCC 34a_100016287902_100000718602 [2,0,0,0,0,0|1,0,1]=4 7816 B12R0.5 CC/C=C/CCCOCCCCC 7a_100016287902_100000210326 [2,0,0,0,0,0|1,0,1]=4 7817 B12R0.5 CC/C=C\CCCCCCCNC 269862a_106832991636_200025770492 [2,0,0,0,0,0|1,0,1]=4 7818 B12R0.5 CC/C=C\CCCCCNCCC 269862a_100020643023_100016288537 [2,0,0,0,0,0|1,0,1]=4 7819 B12R0.5 CC/C=C\CCCCCOCCC 34a_100016268722_100000210303 [2,0,0,0,0,0|1,0,1]=4 7820 B12R0.5 CC/C=C\CCCCCOCCC 7a_100016268722_100000210303 [2,0,0,0,0,0|1,0,1]=4 7821 B12R0.5 CC/C=C\CCCCOCCCC 34a_100016287862_100000210210 [2,0,0,0,0,0|1,0,1]=4 7822 B12R0.5 CC/C=C\CCCCOCCCC 7a_100016287862_100000210211 [2,0,0,0,0,0|1,0,1]=4 7823 B12R0.5 CC/C=C\CCNCCCCCC 2230a_100000210581_100015370543 [2,0,0,0,0,0|1,0,1]=4 7824 B12R0.5 CC/C=C\CCOCCCCCC 34a_100000210259_100015370543 [2,0,0,0,0,0|1,0,1]=4 7825 B12R0.5 CC/C=C\CCOCCCCCC 34a_100016288707_100000210314 [2,0,0,0,0,0|1,0,1]=4 7826 B12R0.5 CC/C=C\CCOCCCCCC 7a_100000210259_100015370543 [2,0,0,0,0,0|1,0,1]=4 7827 B12R0.5 CC/C=C\CCOCCCCCC 7a_100016288707_100000210314 [2,0,0,0,0,0|1,0,1]=4 7828 B12R0.5 CC/C=C\CCSCCCCCC 62a_100000210314_100015370543 [2,0,0,0,0,0|1,0,1]=4 7829 B12R0.5 CC/C=C\CCSCCCCCC 62a_100015370543_100000210757 [2,0,0,0,0,0|1,0,1]=4 7830 B12R0.5 CC/C=C\CNCCCCCCC 2230a_100000229938_100103147603 [2,0,0,0,0,0|1,0,1]=4 7831 B12R0.5 CC/C=C\COCCCCCCC 34a_100000210272_100103147603 [2,0,0,0,0,0|1,0,1]=4 7832 B12R0.5 CC/C=C\COCCCCCCC 34a_100016268518_100000210614 [2,0,0,0,0,0|1,0,1]=4 7833 B12R0.5 CC/C=C\COCCCCCCC 7a_100000210272_100103147603 [2,0,0,0,0,0|1,0,1]=4 7834 B12R0.5 CC/C=C\CSCCCCCCC 62a_100000210614_100103147603 [2,0,0,0,0,0|1,0,1]=4 7835 B12R0.5 CC/C=C\CSCCCCCCC 62a_100103147603_100000210316 [2,0,0,0,0,0|1,0,1]=4 7836 B12R0.5 CC=CCCCOCCCCCC 34a_100020645299_100000210314 [2,0,0,0,0,0|1,0,1]=4 7837 B12R0.5 CC=CCNCCCCCCCC 2230a_100000229939_100000070051 [2,0,0,0,0,0|1,0,1]=4 7838 B12R0.5 CC=CCNCCCCCCCC 34a_100000229939_100000070051 [2,0,0,0,0,0|1,0,1]=4 7839 B12R0.5 CC=CCOCCCCCCCC 34a_100000210232_100000070051 [2,0,0,0,0,0|1,0,1]=4 7840 B12R0.5 CC=CCOCCCCCCCC 7a_100000210232_100000070051 [2,0,0,0,0,0|1,0,1]=4 7841 B12R0.5 CC=CCSCCCCCCCC 62a_100000070051_100000210317 [2,0,0,0,0,0|1,0,1]=4 7842 B12R0.5 CC=CCSCCCCCCCC 62a_100000210759_100000070051 [2,0,0,0,0,0|1,0,1]=4 7843 B12R0.5 CCC#CCCCCCCOCC 34a_100121572206_200000036426 [2,0,0,0,0,0|0,0,2]=4 7844 B12R0.5 CCCC/C=C/CCCCOCC 34a_200020645093_100000210202 [2,0,0,0,0,0|0,0,2]=4 7845 B12R0.5 CCCC/C=C/CCCCOCC 7a_200020645093_100000210202 [2,0,0,0,0,0|0,0,2]=4 7846 B12R0.5 CCCCC#CCCCCOCC 34a_200000066234_100000210202 [2,0,0,0,0,0|0,0,2]=4 7847 B12R0.5 CCCCC#CCCCCOCC 7a_200000066234_100000210202 [2,0,0,0,0,0|0,0,2]=4 7848 B12R0.5 CCCCC/C=C\CCCOCC 34a_100020655193_100000210202 [2,0,0,0,0,0|0,0,2]=4 7849 B12R0.5 CCCCC/C=C\CCCOCC 7a_100020655193_100000210202 [2,0,0,0,0,0|0,0,2]=4 7850 B12R0.5 CCCCCCC#CCCOCC 34a_200000033163_100000210202 [2,0,0,0,0,0|0,0,2]=4 7851 B12R0.5 CCCCCCC#CCCOCC 7a_200000033163_100000210202 [2,0,0,0,0,0|0,0,2]=4 7852 B12R0.5 CCCCCCCC#CCOCC 34a_200000061759_100000210202 [2,0,0,0,0,0|0,0,2]=4 7853 B12R0.5 CCCCCCCC#CCOCC 7a_200000061759_100000210202 [2,0,0,0,0,0|0,0,2]=4 7854 B12R0.5 CCCCCCCCCCCNC 2230a_106832991635_100011215454 [2,0,0,0,0,0|1,0,1]=4 7855 B12R0.5 CCCCCCCCCCCNC 2230a_200011215754_200000210301 [2,0,0,0,0,0|1,0,1]=4 7856 B12R0.5 CCCCCCCCCCCNC 34a_100102657272_100011215454 [2,0,0,0,0,0|1,0,1]=4 7857 B12R0.5 CCCCCCCCCCCNC 34a_200011215754_200000210301 [2,0,0,0,0,0|1,0,1]=4 7858 B12R0.5 CCCCCCCCCCCNC 7a_106832991635_100011215454 [2,0,0,0,0,0|1,0,1]=4 7859 B12R0.5 CCCCCCCCCCCN[13CH3] 2230a_200011215754_200025704644 [2,0,0,0,0,0|1,0,1]=4 7860 B12R0.5 CCCCCCCCCCCN[13CH3] 34a_200011215754_200025704644 [2,0,0,0,0,0|1,0,1]=4 7861 B12R0.5 CCCCCCCCCCCOC 34a_100000210809_200000210301 [2,0,0,0,0,0|0,0,1]=3 7862 B12R0.5 CCCCCCCCCCCOC 34a_100138415774_100011215454 [2,0,0,0,0,0|0,0,1]=3 7863 B12R0.5 CCCCCCCCCCCOC 7a_100000210809_200000210301 [2,0,0,0,0,0|0,0,1]=3 7864 B12R0.5 CCCCCCCCCCCO[13CH3] 34a_100000210809_200025704644 [2,0,0,0,0,0|0,0,1]=3 7865 B12R0.5 CCCCCCCCCCCO[13CH3] 7a_100000210809_200025704644 [2,0,0,0,0,0|0,0,1]=3 7866 B12R0.5 CCCCCCCCCCCSC 62a_200000210301_100011215454 [2,0,0,0,0,0|0,1,1]=4 7867 B12R0.5 CCCCCCCCCCCS[13CH3] 62a_200025704644_100011215454 [2,0,0,0,0,0|0,1,1]=4 7868 B12R0.5 CCCCCCCCCCNCC 2230a_100000684558_100000210202 [2,0,0,0,0,0|1,0,0]=3 7869 B12R0.5 CCCCCCCCCCNCC 2230a_100015525214_100000210320 [2,0,0,0,0,0|1,0,0]=3 7870 B12R0.5 CCCCCCCCCCNCC 34a_100000684558_100000210202 [2,0,0,0,0,0|1,0,0]=3 7871 B12R0.5 CCCCCCCCCCNCF 34a_100000684558_100015361967 [2,0,0,0,0,0|2,0,0]=4 7872 B12R0.5 CCCCCCCCCCOCC 34a_100000210711_100000210202 [2,0,0,0,0,0|0,0,0]=2 7873 B12R0.5 CCCCCCCCCCOCC 34a_100121572206_100000210320 [2,0,0,0,0,0|0,0,0]=2 7874 B12R0.5 CCCCCCCCCCOCC 7a_100000210711_100000210202 [2,0,0,0,0,0|0,0,0]=2 7875 B12R0.5 CCCCCCCCCCOCF 34a_100000210711_100015361967 [2,0,0,0,0,0|1,0,0]=3 7876 B12R0.5 CCCCCCCCCCOCF 7a_100000210711_100015361967 [2,0,0,0,0,0|1,0,0]=3 7877 B12R0.5 CCCCCCCCCCSCC 62a_100000210202_100000210320 [2,0,0,0,0,0|0,1,0]=3 7878 B12R0.5 CCCCCCCCCCSCF 62a_100015361967_100000210320 [2,0,0,0,0,0|1,1,0]=4 7879 B12R0.5 CCCCCCCCCNCCC 2230a_100000212291_100000210303 [2,0,0,0,0,0|1,0,1]=4 7880 B12R0.5 CCCCCCCCCNCCC 34a_100000212291_100000210303 [2,0,0,0,0,0|1,0,1]=4 7881 B12R0.5 CCCCCCCCCNCOC 2230a_100000212291_100000766300 [2,0,0,0,0,0|1,0,1]=4 7882 B12R0.5 CCCCCCCCCOCCC 34a_100000210258_100011214924 [2,0,0,0,0,0|1,0,1]=4 7883 B12R0.5 CCCCCCCCCOCCC 34a_100000210712_100000210303 [2,0,0,0,0,0|1,0,1]=4 7884 B12R0.5 CCCCCCCCCOCCC 7a_100000210712_100000210303 [2,0,0,0,0,0|1,0,1]=4 7885 B12R0.5 CCCCCCCCCSCCC 62a_100000210303_100000210670 [2,0,0,0,0,0|1,0,1]=4 7886 B12R0.5 CCCCCCCCCSCOC 62a_100000766300_100000210670 [2,0,0,0,0,0|1,0,1]=4 7887 B12R0.5 CCCCCCCCNCCCC 2230a_100000102301_100000210759 [2,0,0,0,0,0|1,0,1]=4 7888 B12R0.5 CCCCCCCCNCCCC 2230a_100000229939_100000210211 [2,0,0,0,0,0|1,0,1]=4 7889 B12R0.5 CCCCCCCCNCCCC 34a_100000229939_100000210210 [2,0,0,0,0,0|1,0,1]=4 7890 B12R0.5 CCCCCCCCNCCCC 7a_106832991798_100000210759 [2,0,0,0,0,0|1,0,1]=4 7891 B12R0.5 CCCCCCCCNCCOC 2230a_100000209980_100000210759 [2,0,0,0,0,0|1,0,1]=4 7892 B12R0.5 CCCCCCCCNCCOC 2230a_100000229939_100011201679 [2,0,0,0,0,0|1,0,1]=4 7893 B12R0.5 CCCCCCCCNCCOC 34a_100000229939_100011201679 [2,0,0,0,0,0|1,0,1]=4 7894 B12R0.5 CCCCCCCCOCCCC 34a_100000210227_100000210759 [2,0,0,0,0,0|1,0,1]=4 7895 B12R0.5 CCCCCCCCOCCCC 34a_100000210232_100000210210 [2,0,0,0,0,0|1,0,1]=4 7896 B12R0.5 CCCCCCCCOCCCC 7a_100000210227_100000210759 [2,0,0,0,0,0|1,0,1]=4 7897 B12R0.5 CCCCCCCCOCCCC 7a_100000210232_100000210211 [2,0,0,0,0,0|1,0,1]=4 7898 B12R0.5 CCCCCCCCOCCOC 34a_100000210232_100011201679 [2,0,0,0,0,0|1,0,1]=4 7899 B12R0.5 CCCCCCCCOCCOC 34a_100000210237_100000210759 [2,0,0,0,0,0|1,0,1]=4 7900 B12R0.5 CCCCCCCCOCCOC 7a_100000210232_100000233755 [2,0,0,0,0,0|1,0,1]=4 7901 B12R0.5 CCCCCCCCSCCCC 62a_100000210211_100000210317 [2,0,0,0,0,0|1,0,1]=4 7902 B12R0.5 CCCCCCCCSCCCC 62a_100000210759_100000210210 [2,0,0,0,0,0|1,0,1]=4 7903 B12R0.5 CCCCCCCCSCCOC 62a_100000210759_100000233755 [2,0,0,0,0,0|1,0,1]=4 7904 B12R0.5 CCCCCCCCSCCOC 62a_100000233755_100000210317 [2,0,0,0,0,0|1,0,1]=4 7905 B12R0.5 CCCCCCCCSCOCC 62a_100000210759_100000739092 [2,0,0,0,0,0|1,0,0]=3 7906 B12R0.5 CCCCCCCCSCOCC 62a_100000739092_100000210317 [2,0,0,0,0,0|1,0,0]=3 7907 B12R0.5 CCCCCCCNCCCCC 2230a_100000209983_100000210681 [2,0,0,0,0,0|1,0,1]=4 7908 B12R0.5 CCCCCCCNCCCCC 2230a_100000229938_100000210326 [2,0,0,0,0,0|1,0,1]=4 7909 B12R0.5 CCCCCCCNCCCOC 2230a_100000229938_100000740836 [2,0,0,0,0,0|1,0,1]=4 7910 B12R0.5 CCCCCCCNCCCOC 34a_100150723488_100000210614 [2,0,0,0,0,0|1,0,1]=4 7911 B12R0.5 CCCCCCCNCCOCC 2230a_100000229938_100011215890 [2,0,0,0,0,0|1,0,0]=3 7912 B12R0.5 CCCCCCCNCCOCC 2230a_102516460346_100000210681 [2,0,0,0,0,0|1,0,0]=3 7913 B12R0.5 CCCCCCCNCCOCC 34a_102516460346_100000210614 [2,0,0,0,0,0|1,0,0]=3 7914 B12R0.5 CCCCCCCNCCSCC 2230a_100000106463_100000210681 [2,0,0,0,0,0|1,1,0]=4 7915 B12R0.5 CCCCCCCNCCSCC 2230a_100000229938_100000757381 [2,0,0,0,0,0|1,1,0]=4 7916 B12R0.5 CCCCCCCOCCCCC 34a_100000210253_100000210614 [2,0,0,0,0,0|1,0,1]=4 7917 B12R0.5 CCCCCCCOCCCCC 34a_100000210272_100000718602 [2,0,0,0,0,0|1,0,1]=4 7918 B12R0.5 CCCCCCCOCCCCC 7a_100000210253_100000210614 [2,0,0,0,0,0|1,0,1]=4 7919 B12R0.5 CCCCCCCOCCCCC 7a_100000210272_100000210326 [2,0,0,0,0,0|1,0,1]=4 7920 B12R0.5 CCCCCCCOCCCOC 34a_100000210272_100000740836 [2,0,0,0,0,0|1,0,1]=4 7921 B12R0.5 CCCCCCCOCCCOC 34a_100000740835_100000210614 [2,0,0,0,0,0|1,0,1]=4 7922 B12R0.5 CCCCCCCOCCCOC 7a_100000210272_100000740836 [2,0,0,0,0,0|1,0,1]=4 7923 B12R0.5 CCCCCCCOCCOCC 34a_100000210136_100000210614 [2,0,0,0,0,0|1,0,0]=3 7924 B12R0.5 CCCCCCCOCCOCC 34a_100000210272_100000210147 [2,0,0,0,0,0|1,0,0]=3 7925 B12R0.5 CCCCCCCOCCOCC 7a_100000210136_100000210614 [2,0,0,0,0,0|1,0,0]=3 7926 B12R0.5 CCCCCCCOCCOCC 7a_100000210272_100011215890 [2,0,0,0,0,0|1,0,0]=3 7927 B12R0.5 CCCCCCCOCCSCC 34a_100000210272_100000757381 [2,0,0,0,0,0|1,1,0]=4 7928 B12R0.5 CCCCCCCOCCSCC 34a_100000212035_100000210614 [2,0,0,0,0,0|1,1,0]=4 7929 B12R0.5 CCCCCCCOCCSCC 7a_100000210272_100000757381 [2,0,0,0,0,0|1,1,0]=4 7930 B12R0.5 CCCCCCCOCCSCC 7a_100000212035_100000210614 [2,0,0,0,0,0|1,1,0]=4 7931 B12R0.5 CCCCCCCSCCCCC 62a_100000210326_100000210316 [2,0,0,0,0,0|1,0,1]=4 7932 B12R0.5 CCCCCCCSCCCCC 62a_100000210614_100000210326 [2,0,0,0,0,0|1,0,1]=4 7933 B12R0.5 CCCCCCCSCCCOC 62a_100000210614_100000709357 [2,0,0,0,0,0|1,0,1]=4 7934 B12R0.5 CCCCCCCSCCCOC 62a_100000709357_100000210316 [2,0,0,0,0,0|1,0,1]=4 7935 B12R0.5 CCCCCCCSCCOCC 62a_100000210147_100000210316 [2,0,0,0,0,0|1,0,0]=3 7936 B12R0.5 CCCCCCCSCCOCC 62a_100000210614_100011215890 [2,0,0,0,0,0|1,0,0]=3 7937 B12R0.5 CCCCCCCSCCSCC 62a_100000210614_100000757381 [2,0,0,0,0,0|1,1,0]=4 7938 B12R0.5 CCCCCCCSCCSCC 62a_100000757381_100000210316 [2,0,0,0,0,0|1,1,0]=4 7939 B12R0.5 CCCCCCNCCCCCC 2230a_100000210581_100000210314 [2,0,0,0,0,0|1,0,1]=4 7940 B12R0.5 CCCCCCNCCCCOC 2230a_100000210581_100000730899 [2,0,0,0,0,0|1,0,1]=4 7941 B12R0.5 CCCCCCNCCCOCC 2230a_100000210581_100012232248 [2,0,0,0,0,0|1,0,0]=3 7942 B12R0.5 CCCCCCNCCCOCC 2230a_100000210961_100000210314 [2,0,0,0,0,0|1,0,0]=3 7943 B12R0.5 CCCCCCNCCCOCC 34a_100000210961_100000210314 [2,0,0,0,0,0|1,0,0]=3 7944 B12R0.5 CCCCCCOCCCCCC 34a_100000210259_100000210314 [2,0,0,0,0,0|1,0,1]=4 7945 B12R0.5 CCCCCCOCCCCCC 7a_100000210259_100000210314 [2,0,0,0,0,0|1,0,1]=4 7946 B12R0.5 CCCCCCOCCCCOC 34a_100000210259_100000755781 [2,0,0,0,0,0|1,0,1]=4 7947 B12R0.5 CCCCCCOCCCCOC 34a_100000740925_100000210314 [2,0,0,0,0,0|1,0,1]=4 7948 B12R0.5 CCCCCCOCCCCOC 7a_100000210259_100000730899 [2,0,0,0,0,0|1,0,1]=4 7949 B12R0.5 CCCCCCOCCCOCC 34a_100000210259_100012232248 [2,0,0,0,0,0|1,0,0]=3 7950 B12R0.5 CCCCCCOCCCOCC 34a_100000757476_100000210314 [2,0,0,0,0,0|1,0,0]=3 7951 B12R0.5 CCCCCCOCCCOCC 7a_100000210259_100012232248 [2,0,0,0,0,0|1,0,0]=3 7952 B12R0.5 CCCCCCOCCCOCC 7a_100000757476_100000210314 [2,0,0,0,0,0|1,0,0]=3 7953 B12R0.5 CCCCCCOCCCSCC 34a_100011216438_100000210314 [2,0,0,0,0,0|1,1,0]=4 7954 B12R0.5 CCCCCCOCCCSCC 7a_100011216438_100000210314 [2,0,0,0,0,0|1,1,0]=4 7955 B12R0.5 CCCCCCSCCCCCC 62a_100000210314_100000210757 [2,0,0,0,0,0|1,0,1]=4 7956 B12R0.5 CCCCCCSCCCCOC 62a_100000210314_100000730899 [2,0,0,0,0,0|1,0,1]=4 7957 B12R0.5 CCCCCCSCCCCOC 62a_100000730899_100000210757 [2,0,0,0,0,0|1,0,1]=4 7958 B12R0.5 CCCCCCSCCCOCC 62a_100000210314_100012232248 [2,0,0,0,0,0|1,0,0]=3 7959 B12R0.5 CCCCCCSCCCOCC 62a_100012232248_100000210757 [2,0,0,0,0,0|1,0,0]=3 7960 B12R0.5 CCCCCNCCCCCOC 2230a_100000747528_100000210326 [2,0,0,0,0,0|1,0,1]=4 7961 B12R0.5 CCCCCNCCCCCOC 34a_100000747528_100000718602 [2,0,0,0,0,0|1,0,1]=4 7962 B12R0.5 CCCCNCCCCCCOC 2230a_100000102301_100011998445 [2,0,0,0,0,0|1,0,1]=4 7963 B12R0.5 CCCCNCCCCCCOC 7a_106832991798_100011998445 [2,0,0,0,0,0|1,0,1]=4 7964 B12R0.5 CCCCNCCOCCOCC 2230a_100000102301_100011211534 [2,0,0,0,0,0|2,0,0]=4 7965 B12R0.5 CCCCNCCOCCOCC 2230a_100102712874_100000210211 [2,0,0,0,0,0|2,0,0]=4 7966 B12R0.5 CCCCNCCOCCOCC 34a_100102712874_100000210210 [2,0,0,0,0,0|2,0,0]=4 7967 B12R0.5 CCCCNCCOCCOCC 7a_106832991798_100011211534 [2,0,0,0,0,0|2,0,0]=4 7968 B12R0.5 CCCCOCCCCCCOC 34a_100000210227_100011998445 [2,0,0,0,0,0|1,0,1]=4 7969 B12R0.5 CCCCOCCCCCCOC 34a_200012092642_100000210210 [2,0,0,0,0,0|1,0,1]=4 7970 B12R0.5 CCCCOCCCCCCOC 7a_100000210227_100011998445 [2,0,0,0,0,0|1,0,1]=4 7971 B12R0.5 CCCCOCCCCCCOC 7a_200012092642_100000210211 [2,0,0,0,0,0|1,0,1]=4 7972 B12R0.5 CCCCOCCNCCOCC 2230a_102516460346_100000743108 [2,0,0,0,0,0|2,0,0]=4 7973 B12R0.5 CCCCOCCNCCOCC 34a_102516460346_100000743108 [2,0,0,0,0,0|2,0,0]=4 7974 B12R0.5 CCCCOCCOCCOCC 34a_100000210136_100000743108 [2,0,0,0,0,0|2,0,0]=4 7975 B12R0.5 CCCCOCCOCCOCC 34a_100000210227_100011211534 [2,0,0,0,0,0|2,0,0]=4 7976 B12R0.5 CCCCOCCOCCOCC 34a_100000210238_100000210147 [2,0,0,0,0,0|2,0,0]=4 7977 B12R0.5 CCCCOCCOCCOCC 34a_100000210240_100000210210 [2,0,0,0,0,0|2,0,0]=4 7978 B12R0.5 CCCCOCCOCCOCC 34a_100011215186_100000210202 [2,0,0,0,0,0|2,0,0]=4 7979 B12R0.5 CCCCOCCOCCOCC 7a_100000210136_100000743108 [2,0,0,0,0,0|2,0,0]=4 7980 B12R0.5 CCCCOCCOCCOCC 7a_100000210227_100011211534 [2,0,0,0,0,0|2,0,0]=4 7981 B12R0.5 CCCCOCCOCCOCC 7a_100000210238_100011215890 [2,0,0,0,0,0|2,0,0]=4 7982 B12R0.5 CCCCOCCOCCOCC 7a_100000210240_100000210211 [2,0,0,0,0,0|2,0,0]=4 7983 B12R0.5 CCCCOCCOCCOCC 7a_100011215186_100000210202 [2,0,0,0,0,0|2,0,0]=4 7984 B12R0.5 CCCCOCCSCCOCC 62a_100000210147_100000743108 [2,0,0,0,0,0|2,0,0]=4 7985 B12R0.5 CCCCOCCSCCOCC 62a_100000743108_100011215890 [2,0,0,0,0,0|2,0,0]=4 7986 B12R0.5 CCCCOCNCCCOCC 2230a_100000210961_100011995733 [2,0,0,0,0,0|2,0,0]=4 7987 B12R0.5 CCCCOCNCCCOCC 34a_100000210961_100011995733 [2,0,0,0,0,0|2,0,0]=4 7988 B12R0.5 CCCCOCOCCCOCC 34a_100000757476_100011995733 [2,0,0,0,0,0|2,0,0]=4 7989 B12R0.5 CCCCOCSCCCOCC 62a_100011995733_100012232248 [2,0,0,0,0,0|2,0,0]=4 7990 B12R0.5 CCCCOCSCCCOCC 62a_100012232248_100011995733 [2,0,0,0,0,0|2,0,0]=4 7991 B12R0.5 CCCCSCCCCCCOC 62a_100000210211_100011998445 [2,0,0,0,0,0|1,0,1]=4 7992 B12R0.5 CCCCSCCCCCCOC 62a_100011998445_100000210210 [2,0,0,0,0,0|1,0,1]=4 7993 B12R0.5 CCCCSCCNCCOCC 2230a_100025743550_100011215890 [2,0,0,0,0,0|2,0,0]=4 7994 B12R0.5 CCCCSCCOCCOCC 34a_200000230436_100000210147 [2,0,0,0,0,0|2,0,0]=4 7995 B12R0.5 CCCCSCCOCCOCC 62a_100000210211_100011211534 [2,0,0,0,0,0|2,0,0]=4 7996 B12R0.5 CCCCSCCOCCOCC 62a_100011211534_100000210210 [2,0,0,0,0,0|2,0,0]=4 7997 B12R0.5 CCCCSCCOCCOCC 7a_200000230436_100011215890 [2,0,0,0,0,0|2,0,0]=4 7998 B12R0.5 CCCOCCCNCCOCC 2230a_100011217757_100011215890 [2,0,0,0,0,0|2,0,0]=4 7999 B12R0.5 CCCOCCCNCCOCC 34a_100011217757_100000210147 [2,0,0,0,0,0|2,0,0]=4 8000 B12R0.5 CCCOCCNCCCOCC 2230a_100000210961_100011215938 [2,0,0,0,0,0|2,0,0]=4 8001 B12R0.5 CCCOCCNCCCOCC 2230a_100161115042_100012232248 [2,0,0,0,0,0|2,0,0]=4 8002 B12R0.5 CCCOCCNCCCOCC 34a_100000210961_100011215938 [2,0,0,0,0,0|2,0,0]=4 8003 B12R0.5 CCCOCCNCCCOCC 34a_100161115042_100012232248 [2,0,0,0,0,0|2,0,0]=4 8004 B12R0.5 CCCOCCOCCCOCC 34a_100000752267_100012232248 [2,0,0,0,0,0|2,0,0]=4 8005 B12R0.5 CCCOCCOCCCOCC 34a_100000757476_100011215938 [2,0,0,0,0,0|2,0,0]=4 8006 B12R0.5 CCCOCCOCCCOCC 7a_100000752267_100012232248 [2,0,0,0,0,0|2,0,0]=4 8007 B12R0.5 CCCOCCOCCCOCC 7a_100000757476_100011215938 [2,0,0,0,0,0|2,0,0]=4 8008 B12R0.5 CCCOCCSCCCOCC 62a_100011215938_100012232248 [2,0,0,0,0,0|2,0,0]=4 8009 B12R0.5 CCCOCCSCCCOCC 62a_100012232248_100011215938 [2,0,0,0,0,0|2,0,0]=4 8010 B12R0.5 CCCSCCNCCCOCC 2230a_100020603323_100012232248 [2,0,0,0,0,0|2,0,0]=4 8011 B12R0.5 CCCSCCOCCCOCC 34a_200000230433_100012232248 [2,0,0,0,0,0|2,0,0]=4 8012 B12R0.5 CCCSCCOCCCOCC 7a_200000230433_100012232248 [2,0,0,0,0,0|2,0,0]=4 8013 B12R0.5 CCNCCCCCCCCCO 2230a_100000078944_100000210202 [2,0,0,0,0,0|2,0,0]=4 8014 B12R0.5 CCNCCCCCCCCCO 2230a_100015525214_100009813782 [2,0,0,0,0,0|2,0,0]=4 8015 B12R0.5 CCNCCCCCCCCCO 34a_100000078944_100000210202 [2,0,0,0,0,0|2,0,0]=4 8016 B12R0.5 CCOCCCCCCCCCBr 34a_100009813782_100000210202 [2,0,0,0,0,0|1,0,0]=3 8017 B12R0.5 CCOCCCCCCCCCBr 7a_100009813782_100000210202 [2,0,0,0,0,0|1,0,0]=3 8018 B12R0.5 CCOCCCCCCCCCCl 34a_100009868337_100000210202 [2,0,0,0,0,0|1,0,0]=3 8019 B12R0.5 CCOCCCCCCCCCCl 7a_100009868337_100000210202 [2,0,0,0,0,0|1,0,0]=3 8020 B12R0.5 CCOCCCCCCCCCN 34a_100000078944_100000210202 [2,0,0,0,0,0|1,0,0]=3 8021 B12R0.5 CCOCCCCCCCCCO 34a_100121572206_100009813782 [2,0,0,0,0,0|1,0,0]=3 8022 B12R0.5 CCOCCCNCCCCCF 2230a_100000210961_100000729378 [2,0,0,0,0,0|2,0,0]=4 8023 B12R0.5 CCOCCCNCCCCCF 34a_100000210961_100000729378 [2,0,0,0,0,0|2,0,0]=4 8024 B12R0.5 CCOCCCNCCCCCO 2230a_100000210961_100000746330 [2,0,0,0,0,0|2,0,0]=4 8025 B12R0.5 CCOCCCNCCCCCO 2230a_100000762737_100012232248 [2,0,0,0,0,0|2,0,0]=4 8026 B12R0.5 CCOCCCNCCCCCO 34a_100000210961_100000746330 [2,0,0,0,0,0|2,0,0]=4 8027 B12R0.5 CCOCCCNCCCCCO 34a_100000762737_100012232248 [2,0,0,0,0,0|2,0,0]=4 8028 B12R0.5 CCOCCCNCCCCOC 2230a_100000210961_100000730899 [2,0,0,0,0,0|2,0,0]=4 8029 B12R0.5 CCOCCCNCCCCOC 34a_100000210961_100000755781 [2,0,0,0,0,0|2,0,0]=4 8030 B12R0.5 CCOCCCNCCCOCC 2230a_100000210961_100012232248 [2,0,0,0,0,0|2,0,0]=4 8031 B12R0.5 CCOCCCNCCCOCC 34a_100000210961_100012232248 [2,0,0,0,0,0|2,0,0]=4 8032 B12R0.5 CCOCCCOCCCCCBr 34a_100000746331_100012232248 [2,0,0,0,0,0|2,0,0]=4 8033 B12R0.5 CCOCCCOCCCCCBr 7a_100000746331_100012232248 [2,0,0,0,0,0|2,0,0]=4 8034 B12R0.5 CCOCCCOCCCCCCl 34a_100000746330_100012232248 [2,0,0,0,0,0|2,0,0]=4 8035 B12R0.5 CCOCCCOCCCCCCl 7a_100000746330_100012232248 [2,0,0,0,0,0|2,0,0]=4 8036 B12R0.5 CCOCCCOCCCCCF 34a_100000757476_100000729378 [2,0,0,0,0,0|2,0,0]=4 8037 B12R0.5 CCOCCCOCCCCCF 7a_100000757476_100000729378 [2,0,0,0,0,0|2,0,0]=4 8038 B12R0.5 CCOCCCOCCCCCI 34a_200012148887_100012232248 [2,0,0,0,0,0|2,0,0]=4 8039 B12R0.5 CCOCCCOCCCCCI 7a_200012148887_100012232248 [2,0,0,0,0,0|2,0,0]=4 8040 B12R0.5 CCOCCCOCCCCCN 34a_100000762737_100012232248 [2,0,0,0,0,0|2,0,0]=4 8041 B12R0.5 CCOCCCOCCCCCO 34a_100000757476_100000746330 [2,0,0,0,0,0|2,0,0]=4 8042 B12R0.5 CCOCCCOCCCCCO 7a_100000757476_100000746330 [2,0,0,0,0,0|2,0,0]=4 8043 B12R0.5 CCOCCCOCCCCOC 34a_100000740925_100012232248 [2,0,0,0,0,0|2,0,0]=4 8044 B12R0.5 CCOCCCOCCCCOC 34a_100000757476_100000755781 [2,0,0,0,0,0|2,0,0]=4 8045 B12R0.5 CCOCCCOCCCCOC 7a_100000757476_100000730899 [2,0,0,0,0,0|2,0,0]=4 8046 B12R0.5 CCOCCCOCCCCSC 34a_100011217163_100012232248 [2,0,0,0,0,0|2,0,0]=4 8047 B12R0.5 CCOCCCOCCCCSC 7a_100011217163_100012232248 [2,0,0,0,0,0|2,0,0]=4 8048 B12R0.5 CCOCCCOCCCOCC 34a_100000757476_100012232248 [2,0,0,0,0,0|2,0,0]=4 8049 B12R0.5 CCOCCCOCCCOCC 7a_100000757476_100012232248 [2,0,0,0,0,0|2,0,0]=4 8050 B12R0.5 CCOCCCOCCCSCC 34a_100011216438_100012232248 [2,0,0,0,0,0|2,0,0]=4 8051 B12R0.5 CCOCCCOCCCSCC 7a_100011216438_100012232248 [2,0,0,0,0,0|2,0,0]=4 8052 B12R0.5 CCOCCCSCCCCCF 62a_100000729378_100012232248 [2,0,0,0,0,0|2,0,0]=4 8053 B12R0.5 CCOCCCSCCCCCF 62a_100012232248_100000729378 [2,0,0,0,0,0|2,0,0]=4 8054 B12R0.5 CCOCCCSCCCCCO 62a_100000746330_100012232248 [2,0,0,0,0,0|2,0,0]=4 8055 B12R0.5 CCOCCCSCCCCCO 62a_100012232248_100000746330 [2,0,0,0,0,0|2,0,0]=4 8056 B12R0.5 CCOCCCSCCCCOC 62a_100000730899_100012232248 [2,0,0,0,0,0|2,0,0]=4 8057 B12R0.5 CCOCCCSCCCCOC 62a_100012232248_100000730899 [2,0,0,0,0,0|2,0,0]=4 8058 B12R0.5 CCOCCCSCCCOCC 62a_100012232248_100012232248 [2,0,0,0,0,0|2,0,0]=4 8059 B12R0.5 CCOCCNCCCCCCF 2230a_102516460346_100015922095 [2,0,0,0,0,0|2,0,0]=4 8060 B12R0.5 CCOCCNCCCCCCF 34a_102516460346_100015922095 [2,0,0,0,0,0|2,0,0]=4 8061 B12R0.5 CCOCCNCCCCCCO 2230a_100000686447_100011215890 [2,0,0,0,0,0|2,0,0]=4 8062 B12R0.5 CCOCCNCCCCCCO 2230a_102516460346_100000766143 [2,0,0,0,0,0|2,0,0]=4 8063 B12R0.5 CCOCCNCCCCCCO 34a_100000686447_100000210147 [2,0,0,0,0,0|2,0,0]=4 8064 B12R0.5 CCOCCNCCCCCCO 34a_102516460346_100000766143 [2,0,0,0,0,0|2,0,0]=4 8065 B12R0.5 CCOCCNCCCCCOC 2230a_100000747528_100011215890 [2,0,0,0,0,0|2,0,0]=4 8066 B12R0.5 CCOCCNCCCCCOC 34a_100000747528_100000210147 [2,0,0,0,0,0|2,0,0]=4 8067 B12R0.5 CCOCCOCCCCCCBr 34a_100011215345_100000210147 [2,0,0,0,0,0|2,0,0]=4 8068 B12R0.5 CCOCCOCCCCCCBr 7a_100011215345_100011215890 [2,0,0,0,0,0|2,0,0]=4 8069 B12R0.5 CCOCCOCCCCCCCl 34a_100000766143_100000210147 [2,0,0,0,0,0|2,0,0]=4 8070 B12R0.5 CCOCCOCCCCCCCl 7a_100000766143_100011215890 [2,0,0,0,0,0|2,0,0]=4 8071 B12R0.5 CCOCCOCCCCCCF 34a_100000210136_100015922095 [2,0,0,0,0,0|2,0,0]=4 8072 B12R0.5 CCOCCOCCCCCCF 34a_100000732779_100000210147 [2,0,0,0,0,0|2,0,0]=4 8073 B12R0.5 CCOCCOCCCCCCF 7a_100000210136_100015922095 [2,0,0,0,0,0|2,0,0]=4 8074 B12R0.5 CCOCCOCCCCCCF 7a_100000732779_100011215890 [2,0,0,0,0,0|2,0,0]=4 8075 B12R0.5 CCOCCOCCCCCCN 34a_100000686447_100000210147 [2,0,0,0,0,0|2,0,0]=4 8076 B12R0.5 CCOCCOCCCCCCO 34a_100000210136_100000766143 [2,0,0,0,0,0|2,0,0]=4 8077 B12R0.5 CCOCCOCCCCCCO 7a_100000210136_100000766143 [2,0,0,0,0,0|2,0,0]=4 8078 B12R0.5 CCOCCOCCCCCNC 34a_100000722520_100000210147 [2,0,0,0,0,0|2,0,0]=4 8079 B12R0.5 CCOCCSCCCCCCF 62a_100000210147_100015922095 [2,0,0,0,0,0|2,0,0]=4 8080 B12R0.5 CCOCCSCCCCCCF 62a_100015922095_100011215890 [2,0,0,0,0,0|2,0,0]=4 8081 B12R0.5 CCOCCSCCCCCCO 62a_100000210147_100000766143 [2,0,0,0,0,0|2,0,0]=4 8082 B12R0.5 CCOCCSCCCCCCO 62a_100000766143_100011215890 [2,0,0,0,0,0|2,0,0]=4 8083 B12R0.5 CCOCSCCCCCCCO 62a_100000739092_100000760002 [2,0,0,0,0,0|2,0,0]=4 8084 B12R0.5 CCOCSCCCCCCCO 62a_100000760002_100000739092 [2,0,0,0,0,0|2,0,0]=4 8085 B12R0.5 CCOCSCCCCCCOC 62a_100000739092_100011998445 [2,0,0,0,0,0|2,0,0]=4 8086 B12R0.5 CCOCSCCCCCCOC 62a_100011998445_100000739092 [2,0,0,0,0,0|2,0,0]=4 8087 B12R0.5 CCSCCCCCCCCCO 62a_100000210202_100009813782 [2,0,0,0,0,0|1,1,0]=4 8088 B12R0.5 CCSCCCCCCCCCO 62a_100009813782_100000210202 [2,0,0,0,0,0|1,1,0]=4 8089 B12R0.5 COCCCCCCCCCCBr 34a_100009813290_200000210301 [2,0,0,0,0,0|1,0,1]=4 8090 B12R0.5 COCCCCCCCCCCBr 7a_100009813290_200000210301 [2,0,0,0,0,0|1,0,1]=4 8091 B12R0.5 COCCCCCCCCCCCl 34a_200000033068_200000210301 [2,0,0,0,0,0|1,0,1]=4 8092 B12R0.5 COCCCCCCCCCCCl 7a_200000033068_200000210301 [2,0,0,0,0,0|1,0,1]=4 8093 B12R0.5 COCCCCCCCCCCN 34a_100000066964_200000210301 [2,0,0,0,0,0|1,0,1]=4 8094 B12R0.5 COCCCCCCCCCCO 34a_100138415774_100009813290 [2,0,0,0,0,0|1,0,1]=4 8095 B12R0.5 FCOCCCCCCCCCBr 34a_100009813782_100015361967 [2,0,0,0,0,0|2,0,0]=4 8096 B12R0.5 FCOCCCCCCCCCBr 7a_100009813782_100015361967 [2,0,0,0,0,0|2,0,0]=4 8097 B12R0.5 FCOCCCCCCCCCCl 34a_100009868337_100015361967 [2,0,0,0,0,0|2,0,0]=4 8098 B12R0.5 FCOCCCCCCCCCCl 7a_100009868337_100015361967 [2,0,0,0,0,0|2,0,0]=4 8099 B12R0.5 NCCCCCCCCCOCF 34a_100000078944_100015361967 [2,0,0,0,0,0|2,0,0]=4 8100 B12R0.5 [13CH3]OCCCCCCCCCCBr 34a_100009813290_200025704644 [2,0,0,0,0,0|1,0,1]=4 8101 B12R0.5 [13CH3]OCCCCCCCCCCBr 7a_100009813290_200025704644 [2,0,0,0,0,0|1,0,1]=4 8102 B12R0.5 [13CH3]OCCCCCCCCCCCl 34a_200000033068_200025704644 [2,0,0,0,0,0|1,0,1]=4 8103 B12R0.5 [13CH3]OCCCCCCCCCCCl 7a_200000033068_200025704644 [2,0,0,0,0,0|1,0,1]=4 8104 B12R0.5 [13CH3]OCCCCCCCCCCN 34a_100000066964_200025704644 [2,0,0,0,0,0|1,0,1]=4 8105 B12R0.248 C#CC(=O)CCCCCCCCC 1458a_100000211873_100000210670 [2,0,0,0,0,0|0,0,2]=4 8106 B12R0.248 C#CCCCCCCCC(=O)CC 1458a_100000087357_100000210202 [2,0,0,0,0,0|0,0,2]=4 8107 B12R0.248 C#CCCCCCCCC(=O)CC 1458a_100000210414_100153394163 [2,0,0,0,0,0|0,0,2]=4 8108 B12R0.248 C=CC(=O)CCCCCCCCC 1458a_100000185746_100000210670 [2,0,0,0,0,0|0,0,2]=4 8109 B12R0.248 C=CCCCCCCCC(=O)CC 1458a_100000210414_100012355270 [2,0,0,0,0,0|0,0,2]=4 8110 B12R0.248 C=CCCCCCCCC(=O)CC 1458a_100011216160_100000210202 [2,0,0,0,0,0|0,0,2]=4 8111 B12R0.248 CCC(=O)CCCCCCCCO 1458a_100000210414_100000033203 [2,0,0,0,0,0|1,0,0]=3 8112 B12R0.248 CCC(=O)COCCCCCCBr 7a_100011215345_100000747405 [2,0,0,0,0,0|2,0,0]=4 8113 B12R0.248 CCC(=O)COCCCCCCCl 7a_100000766143_100000747405 [2,0,0,0,0,0|2,0,0]=4 8114 B12R0.248 CCC(=O)COCCCCCCF 34a_100000725409_100015922095 [2,0,0,0,0,0|2,0,0]=4 8115 B12R0.248 CCC(=O)COCCCCCCF 7a_100000732779_100000747405 [2,0,0,0,0,0|2,0,0]=4 8116 B12R0.248 CCC(=O)COCCCCCCO 34a_100000725409_100000766143 [2,0,0,0,0,0|2,0,0]=4 8117 B12R0.248 CCC(=O)CSCCCCCCF 62a_100000747405_100015922095 [2,0,0,0,0,0|2,0,0]=4 8118 B12R0.248 CCC(=O)CSCCCCCCF 62a_100015922095_100000747405 [2,0,0,0,0,0|2,0,0]=4 8119 B12R0.248 CCC(=O)CSCCCCCCO 62a_100000747405_100000766143 [2,0,0,0,0,0|2,0,0]=4 8120 B12R0.248 CCC(=O)CSCCCCCCO 62a_100000766143_100000747405 [2,0,0,0,0,0|2,0,0]=4 8121 B12R0.248 CCC(=O)NCCCCCCCO 240690a_100011996573_100000210414 [2,0,0,0,0,0|2,0,0]=4 8122 B12R0.248 CCCCC#CCCCC(=O)CC 1458a_100000210414_200000047210 [2,0,0,0,0,0|0,0,2]=4 8123 B12R0.248 CCCCC/C=C/CCC(=O)CC 1458a_200015255902_100000210202 [2,0,0,0,0,0|0,0,2]=4 8124 B12R0.248 CCCCCC/C=C/CC(=O)CC 1458a_100020681715_100000210202 [2,0,0,0,0,0|0,0,2]=4 8125 B12R0.248 CCCCCCCC=CC(=O)CC 1458a_200015332781_100000210202 [2,0,0,0,0,0|0,0,2]=4 8126 B12R0.248 CCCCCCCCCC(=O)CC 1458a_100000210414_100000210670 [2,0,0,0,0,0|0,0,0]=2 8127 B12R0.248 CCCCCCCCCC(=O)CC 1458a_100000210558_100000210202 [2,0,0,0,0,0|0,0,0]=2 8128 B12R0.248 CCCCCCCCCC(=O)CF 1458a_100000210558_100015361967 [2,0,0,0,0,0|1,0,0]=3 8129 B12R0.248 CCCCCCCCCC(=O)CO 1458a_100000210174_100000210670 [2,0,0,0,0,0|1,0,0]=3 8130 B12R0.248 CCCCCCCCCC(=O)NC 11a_106832991635_100000210558 [2,0,0,0,0,0|1,0,0]=3 8131 B12R0.248 CCCCCCCCCC(=O)NC 1626a_100102657272_100000210558 [2,0,0,0,0,0|1,0,0]=3 8132 B12R0.248 CCCCCCCCCC(=O)NC 240690a_100102657272_100000210558 [2,0,0,0,0,0|1,0,0]=3 8133 B12R0.248 CCCCCCCCCC(=O)NC 527a_100102657272_100000210558 [2,0,0,0,0,0|1,0,0]=3 8134 B12R0.248 CCCCCCCCCC(C)OC 34a_100011218016_200000210301 [2,0,0,0,0,0|1,0,1]=4 8135 B12R0.248 CCCCCCCCCC(C)OC 7a_100011218016_200000210301 [2,0,0,0,0,0|1,0,1]=4 8136 B12R0.248 CCCCCCCCCC(C)O[13CH3] 34a_100011218016_200025704644 [2,0,0,0,0,0|1,0,1]=4 8137 B12R0.248 CCCCCCCCCC(C)O[13CH3] 7a_100011218016_200025704644 [2,0,0,0,0,0|1,0,1]=4 8138 B12R0.248 CCCCCCCCCN(C)CC 2230a_100000225621_100011214924 [2,0,0,0,0,0|2,0,0]=4 8139 B12R0.248 CCCCCCCCCN(C)CC 2230a_100000232482_100000210202 [2,0,0,0,0,0|2,0,0]=4 8140 B12R0.248 CCCCCCCCCN(C)CC 269982a_100000225621_100000210670 [2,0,0,0,0,0|2,0,0]=4 8141 B12R0.248 CCCCCCCCCN(C)CC 269982a_100000232482_100000204670 [2,0,0,0,0,0|2,0,0]=4 8142 B12R0.248 CCCCCCCCNC(=O)CC 11a_100000229939_100000210414 [2,0,0,0,0,0|1,0,0]=3 8143 B12R0.248 CCCCCCCCNC(=O)CC 1626a_100000229939_100000210414 [2,0,0,0,0,0|1,0,0]=3 8144 B12R0.248 CCCCCCCCNC(=O)CC 240690a_100000229939_100000210414 [2,0,0,0,0,0|1,0,0]=3 8145 B12R0.248 CCCCCCCCNC(=O)CC 527a_100000229939_100000210414 [2,0,0,0,0,0|1,0,0]=3 8146 B12R0.248 CCCCCCCCNC(=O)CO 240690a_100000229939_100000210174 [2,0,0,0,0,0|2,0,0]=4 8147 B12R0.248 CCCCCCCCNC(=O)CO 527a_100000229939_100000210174 [2,0,0,0,0,0|2,0,0]=4 8148 B12R0.248 CCCCCCCCNC(=O)NC 2708a_100000229939_106832991635 [2,0,0,0,0,0|2,0,0]=4 8149 B12R0.248 CCCCCCCCNC(=O)NC 2708a_100102657272_100000229939 [2,0,0,0,0,0|2,0,0]=4 8150 B12R0.248 CCCCCCCCNC(=O)NC 273464a_100000229939_100102657272 [2,0,0,0,0,0|2,0,0]=4 8151 B12R0.248 CCCCCCCCNC(=O)NC 273464a_100102657272_100000229939 [2,0,0,0,0,0|2,0,0]=4 8152 B12R0.248 CCCCCCCCNC(=O)NC 512a_100000229939_100102657272 [2,0,0,0,0,0|2,0,0]=4 8153 B12R0.248 CCCCCCCCNC(=O)NC 512a_106832991638_100000229939 [2,0,0,0,0,0|2,0,0]=4 8154 B12R0.248 CCCCCCCNCC(=O)NC 2230a_100000229938_100000183359 [2,0,0,0,0,0|2,0,0]=4 8155 B12R0.248 CCCCCCCNCC(=O)NC 2230a_100000693194_100000210681 [2,0,0,0,0,0|2,0,0]=4 8156 B12R0.248 CCCCCCCNCC(=O)OC 2230a_100000229938_100000747449 [2,0,0,0,0,0|1,0,0]=3 8157 B12R0.248 CCCCCCCOCC(=O)CC 34a_100000725409_100000210614 [2,0,0,0,0,0|1,0,0]=3 8158 B12R0.248 CCCCCCCOCC(=O)CC 7a_100000210272_100000747405 [2,0,0,0,0,0|1,0,0]=3 8159 B12R0.248 CCCCCCCOCC(=O)NC 34a_100000210272_100000183359 [2,0,0,0,0,0|2,0,0]=4 8160 B12R0.248 CCCCCCCOCC(=O)NC 34a_100000750040_100000210614 [2,0,0,0,0,0|2,0,0]=4 8161 B12R0.248 CCCCCCCOCC(=O)NC 7a_100000210272_100000183359 [2,0,0,0,0,0|2,0,0]=4 8162 B12R0.248 CCCCCCCOCC(=O)OC 34a_100000210272_100000747449 [2,0,0,0,0,0|1,0,0]=3 8163 B12R0.248 CCCCCCCOCC(=O)OC 7a_100000210272_100000747449 [2,0,0,0,0,0|1,0,0]=3 8164 B12R0.248 CCCCCCCSCC(=O)CC 62a_100000210614_100000747405 [2,0,0,0,0,0|1,0,0]=3 8165 B12R0.248 CCCCCCCSCC(=O)CC 62a_100000747405_100000210316 [2,0,0,0,0,0|1,0,0]=3 8166 B12R0.248 CCCCCCCSCC(=O)NC 62a_100000183359_100000210316 [2,0,0,0,0,0|2,0,0]=4 8167 B12R0.248 CCCCCCCSCC(=O)NC 62a_100000210614_100000183359 [2,0,0,0,0,0|2,0,0]=4 8168 B12R0.248 CCCCCCCSCC(=O)OC 62a_100000210614_100000747449 [2,0,0,0,0,0|1,0,0]=3 8169 B12R0.248 CCCCCCCSCC(=O)OC 62a_100000747449_100000210316 [2,0,0,0,0,0|1,0,0]=3 8170 B12R0.248 CCCCCCNCCC(=O)NC 2230a_100000210581_100000737683 [2,0,0,0,0,0|2,0,0]=4 8171 B12R0.248 CCCCCCNCCC(=O)NC 2230a_100000738227_100000210314 [2,0,0,0,0,0|2,0,0]=4 8172 B12R0.248 CCCCCCNCCC(=O)NC 34a_100000738227_100000210314 [2,0,0,0,0,0|2,0,0]=4 8173 B12R0.248 CCCCCCNCCC(=O)OC 2230a_100000210581_100000204255 [2,0,0,0,0,0|1,0,0]=3 8174 B12R0.248 CCCCCCOCCC(=O)NC 34a_100000210259_100012179268 [2,0,0,0,0,0|2,0,0]=4 8175 B12R0.248 CCCCCCOCCC(=O)NC 34a_100000754576_100000210314 [2,0,0,0,0,0|2,0,0]=4 8176 B12R0.248 CCCCCCOCCC(=O)NC 7a_100000210259_100000737683 [2,0,0,0,0,0|2,0,0]=4 8177 B12R0.248 CCCCCCOCCC(=O)OC 34a_100000210259_100000742370 [2,0,0,0,0,0|1,0,0]=3 8178 B12R0.248 CCCCCCOCCC(=O)OC 7a_100000210259_100000204255 [2,0,0,0,0,0|1,0,0]=3 8179 B12R0.248 CCCCCCSCCC(=O)NC 62a_100000210314_100000737683 [2,0,0,0,0,0|2,0,0]=4 8180 B12R0.248 CCCCCCSCCC(=O)NC 62a_100000737683_100000210757 [2,0,0,0,0,0|2,0,0]=4 8181 B12R0.248 CCCCCCSCCC(=O)OC 62a_100000204255_100000210757 [2,0,0,0,0,0|1,0,0]=3 8182 B12R0.248 CCCCCCSCCC(=O)OC 62a_100000210314_100000204255 [2,0,0,0,0,0|1,0,0]=3 8183 B12R0.248 CCCCCCSCOC(=O)OC 62a_100000210314_100000139417 [2,0,0,0,0,0|2,0,0]=4 8184 B12R0.248 CCCCCNCCCC(=O)NC 2230a_100000209983_100000741757 [2,0,0,0,0,0|2,0,0]=4 8185 B12R0.248 CCCCCNCCCC(=O)NC 2230a_100000740002_100000210326 [2,0,0,0,0,0|2,0,0]=4 8186 B12R0.248 CCCCCNCCCC(=O)NC 34a_100000740002_100000718602 [2,0,0,0,0,0|2,0,0]=4 8187 B12R0.248 CCCCCNCCCC(=O)OC 2230a_100000209983_100011218270 [2,0,0,0,0,0|1,0,0]=3 8188 B12R0.248 CCCCCNCCNC(=O)CC 34a_100132302217_100000718602 [2,0,0,0,0,0|2,0,0]=4 8189 B12R0.248 CCCCCOCCCC(=O)NC 34a_100000210253_100000741757 [2,0,0,0,0,0|2,0,0]=4 8190 B12R0.248 CCCCCOCCCC(=O)NC 7a_100000210253_100000741757 [2,0,0,0,0,0|2,0,0]=4 8191 B12R0.248 CCCCCOCCCC(=O)OC 34a_100000210253_100000742333 [2,0,0,0,0,0|1,0,0]=3 8192 B12R0.248 CCCCCOCCCC(=O)OC 7a_100000210253_100011218270 [2,0,0,0,0,0|1,0,0]=3 8193 B12R0.248 CCCCCOCCNC(=O)CC 34a_200000158885_100000718602 [2,0,0,0,0,0|2,0,0]=4 8194 B12R0.248 CCCCCOCCNC(=O)CC 7a_200000158885_100000210326 [2,0,0,0,0,0|2,0,0]=4 8195 B12R0.248 CCCCCOCCNC(=O)OC 34a_100000757965_100000718602 [2,0,0,0,0,0|2,0,0]=4 8196 B12R0.248 CCCCCOCCOC(=O)CC 7a_200000031056_100000210326 [2,0,0,0,0,0|2,0,0]=4 8197 B12R0.248 CCCCCOCCOC(=O)OC 34a_100010262106_100000718602 [2,0,0,0,0,0|2,0,0]=4 8198 B12R0.248 CCCCCSCCCC(=O)NC 62a_100000210326_100000741757 [2,0,0,0,0,0|2,0,0]=4 8199 B12R0.248 CCCCCSCCCC(=O)NC 62a_100000741757_100000210326 [2,0,0,0,0,0|2,0,0]=4 8200 B12R0.248 CCCCCSCCCC(=O)OC 62a_100000210326_100011218270 [2,0,0,0,0,0|1,0,0]=3 8201 B12R0.248 CCCCCSCCCC(=O)OC 62a_100011218270_100000210326 [2,0,0,0,0,0|1,0,0]=3 8202 B12R0.248 CCCCNCCCCC(=O)OC 2230a_100000102301_100000204269 [2,0,0,0,0,0|1,0,0]=3 8203 B12R0.248 CCCCNCCCCC(=O)OC 7a_106832991798_100000204269 [2,0,0,0,0,0|1,0,0]=3 8204 B12R0.248 CCCCNCCOCC(=O)OC 2230a_100000102301_100000090808 [2,0,0,0,0,0|2,0,0]=4 8205 B12R0.248 CCCCNCCOCC(=O)OC 7a_106832991798_100000090808 [2,0,0,0,0,0|2,0,0]=4 8206 B12R0.248 CCCCOCCCCC(=O)OC 34a_100000059025_100000210210 [2,0,0,0,0,0|1,0,0]=3 8207 B12R0.248 CCCCOCCCCC(=O)OC 34a_100000210227_100000204269 [2,0,0,0,0,0|1,0,0]=3 8208 B12R0.248 CCCCOCCCCC(=O)OC 7a_100000059025_100000210211 [2,0,0,0,0,0|1,0,0]=3 8209 B12R0.248 CCCCOCCCCC(=O)OC 7a_100000210227_100000204269 [2,0,0,0,0,0|1,0,0]=3 8210 B12R0.248 CCCCOCCCNC(=O)CC 1626a_200000211371_100000210414 [2,0,0,0,0,0|2,0,0]=4 8211 B12R0.248 CCCCOCCCNC(=O)CC 240690a_200000211371_100000210414 [2,0,0,0,0,0|2,0,0]=4 8212 B12R0.248 CCCCOCCCNC(=O)CC 527a_200000211371_100000210414 [2,0,0,0,0,0|2,0,0]=4 8213 B12R0.248 CCCCOCCOCC(=O)CC 1458a_100011216887_100000210202 [2,0,0,0,0,0|2,0,0]=4 8214 B12R0.248 CCCCOCCOCC(=O)CC 34a_100000725409_100000743108 [2,0,0,0,0,0|2,0,0]=4 8215 B12R0.248 CCCCOCCOCC(=O)CC 7a_100000210238_100000747405 [2,0,0,0,0,0|2,0,0]=4 8216 B12R0.248 CCCCOCCOCC(=O)OC 34a_100000210227_100000090808 [2,0,0,0,0,0|2,0,0]=4 8217 B12R0.248 CCCCOCCOCC(=O)OC 34a_100000210238_100000747449 [2,0,0,0,0,0|2,0,0]=4 8218 B12R0.248 CCCCOCCOCC(=O)OC 7a_100000210227_100000090808 [2,0,0,0,0,0|2,0,0]=4 8219 B12R0.248 CCCCOCCOCC(=O)OC 7a_100000210238_100000747449 [2,0,0,0,0,0|2,0,0]=4 8220 B12R0.248 CCCCOCCSCC(=O)CC 62a_100000743108_100000747405 [2,0,0,0,0,0|2,0,0]=4 8221 B12R0.248 CCCCOCCSCC(=O)CC 62a_100000747405_100000743108 [2,0,0,0,0,0|2,0,0]=4 8222 B12R0.248 CCCCOCCSCC(=O)OC 62a_100000743108_100000747449 [2,0,0,0,0,0|2,0,0]=4 8223 B12R0.248 CCCCOCCSCC(=O)OC 62a_100000747449_100000743108 [2,0,0,0,0,0|2,0,0]=4 8224 B12R0.248 CCCCOCSCCC(=O)OC 62a_100000204255_100011995733 [2,0,0,0,0,0|2,0,0]=4 8225 B12R0.248 CCCCOCSCCC(=O)OC 62a_100011995733_100000204255 [2,0,0,0,0,0|2,0,0]=4 8226 B12R0.248 CCCCSCCCCC(=O)OC 62a_100000204269_100000210210 [2,0,0,0,0,0|1,0,0]=3 8227 B12R0.248 CCCCSCCCCC(=O)OC 62a_100000210211_100000204269 [2,0,0,0,0,0|1,0,0]=3 8228 B12R0.248 CCCCSCCNCC(=O)OC 2230a_100025743550_100000747449 [2,0,0,0,0,0|2,0,0]=4 8229 B12R0.248 CCCCSCCOCC(=O)CC 7a_200000230436_100000747405 [2,0,0,0,0,0|2,0,0]=4 8230 B12R0.248 CCCCSCCOCC(=O)OC 34a_200000230436_100000747449 [2,0,0,0,0,0|2,0,0]=4 8231 B12R0.248 CCCCSCCOCC(=O)OC 62a_100000090808_100000210210 [2,0,0,0,0,0|2,0,0]=4 8232 B12R0.248 CCCCSCCOCC(=O)OC 62a_100000210211_100000090808 [2,0,0,0,0,0|2,0,0]=4 8233 B12R0.248 CCCCSCCOCC(=O)OC 7a_200000230436_100000747449 [2,0,0,0,0,0|2,0,0]=4 8234 B12R0.248 CCCOCCCCCC(=O)OC 34a_100000074720_100000210303 [2,0,0,0,0,0|1,0,0]=3 8235 B12R0.248 CCCOCCCCCC(=O)OC 34a_100000210258_100009816466 [2,0,0,0,0,0|1,0,0]=3 8236 B12R0.248 CCCOCCCCCC(=O)OC 7a_100000074720_100000210303 [2,0,0,0,0,0|1,0,0]=3 8237 B12R0.248 CCCOCCCNCC(=O)OC 2230a_100011217757_100000747449 [2,0,0,0,0,0|2,0,0]=4 8238 B12R0.248 CCCOCCCNCC(=O)OC 34a_100011217757_100000747449 [2,0,0,0,0,0|2,0,0]=4 8239 B12R0.248 CCCOCCNCCC(=O)OC 2230a_100161115042_100000204255 [2,0,0,0,0,0|2,0,0]=4 8240 B12R0.248 CCCOCCNCCC(=O)OC 34a_100161115042_100000742370 [2,0,0,0,0,0|2,0,0]=4 8241 B12R0.248 CCCOCCOCCC(=O)OC 34a_100000752267_100000742370 [2,0,0,0,0,0|2,0,0]=4 8242 B12R0.248 CCCOCCOCCC(=O)OC 7a_100000752267_100000204255 [2,0,0,0,0,0|2,0,0]=4 8243 B12R0.248 CCCOCCSCCC(=O)OC 62a_100000204255_100011215938 [2,0,0,0,0,0|2,0,0]=4 8244 B12R0.248 CCCOCCSCCC(=O)OC 62a_100011215938_100000204255 [2,0,0,0,0,0|2,0,0]=4 8245 B12R0.248 CCCSCCCCCC(=O)OC 62a_100000210303_100009816466 [2,0,0,0,0,0|1,0,0]=3 8246 B12R0.248 CCCSCCCCCC(=O)OC 62a_100009816466_100000210303 [2,0,0,0,0,0|1,0,0]=3 8247 B12R0.248 CCCSCCNCCC(=O)OC 2230a_100020603323_100000204255 [2,0,0,0,0,0|2,0,0]=4 8248 B12R0.248 CCCSCCOCCC(=O)OC 34a_200000230433_100000742370 [2,0,0,0,0,0|2,0,0]=4 8249 B12R0.248 CCCSCCOCCC(=O)OC 7a_200000230433_100000204255 [2,0,0,0,0,0|2,0,0]=4 8250 B12R0.248 CCNCCCCCCC(=O)OC 2230a_100015525214_100009815986 [2,0,0,0,0,0|1,0,0]=3 8251 B12R0.248 CCOCCCCCCC(=O)OC 34a_100009863599_100000210202 [2,0,0,0,0,0|1,0,0]=3 8252 B12R0.248 CCOCCCCCCC(=O)OC 34a_100121572206_100009815986 [2,0,0,0,0,0|1,0,0]=3 8253 B12R0.248 CCOCCCCCCC(=O)OC 7a_100009863599_100000210202 [2,0,0,0,0,0|1,0,0]=3 8254 B12R0.248 CCOCCCNCCC(=O)OC 2230a_100000210961_100000204255 [2,0,0,0,0,0|2,0,0]=4 8255 B12R0.248 CCOCCCNCCC(=O)OC 34a_100000210961_100000742370 [2,0,0,0,0,0|2,0,0]=4 8256 B12R0.248 CCOCCCOCCC(=O)OC 34a_100000757476_100000742370 [2,0,0,0,0,0|2,0,0]=4 8257 B12R0.248 CCOCCCOCCC(=O)OC 7a_100000757476_100000204255 [2,0,0,0,0,0|2,0,0]=4 8258 B12R0.248 CCOCCCSCCC(=O)OC 62a_100000204255_100012232248 [2,0,0,0,0,0|2,0,0]=4 8259 B12R0.248 CCOCCCSCCC(=O)OC 62a_100012232248_100000204255 [2,0,0,0,0,0|2,0,0]=4 8260 B12R0.248 CCOCCNCCCC(=O)OC 2230a_102516460346_100011218270 [2,0,0,0,0,0|2,0,0]=4 8261 B12R0.248 CCOCCNCCCC(=O)OC 34a_102516460346_100000742333 [2,0,0,0,0,0|2,0,0]=4 8262 B12R0.248 CCOCCOCCCC(=O)OC 34a_100000210136_100000742333 [2,0,0,0,0,0|2,0,0]=4 8263 B12R0.248 CCOCCOCCCC(=O)OC 7a_100000210136_100011218270 [2,0,0,0,0,0|2,0,0]=4 8264 B12R0.248 CCOCCSCCCC(=O)OC 62a_100000210147_100011218270 [2,0,0,0,0,0|2,0,0]=4 8265 B12R0.248 CCOCCSCCCC(=O)OC 62a_100011218270_100011215890 [2,0,0,0,0,0|2,0,0]=4 8266 B12R0.248 CCOCSCCCCC(=O)OC 62a_100000204269_100000739092 [2,0,0,0,0,0|2,0,0]=4 8267 B12R0.248 CCOCSCCCCC(=O)OC 62a_100000739092_100000204269 [2,0,0,0,0,0|2,0,0]=4 8268 B12R0.248 CCSCCCCCCC(=O)OC 62a_100000210202_100009815986 [2,0,0,0,0,0|1,0,0]=3 8269 B12R0.248 CCSCCCCCCC(=O)OC 62a_100009815986_100000210202 [2,0,0,0,0,0|1,0,0]=3 8270 B12R0.248 CCSCCCOCCC(=O)OC 34a_100011216438_100000742370 [2,0,0,0,0,0|2,0,0]=4 8271 B12R0.248 CCSCCCOCCC(=O)OC 7a_100011216438_100000204255 [2,0,0,0,0,0|2,0,0]=4 8272 B12R0.248 CCSCCNCCCC(=O)OC 2230a_100000106463_100011218270 [2,0,0,0,0,0|2,0,0]=4 8273 B12R0.248 CCSCCOCCCC(=O)OC 34a_100000212035_100000742333 [2,0,0,0,0,0|2,0,0]=4 8274 B12R0.248 CCSCCOCCCC(=O)OC 7a_100000212035_100011218270 [2,0,0,0,0,0|2,0,0]=4 8275 B12R0.248 CCSCCSCCCC(=O)OC 62a_100000757381_100011218270 [2,0,0,0,0,0|2,0,0]=4 8276 B12R0.248 CCSCCSCCCC(=O)OC 62a_100011218270_100000757381 [2,0,0,0,0,0|2,0,0]=4 8277 B12R0.248 CNC(=O)CCCCCCCCO 240690a_100102657272_100000015970 [2,0,0,0,0,0|2,0,0]=4 8278 B12R0.248 CNCCCCCCCC(=O)OC 2230a_106832991635_100010004213 [2,0,0,0,0,0|1,0,0]=3 8279 B12R0.248 CNCCCCCCCC(=O)OC 34a_100102657272_100010004213 [2,0,0,0,0,0|1,0,0]=3 8280 B12R0.248 CNCCCCCCCC(=O)OC 7a_106832991635_100010004213 [2,0,0,0,0,0|1,0,0]=3 8281 B12R0.248 CNCCCCCOCC(=O)OC 34a_100000722520_100000747449 [2,0,0,0,0,0|2,0,0]=4 8282 B12R0.248 CNCCCOCCCC(=O)OC 34a_100000213112_100000742333 [2,0,0,0,0,0|2,0,0]=4 8283 B12R0.248 COC(=O)CCCCCCCO[13CH3] 34a_100011022521_200025704644 [2,0,0,0,0,0|1,0,0]=3 8284 B12R0.248 COC(=O)CCCCCCCO[13CH3] 7a_100011022521_200025704644 [2,0,0,0,0,0|1,0,0]=3 8285 B12R0.248 COC(=O)CCCCCCCSC 62a_100010004213_200000210301 [2,0,0,0,0,0|1,0,0]=3 8286 B12R0.248 COC(=O)CCCCCCCSC 62a_200000210301_100010004213 [2,0,0,0,0,0|1,0,0]=3 8287 B12R0.248 COC(=O)CCCCCCCS[13CH3] 62a_100010004213_200025704644 [2,0,0,0,0,0|1,0,0]=3 8288 B12R0.248 COC(=O)CCCCCCCS[13CH3] 62a_200025704644_100010004213 [2,0,0,0,0,0|1,0,0]=3 8289 B12R0.248 COC(=O)CCCCCCOCF 34a_100009863599_100015361967 [2,0,0,0,0,0|2,0,0]=4 8290 B12R0.248 COC(=O)CCCCCCOCF 7a_100009863599_100015361967 [2,0,0,0,0,0|2,0,0]=4 8291 B12R0.248 COC(=O)CCCCCCSCF 62a_100009815986_100015361967 [2,0,0,0,0,0|2,0,0]=4 8292 B12R0.248 COC(=O)CCCCCCSCF 62a_100015361967_100009815986 [2,0,0,0,0,0|2,0,0]=4 8293 B12R0.248 COC(=O)CCCCCNCCF 34a_100000724931_100009816466 [2,0,0,0,0,0|2,0,0]=4 8294 B12R0.248 COC(=O)CCCCCNCCO 2230a_100016997473_100009816466 [2,0,0,0,0,0|2,0,0]=4 8295 B12R0.248 COC(=O)CCCCCNCCO 34a_100016990907_100009816466 [2,0,0,0,0,0|2,0,0]=4 8296 B12R0.248 COC(=O)CCCCCOCCBr 34a_100000211926_100009816466 [2,0,0,0,0,0|2,0,0]=4 8297 B12R0.248 COC(=O)CCCCCOCCF 34a_100000074720_100011217306 [2,0,0,0,0,0|2,0,0]=4 8298 B12R0.248 COC(=O)CCCCCOCCF 7a_100000074720_100011217306 [2,0,0,0,0,0|2,0,0]=4 8299 B12R0.248 COC(=O)CCCCCOCCN 34a_100000210304_100009816466 [2,0,0,0,0,0|2,0,0]=4 8300 B12R0.248 COC(=O)CCCCCOCCO 34a_100000074720_100000211926 [2,0,0,0,0,0|2,0,0]=4 8301 B12R0.248 COC(=O)CCCCCOCCO 7a_100000074720_100000211926 [2,0,0,0,0,0|2,0,0]=4 8302 B12R0.248 COC(=O)CCCCCOCSC 34a_100000074720_100011218213 [2,0,0,0,0,0|2,0,0]=4 8303 B12R0.248 COC(=O)CCCCCSCCF 62a_100009816466_100011217306 [2,0,0,0,0,0|2,0,0]=4 8304 B12R0.248 COC(=O)CCCCCSCCF 62a_100011217306_100009816466 [2,0,0,0,0,0|2,0,0]=4 8305 B12R0.248 COC(=O)CCCCCSCCO 62a_100000211926_100009816466 [2,0,0,0,0,0|2,0,0]=4 8306 B12R0.248 COC(=O)CCCCCSCCO 62a_100009816466_100000211926 [2,0,0,0,0,0|2,0,0]=4 8307 B12R0.248 COC(=O)CCCCCSCSC 62a_100009816466_100011218213 [2,0,0,0,0,0|2,0,0]=4 8308 B12R0.248 COC(=O)CCCCCSCSC 62a_100011218213_100009816466 [2,0,0,0,0,0|2,0,0]=4 8309 B12R0.248 COC(=O)CCCCNCCCF 2230a_100015189416_100000204269 [2,0,0,0,0,0|2,0,0]=4 8310 B12R0.248 COC(=O)CCCCNCCCF 34a_100015189416_100000204269 [2,0,0,0,0,0|2,0,0]=4 8311 B12R0.248 COC(=O)CCCCNCCSC 2230a_100020590264_100000204269 [2,0,0,0,0,0|2,0,0]=4 8312 B12R0.248 COC(=O)CCCCOCCCBr 34a_100011217188_100000204269 [2,0,0,0,0,0|2,0,0]=4 8313 B12R0.248 COC(=O)CCCCOCCCCl 34a_100000230001_100000204269 [2,0,0,0,0,0|2,0,0]=4 8314 B12R0.248 COC(=O)CCCCOCCCF 34a_100000059025_100011934791 [2,0,0,0,0,0|2,0,0]=4 8315 B12R0.248 COC(=O)CCCCOCCCF 34a_100000759539_100000204269 [2,0,0,0,0,0|2,0,0]=4 8316 B12R0.248 COC(=O)CCCCOCCCF 7a_100000059025_100011934791 [2,0,0,0,0,0|2,0,0]=4 8317 B12R0.248 COC(=O)CCCCOCCCN 34a_100000182051_100000204269 [2,0,0,0,0,0|2,0,0]=4 8318 B12R0.248 COC(=O)CCCCOCCCO 34a_100000059025_100000230001 [2,0,0,0,0,0|2,0,0]=4 8319 B12R0.248 COC(=O)CCCCOCCCO 7a_100000059025_100011215043 [2,0,0,0,0,0|2,0,0]=4 8320 B12R0.248 COC(=O)CCCCOCCSC 34a_100000059025_100000212216 [2,0,0,0,0,0|2,0,0]=4 8321 B12R0.248 COC(=O)CCCCOCCSC 34a_100000230434_100000204269 [2,0,0,0,0,0|2,0,0]=4 8322 B12R0.248 COC(=O)CCCCOCCSC 7a_100000059025_100000212216 [2,0,0,0,0,0|2,0,0]=4 8323 B12R0.248 COC(=O)CCCCOCCSC 7a_100000230434_100000204269 [2,0,0,0,0,0|2,0,0]=4 8324 B12R0.248 COC(=O)CCCCSCCCF 62a_100000204269_100011934791 [2,0,0,0,0,0|2,0,0]=4 8325 B12R0.248 COC(=O)CCCCSCCCF 62a_100011934791_100000204269 [2,0,0,0,0,0|2,0,0]=4 8326 B12R0.248 COC(=O)CCCCSCCCO 62a_100000204269_100011215043 [2,0,0,0,0,0|2,0,0]=4 8327 B12R0.248 COC(=O)CCCCSCCCO 62a_100011215043_100000204269 [2,0,0,0,0,0|2,0,0]=4 8328 B12R0.248 COC(=O)CCCCSCCSC 62a_100000204269_100000751147 [2,0,0,0,0,0|2,0,0]=4 8329 B12R0.248 COC(=O)CCCCSCCSC 62a_100000212216_100000204269 [2,0,0,0,0,0|2,0,0]=4 8330 B12R0.248 COC(=O)CCCNCCCCO 2230a_100000750430_100011218270 [2,0,0,0,0,0|2,0,0]=4 8331 B12R0.248 COC(=O)CCCNCCCCO 34a_100000750430_100000742333 [2,0,0,0,0,0|2,0,0]=4 8332 B12R0.248 COC(=O)CCCNCCCSC 2230a_100000749238_100011218270 [2,0,0,0,0,0|2,0,0]=4 8333 B12R0.248 COC(=O)CCCOCCCCBr 34a_100011216708_100000742333 [2,0,0,0,0,0|2,0,0]=4 8334 B12R0.248 COC(=O)CCCOCCCCCl 34a_100000210776_100000742333 [2,0,0,0,0,0|2,0,0]=4 8335 B12R0.248 COC(=O)CCCOCCCCCl 7a_100000210776_100011218270 [2,0,0,0,0,0|2,0,0]=4 8336 B12R0.248 COC(=O)CCCOCCCCF 34a_100011995726_100000742333 [2,0,0,0,0,0|2,0,0]=4 8337 B12R0.248 COC(=O)CCCOCCCCF 7a_100011995726_100011218270 [2,0,0,0,0,0|2,0,0]=4 8338 B12R0.248 COC(=O)CCCOCCCCI 34a_200012148704_100000742333 [2,0,0,0,0,0|2,0,0]=4 8339 B12R0.248 COC(=O)CCCOCCCCN 34a_100000750430_100000742333 [2,0,0,0,0,0|2,0,0]=4 8340 B12R0.248 COC(=O)CCCOCCCSC 34a_100000690336_100000742333 [2,0,0,0,0,0|2,0,0]=4 8341 B12R0.248 COC(=O)CCCOCCCSC 7a_100000690336_100011218270 [2,0,0,0,0,0|2,0,0]=4 8342 B12R0.248 COC(=O)CCCSCCCCF 62a_100000729493_100011218270 [2,0,0,0,0,0|2,0,0]=4 8343 B12R0.248 COC(=O)CCCSCCCCF 62a_100011218270_100000729493 [2,0,0,0,0,0|2,0,0]=4 8344 B12R0.248 COC(=O)CCCSCCCCO 62a_100000210776_100011218270 [2,0,0,0,0,0|2,0,0]=4 8345 B12R0.248 COC(=O)CCCSCCCCO 62a_100011218270_100000210776 [2,0,0,0,0,0|2,0,0]=4 8346 B12R0.248 COC(=O)CCNCCCCCO 2230a_100000762737_100000204255 [2,0,0,0,0,0|2,0,0]=4 8347 B12R0.248 COC(=O)CCNCCCCCO 34a_100000762737_100000742370 [2,0,0,0,0,0|2,0,0]=4 8348 B12R0.248 COC(=O)CCOCCCCCBr 34a_100000746331_100000742370 [2,0,0,0,0,0|2,0,0]=4 8349 B12R0.248 COC(=O)CCOCCCCCBr 7a_100000746331_100000204255 [2,0,0,0,0,0|2,0,0]=4 8350 B12R0.248 COC(=O)CCOCCCCCCl 34a_100000746330_100000742370 [2,0,0,0,0,0|2,0,0]=4 8351 B12R0.248 COC(=O)CCOCCCCCCl 7a_100000746330_100000204255 [2,0,0,0,0,0|2,0,0]=4 8352 B12R0.248 COC(=O)CCOCCCCCI 34a_200012148887_100000742370 [2,0,0,0,0,0|2,0,0]=4 8353 B12R0.248 COC(=O)CCOCCCCCI 7a_200012148887_100000204255 [2,0,0,0,0,0|2,0,0]=4 8354 B12R0.248 COC(=O)CCOCCCCCN 34a_100000762737_100000742370 [2,0,0,0,0,0|2,0,0]=4 8355 B12R0.248 COC(=O)CCOCCCCSC 34a_100011217163_100000742370 [2,0,0,0,0,0|2,0,0]=4 8356 B12R0.248 COC(=O)CCOCCCCSC 7a_100011217163_100000204255 [2,0,0,0,0,0|2,0,0]=4 8357 B12R0.248 COC(=O)CCSCCCCCF 62a_100000204255_100000729378 [2,0,0,0,0,0|2,0,0]=4 8358 B12R0.248 COC(=O)CCSCCCCCF 62a_100000729378_100000204255 [2,0,0,0,0,0|2,0,0]=4 8359 B12R0.248 COC(=O)CCSCCCCCO 62a_100000204255_100000746330 [2,0,0,0,0,0|2,0,0]=4 8360 B12R0.248 COC(=O)CCSCCCCCO 62a_100000746330_100000204255 [2,0,0,0,0,0|2,0,0]=4 8361 B12R0.248 COC(=O)CNCCCCCCO 2230a_100000686447_100000747449 [2,0,0,0,0,0|2,0,0]=4 8362 B12R0.248 COC(=O)CNCCCCCCO 34a_100000686447_100000747449 [2,0,0,0,0,0|2,0,0]=4 8363 B12R0.248 COC(=O)COCCCCCCBr 34a_100011215345_100000747449 [2,0,0,0,0,0|2,0,0]=4 8364 B12R0.248 COC(=O)COCCCCCCBr 7a_100011215345_100000747449 [2,0,0,0,0,0|2,0,0]=4 8365 B12R0.248 COC(=O)COCCCCCCCl 34a_100000766143_100000747449 [2,0,0,0,0,0|2,0,0]=4 8366 B12R0.248 COC(=O)COCCCCCCCl 7a_100000766143_100000747449 [2,0,0,0,0,0|2,0,0]=4 8367 B12R0.248 COC(=O)COCCCCCCF 34a_100000732779_100000747449 [2,0,0,0,0,0|2,0,0]=4 8368 B12R0.248 COC(=O)COCCCCCCF 7a_100000732779_100000747449 [2,0,0,0,0,0|2,0,0]=4 8369 B12R0.248 COC(=O)COCCCCCCN 34a_100000686447_100000747449 [2,0,0,0,0,0|2,0,0]=4 8370 B12R0.248 COC(=O)CSCCCCCCF 62a_100000747449_100015922095 [2,0,0,0,0,0|2,0,0]=4 8371 B12R0.248 COC(=O)CSCCCCCCF 62a_100015922095_100000747449 [2,0,0,0,0,0|2,0,0]=4 8372 B12R0.248 COC(=O)CSCCCCCCO 62a_100000747449_100000766143 [2,0,0,0,0,0|2,0,0]=4 8373 B12R0.248 COC(=O)CSCCCCCCO 62a_100000766143_100000747449 [2,0,0,0,0,0|2,0,0]=4 8374 B12R0.248 COCCCCCCCC(=O)OC 34a_100011022521_200000210301 [2,0,0,0,0,0|1,0,0]=3 8375 B12R0.248 COCCCCCCCC(=O)OC 34a_100138415774_100010004213 [2,0,0,0,0,0|1,0,0]=3 8376 B12R0.248 COCCCCCCCC(=O)OC 7a_100011022521_200000210301 [2,0,0,0,0,0|1,0,0]=3 8377 B12R0.248 COCCCCCNCC(=O)OC 2230a_100000747528_100000747449 [2,0,0,0,0,0|2,0,0]=4 8378 B12R0.248 COCCCCCNCC(=O)OC 34a_100000747528_100000747449 [2,0,0,0,0,0|2,0,0]=4 8379 B12R0.248 COCCCCOCCC(=O)OC 34a_100000740925_100000742370 [2,0,0,0,0,0|2,0,0]=4 8380 B12R0.248 COCCCCSCCC(=O)OC 62a_100000204255_100000730899 [2,0,0,0,0,0|2,0,0]=4 8381 B12R0.248 COCCCCSCCC(=O)OC 62a_100000730899_100000204255 [2,0,0,0,0,0|2,0,0]=4 8382 B12R0.248 COCCCNCCCC(=O)OC 34a_100150723488_100000742333 [2,0,0,0,0,0|2,0,0]=4 8383 B12R0.248 COCCCOCCCC(=O)OC 34a_100000740835_100000742333 [2,0,0,0,0,0|2,0,0]=4 8384 B12R0.248 COCCCSCCCC(=O)OC 62a_100000709357_100011218270 [2,0,0,0,0,0|2,0,0]=4 8385 B12R0.248 COCCCSCCCC(=O)OC 62a_100011218270_100000709357 [2,0,0,0,0,0|2,0,0]=4 8386 B12R0.248 COCCNCCCCC(=O)OC 2230a_100000209980_100000204269 [2,0,0,0,0,0|2,0,0]=4 8387 B12R0.248 COCCOCCCCC(=O)OC 34a_100000059025_100011201679 [2,0,0,0,0,0|2,0,0]=4 8388 B12R0.248 COCCOCCCCC(=O)OC 34a_100000210237_100000204269 [2,0,0,0,0,0|2,0,0]=4 8389 B12R0.248 COCCOCCCCC(=O)OC 7a_100000059025_100000233755 [2,0,0,0,0,0|2,0,0]=4 8390 B12R0.248 COCCSCCCCC(=O)OC 62a_100000204269_100000233755 [2,0,0,0,0,0|2,0,0]=4 8391 B12R0.248 COCCSCCCCC(=O)OC 62a_100000233755_100000204269 [2,0,0,0,0,0|2,0,0]=4 8392 B12R0.248 COCSCCCCCC(=O)OC 62a_100000766300_100009816466 [2,0,0,0,0,0|2,0,0]=4 8393 B12R0.248 COCSCCCCCC(=O)OC 62a_100009816466_100000766300 [2,0,0,0,0,0|2,0,0]=4 8394 B12R0.248 O=C(CO)CCCCCCCCO 1458a_100000210174_100000033203 [2,0,0,0,0,0|2,0,0]=4 8395 B12R0.234 C#CCCCCCCCCC(=O)C 1458a_100000029693_200000210301 [2,0,0,0,0,0|0,0,2]=4 8396 B12R0.234 C#CCCCCCCCCC(=O)[13CH3] 1458a_100000029693_200025704644 [2,0,0,0,0,0|0,0,2]=4 8397 B12R0.234 C=C(C)CCNCCCCCCC 2230a_100000229938_100000730704 [2,0,0,0,0,0|2,0,0]=4 8398 B12R0.234 C=C(C)CCOCCCCCCC 34a_100000210272_100000730704 [2,0,0,0,0,0|2,0,0]=4 8399 B12R0.234 C=C(C)CCOCCCCCCC 34a_100000764851_100000210614 [2,0,0,0,0,0|2,0,0]=4 8400 B12R0.234 C=C(C)CCOCCCCCCC 7a_100000210272_100000730704 [2,0,0,0,0,0|2,0,0]=4 8401 B12R0.234 C=C(C)CCSCCCCCCC 62a_100000210614_100000730704 [2,0,0,0,0,0|2,0,0]=4 8402 B12R0.234 C=C(C)CCSCCCCCCC 62a_100000730704_100000210316 [2,0,0,0,0,0|2,0,0]=4 8403 B12R0.234 C=C(C)CNCCCCCCCC 2230a_100000229939_100000748629 [2,0,0,0,0,0|2,0,0]=4 8404 B12R0.234 C=C(C)CNCCCCCCCC 34a_100000229939_100000748629 [2,0,0,0,0,0|2,0,0]=4 8405 B12R0.234 C=C(C)COCCCCCCCC 34a_100000210232_100000748629 [2,0,0,0,0,0|2,0,0]=4 8406 B12R0.234 C=C(C)COCCCCCCCC 34a_100000210245_100000210759 [2,0,0,0,0,0|2,0,0]=4 8407 B12R0.234 C=C(C)COCCCCCCCC 7a_100000210232_100000748629 [2,0,0,0,0,0|2,0,0]=4 8408 B12R0.234 C=C(C)CSCCCCCCCC 62a_100000210759_100000211660 [2,0,0,0,0,0|2,0,0]=4 8409 B12R0.234 C=C(C)CSCCCCCCCC 62a_100000748629_100000210317 [2,0,0,0,0,0|2,0,0]=4 8410 B12R0.234 C=CCCCCCCCCC(=O)C 1458a_100000070787_100011933949 [2,0,0,0,0,0|0,0,2]=4 8411 B12R0.234 C=CCCCCCCCCC(=O)C 1458a_100000211349_200000210301 [2,0,0,0,0,0|0,0,2]=4 8412 B12R0.234 C=CCCCCCCCCC(=O)[13CH3] 1458a_100000211349_200025704644 [2,0,0,0,0,0|0,0,2]=4 8413 B12R0.234 CC#CCCCCCCCC(=O)C 1458a_100000066323_200000210301 [2,0,0,0,0,0|0,0,2]=4 8414 B12R0.234 CC#CCCCCCCCC(=O)[13CH3] 1458a_100000066323_200025704644 [2,0,0,0,0,0|0,0,2]=4 8415 B12R0.234 CC(=O)CCCCCCCCCF 1458a_200009909015_200000210301 [2,0,0,0,0,0|1,0,0]=3 8416 B12R0.234 CC(=O)CCCCCCCCCO 1458a_100000070787_100009813782 [2,0,0,0,0,0|1,0,0]=3 8417 B12R0.234 CC(=O)CCCCNCCCCO 34a_100000750430_100009817362 [2,0,0,0,0,0|2,0,0]=4 8418 B12R0.234 CC(=O)CCCCOCCCCBr 34a_100011216708_100009817362 [2,0,0,0,0,0|2,0,0]=4 8419 B12R0.234 CC(=O)CCCCOCCCCCl 34a_100000210776_100009817362 [2,0,0,0,0,0|2,0,0]=4 8420 B12R0.234 CC(=O)CCCCOCCCCCl 7a_100000210776_100000735457 [2,0,0,0,0,0|2,0,0]=4 8421 B12R0.234 CC(=O)CCCCOCCCCF 34a_100011995726_100009817362 [2,0,0,0,0,0|2,0,0]=4 8422 B12R0.234 CC(=O)CCCCOCCCCF 7a_100011995726_100000735457 [2,0,0,0,0,0|2,0,0]=4 8423 B12R0.234 CC(=O)CCCCOCCCCI 34a_200012148704_100009817362 [2,0,0,0,0,0|2,0,0]=4 8424 B12R0.234 CC(=O)CCCCOCCCCN 34a_100000750430_100009817362 [2,0,0,0,0,0|2,0,0]=4 8425 B12R0.234 CC(=O)CCCCSCCCCF 62a_100000729493_100000735457 [2,0,0,0,0,0|2,0,0]=4 8426 B12R0.234 CC(=O)CCCCSCCCCF 62a_100000735457_100000729493 [2,0,0,0,0,0|2,0,0]=4 8427 B12R0.234 CC(=O)CCCCSCCCCO 62a_100000210776_100000735457 [2,0,0,0,0,0|2,0,0]=4 8428 B12R0.234 CC(=O)CCCCSCCCCO 62a_100000735457_100000210776 [2,0,0,0,0,0|2,0,0]=4 8429 B12R0.234 CC(=O)CCCNCCCCCO 34a_100000762737_100000685027 [2,0,0,0,0,0|2,0,0]=4 8430 B12R0.234 CC(=O)CCCOCCCCCBr 34a_100000746331_100000685027 [2,0,0,0,0,0|2,0,0]=4 8431 B12R0.234 CC(=O)CCCOCCCCCBr 7a_100000746331_100011215641 [2,0,0,0,0,0|2,0,0]=4 8432 B12R0.234 CC(=O)CCCOCCCCCCl 34a_100000746330_100000685027 [2,0,0,0,0,0|2,0,0]=4 8433 B12R0.234 CC(=O)CCCOCCCCCCl 7a_100000746330_100011215641 [2,0,0,0,0,0|2,0,0]=4 8434 B12R0.234 CC(=O)CCCOCCCCCF 34a_100000759063_100000729378 [2,0,0,0,0,0|2,0,0]=4 8435 B12R0.234 CC(=O)CCCOCCCCCF 7a_100000759063_100000729378 [2,0,0,0,0,0|2,0,0]=4 8436 B12R0.234 CC(=O)CCCOCCCCCI 34a_200012148887_100000685027 [2,0,0,0,0,0|2,0,0]=4 8437 B12R0.234 CC(=O)CCCOCCCCCI 7a_200012148887_100011215641 [2,0,0,0,0,0|2,0,0]=4 8438 B12R0.234 CC(=O)CCCOCCCCCN 34a_100000762737_100000685027 [2,0,0,0,0,0|2,0,0]=4 8439 B12R0.234 CC(=O)CCCOCCCCCO 34a_100000759063_100000746330 [2,0,0,0,0,0|2,0,0]=4 8440 B12R0.234 CC(=O)CCCOCCCCCO 7a_100000759063_100000746330 [2,0,0,0,0,0|2,0,0]=4 8441 B12R0.234 CC(=O)CCCSCCCCCF 62a_100000729378_100011215641 [2,0,0,0,0,0|2,0,0]=4 8442 B12R0.234 CC(=O)CCCSCCCCCF 62a_100011215641_100000729378 [2,0,0,0,0,0|2,0,0]=4 8443 B12R0.234 CC(=O)CCCSCCCCCO 62a_100000746330_100011215641 [2,0,0,0,0,0|2,0,0]=4 8444 B12R0.234 CC(=O)CCCSCCCCCO 62a_100011215641_100000746330 [2,0,0,0,0,0|2,0,0]=4 8445 B12R0.234 CC(=O)CCOCCCCCCBr 7a_100011215345_100000053229 [2,0,0,0,0,0|2,0,0]=4 8446 B12R0.234 CC(=O)CCOCCCCCCCl 7a_100000766143_100000053229 [2,0,0,0,0,0|2,0,0]=4 8447 B12R0.234 CC(=O)CCOCCCCCCF 34a_100000759926_100015922095 [2,0,0,0,0,0|2,0,0]=4 8448 B12R0.234 CC(=O)CCOCCCCCCF 7a_100000732779_100000053229 [2,0,0,0,0,0|2,0,0]=4 8449 B12R0.234 CC(=O)CCOCCCCCCF 7a_100000759926_100015922095 [2,0,0,0,0,0|2,0,0]=4 8450 B12R0.234 CC(=O)CCOCCCCCCO 34a_100000759926_100000766143 [2,0,0,0,0,0|2,0,0]=4 8451 B12R0.234 CC(=O)CCOCCCCCCO 7a_100000759926_100000766143 [2,0,0,0,0,0|2,0,0]=4 8452 B12R0.234 CC(=O)CCSCCCCCCF 62a_100000053229_100015922095 [2,0,0,0,0,0|2,0,0]=4 8453 B12R0.234 CC(=O)CCSCCCCCCF 62a_100015922095_100000053229 [2,0,0,0,0,0|2,0,0]=4 8454 B12R0.234 CC(=O)CCSCCCCCCO 62a_100000053229_100000766143 [2,0,0,0,0,0|2,0,0]=4 8455 B12R0.234 CC(=O)CCSCCCCCCO 62a_100000766143_100000053229 [2,0,0,0,0,0|2,0,0]=4 8456 B12R0.234 CC(=O)COCCCCCCCO 34a_100000211253_100000760002 [2,0,0,0,0,0|2,0,0]=4 8457 B12R0.234 CC(=O)NCCCCCCCCO 240690a_102515433106_100015343762 [2,0,0,0,0,0|2,0,0]=4 8458 B12R0.234 CCC#CCCCCCCC(=O)C 1458a_100000070787_200000036426 [2,0,0,0,0,0|0,0,2]=4 8459 B12R0.234 CCCCCCCCC=CC(=O)C 1458a_100015345288_200000210301 [2,0,0,0,0,0|0,0,2]=4 8460 B12R0.234 CCCCCCCCC=CC(=O)[13CH3] 1458a_100015345288_200025704644 [2,0,0,0,0,0|0,0,2]=4 8461 B12R0.234 CCCCCCCCCCC(=O)C 1458a_100000070787_100000210319 [2,0,0,0,0,0|0,0,0]=2 8462 B12R0.234 CCCCCCCCCCC(=O)C 1458a_100000210375_200000210301 [2,0,0,0,0,0|0,0,0]=2 8463 B12R0.234 CCCCCCCCCCC(=O)[13CH3] 1458a_100000210375_200025704644 [2,0,0,0,0,0|0,0,0]=2 8464 B12R0.234 CCCCCCCCCCN(C)C 2230a_100000207566_200000210301 [2,0,0,0,0,0|2,0,0]=4 8465 B12R0.234 CCCCCCCCCCN(C)C 2230a_100102631434_100000210320 [2,0,0,0,0,0|2,0,0]=4 8466 B12R0.234 CCCCCCCCCCN(C)C 269982a_100000207566_200000210301 [2,0,0,0,0,0|2,0,0]=4 8467 B12R0.234 CCCCCCCCCCN(C)C 269982a_100102631434_100000210320 [2,0,0,0,0,0|2,0,0]=4 8468 B12R0.234 CCCCCCCCCCN(C)[13CH3] 2230a_100000207566_200025704644 [2,0,0,0,0,0|2,0,0]=4 8469 B12R0.234 CCCCCCCCCCN(C)[13CH3] 269982a_100000207566_200025704644 [2,0,0,0,0,0|2,0,0]=4 8470 B12R0.234 CCCCCCCCCNC(=O)C 11a_100000212291_100015343762 [2,0,0,0,0,0|1,0,0]=3 8471 B12R0.234 CCCCCCCCCNC(=O)C 1626a_100000212291_100015343762 [2,0,0,0,0,0|1,0,0]=3 8472 B12R0.234 CCCCCCCCCNC(=O)C 240690a_100000212291_100015343762 [2,0,0,0,0,0|1,0,0]=3 8473 B12R0.234 CCCCCCCCCNC(=O)C 527a_100000212291_100103153847 [2,0,0,0,0,0|1,0,0]=3 8474 B12R0.234 CCCCCCCCNCC(=O)N 2230a_100000229939_100000747473 [2,0,0,0,0,0|2,0,0]=4 8475 B12R0.234 CCCCCCCCNCC(=O)N 2230a_100000711301_100000210759 [2,0,0,0,0,0|2,0,0]=4 8476 B12R0.234 CCCCCCCCNCC(=O)N 34a_100000229939_100000187820 [2,0,0,0,0,0|2,0,0]=4 8477 B12R0.234 CCCCCCCCNCC(=O)O 269956a_100016091260_100000210759 [2,0,0,0,0,0|1,0,0]=3 8478 B12R0.234 CCCCCCCCNCC(=O)[O-] 34a_100000229939_100020667443 [2,0,0,0,0,0|1,0,1]=4 8479 B12R0.234 CCCCCCCCOCC(=O)C 1458a_100000759886_200000210301 [2,0,0,0,0,0|1,0,0]=3 8480 B12R0.234 CCCCCCCCOCC(=O)C 34a_100000211253_100000210759 [2,0,0,0,0,0|1,0,0]=3 8481 B12R0.234 CCCCCCCCOCC(=O)N 34a_100000210232_100000187820 [2,0,0,0,0,0|2,0,0]=4 8482 B12R0.234 CCCCCCCCOCC(=O)N 7a_100000210232_100000187820 [2,0,0,0,0,0|2,0,0]=4 8483 B12R0.234 CCCCCCCCOCC(=O)[13CH3] 1458a_100000759886_200025704644 [2,0,0,0,0,0|1,0,0]=3 8484 B12R0.234 CCCCCCCCOCC(=O)[O-] 34a_100000210232_100020667443 [2,0,0,0,0,0|1,0,1]=4 8485 B12R0.234 CCCCCCCCSCC(=O)N 62a_100000210759_100000747473 [2,0,0,0,0,0|2,0,0]=4 8486 B12R0.234 CCCCCCCCSCC(=O)N 62a_100000747473_100000210317 [2,0,0,0,0,0|2,0,0]=4 8487 B12R0.234 CCCCCCCCSCC(=O)[O-] 62a_100000210759_100020667443 [2,0,0,0,0,0|1,0,1]=4 8488 B12R0.234 CCCCCCCCSCC(=O)[O-] 62a_100020667443_100000210317 [2,0,0,0,0,0|1,0,1]=4 8489 B12R0.234 CCCCCCCNCCC(=O)N 2230a_100000229938_100000744528 [2,0,0,0,0,0|2,0,0]=4 8490 B12R0.234 CCCCCCCNOCC(=O)O 269956a_100000106656_100000210614 [2,0,0,0,0,0|2,0,0]=4 8491 B12R0.234 CCCCCCCOCCC(=O)C 34a_100000759926_100000210614 [2,0,0,0,0,0|1,0,0]=3 8492 B12R0.234 CCCCCCCOCCC(=O)C 7a_100000210272_100000053229 [2,0,0,0,0,0|1,0,0]=3 8493 B12R0.234 CCCCCCCOCCC(=O)C 7a_100000759926_100000210614 [2,0,0,0,0,0|1,0,0]=3 8494 B12R0.234 CCCCCCCOCCC(=O)N 34a_100000210272_100000731001 [2,0,0,0,0,0|2,0,0]=4 8495 B12R0.234 CCCCCCCOCCC(=O)N 34a_100000757172_100000210614 [2,0,0,0,0,0|2,0,0]=4 8496 B12R0.234 CCCCCCCOCCC(=O)N 7a_100000210272_100000744528 [2,0,0,0,0,0|2,0,0]=4 8497 B12R0.234 CCCCCCCOCCC(=O)N 7a_100000757172_100000210614 [2,0,0,0,0,0|2,0,0]=4 8498 B12R0.234 CCCCCCCOCOC(=O)C 34a_100000210272_100009813279 [2,0,0,0,0,0|2,0,0]=4 8499 B12R0.234 CCCCCCCSCCC(=O)C 62a_100000053229_100000210316 [2,0,0,0,0,0|1,0,0]=3 8500 B12R0.234 CCCCCCCSCCC(=O)C 62a_100000210614_100000053229 [2,0,0,0,0,0|1,0,0]=3 8501 B12R0.234 CCCCCCCSCCC(=O)N 62a_100000210614_100000744528 [2,0,0,0,0,0|2,0,0]=4 8502 B12R0.234 CCCCCCCSCCC(=O)N 62a_100000744528_100000210316 [2,0,0,0,0,0|2,0,0]=4 8503 B12R0.234 CCCCCCCSCOC(=O)C 62a_100000076356_100000210316 [2,0,0,0,0,0|2,0,0]=4 8504 B12R0.234 CCCCCCCSCOC(=O)C 62a_100000210614_100000076356 [2,0,0,0,0,0|2,0,0]=4 8505 B12R0.234 CCCCCCNCCCC(=O)N 34a_100000739312_100000210314 [2,0,0,0,0,0|2,0,0]=4 8506 B12R0.234 CCCCCCNCCCS(=O)C 2230a_200000753449_100000210314 [2,0,0,0,0,0|2,0,0]=4 8507 B12R0.234 CCCCCCNCCNC(=O)C 2230a_100000209853_100000210314 [2,0,0,0,0,0|2,0,0]=4 8508 B12R0.234 CCCCCCNCCNC(=O)C 2230a_100000210581_100000189650 [2,0,0,0,0,0|2,0,0]=4 8509 B12R0.234 CCCCCCOCCCC(=O)C 34a_100000210259_100000685027 [2,0,0,0,0,0|1,0,0]=3 8510 B12R0.234 CCCCCCOCCCC(=O)C 34a_100000759063_100000210314 [2,0,0,0,0,0|1,0,0]=3 8511 B12R0.234 CCCCCCOCCCC(=O)C 7a_100000210259_100011215641 [2,0,0,0,0,0|1,0,0]=3 8512 B12R0.234 CCCCCCOCCCC(=O)C 7a_100000759063_100000210314 [2,0,0,0,0,0|1,0,0]=3 8513 B12R0.234 CCCCCCOCCCC(=O)N 34a_100000210259_100102525003 [2,0,0,0,0,0|2,0,0]=4 8514 B12R0.234 CCCCCCOCCCC(=O)N 7a_100000210259_100102525003 [2,0,0,0,0,0|2,0,0]=4 8515 B12R0.234 CCCCCCOCCNC(=O)C 34a_100000158858_100000210314 [2,0,0,0,0,0|2,0,0]=4 8516 B12R0.234 CCCCCCOCCNC(=O)C 7a_100000210259_100000189650 [2,0,0,0,0,0|2,0,0]=4 8517 B12R0.234 CCCCCCOCCOC(=O)C 34a_100000210259_100009814007 [2,0,0,0,0,0|2,0,0]=4 8518 B12R0.234 CCCCCCOCCOC(=O)C 7a_100000210259_100009814007 [2,0,0,0,0,0|2,0,0]=4 8519 B12R0.234 CCCCCCSCCCC(=O)C 62a_100000210314_100011215641 [2,0,0,0,0,0|1,0,0]=3 8520 B12R0.234 CCCCCCSCCCC(=O)C 62a_100011215641_100000210757 [2,0,0,0,0,0|1,0,0]=3 8521 B12R0.234 CCCCCCSCCCC(=O)N 62a_100000210314_100102525003 [2,0,0,0,0,0|2,0,0]=4 8522 B12R0.234 CCCCCCSCCCC(=O)N 62a_100102525003_100000210757 [2,0,0,0,0,0|2,0,0]=4 8523 B12R0.234 CCCCCCSCCNC(=O)C 62a_100000189650_100000210757 [2,0,0,0,0,0|2,0,0]=4 8524 B12R0.234 CCCCCCSCCNC(=O)C 62a_100000210314_100000189650 [2,0,0,0,0,0|2,0,0]=4 8525 B12R0.234 CCCCCCSCCOC(=O)C 62a_100000210314_100009814007 [2,0,0,0,0,0|2,0,0]=4 8526 B12R0.234 CCCCCCSCCOC(=O)C 62a_100009814007_100000210757 [2,0,0,0,0,0|2,0,0]=4 8527 B12R0.234 CCCCCNCCCCC(=O)N 34a_100000696515_100000718602 [2,0,0,0,0,0|2,0,0]=4 8528 B12R0.234 CCCCCNCCCNC(=O)C 34a_100000736810_100000718602 [2,0,0,0,0,0|2,0,0]=4 8529 B12R0.234 CCCCCNCCCSC(=O)C 2230a_100000209983_100000038929 [2,0,0,0,0,0|2,0,0]=4 8530 B12R0.234 CCCCCNCCOCC(=O)O 269956a_100000700818_100000210326 [2,0,0,0,0,0|2,0,0]=4 8531 B12R0.234 CCCCCOCCCCC(=O)C 34a_100000210253_100009817362 [2,0,0,0,0,0|1,0,0]=3 8532 B12R0.234 CCCCCOCCCCC(=O)C 7a_100000210253_100000735457 [2,0,0,0,0,0|1,0,0]=3 8533 B12R0.234 CCCCCOCCCCC(=O)N 34a_100012022536_100000718602 [2,0,0,0,0,0|2,0,0]=4 8534 B12R0.234 CCCCCOCCCCC(=O)N 7a_100012022536_100000210326 [2,0,0,0,0,0|2,0,0]=4 8535 B12R0.234 CCCCCOCCCNC(=O)C 34a_100000752032_100000718602 [2,0,0,0,0,0|2,0,0]=4 8536 B12R0.234 CCCCCOCCCOC(=O)C 34a_100000210253_100000042594 [2,0,0,0,0,0|2,0,0]=4 8537 B12R0.234 CCCCCOCCCOC(=O)C 7a_100000210253_100000042594 [2,0,0,0,0,0|2,0,0]=4 8538 B12R0.234 CCCCCOCCCSC(=O)C 34a_100000210253_100000038929 [2,0,0,0,0,0|2,0,0]=4 8539 B12R0.234 CCCCCOCCCSC(=O)C 7a_100000210253_100000038929 [2,0,0,0,0,0|2,0,0]=4 8540 B12R0.234 CCCCCSCCCCC(=O)C 62a_100000210326_100000735457 [2,0,0,0,0,0|1,0,0]=3 8541 B12R0.234 CCCCCSCCCCC(=O)C 62a_100000735457_100000210326 [2,0,0,0,0,0|1,0,0]=3 8542 B12R0.234 CCCCCSCCCOC(=O)C 62a_100000042594_100000210326 [2,0,0,0,0,0|2,0,0]=4 8543 B12R0.234 CCCCCSCCCOC(=O)C 62a_100000210326_100000042594 [2,0,0,0,0,0|2,0,0]=4 8544 B12R0.234 CCCCCSCCCSC(=O)C 62a_100000038929_100000210326 [2,0,0,0,0,0|2,0,0]=4 8545 B12R0.234 CCCCCSCCCSC(=O)C 62a_100000210326_100000038929 [2,0,0,0,0,0|2,0,0]=4 8546 B12R0.234 CCCCNCCCCCC(=O)N 2230a_100000102301_100009817443 [2,0,0,0,0,0|2,0,0]=4 8547 B12R0.234 CCCCNCCCCCC(=O)N 7a_106832991798_100009817443 [2,0,0,0,0,0|2,0,0]=4 8548 B12R0.234 CCCCNCCCCNC(=O)C 2230a_200011368371_100000210211 [2,0,0,0,0,0|2,0,0]=4 8549 B12R0.234 CCCCNCCCCNC(=O)C 34a_200011368371_100000210210 [2,0,0,0,0,0|2,0,0]=4 8550 B12R0.234 CCCCNCCCCOC(=O)C 7a_106832991798_100000033659 [2,0,0,0,0,0|2,0,0]=4 8551 B12R0.234 CCCCNCCCCSC(=O)C 2230a_100000102301_200010402107 [2,0,0,0,0,0|2,0,0]=4 8552 B12R0.234 CCCCNCCCCSC(=O)C 7a_106832991798_200010402107 [2,0,0,0,0,0|2,0,0]=4 8553 B12R0.234 CCCCOCCCCCC(=O)N 34a_100000123541_100000210210 [2,0,0,0,0,0|2,0,0]=4 8554 B12R0.234 CCCCOCCCCCC(=O)N 34a_100000210227_100009817443 [2,0,0,0,0,0|2,0,0]=4 8555 B12R0.234 CCCCOCCCCCC(=O)N 7a_100000123541_100000210211 [2,0,0,0,0,0|2,0,0]=4 8556 B12R0.234 CCCCOCCCCCC(=O)N 7a_100000210227_100009817443 [2,0,0,0,0,0|2,0,0]=4 8557 B12R0.234 CCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210211 [2,0,0,0,0,0|1,0,1]=4 8558 B12R0.234 CCCCOCCCCOC(=O)C 34a_100000073216_100000210210 [2,0,0,0,0,0|2,0,0]=4 8559 B12R0.234 CCCCOCCCCOC(=O)C 34a_100000210227_100000033659 [2,0,0,0,0,0|2,0,0]=4 8560 B12R0.234 CCCCOCCCCOC(=O)C 7a_100000073216_100000210211 [2,0,0,0,0,0|2,0,0]=4 8561 B12R0.234 CCCCOCCCCOC(=O)C 7a_100000210227_100000033659 [2,0,0,0,0,0|2,0,0]=4 8562 B12R0.234 CCCCOCCCCSC(=O)C 34a_100000210227_200010402107 [2,0,0,0,0,0|2,0,0]=4 8563 B12R0.234 CCCCOCCCCSC(=O)C 7a_100000210227_200010402107 [2,0,0,0,0,0|2,0,0]=4 8564 B12R0.234 CCCCOCCOCCC(=O)C 34a_100000759926_100000743108 [2,0,0,0,0,0|2,0,0]=4 8565 B12R0.234 CCCCOCCOCCC(=O)C 7a_100000210238_100000053229 [2,0,0,0,0,0|2,0,0]=4 8566 B12R0.234 CCCCOCCOCCC(=O)C 7a_100000759926_100000743108 [2,0,0,0,0,0|2,0,0]=4 8567 B12R0.234 CCCCOCCSCCC(=O)C 62a_100000053229_100000743108 [2,0,0,0,0,0|2,0,0]=4 8568 B12R0.234 CCCCOCCSCCC(=O)C 62a_100000743108_100000053229 [2,0,0,0,0,0|2,0,0]=4 8569 B12R0.234 CCCCOCOCCCC(=O)C 34a_100000759063_100011995733 [2,0,0,0,0,0|2,0,0]=4 8570 B12R0.234 CCCCOCSCCCC(=O)C 62a_100011215641_100011995733 [2,0,0,0,0,0|2,0,0]=4 8571 B12R0.234 CCCCOCSCCCC(=O)C 62a_100011995733_100011215641 [2,0,0,0,0,0|2,0,0]=4 8572 B12R0.234 CCCCSCCCCCC(=O)N 62a_100000210211_100009817443 [2,0,0,0,0,0|2,0,0]=4 8573 B12R0.234 CCCCSCCCCCC(=O)N 62a_100009817443_100000210210 [2,0,0,0,0,0|2,0,0]=4 8574 B12R0.234 CCCCSCCCCOC(=O)C 62a_100000033659_100000210210 [2,0,0,0,0,0|2,0,0]=4 8575 B12R0.234 CCCCSCCCCOC(=O)C 62a_100000210211_100000033659 [2,0,0,0,0,0|2,0,0]=4 8576 B12R0.234 CCCCSCCCCSC(=O)C 62a_100000210211_200010402107 [2,0,0,0,0,0|2,0,0]=4 8577 B12R0.234 CCCCSCCCCSC(=O)C 62a_200010402107_100000210210 [2,0,0,0,0,0|2,0,0]=4 8578 B12R0.234 CCCCSCCOCCC(=O)C 7a_200000230436_100000053229 [2,0,0,0,0,0|2,0,0]=4 8579 B12R0.234 CCCNCCCCCNC(=O)C 2230a_200012022750_100000210303 [2,0,0,0,0,0|2,0,0]=4 8580 B12R0.234 CCCNCCCCCNC(=O)C 34a_200012022750_100000210303 [2,0,0,0,0,0|2,0,0]=4 8581 B12R0.234 CCCOCCCCCOC(=O)C 34a_100000210258_100000033007 [2,0,0,0,0,0|2,0,0]=4 8582 B12R0.234 CCCOCCNCCCC(=O)C 34a_100161115042_100000685027 [2,0,0,0,0,0|2,0,0]=4 8583 B12R0.234 CCCOCCOCCCC(=O)C 34a_100000752267_100000685027 [2,0,0,0,0,0|2,0,0]=4 8584 B12R0.234 CCCOCCOCCCC(=O)C 34a_100000759063_100011215938 [2,0,0,0,0,0|2,0,0]=4 8585 B12R0.234 CCCOCCOCCCC(=O)C 7a_100000752267_100011215641 [2,0,0,0,0,0|2,0,0]=4 8586 B12R0.234 CCCOCCOCCCC(=O)C 7a_100000759063_100011215938 [2,0,0,0,0,0|2,0,0]=4 8587 B12R0.234 CCCOCCSCCCC(=O)C 62a_100011215641_100011215938 [2,0,0,0,0,0|2,0,0]=4 8588 B12R0.234 CCCOCCSCCCC(=O)C 62a_100011215938_100011215641 [2,0,0,0,0,0|2,0,0]=4 8589 B12R0.234 CCCSCCCCCOC(=O)C 62a_100000033007_100000210303 [2,0,0,0,0,0|2,0,0]=4 8590 B12R0.234 CCCSCCCCCOC(=O)C 62a_100000210303_100000033007 [2,0,0,0,0,0|2,0,0]=4 8591 B12R0.234 CCCSCCOCCCC(=O)C 34a_200000230433_100000685027 [2,0,0,0,0,0|2,0,0]=4 8592 B12R0.234 CCCSCCOCCCC(=O)C 7a_200000230433_100011215641 [2,0,0,0,0,0|2,0,0]=4 8593 B12R0.234 CCNCCCCCCNC(=O)C 2230a_200011996284_100000210202 [2,0,0,0,0,0|2,0,0]=4 8594 B12R0.234 CCNCCCCCCNC(=O)C 34a_200011996284_100000210202 [2,0,0,0,0,0|2,0,0]=4 8595 B12R0.234 CCOCCCNCCCC(=O)C 34a_100000210961_100000685027 [2,0,0,0,0,0|2,0,0]=4 8596 B12R0.234 CCOCCCOCCCC(=O)C 34a_100000757476_100000685027 [2,0,0,0,0,0|2,0,0]=4 8597 B12R0.234 CCOCCCOCCCC(=O)C 34a_100000759063_100012232248 [2,0,0,0,0,0|2,0,0]=4 8598 B12R0.234 CCOCCCOCCCC(=O)C 7a_100000757476_100011215641 [2,0,0,0,0,0|2,0,0]=4 8599 B12R0.234 CCOCCCOCCCC(=O)C 7a_100000759063_100012232248 [2,0,0,0,0,0|2,0,0]=4 8600 B12R0.234 CCOCCCSCCCC(=O)C 62a_100011215641_100012232248 [2,0,0,0,0,0|2,0,0]=4 8601 B12R0.234 CCOCCCSCCCC(=O)C 62a_100012232248_100011215641 [2,0,0,0,0,0|2,0,0]=4 8602 B12R0.234 CCOCCNCCCCC(=O)C 34a_102516460346_100009817362 [2,0,0,0,0,0|2,0,0]=4 8603 B12R0.234 CCOCCOCCCCC(=O)C 34a_100000210136_100009817362 [2,0,0,0,0,0|2,0,0]=4 8604 B12R0.234 CCOCCOCCCCC(=O)C 7a_100000210136_100000735457 [2,0,0,0,0,0|2,0,0]=4 8605 B12R0.234 CCOCCSCCCCC(=O)C 62a_100000210147_100000735457 [2,0,0,0,0,0|2,0,0]=4 8606 B12R0.234 CCOCCSCCCCC(=O)C 62a_100000735457_100011215890 [2,0,0,0,0,0|2,0,0]=4 8607 B12R0.234 CCSCCCOCCCC(=O)C 34a_100011216438_100000685027 [2,0,0,0,0,0|2,0,0]=4 8608 B12R0.234 CCSCCCOCCCC(=O)C 7a_100011216438_100011215641 [2,0,0,0,0,0|2,0,0]=4 8609 B12R0.234 CCSCCOCCCCC(=O)C 34a_100000212035_100009817362 [2,0,0,0,0,0|2,0,0]=4 8610 B12R0.234 CCSCCOCCCCC(=O)C 7a_100000212035_100000735457 [2,0,0,0,0,0|2,0,0]=4 8611 B12R0.234 CCSCCSCCCCC(=O)C 62a_100000735457_100000757381 [2,0,0,0,0,0|2,0,0]=4 8612 B12R0.234 CCSCCSCCCCC(=O)C 62a_100000757381_100000735457 [2,0,0,0,0,0|2,0,0]=4 8613 B12R0.234 CNCCCOCCCCC(=O)C 34a_100000213112_100009817362 [2,0,0,0,0,0|2,0,0]=4 8614 B12R0.234 COCCCCCCNCC(=O)O 269956a_100016091260_100011998445 [2,0,0,0,0,0|2,0,0]=4 8615 B12R0.234 COCCCCCCOCC(=O)C 34a_100000211253_100011998445 [2,0,0,0,0,0|2,0,0]=4 8616 B12R0.234 COCCCCOCCCC(=O)C 34a_100000740925_100000685027 [2,0,0,0,0,0|2,0,0]=4 8617 B12R0.234 COCCCCOCCCC(=O)C 34a_100000759063_100000755781 [2,0,0,0,0,0|2,0,0]=4 8618 B12R0.234 COCCCCOCCCC(=O)C 7a_100000759063_100000730899 [2,0,0,0,0,0|2,0,0]=4 8619 B12R0.234 COCCCCSCCCC(=O)C 62a_100000730899_100011215641 [2,0,0,0,0,0|2,0,0]=4 8620 B12R0.234 COCCCCSCCCC(=O)C 62a_100011215641_100000730899 [2,0,0,0,0,0|2,0,0]=4 8621 B12R0.234 COCCCNCCCCC(=O)C 34a_100150723488_100009817362 [2,0,0,0,0,0|2,0,0]=4 8622 B12R0.234 COCCCOCCCCC(=O)C 34a_100000740835_100009817362 [2,0,0,0,0,0|2,0,0]=4 8623 B12R0.234 COCCCSCCCCC(=O)C 62a_100000709357_100000735457 [2,0,0,0,0,0|2,0,0]=4 8624 B12R0.234 COCCCSCCCCC(=O)C 62a_100000735457_100000709357 [2,0,0,0,0,0|2,0,0]=4 8625 B12R0.234 CSCCCCOCCCC(=O)C 34a_100011217163_100000685027 [2,0,0,0,0,0|2,0,0]=4 8626 B12R0.234 CSCCCCOCCCC(=O)C 7a_100011217163_100011215641 [2,0,0,0,0,0|2,0,0]=4 8627 B12R0.234 CSCCCOCCCCC(=O)C 34a_100000690336_100009817362 [2,0,0,0,0,0|2,0,0]=4 8628 B12R0.234 CSCCCOCCCCC(=O)C 7a_100000690336_100000735457 [2,0,0,0,0,0|2,0,0]=4 8629 B12R0.234 O=C(O)CNCCCCCCCO 269956a_100016091260_100000760002 [2,0,0,0,0,0|2,0,0]=4 8630 B12R0.234 [13CH3]C(=O)CCCCCCCCCF 1458a_200009909015_200025704644 [2,0,0,0,0,0|1,0,0]=3 8631 B14R0.1 CCCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100000210303 [1,1,0,0,0,0|0,0,1]=3 8632 B14R0.1 CCCC(=O)CCCCCC(=O)OCC 1458a_100000211992_100000755133 [1,1,0,0,0,0|0,0,1]=3 8633 B14R0.1 CCCC(=O)CCCOCC(=O)OCC 1458a_100000211992_100009893628 [1,1,0,0,0,0|1,0,1]=4 8634 B14R0.1 CCCC(=O)COCCCC(=O)OCC 7a_100012001163_100000747444 [1,1,0,0,0,0|1,0,1]=4 8635 B14R0.1 CCCC(=O)COCCCC(C)CCC 7a_100011713154_100000747444 [1,1,0,0,0,0|2,0,0]=4 8636 B14R0.1 CCCC(=O)CSCCCC(=O)OCC 62a_100000747444_100009991533 [1,1,0,0,0,0|1,0,1]=4 8637 B14R0.1 CCCC(=O)CSCCCC(=O)OCC 62a_100009991533_100000747444 [1,1,0,0,0,0|1,0,1]=4 8638 B14R0.1 CCCC(=O)NCCCCC(=O)OCC 188690a_100000718961_100000211992 [1,1,0,0,0,0|1,0,1]=4 8639 B14R0.1 CCCC(C)CCCOCC(=O)NCC 34a_100011713154_100000183381 [1,1,0,0,0,0|2,0,0]=4 8640 B14R0.1 CCCC(C)CCCOCC(=O)NCC 7a_100011713154_100000183381 [1,1,0,0,0,0|2,0,0]=4 8641 B14R0.1 CCCC(C)CCCOCC(=O)OCC 34a_100011713154_100000188475 [1,1,0,0,0,0|1,0,0]=3 8642 B14R0.1 CCCC(C)CCCOCC(=O)OCC 7a_100011713154_100000188475 [1,1,0,0,0,0|1,0,0]=3 8643 B14R0.1 CCCC(C)CCOCCC(=O)NCC 7a_100011217855_100000737597 [1,1,0,0,0,0|2,0,0]=4 8644 B14R0.1 CCCC(C)CCOCCC(=O)OCC 34a_100011217855_100000765890 [1,1,0,0,0,0|1,0,0]=3 8645 B14R0.1 CCCC(C)CCOCCC(=O)OCC 7a_100011217855_100011206558 [1,1,0,0,0,0|1,0,0]=3 8646 B14R0.1 CCCC(C)COCCCC(=O)OCC 34a_100000688023_100009991533 [1,1,0,0,0,0|1,0,0]=3 8647 B14R0.1 CCCC(C)COCCCC(=O)OCC 7a_100000688023_100011215271 [1,1,0,0,0,0|1,0,0]=3 8648 B14R0.1 CCCC(C)COCCCC(=O)OCC 7a_100012001163_100011216630 [1,1,0,0,0,0|1,0,0]=3 8649 B14R0.1 CCCC(C)COCCNC(=O)OCC 34a_100000158857_100011216630 [1,1,0,0,0,0|2,0,0]=4 8650 B14R0.1 CCCC(C)COCCNC(=O)OCC 7a_100000688023_200011445536 [1,1,0,0,0,0|2,0,0]=4 8651 B14R0.1 CCCC(C)CSCCCC(=O)OCC 62a_100009991533_100011216630 [1,1,0,0,0,0|1,0,0]=3 8652 B14R0.1 CCCC(C)CSCCCC(=O)OCC 62a_100011216630_100009991533 [1,1,0,0,0,0|1,0,0]=3 8653 B14R0.1 CCCC(C)CSCCNC(=O)OCC 62a_100011216630_200011445536 [1,1,0,0,0,0|2,0,0]=4 8654 B14R0.1 CCCC(C)NCCCCC(=O)OCC 2230a_100000741246_100000750268 [1,1,0,0,0,0|1,0,0]=3 8655 B14R0.1 CCCC(C)NCCOCC(=O)OCC 2230a_100000741246_100000088970 [1,1,0,0,0,0|2,0,0]=4 8656 B14R0.1 CCCC(C)OCCCCC(=O)OCC 34a_100000764384_100000750268 [1,1,0,0,0,0|1,0,0]=3 8657 B14R0.1 CCCC(C)OCCCCC(=O)OCC 7a_100000764384_100000750268 [1,1,0,0,0,0|1,0,0]=3 8658 B14R0.1 CCCC(C)OCCOCC(=O)OCC 34a_100000764384_100000088970 [1,1,0,0,0,0|2,0,0]=4 8659 B14R0.1 CCCC(C)OCCOCC(=O)OCC 7a_100000764384_100000088970 [1,1,0,0,0,0|2,0,0]=4 8660 B14R0.1 CCCC(C)OCCSCC(=O)OCC 7a_200000230590_100000766640 [1,1,0,0,0,0|2,0,0]=4 8661 B14R0.1 CCCC(C)SCCCCC(=O)OCC 62a_100000750268_100000766640 [1,1,0,0,0,0|1,0,0]=3 8662 B14R0.1 CCCC(C)SCCCCC(=O)OCC 62a_100000766640_100000750268 [1,1,0,0,0,0|1,0,0]=3 8663 B14R0.1 CCCC(C)SCCOCC(=O)OCC 62a_100000088970_100000766640 [1,1,0,0,0,0|2,0,0]=4 8664 B14R0.1 CCCC(C)SCCOCC(=O)OCC 62a_100000766640_100000088970 [1,1,0,0,0,0|2,0,0]=4 8665 B14R0.1 CCCN(C)CCCCCC(=O)OCC 2230a_100000747261_100000755133 [1,1,0,0,0,0|1,0,0]=3 8666 B14R0.1 CCCN(C)CCCCCC(=O)OCC 269982a_100000747261_100000755133 [1,1,0,0,0,0|1,0,0]=3 8667 B14R0.1 CCCN(C)CCCOCC(=O)OCC 2230a_100000747261_100009893628 [1,1,0,0,0,0|2,0,0]=4 8668 B14R0.1 CCCN(C)CCCOCC(=O)OCC 269982a_100000747261_100009893628 [1,1,0,0,0,0|2,0,0]=4 8669 B14R0.1 CCC[C@H](N)CCOCCC(=O)OCC 34a_100015193777_100000765890 [1,1,0,0,0,0|1,0,0]=3 8670 B14R0.1 CCC[C@H](N)COCCCC(=O)OCC 34a_100000732646_100009991533 [1,1,0,0,0,0|1,0,0]=3 8671 B14R0.1 CCNC(=O)CCCCCC(=O)OCC 11a_100015525214_100000037472 [1,1,0,0,0,0|1,0,1]=4 8672 B14R0.1 CCNC(=O)CCCCCC(=O)OCC 240690a_100015525214_100000037472 [1,1,0,0,0,0|1,0,1]=4 8673 B14R0.1 CCNC(=O)CCCCCC(=O)OCC 527a_100015525214_100000037472 [1,1,0,0,0,0|1,0,1]=4 8674 B14R0.1 CCOC(=O)CCCCCC(=O)CCF 1458a_100000037472_100011217306 [1,1,0,0,0,0|1,0,1]=4 8675 B14R0.1 CCOC(=O)CCCCCC(=O)CCO 1458a_100000037472_100000211926 [1,1,0,0,0,0|1,0,1]=4 8676 B14R0.1 CCOC(=O)CCCCCC(=O)CCO 1458a_100011216618_100000755133 [1,1,0,0,0,0|1,0,1]=4 8677 B14R0.1 CCOC(=O)CCCCCC(=O)COC 1458a_100000210968_100000755133 [1,1,0,0,0,0|1,0,1]=4 8678 B14R0.1 CCOC(=O)CCCCCC(=O)CSC 1458a_100000184570_100000755133 [1,1,0,0,0,0|1,0,1]=4 8679 B14R0.1 CCOC(=O)CCCCCN(C)CCO 2230a_100000210263_100000755133 [1,1,0,0,0,0|2,0,0]=4 8680 B14R0.1 CCOC(=O)CCCCCN(C)CCO 269982a_100000210263_100000755133 [1,1,0,0,0,0|2,0,0]=4 8681 B14R0.1 CCOC(=O)CCCCN[C@H](C)CCO 2230a_100000706166_100000750268 [1,1,0,0,0,0|2,0,0]=4 8682 B14R0.1 CCOC(=O)CCCCN[C@H](C)CCO 34a_100000706166_100000750268 [1,1,0,0,0,0|2,0,0]=4 8683 B14R0.1 CCOC(=O)CCCCN[C@H](C)COC 2230a_100000764878_100000750268 [1,1,0,0,0,0|2,0,0]=4 8684 B14R0.1 CCOC(=O)CCCCOC(C)CCBr 34a_100012276601_100000750268 [1,1,0,0,0,0|2,0,0]=4 8685 B14R0.1 CCOC(=O)CCCCO[C@H](C)COC 34a_100011934205_100000750268 [1,1,0,0,0,0|2,0,0]=4 8686 B14R0.1 CCOC(=O)CCCCSC(C)CCO 62a_100000750268_100009893172 [1,1,0,0,0,0|2,0,0]=4 8687 B14R0.1 CCOC(=O)CCCCSC(C)CCO 62a_100009893172_100000750268 [1,1,0,0,0,0|2,0,0]=4 8688 B14R0.1 CCOC(=O)CCCCSC(C)COC 62a_100000750268_100000765312 [1,1,0,0,0,0|2,0,0]=4 8689 B14R0.1 CCOC(=O)CCCCSC(C)COC 62a_100000765312_100000750268 [1,1,0,0,0,0|2,0,0]=4 8690 B14R0.1 CCOC(=O)CCCNCC(O)COC 2230a_100000756049_100009991533 [1,1,0,0,0,0|2,0,0]=4 8691 B14R0.1 CCOC(=O)CCCNCC(O)COC 34a_100000756049_100009991533 [1,1,0,0,0,0|2,0,0]=4 8692 B14R0.1 CCOC(=O)CCCOCC(C)CCN 34a_106354213184_100009991533 [1,1,0,0,0,0|2,0,0]=4 8693 B14R0.1 CCOC(=O)CCCOCC(N)COC 34a_100000724102_100009991533 [1,1,0,0,0,0|2,0,0]=4 8694 B14R0.1 CCOC(=O)CCCOCC(O)COC 7a_100012001163_100011215053 [1,1,0,0,0,0|2,0,0]=4 8695 B14R0.1 CCOC(=O)CCCSCC(O)COC 62a_100009991533_100011215053 [1,1,0,0,0,0|2,0,0]=4 8696 B14R0.1 CCOC(=O)CCCSCC(O)COC 62a_100011215053_100009991533 [1,1,0,0,0,0|2,0,0]=4 8697 B14R0.32 CCNC(=O)CCOCCCC(C)CC 7a_100011216074_100000737597 [1,1,0,0,0,0|2,0,0]=4 8698 B14R0.32 CCOC(=O)CCCCCCC(=O)CC 1458a_100000031895_100000210202 [1,1,0,0,0,0|0,0,1]=3 8699 B14R0.32 CCOC(=O)CCCCCCC(=O)CC 1458a_100000210414_100009814379 [1,1,0,0,0,0|0,0,1]=3 8700 B14R0.32 CCOC(=O)CCCCCCC(=O)CF 1458a_100000031895_100015361967 [1,1,0,0,0,0|1,0,1]=4 8701 B14R0.32 CCOC(=O)CCCCCCC(=O)CO 1458a_100000210174_100009814379 [1,1,0,0,0,0|1,0,1]=4 8702 B14R0.32 CCOC(=O)CCCCCCC(=O)NC 11a_106832991635_100000031895 [1,1,0,0,0,0|1,0,1]=4 8703 B14R0.32 CCOC(=O)CCCCCCC(=O)NC 1626a_100102657272_100000031895 [1,1,0,0,0,0|1,0,1]=4 8704 B14R0.32 CCOC(=O)CCCCCCC(=O)NC 240690a_100102657272_100000031895 [1,1,0,0,0,0|1,0,1]=4 8705 B14R0.32 CCOC(=O)CCCCCCC(=O)NC 527a_100102657272_100000031895 [1,1,0,0,0,0|1,0,1]=4 8706 B14R0.32 CCOC(=O)CCCCCCN(C)CC 2230a_100000225621_100009814379 [1,1,0,0,0,0|1,0,0]=3 8707 B14R0.32 CCOC(=O)CCCCCCN(C)CC 269982a_100000225621_100009814379 [1,1,0,0,0,0|1,0,0]=3 8708 B14R0.32 CCOC(=O)CCCCCNC(=O)CC 188690a_100000062434_100000210414 [1,1,0,0,0,0|1,0,1]=4 8709 B14R0.32 CCOC(=O)CCCCCNC(C)CC 2230a_100000209981_100000755133 [1,1,0,0,0,0|1,0,0]=3 8710 B14R0.32 CCOC(=O)CCCCCN[C@H](C)CO 2230a_100000737577_100000755133 [1,1,0,0,0,0|2,0,0]=4 8711 B14R0.32 CCOC(=O)CCCCCOC(C)CC 7a_100000210228_100000755133 [1,1,0,0,0,0|1,0,0]=3 8712 B14R0.32 CCOC(=O)CCCCCOC(C)CC 7a_100011214988_100000758301 [1,1,0,0,0,0|1,0,0]=3 8713 B14R0.32 CCOC(=O)CCCCCOC(C)CF 34a_100016041109_100000755133 [1,1,0,0,0,0|2,0,0]=4 8714 B14R0.32 CCOC(=O)CCCCCOC(C)CF 7a_100016041109_100000755133 [1,1,0,0,0,0|2,0,0]=4 8715 B14R0.32 CCOC(=O)CCCCCOC(C)CN 34a_100000210904_100000755133 [1,1,0,0,0,0|2,0,0]=4 8716 B14R0.32 CCOC(=O)CCCCCOC(C)CO 7a_100011214988_100012180447 [1,1,0,0,0,0|2,0,0]=4 8717 B14R0.32 CCOC(=O)CCCCCSC(C)CC 62a_100000755133_100000758301 [1,1,0,0,0,0|1,0,0]=3 8718 B14R0.32 CCOC(=O)CCCCCSC(C)CC 62a_100000758301_100000755133 [1,1,0,0,0,0|1,0,0]=3 8719 B14R0.32 CCOC(=O)CCCCCSC(C)CO 62a_100012180447_100000755133 [1,1,0,0,0,0|2,0,0]=4 8720 B14R0.32 CCOC(=O)CCCCCSC(C)OC 62a_100000755133_100009879195 [1,1,0,0,0,0|2,0,0]=4 8721 B14R0.32 CCOC(=O)CCCCCSC(C)OC 62a_100009879195_100000755133 [1,1,0,0,0,0|2,0,0]=4 8722 B14R0.32 CCOC(=O)CCCCCS[C@H](C)CO 62a_100000755133_100016084084 [1,1,0,0,0,0|2,0,0]=4 8723 B14R0.32 CCOC(=O)CCCCCS[C@H](C)CO 62a_100016084084_100000755133 [1,1,0,0,0,0|2,0,0]=4 8724 B14R0.32 CCOC(=O)CCCCNCC(C)CC 2230a_100020588543_100000750268 [1,1,0,0,0,0|1,0,0]=3 8725 B14R0.32 CCOC(=O)CCCCNCC(C)CO 34a_100000744482_100000750268 [1,1,0,0,0,0|2,0,0]=4 8726 B14R0.32 CCOC(=O)CCCCNCC(O)CC 2230a_100011218483_100000750268 [1,1,0,0,0,0|1,0,0]=3 8727 B14R0.32 CCOC(=O)CCCCNC[C@@H](C)OC 2230a_100020591295_100000750268 [1,1,0,0,0,0|2,0,0]=4 8728 B14R0.32 CCOC(=O)CCCCNC[C@@H](F)CO 34a_100015665980_100000750268 [1,1,0,0,0,0|2,0,0]=4 8729 B14R0.32 CCOC(=O)CCCCNC[C@H](O)CO 2230a_100020644852_100000750268 [1,1,0,0,0,0|2,0,0]=4 8730 B14R0.32 CCOC(=O)CCCCOCC(=O)CC 34a_100000725409_100000750268 [1,1,0,0,0,0|1,0,1]=4 8731 B14R0.32 CCOC(=O)CCCCOCC(C)CN 34a_100000744482_100000750268 [1,1,0,0,0,0|2,0,0]=4 8732 B14R0.32 CCOC(=O)CCCCOCC(C)OC 34a_100000690652_100000750268 [1,1,0,0,0,0|2,0,0]=4 8733 B14R0.32 CCOC(=O)CCCCOCC(Cl)CCl 34a_100000033668_100000750268 [1,1,0,0,0,0|2,0,0]=4 8734 B14R0.32 CCOC(=O)CCCCOC[C@@H](C)CC 7a_100009816381_100000750268 [1,1,0,0,0,0|1,0,0]=3 8735 B14R0.32 CCOC(=O)CCCCOC[C@H](F)CN 34a_100015665980_100000750268 [1,1,0,0,0,0|2,0,0]=4 8736 B14R0.32 CCOC(=O)CCCCSCC(=O)CC 62a_100000747405_100000750268 [1,1,0,0,0,0|1,0,1]=4 8737 B14R0.32 CCOC(=O)CCCCSCC(=O)CC 62a_100000750268_100000747405 [1,1,0,0,0,0|1,0,1]=4 8738 B14R0.32 CCOC(=O)CCCCSCC(C)CC 62a_100000748023_100000750268 [1,1,0,0,0,0|1,0,0]=3 8739 B14R0.32 CCOC(=O)CCCCSCC(C)CC 62a_100000750268_100000748023 [1,1,0,0,0,0|1,0,0]=3 8740 B14R0.32 CCOC(=O)CCCCSCC(O)CC 62a_100000750268_100011218378 [1,1,0,0,0,0|1,0,0]=3 8741 B14R0.32 CCOC(=O)CCCCSCC(O)CC 62a_100011218378_100000750268 [1,1,0,0,0,0|1,0,0]=3 8742 B14R0.32 CCOC(=O)CCCCSCC(O)CO 62a_100000750268_100011219619 [1,1,0,0,0,0|2,0,0]=4 8743 B14R0.32 CCOC(=O)CCCCSCC(O)CO 62a_100011219619_100000750268 [1,1,0,0,0,0|2,0,0]=4 8744 B14R0.32 CCOC(=O)CCCCSC[C@@H](C)CC 62a_100000750268_100009816398 [1,1,0,0,0,0|1,0,0]=3 8745 B14R0.32 CCOC(=O)CCCCSC[C@@H](C)CC 62a_100009816398_100000750268 [1,1,0,0,0,0|1,0,0]=3 8746 B14R0.32 CCOC(=O)CCCCSC[C@@H](C)CO 62a_100000059175_100000750268 [1,1,0,0,0,0|2,0,0]=4 8747 B14R0.32 CCOC(=O)CCCCSC[C@@H](C)CO 62a_100000750268_100000059175 [1,1,0,0,0,0|2,0,0]=4 8748 B14R0.32 CCOC(=O)CCCCSC[C@@H](O)CF 62a_100000750268_100015614560 [1,1,0,0,0,0|2,0,0]=4 8749 B14R0.32 CCOC(=O)CCCCSC[C@@H](O)CF 62a_100015614560_100000750268 [1,1,0,0,0,0|2,0,0]=4 8750 B14R0.32 CCOC(=O)CCCCSC[C@@H](O)CO 62a_100000750268_100009815848 [1,1,0,0,0,0|2,0,0]=4 8751 B14R0.32 CCOC(=O)CCCCSC[C@@H](O)CO 62a_100009815848_100000750268 [1,1,0,0,0,0|2,0,0]=4 8752 B14R0.32 CCOC(=O)CCCNCCC(C)CC 2230a_100020591266_100009991533 [1,1,0,0,0,0|1,0,0]=3 8753 B14R0.32 CCOC(=O)CCCNCCC(C)CO 2230a_106354213184_100009991533 [1,1,0,0,0,0|2,0,0]=4 8754 B14R0.32 CCOC(=O)CCCNCCC(C)CO 34a_106354213184_100009991533 [1,1,0,0,0,0|2,0,0]=4 8755 B14R0.32 CCOC(=O)CCCOCCC(C)CC 7a_100011215188_100011215271 [1,1,0,0,0,0|1,0,0]=3 8756 B14R0.32 CCOC(=O)CCCOCCC(C)OC 7a_100000764861_100011215271 [1,1,0,0,0,0|2,0,0]=4 8757 B14R0.32 CCOC(=O)CCOCCCC(C)CC 7a_100011216074_100011206558 [1,1,0,0,0,0|1,0,0]=3 8758 B14R0.32 CCOC(=O)CCOCCC[C@@H](C)CN 34a_100160569302_100000765890 [1,1,0,0,0,0|2,0,0]=4 8759 B14R0.32 CCOC(=O)CCSCCCN(C)CC 62a_100000765890_100015186262 [1,1,0,0,0,0|2,0,0]=4 8760 B14R0.32 CCOC(=O)COCCCNC(C)CC 2230a_100000209981_100009893628 [1,1,0,0,0,0|2,0,0]=4 8761 B14R0.32 CCOC(=O)COCCCOC(C)CC 7a_100000210228_100009893628 [1,1,0,0,0,0|2,0,0]=4 8762 B14R0.32 CCOC(=O)COCCCSC(C)CC 62a_100000758301_100009893628 [1,1,0,0,0,0|2,0,0]=4 8763 B14R0.32 CCOC(=O)COCCCSC(C)CC 62a_100009893628_100000758301 [1,1,0,0,0,0|2,0,0]=4 8764 B14R0.32 CCOC(=O)COCCNCC(C)CC 2230a_100020588543_100000088970 [1,1,0,0,0,0|2,0,0]=4 8765 B14R0.32 CCOC(=O)COCCNCC(O)CC 2230a_100011218483_100000088970 [1,1,0,0,0,0|2,0,0]=4 8766 B14R0.32 CCOC(=O)COCCOC[C@@H](C)CC 7a_100009816381_100000088970 [1,1,0,0,0,0|2,0,0]=4 8767 B14R0.32 CCOC(=O)COCCSCC(C)CC 62a_100000088970_100000748023 [1,1,0,0,0,0|2,0,0]=4 8768 B14R0.32 CCOC(=O)COCCSCC(C)CC 62a_100000748023_100000088970 [1,1,0,0,0,0|2,0,0]=4 8769 B14R0.32 CCOC(=O)COCCSCC(O)CC 62a_100000088970_100011218378 [1,1,0,0,0,0|2,0,0]=4 8770 B14R0.32 CCOC(=O)COCCSCC(O)CC 62a_100011218378_100000088970 [1,1,0,0,0,0|2,0,0]=4 8771 B14R0.32 CCOC(=O)COCCSC[C@@H](C)CC 62a_100000088970_100009816398 [1,1,0,0,0,0|2,0,0]=4 8772 B14R0.32 CCOC(=O)COCCSC[C@@H](C)CC 62a_100009816398_100000088970 [1,1,0,0,0,0|2,0,0]=4 8773 B14R0.32 CCOC(=O)CSCCOCC(C)CC 7a_200000230590_100000748023 [1,1,0,0,0,0|2,0,0]=4 8774 B14R0.32 CCOC(=O)CSCCOCC(O)CC 7a_200000230590_100011218378 [1,1,0,0,0,0|2,0,0]=4 8775 B14R0.32 CCOC(=O)CSCCOC[C@@H](C)CC 7a_200000230590_100009816398 [1,1,0,0,0,0|2,0,0]=4 8776 B14R0.32 CCOC(=O)NCCOCCC(C)CC 7a_100011215188_200011445536 [1,1,0,0,0,0|2,0,0]=4 8777 B14R0.73 CCCCCCCC(=O)CC(=O)CCC 1458a_100000211969_100000747444 [1,1,0,0,0,0|1,0,1]=4 8778 B14R0.73 CCCCCCCC(=O)CC(=O)NCC 1458a_100000211969_100000183381 [1,1,0,0,0,0|1,0,1]=4 8779 B14R0.73 CCCCCCCC(=O)CC(=O)OCC 1458a_100000211969_100000188475 [1,1,0,0,0,0|0,0,1]=3 8780 B14R0.73 CCCCCCCC(=O)CC(=O)OCC 1458a_100000243816_100000210614 [1,1,0,0,0,0|0,0,1]=3 8781 B14R0.73 CCCCCCCC(O)CC(=O)CCC 1458a_200011667753_100000210303 [1,1,0,0,0,0|1,0,0]=3 8782 B14R0.73 CCCCCCCC(O)CC(=O)CCF 1458a_200011667753_100011217306 [1,1,0,0,0,0|2,0,0]=4 8783 B14R0.73 CCCCCCCC(O)CC(=O)CCO 1458a_200011667753_100000211926 [1,1,0,0,0,0|2,0,0]=4 8784 B14R0.73 CCCCCCCC(O)CC(=O)NCC 240690a_100015525214_200011667753 [1,1,0,0,0,0|1,0,0]=3 8785 B14R0.73 CCCCCCCC(O)CC(=O)NNC 22a_100016993582_200011667753 [1,1,0,0,0,0|2,0,0]=4 8786 B14R0.73 CCCCCCCN(C)CC(=O)CCC 2230a_100000228206_100000747444 [1,1,0,0,0,0|2,0,0]=4 8787 B14R0.73 CCCCCCCN(C)CC(=O)CCC 269982a_100000228206_100000747444 [1,1,0,0,0,0|2,0,0]=4 8788 B14R0.73 CCCCCCCN(C)CC(=O)NCC 2230a_100000228206_100000183381 [1,1,0,0,0,0|2,0,0]=4 8789 B14R0.73 CCCCCCCN(C)CC(=O)NCC 2230a_100000741943_100000210681 [1,1,0,0,0,0|2,0,0]=4 8790 B14R0.73 CCCCCCCN(C)CC(=O)NCC 269982a_100000228206_100000183381 [1,1,0,0,0,0|2,0,0]=4 8791 B14R0.73 CCCCCCCN(C)CC(=O)NCC 269982a_100000741943_100000210681 [1,1,0,0,0,0|2,0,0]=4 8792 B14R0.73 CCCCCCCN(C)CC(=O)OCC 2230a_100000220588_100000210681 [1,1,0,0,0,0|1,0,0]=3 8793 B14R0.73 CCCCCCCN(C)CC(=O)OCC 2230a_100000228206_100000188475 [1,1,0,0,0,0|1,0,0]=3 8794 B14R0.73 CCCCCCCN(C)CC(=O)OCC 269982a_100000228206_100000188475 [1,1,0,0,0,0|1,0,0]=3 8795 B14R0.73 CCCCCCNC(=O)CC(=O)OCC 240690a_100000210581_100000243816 [1,1,0,0,0,0|1,0,1]=4 8796 B14R0.73 CCCCCCNC(C)CC(=O)OCC 2230a_100000210581_100009817359 [1,1,0,0,0,0|1,0,0]=3 8797 B14R0.73 CCCCCCOC(C)CC(=O)OCC 7a_100000210259_100009817359 [1,1,0,0,0,0|1,0,0]=3 8798 B14R0.73 CCCCCCO[C@H](C)CC(=O)OCC 7a_100009816390_100000210314 [1,1,0,0,0,0|1,0,0]=3 8799 B14R0.73 CCCCCCSC(C)CC(=O)OCC 62a_100000210314_100009817359 [1,1,0,0,0,0|1,0,0]=3 8800 B14R0.73 CCCCCCSC(C)CC(=O)OCC 62a_100009817359_100000210757 [1,1,0,0,0,0|1,0,0]=3 8801 B14R0.73 CCCCCCSC(C)OC(=O)OCC 62a_100000036008_100000210757 [1,1,0,0,0,0|2,0,0]=4 8802 B14R0.73 CCCCCCSC(C)OC(=O)OCC 62a_100000210314_100000036008 [1,1,0,0,0,0|2,0,0]=4 8803 B14R0.73 CCCCCOC[C@@H](O)CC(=O)OCC 34a_100000210253_100000688340 [1,1,0,0,0,0|1,0,0]=3 8804 B14R0.73 CCCCCOC[C@@H](O)CC(=O)OCC 7a_100000210253_100000688340 [1,1,0,0,0,0|1,0,0]=3 8805 B14R0.73 CCCCCSCC(=O)CC(=O)OCC 62a_100000210311_100000210326 [1,1,0,0,0,0|1,0,1]=4 8806 B14R0.73 CCCCCSCC(=O)CC(=O)OCC 62a_100000210326_100000210311 [1,1,0,0,0,0|1,0,1]=4 8807 B14R0.73 CCCCCSC[C@@H](O)CC(=O)OCC 62a_100000210326_100000688340 [1,1,0,0,0,0|1,0,0]=3 8808 B14R0.73 CCCCCSC[C@@H](O)CC(=O)OCC 62a_100000688340_100000210326 [1,1,0,0,0,0|1,0,0]=3 8809 B14R0.73 CCCCOCCC(=O)CC(=O)OCC 1458a_100000243816_100000743108 [1,1,0,0,0,0|1,0,1]=4 8810 B14R0.73 CCCCOCCN(C)CC(=O)OCC 2230a_100000220588_100000743108 [1,1,0,0,0,0|2,0,0]=4 8811 B14R0.73 CCCCOCSC(C)CC(=O)OCC 62a_100009817359_100011995733 [1,1,0,0,0,0|2,0,0]=4 8812 B14R0.73 CCCCOCSC(C)CC(=O)OCC 62a_100011995733_100009817359 [1,1,0,0,0,0|2,0,0]=4 8813 B14R0.73 CCCOCCNC(C)CC(=O)OCC 2230a_100161115042_100009817359 [1,1,0,0,0,0|2,0,0]=4 8814 B14R0.73 CCCOCCOC(C)CC(=O)OCC 7a_100000752267_100009817359 [1,1,0,0,0,0|2,0,0]=4 8815 B14R0.73 CCCOCCO[C@H](C)CC(=O)OCC 7a_100009816390_100011215938 [1,1,0,0,0,0|2,0,0]=4 8816 B14R0.73 CCCOCCSC(C)CC(=O)OCC 62a_100009817359_100011215938 [1,1,0,0,0,0|2,0,0]=4 8817 B14R0.73 CCCOCCSC(C)CC(=O)OCC 62a_100011215938_100009817359 [1,1,0,0,0,0|2,0,0]=4 8818 B14R0.73 CCCSCCNC(C)CC(=O)OCC 2230a_100020603323_100009817359 [1,1,0,0,0,0|2,0,0]=4 8819 B14R0.73 CCCSCCOC(C)CC(=O)OCC 7a_200000230433_100009817359 [1,1,0,0,0,0|2,0,0]=4 8820 B14R0.73 CCOC(=O)CC(=O)CCCCCCF 1458a_100000243816_100015922095 [1,1,0,0,0,0|1,0,1]=4 8821 B14R0.73 CCOC(=O)CC(=O)CCCCCCO 1458a_100000243816_100000766143 [1,1,0,0,0,0|1,0,1]=4 8822 B14R0.73 CCOC(=O)CC(=O)CCCCCCO 1458a_100011996774_100000188475 [1,1,0,0,0,0|1,0,1]=4 8823 B14R0.73 CCOC(=O)CC(=O)CCCCCOC 1458a_100011935119_100000188475 [1,1,0,0,0,0|1,0,1]=4 8824 B14R0.73 CCOC(=O)CC(C)NCCCCCO 2230a_100000762737_100009817359 [1,1,0,0,0,0|2,0,0]=4 8825 B14R0.73 CCOC(=O)CC(C)OCCCCCBr 7a_100000746331_100009817359 [1,1,0,0,0,0|2,0,0]=4 8826 B14R0.73 CCOC(=O)CC(C)OCCCCCCl 7a_100000746330_100009817359 [1,1,0,0,0,0|2,0,0]=4 8827 B14R0.73 CCOC(=O)CC(C)OCCCCCI 7a_200012148887_100009817359 [1,1,0,0,0,0|2,0,0]=4 8828 B14R0.73 CCOC(=O)CC(C)OCCCCSC 7a_100011217163_100009817359 [1,1,0,0,0,0|2,0,0]=4 8829 B14R0.73 CCOC(=O)CC(C)OCCCSCC 7a_100011216438_100009817359 [1,1,0,0,0,0|2,0,0]=4 8830 B14R0.73 CCOC(=O)CC(C)SCCCCCF 62a_100000729378_100009817359 [1,1,0,0,0,0|2,0,0]=4 8831 B14R0.73 CCOC(=O)CC(C)SCCCCCF 62a_100009817359_100000729378 [1,1,0,0,0,0|2,0,0]=4 8832 B14R0.73 CCOC(=O)CC(C)SCCCCCO 62a_100000746330_100009817359 [1,1,0,0,0,0|2,0,0]=4 8833 B14R0.73 CCOC(=O)CC(C)SCCCCCO 62a_100009817359_100000746330 [1,1,0,0,0,0|2,0,0]=4 8834 B14R0.73 CCOC(=O)CC(C)SCCCCOC 62a_100000730899_100009817359 [1,1,0,0,0,0|2,0,0]=4 8835 B14R0.73 CCOC(=O)CC(C)SCCCCOC 62a_100009817359_100000730899 [1,1,0,0,0,0|2,0,0]=4 8836 B14R0.73 CCOC(=O)CN(C)CCCCCCF 2230a_100000220588_100015922095 [1,1,0,0,0,0|2,0,0]=4 8837 B14R0.73 CCOC(=O)CN(C)CCCCCCO 2230a_100000220588_100000766143 [1,1,0,0,0,0|2,0,0]=4 8838 B14R0.73 CCOC(=O)C[C@@H](C)OCCCCCF 7a_100009816390_100000729378 [1,1,0,0,0,0|2,0,0]=4 8839 B14R0.73 CCOC(=O)C[C@@H](C)OCCCCCO 7a_100009816390_100000746330 [1,1,0,0,0,0|2,0,0]=4 8840 B14R0.73 CCOC(=O)C[C@@H](C)OCCCCOC 7a_100009816390_100000730899 [1,1,0,0,0,0|2,0,0]=4 8841 B14R0.73 CCOC(=O)C[C@H](O)CNCCCCO 34a_100000750430_100000688340 [1,1,0,0,0,0|2,0,0]=4 8842 B14R0.73 CCOC(=O)C[C@H](O)CNCCCOC 34a_100150723488_100000688340 [1,1,0,0,0,0|2,0,0]=4 8843 B14R0.73 CCOC(=O)C[C@H](O)COCCCCBr 34a_100011216708_100000688340 [1,1,0,0,0,0|2,0,0]=4 8844 B14R0.73 CCOC(=O)C[C@H](O)COCCCCCl 34a_100000210776_100000688340 [1,1,0,0,0,0|2,0,0]=4 8845 B14R0.73 CCOC(=O)C[C@H](O)COCCCCCl 7a_100000210776_100000688340 [1,1,0,0,0,0|2,0,0]=4 8846 B14R0.73 CCOC(=O)C[C@H](O)COCCCCF 34a_100011995726_100000688340 [1,1,0,0,0,0|2,0,0]=4 8847 B14R0.73 CCOC(=O)C[C@H](O)COCCCCF 7a_100011995726_100000688340 [1,1,0,0,0,0|2,0,0]=4 8848 B14R0.73 CCOC(=O)C[C@H](O)COCCCCI 34a_200012148704_100000688340 [1,1,0,0,0,0|2,0,0]=4 8849 B14R0.73 CCOC(=O)C[C@H](O)COCCCCN 34a_100000750430_100000688340 [1,1,0,0,0,0|2,0,0]=4 8850 B14R0.73 CCOC(=O)C[C@H](O)COCCCNC 34a_100000213112_100000688340 [1,1,0,0,0,0|2,0,0]=4 8851 B14R0.73 CCOC(=O)C[C@H](O)COCCCOC 34a_100000740835_100000688340 [1,1,0,0,0,0|2,0,0]=4 8852 B14R0.73 CCOC(=O)C[C@H](O)COCCCSC 34a_100000690336_100000688340 [1,1,0,0,0,0|2,0,0]=4 8853 B14R0.73 CCOC(=O)C[C@H](O)COCCCSC 7a_100000690336_100000688340 [1,1,0,0,0,0|2,0,0]=4 8854 B14R0.73 CCOC(=O)C[C@H](O)COCCSCC 34a_100000212035_100000688340 [1,1,0,0,0,0|2,0,0]=4 8855 B14R0.73 CCOC(=O)C[C@H](O)COCCSCC 7a_100000212035_100000688340 [1,1,0,0,0,0|2,0,0]=4 8856 B14R0.73 CCOC(=O)C[C@H](O)CSCCCCF 62a_100000688340_100000729493 [1,1,0,0,0,0|2,0,0]=4 8857 B14R0.73 CCOC(=O)C[C@H](O)CSCCCCF 62a_100000729493_100000688340 [1,1,0,0,0,0|2,0,0]=4 8858 B14R0.73 CCOC(=O)C[C@H](O)CSCCCCO 62a_100000210776_100000688340 [1,1,0,0,0,0|2,0,0]=4 8859 B14R0.73 CCOC(=O)C[C@H](O)CSCCCCO 62a_100000688340_100000210776 [1,1,0,0,0,0|2,0,0]=4 8860 B14R0.73 CCOC(=O)C[C@H](O)CSCCCOC 62a_100000688340_100000709357 [1,1,0,0,0,0|2,0,0]=4 8861 B14R0.73 CCOC(=O)C[C@H](O)CSCCCOC 62a_100000709357_100000688340 [1,1,0,0,0,0|2,0,0]=4 8862 B14R0.73 CCOC(=O)C[C@H](O)CSCCSCC 62a_100000688340_100000757381 [1,1,0,0,0,0|2,0,0]=4 8863 B14R0.73 CCOC(=O)C[C@H](O)CSCCSCC 62a_100000757381_100000688340 [1,1,0,0,0,0|2,0,0]=4 8864 B14R0.73 CCOCCCNC(C)CC(=O)OCC 2230a_100000210961_100009817359 [1,1,0,0,0,0|2,0,0]=4 8865 B14R0.73 CCOCCCOC(C)CC(=O)OCC 7a_100000757476_100009817359 [1,1,0,0,0,0|2,0,0]=4 8866 B14R0.73 CCOCCCO[C@H](C)CC(=O)OCC 7a_100009816390_100012232248 [1,1,0,0,0,0|2,0,0]=4 8867 B14R0.73 CCOCCCSC(C)CC(=O)OCC 62a_100009817359_100012232248 [1,1,0,0,0,0|2,0,0]=4 8868 B14R0.73 CCOCCCSC(C)CC(=O)OCC 62a_100012232248_100009817359 [1,1,0,0,0,0|2,0,0]=4 8869 B14R0.73 CCOCCNC[C@@H](O)CC(=O)OCC 34a_102516460346_100000688340 [1,1,0,0,0,0|2,0,0]=4 8870 B14R0.73 CCOCCOC[C@@H](O)CC(=O)OCC 34a_100000210136_100000688340 [1,1,0,0,0,0|2,0,0]=4 8871 B14R0.73 CCOCCOC[C@@H](O)CC(=O)OCC 7a_100000210136_100000688340 [1,1,0,0,0,0|2,0,0]=4 8872 B14R0.73 CCOCCSC[C@@H](O)CC(=O)OCC 62a_100000210147_100000688340 [1,1,0,0,0,0|2,0,0]=4 8873 B14R0.73 CCOCCSC[C@@H](O)CC(=O)OCC 62a_100000688340_100011215890 [1,1,0,0,0,0|2,0,0]=4 8874 B14R0.83 C=C(COCCCCCC)C(=O)OCC 34a_100000210259_100000755967 [1,1,0,0,0,0|1,0,1]=4 8875 B14R0.83 C=C(COCCCCCC)C(=O)OCC 7a_100000210259_100000755967 [1,1,0,0,0,0|1,0,1]=4 8876 B14R0.83 C=C(CSCCCCCC)C(=O)OCC 62a_100000210314_100000755967 [1,1,0,0,0,0|1,0,1]=4 8877 B14R0.83 C=C(CSCCCCCC)C(=O)OCC 62a_100000755967_100000210757 [1,1,0,0,0,0|1,0,1]=4 8878 B14R0.83 CCCCCCCCC(=O)C(=O)NCC 1458a_200011297158_100000210759 [1,1,0,0,0,0|1,0,1]=4 8879 B14R0.83 CCCCCCCCC(O)C(=O)CCC 1458a_200011995895_100000210303 [1,1,0,0,0,0|1,0,0]=3 8880 B14R0.83 CCCCCCCCC(O)C(=O)CCF 1458a_200011995895_100011217306 [1,1,0,0,0,0|2,0,0]=4 8881 B14R0.83 CCCCCCCCC(O)C(=O)CCO 1458a_200011995895_100000211926 [1,1,0,0,0,0|2,0,0]=4 8882 B14R0.83 CCCCCCCCC(O)C(=O)NCC 240690a_100015525214_200011995895 [1,1,0,0,0,0|1,0,0]=3 8883 B14R0.83 CCCCCCCCC(O)C(=O)NNC 22a_100016993582_200011995895 [1,1,0,0,0,0|2,0,0]=4 8884 B14R0.83 CCCCCCCCN(C)C(=O)CCC 11a_100000207567_100000211992 [1,1,0,0,0,0|2,0,0]=4 8885 B14R0.83 CCCCCCCCN(C)C(=O)CCC 1626a_100000207567_100000211992 [1,1,0,0,0,0|2,0,0]=4 8886 B14R0.83 CCCCCCCCN(C)C(=O)CCC 240690a_100000207567_100000211992 [1,1,0,0,0,0|2,0,0]=4 8887 B14R0.83 CCCCCCCCN(C)C(=O)CCC 527a_100000207567_100000211992 [1,1,0,0,0,0|2,0,0]=4 8888 B14R0.83 CCCCCCCCN(C)C(=O)NCC 2708a_100015525214_100000207567 [1,1,0,0,0,0|2,0,0]=4 8889 B14R0.83 CCCCCCCCN(C)C(=O)NCC 273464a_100015525214_100000207567 [1,1,0,0,0,0|2,0,0]=4 8890 B14R0.83 CCCCCCCNC(=O)C(=O)OCC 11a_100000229938_100014798877 [1,1,0,0,0,0|1,0,1]=4 8891 B14R0.83 CCCCCCCNC(=O)C(=O)OCC 1626a_100000229938_100014798877 [1,1,0,0,0,0|1,0,1]=4 8892 B14R0.83 CCCCCCCNC(=O)C(=O)OCC 240690a_100000229938_100014798877 [1,1,0,0,0,0|1,0,1]=4 8893 B14R0.83 CCCCCCCNC(C)C(=O)NCC 2230a_100000229938_100000230173 [1,1,0,0,0,0|2,0,0]=4 8894 B14R0.83 CCCCCCCNC(C)C(=O)NCC 2230a_100000736553_100000210681 [1,1,0,0,0,0|2,0,0]=4 8895 B14R0.83 CCCCCCCNC(C)C(=O)NCC 34a_100000736553_100000210614 [1,1,0,0,0,0|2,0,0]=4 8896 B14R0.83 CCCCCCCNC(C)C(=O)OCC 2230a_100000229938_100011215307 [1,1,0,0,0,0|1,0,0]=3 8897 B14R0.83 CCCCCCCNC(F)C(=O)OCC 2230a_100000229938_100000760018 [1,1,0,0,0,0|1,0,0]=3 8898 B14R0.83 CCCCCCCN[C@@H](C)C(=O)SCC 2230a_100103168634_100000210681 [1,1,0,0,0,0|1,1,0]=4 8899 B14R0.83 CCCCCCCOC(C)C(=O)NCC 34a_100000210272_100000230173 [1,1,0,0,0,0|2,0,0]=4 8900 B14R0.83 CCCCCCCOC(C)C(=O)NCC 7a_100000210272_100000230173 [1,1,0,0,0,0|2,0,0]=4 8901 B14R0.83 CCCCCCCOC(C)C(=O)OCC 34a_100000210272_100011216346 [1,1,0,0,0,0|1,0,0]=3 8902 B14R0.83 CCCCCCCOC(C)C(=O)OCC 7a_100000210272_100011216346 [1,1,0,0,0,0|1,0,0]=3 8903 B14R0.83 CCCCCCCOC(F)C(=O)OCC 34a_100000210272_100000760018 [1,1,0,0,0,0|1,0,0]=3 8904 B14R0.83 CCCCCCCOC(F)C(=O)OCC 7a_100000210272_100000040065 [1,1,0,0,0,0|1,0,0]=3 8905 B14R0.83 CCCCCCCO[C@@H](C)C(=O)OCC 7a_100000751109_100000210614 [1,1,0,0,0,0|1,0,0]=3 8906 B14R0.83 CCCCCCCSC(C)C(=O)NCC 62a_100000210614_100000230173 [1,1,0,0,0,0|2,0,0]=4 8907 B14R0.83 CCCCCCCSC(C)C(=O)NCC 62a_100000230173_100000210316 [1,1,0,0,0,0|2,0,0]=4 8908 B14R0.83 CCCCCCCSC(C)C(=O)OCC 62a_100000210614_100011216346 [1,1,0,0,0,0|1,0,0]=3 8909 B14R0.83 CCCCCCCSC(C)C(=O)OCC 62a_100011216346_100000210316 [1,1,0,0,0,0|1,0,0]=3 8910 B14R0.83 CCCCCCCSC(F)C(=O)OCC 62a_100000210614_100000760018 [1,1,0,0,0,0|1,0,0]=3 8911 B14R0.83 CCCCCCCSC(F)C(=O)OCC 62a_100000760018_100000210316 [1,1,0,0,0,0|1,0,0]=3 8912 B14R0.83 CCCCCCSCC(=O)C(=O)OCC 62a_100000210314_100000211299 [1,1,0,0,0,0|1,0,1]=4 8913 B14R0.83 CCCCCCSCC(=O)C(=O)OCC 62a_100000211299_100000210757 [1,1,0,0,0,0|1,0,1]=4 8914 B14R0.83 CCCCOCCOC(C)C(=O)OCC 34a_100000210238_100011216346 [1,1,0,0,0,0|2,0,0]=4 8915 B14R0.83 CCCCOCCOC(C)C(=O)OCC 7a_100000210238_100011216346 [1,1,0,0,0,0|2,0,0]=4 8916 B14R0.83 CCCCOCCOC(F)C(=O)OCC 34a_100000210238_100000760018 [1,1,0,0,0,0|2,0,0]=4 8917 B14R0.83 CCCCOCCOC(F)C(=O)OCC 7a_100000210238_100000040065 [1,1,0,0,0,0|2,0,0]=4 8918 B14R0.83 CCCCOCCO[C@@H](C)C(=O)OCC 7a_100000751109_100000743108 [1,1,0,0,0,0|2,0,0]=4 8919 B14R0.83 CCCCOCCSC(C)C(=O)OCC 62a_100000743108_100011216346 [1,1,0,0,0,0|2,0,0]=4 8920 B14R0.83 CCCCOCCSC(C)C(=O)OCC 62a_100011216346_100000743108 [1,1,0,0,0,0|2,0,0]=4 8921 B14R0.83 CCCCOCCSC(F)C(=O)OCC 62a_100000743108_100000760018 [1,1,0,0,0,0|2,0,0]=4 8922 B14R0.83 CCCCOCCSC(F)C(=O)OCC 62a_100000760018_100000743108 [1,1,0,0,0,0|2,0,0]=4 8923 B14R0.83 CCCCSCCNC(C)C(=O)OCC 2230a_100025743550_100011215307 [1,1,0,0,0,0|2,0,0]=4 8924 B14R0.83 CCCCSCCNC(F)C(=O)OCC 2230a_100025743550_100000760018 [1,1,0,0,0,0|2,0,0]=4 8925 B14R0.83 CCCCSCCOC(C)C(=O)OCC 34a_200000230436_100011216346 [1,1,0,0,0,0|2,0,0]=4 8926 B14R0.83 CCCCSCCOC(C)C(=O)OCC 7a_200000230436_100011216346 [1,1,0,0,0,0|2,0,0]=4 8927 B14R0.83 CCCCSCCOC(F)C(=O)OCC 34a_200000230436_100000760018 [1,1,0,0,0,0|2,0,0]=4 8928 B14R0.83 CCCCSCCOC(F)C(=O)OCC 7a_200000230436_100000040065 [1,1,0,0,0,0|2,0,0]=4 8929 B14R0.83 CCCOCCCNC(C)C(=O)OCC 2230a_100011217757_100011215307 [1,1,0,0,0,0|2,0,0]=4 8930 B14R0.83 CCCOCCCNC(C)C(=O)OCC 34a_100011217757_100011216346 [1,1,0,0,0,0|2,0,0]=4 8931 B14R0.83 CCCOCCCNC(F)C(=O)OCC 2230a_100011217757_100000760018 [1,1,0,0,0,0|2,0,0]=4 8932 B14R0.83 CCCOCCCNC(F)C(=O)OCC 34a_100011217757_100000760018 [1,1,0,0,0,0|2,0,0]=4 8933 B14R0.83 CCNCCCCCC(=O)C(=O)OCC 2230a_100015525214_100000068741 [1,1,0,0,0,0|1,0,1]=4 8934 B14R0.83 CCOC(=O)C(=O)CCCCCSCC 62a_100000210202_100000068741 [1,1,0,0,0,0|1,0,1]=4 8935 B14R0.83 CCOC(=O)C(C)NCCCCCCO 2230a_100000686447_100011215307 [1,1,0,0,0,0|2,0,0]=4 8936 B14R0.83 CCOC(=O)C(C)NCCCCCCO 34a_100000686447_100011216346 [1,1,0,0,0,0|2,0,0]=4 8937 B14R0.83 CCOC(=O)C(C)NCCCCCOC 2230a_100000747528_100011215307 [1,1,0,0,0,0|2,0,0]=4 8938 B14R0.83 CCOC(=O)C(C)NCCCCCOC 34a_100000747528_100011216346 [1,1,0,0,0,0|2,0,0]=4 8939 B14R0.83 CCOC(=O)C(C)OCCCCCCBr 34a_100011215345_100011216346 [1,1,0,0,0,0|2,0,0]=4 8940 B14R0.83 CCOC(=O)C(C)OCCCCCCBr 7a_100011215345_100011216346 [1,1,0,0,0,0|2,0,0]=4 8941 B14R0.83 CCOC(=O)C(C)OCCCCCCCl 34a_100000766143_100011216346 [1,1,0,0,0,0|2,0,0]=4 8942 B14R0.83 CCOC(=O)C(C)OCCCCCCCl 7a_100000766143_100011216346 [1,1,0,0,0,0|2,0,0]=4 8943 B14R0.83 CCOC(=O)C(C)OCCCCCCF 34a_100000732779_100011216346 [1,1,0,0,0,0|2,0,0]=4 8944 B14R0.83 CCOC(=O)C(C)OCCCCCCF 7a_100000732779_100011216346 [1,1,0,0,0,0|2,0,0]=4 8945 B14R0.83 CCOC(=O)C(C)OCCCCCCN 34a_100000686447_100011216346 [1,1,0,0,0,0|2,0,0]=4 8946 B14R0.83 CCOC(=O)C(C)OCCCCCNC 34a_100000722520_100011216346 [1,1,0,0,0,0|2,0,0]=4 8947 B14R0.83 CCOC(=O)C(C)SCCCCCCF 62a_100011216346_100015922095 [1,1,0,0,0,0|2,0,0]=4 8948 B14R0.83 CCOC(=O)C(C)SCCCCCCF 62a_100015922095_100011216346 [1,1,0,0,0,0|2,0,0]=4 8949 B14R0.83 CCOC(=O)C(C)SCCCCCCO 62a_100000766143_100011216346 [1,1,0,0,0,0|2,0,0]=4 8950 B14R0.83 CCOC(=O)C(C)SCCCCCCO 62a_100011216346_100000766143 [1,1,0,0,0,0|2,0,0]=4 8951 B14R0.83 CCOC(=O)C(F)NCCCCCCO 2230a_100000686447_100000760018 [1,1,0,0,0,0|2,0,0]=4 8952 B14R0.83 CCOC(=O)C(F)NCCCCCCO 34a_100000686447_100000760018 [1,1,0,0,0,0|2,0,0]=4 8953 B14R0.83 CCOC(=O)C(F)NCCCCCOC 2230a_100000747528_100000760018 [1,1,0,0,0,0|2,0,0]=4 8954 B14R0.83 CCOC(=O)C(F)NCCCCCOC 34a_100000747528_100000760018 [1,1,0,0,0,0|2,0,0]=4 8955 B14R0.83 CCOC(=O)C(F)OCCCCCCBr 34a_100011215345_100000760018 [1,1,0,0,0,0|2,0,0]=4 8956 B14R0.83 CCOC(=O)C(F)OCCCCCCBr 7a_100011215345_100000040065 [1,1,0,0,0,0|2,0,0]=4 8957 B14R0.83 CCOC(=O)C(F)OCCCCCCCl 34a_100000766143_100000760018 [1,1,0,0,0,0|2,0,0]=4 8958 B14R0.83 CCOC(=O)C(F)OCCCCCCCl 7a_100000766143_100000040065 [1,1,0,0,0,0|2,0,0]=4 8959 B14R0.83 CCOC(=O)C(F)OCCCCCCF 34a_100000732779_100000760018 [1,1,0,0,0,0|2,0,0]=4 8960 B14R0.83 CCOC(=O)C(F)OCCCCCCF 7a_100000732779_100000040065 [1,1,0,0,0,0|2,0,0]=4 8961 B14R0.83 CCOC(=O)C(F)OCCCCCCN 34a_100000686447_100000760018 [1,1,0,0,0,0|2,0,0]=4 8962 B14R0.83 CCOC(=O)C(F)OCCCCCNC 34a_100000722520_100000760018 [1,1,0,0,0,0|2,0,0]=4 8963 B14R0.83 CCOC(=O)C(F)SCCCCCCF 62a_100000760018_100015922095 [1,1,0,0,0,0|2,0,0]=4 8964 B14R0.83 CCOC(=O)C(F)SCCCCCCF 62a_100015922095_100000760018 [1,1,0,0,0,0|2,0,0]=4 8965 B14R0.83 CCOC(=O)C(F)SCCCCCCO 62a_100000760018_100000766143 [1,1,0,0,0,0|2,0,0]=4 8966 B14R0.83 CCOC(=O)C(F)SCCCCCCO 62a_100000766143_100000760018 [1,1,0,0,0,0|2,0,0]=4 8967 B14R0.83 CCOC(=O)[C@H](C)OCCCCCCF 7a_100000751109_100015922095 [1,1,0,0,0,0|2,0,0]=4 8968 B14R0.83 CCOC(=O)[C@H](C)OCCCCCCO 7a_100000751109_100000766143 [1,1,0,0,0,0|2,0,0]=4 8969 B14R0.163 CCCCC(=O)CCCCC(=O)OCC 1458a_100000210183_100000750268 [1,1,0,0,0,0|0,0,1]=3 8970 B14R0.163 CCCCC(=O)CCCCC(=O)OCC 1458a_100011217402_100000210211 [1,1,0,0,0,0|0,0,1]=3 8971 B14R0.163 CCCCC(=O)CCOCC(=O)OCC 1458a_100000210183_100000088970 [1,1,0,0,0,0|1,0,1]=4 8972 B14R0.163 CCCCC(=O)NCCCC(=O)OCC 188690a_100000211256_100000210183 [1,1,0,0,0,0|1,0,1]=4 8973 B14R0.163 CCCCC(C)COCCC(=O)NCC 7a_100011995851_100000737597 [1,1,0,0,0,0|2,0,0]=4 8974 B14R0.163 CCCCC(C)COCCC(=O)OCC 34a_100011995851_100000765890 [1,1,0,0,0,0|1,0,0]=3 8975 B14R0.163 CCCCC(C)COCCC(=O)OCC 7a_100011995851_100011206558 [1,1,0,0,0,0|1,0,0]=3 8976 B14R0.163 CCCCC(C)NCCCC(=O)OCC 2230a_100000126638_100009991533 [1,1,0,0,0,0|1,0,0]=3 8977 B14R0.163 CCCCC(C)OCCCC(=O)OCC 34a_100000687866_100009991533 [1,1,0,0,0,0|1,0,0]=3 8978 B14R0.163 CCCCC(C)OCCCC(=O)OCC 7a_100000687866_100011215271 [1,1,0,0,0,0|1,0,0]=3 8979 B14R0.163 CCCCC(C)OCCCC(=O)OCC 7a_100012001163_200011215066 [1,1,0,0,0,0|1,0,0]=3 8980 B14R0.163 CCCCC(C)OCCNC(=O)OCC 34a_100000158857_200011215066 [1,1,0,0,0,0|2,0,0]=4 8981 B14R0.163 CCCCC(C)OCCNC(=O)OCC 7a_100000687866_200011445536 [1,1,0,0,0,0|2,0,0]=4 8982 B14R0.163 CCCCC(C)SCCCC(=O)OCC 62a_100009991533_200011215066 [1,1,0,0,0,0|1,0,0]=3 8983 B14R0.163 CCCCC(C)SCCCC(=O)OCC 62a_200011215066_100009991533 [1,1,0,0,0,0|1,0,0]=3 8984 B14R0.163 CCCCC(C)SCCNC(=O)OCC 62a_200011215066_200011445536 [1,1,0,0,0,0|2,0,0]=4 8985 B14R0.163 CCCCN(C)CCCCC(=O)OCC 2230a_100000207549_100000750268 [1,1,0,0,0,0|1,0,0]=3 8986 B14R0.163 CCCCN(C)CCCCC(=O)OCC 269982a_100000207549_100000750268 [1,1,0,0,0,0|1,0,0]=3 8987 B14R0.163 CCCCN(C)CCOCC(=O)OCC 2230a_100000207549_100000088970 [1,1,0,0,0,0|2,0,0]=4 8988 B14R0.163 CCCCN(C)CCOCC(=O)OCC 269982a_100000207549_100000088970 [1,1,0,0,0,0|2,0,0]=4 8989 B14R0.163 CCCC[C@H](N)COCCC(=O)OCC 34a_100011934283_100000765890 [1,1,0,0,0,0|1,0,0]=3 8990 B14R0.163 CCCNC(=O)CCCCC(=O)OCC 11a_100020643023_100011217402 [1,1,0,0,0,0|1,0,1]=4 8991 B14R0.163 CCCNC(=O)CCCCC(=O)OCC 1626a_100020643023_100011217402 [1,1,0,0,0,0|1,0,1]=4 8992 B14R0.163 CCCNC(=O)CCCCC(=O)OCC 240690a_100020643023_100011217402 [1,1,0,0,0,0|1,0,1]=4 8993 B14R0.163 CCCNC(=O)CCCCC(=O)OCC 527a_100020643023_100011217402 [1,1,0,0,0,0|1,0,1]=4 8994 B14R0.163 CCCOC(C)CNCCC(=O)OCC 2230a_100015185124_100011206558 [1,1,0,0,0,0|2,0,0]=4 8995 B14R0.163 CCCOC(C)CNCCC(=O)OCC 34a_100015185124_100000765890 [1,1,0,0,0,0|2,0,0]=4 8996 B14R0.163 CCOC(=O)CCCCC(=O)CCCF 1458a_100011217402_100011934791 [1,1,0,0,0,0|1,0,1]=4 8997 B14R0.163 CCOC(=O)CCCCC(=O)CCCO 1458a_100011217402_100011215043 [1,1,0,0,0,0|1,0,1]=4 8998 B14R0.163 CCOC(=O)CCCCC(=O)CCOC 1458a_100000749529_100000750268 [1,1,0,0,0,0|1,0,1]=4 8999 B14R0.163 CCOC(=O)CCCCC(=O)CCOC 1458a_100011217402_100000233755 [1,1,0,0,0,0|1,0,1]=4 9000 B14R0.163 CCOC(=O)CCCCC(=O)CCSC 1458a_100000174002_100000750268 [1,1,0,0,0,0|1,0,1]=4 9001 B14R0.163 CCOC(=O)CCCCC(=O)CCSC 1458a_100011217402_100000751147 [1,1,0,0,0,0|1,0,1]=4 9002 B14R0.163 CCOC(=O)CCCCC(=O)CSCC 1458a_100000230394_100000750268 [1,1,0,0,0,0|1,0,1]=4 9003 B14R0.163 CCOC(=O)CCCCN(C)CCCO 2230a_100000213112_100000750268 [1,1,0,0,0,0|2,0,0]=4 9004 B14R0.163 CCOC(=O)CCCCN(C)CCCO 269982a_100000213112_100000750268 [1,1,0,0,0,0|2,0,0]=4 9005 B14R0.163 CCOC(=O)CCCCN(C)CCOC 2230a_100000743101_100000750268 [1,1,0,0,0,0|2,0,0]=4 9006 B14R0.163 CCOC(=O)CCCCN(C)CCOC 269982a_100000743101_100000750268 [1,1,0,0,0,0|2,0,0]=4 9007 B14R0.163 CCOC(=O)CCCCN(C)CCSC 2230a_100000686725_100000750268 [1,1,0,0,0,0|2,0,0]=4 9008 B14R0.163 CCOC(=O)CCCCN(C)CCSC 269982a_100000686725_100000750268 [1,1,0,0,0,0|2,0,0]=4 9009 B14R0.163 CCOC(=O)CCCOC(C)CCCCl 34a_200000718107_100009991533 [1,1,0,0,0,0|2,0,0]=4 9010 B14R0.163 CCOC(=O)CCCOC(C)CCCCl 7a_200000718107_100011215271 [1,1,0,0,0,0|2,0,0]=4 9011 B14R0.163 CCOC(=O)CCNC[C@H](C)CCCO 2230a_100160569302_100011206558 [1,1,0,0,0,0|2,0,0]=4 9012 B14R0.163 CCOC(=O)CCNC[C@H](C)CCCO 34a_100160569302_100000765890 [1,1,0,0,0,0|2,0,0]=4 9013 B14R0.163 CCOC(=O)CCOC[C@@H](N)CCSC 34a_100011827619_100000765890 [1,1,0,0,0,0|2,0,0]=4 9014 B14R0.163 CCOCC(=O)CCCCC(=O)OCC 1458a_100000211967_100000750268 [1,1,0,0,0,0|1,0,1]=4 9015 B14R0.163 CCOCC(C)OCCCC(=O)OCC 34a_100000718985_100009991533 [1,1,0,0,0,0|2,0,0]=4 9016 B14R0.163 CCOCC(C)OCCCC(=O)OCC 7a_100000718985_100011215271 [1,1,0,0,0,0|2,0,0]=4 9017 B14R0.163 CCOCC(O)CNCCC(=O)OCC 2230a_102515437182_100011206558 [1,1,0,0,0,0|2,0,0]=4 9018 B14R0.163 CCOCC(O)CNCCC(=O)OCC 34a_102515437182_100000765890 [1,1,0,0,0,0|2,0,0]=4 9019 B14R0.181 C/C=C(\C)/C(=O)CCCCCCCCC 1458a_100020587367_100000210670 [1,1,0,0,0,0|1,0,1]=4 9020 B14R0.181 CCC(C)C(=O)CCCCCCCCO 1458a_100011192722_100000033203 [1,1,0,0,0,0|2,0,0]=4 9021 B14R0.181 CCC(O)C(=O)CCCCCCCCO 1458a_100011196387_100000033203 [1,1,0,0,0,0|2,0,0]=4 9022 B14R0.181 CCCCCCCCCC(=O)C(=O)NC 1458a_100011218921_100000210670 [1,1,0,0,0,0|2,0,0]=4 9023 B14R0.181 CCCCCCCCCC(=O)C(C)CC 1458a_100000210558_100000758301 [1,1,0,0,0,0|1,0,0]=3 9024 B14R0.181 CCCCCCCCCC(=O)C(C)CC 1458a_100011192722_100000210670 [1,1,0,0,0,0|1,0,0]=3 9025 B14R0.181 CCCCCCCCCC(=O)C(C)OC 1458a_100000743197_100000210670 [1,1,0,0,0,0|2,0,0]=4 9026 B14R0.181 CCCCCCCCCC(=O)C(C)SC 1458a_100000149566_100000210670 [1,1,0,0,0,0|2,0,0]=4 9027 B14R0.181 CCCCCCCCCC(=O)C(O)CC 1458a_100011196387_100000210670 [1,1,0,0,0,0|1,0,0]=3 9028 B14R0.181 CCCCCCCCCC(=O)C(O)CO 1458a_100011215603_100000210670 [1,1,0,0,0,0|2,0,0]=4 9029 B14R0.181 CCCCCCCCCC(=O)N(C)CC 11a_100000225621_100000210558 [1,1,0,0,0,0|1,0,0]=3 9030 B14R0.181 CCCCCCCCCC(=O)N(C)CC 1626a_100000225621_100000210558 [1,1,0,0,0,0|1,0,0]=3 9031 B14R0.181 CCCCCCCCCC(=O)N(C)CC 240690a_100000225621_100000210558 [1,1,0,0,0,0|1,0,0]=3 9032 B14R0.181 CCCCCCCCCC(=O)N(C)CC 527a_100000225621_100000210558 [1,1,0,0,0,0|1,0,0]=3 9033 B14R0.181 CCCCCCCCNC(=O)C(C)CC 11a_100000229939_100011192722 [1,1,0,0,0,0|2,0,0]=4 9034 B14R0.181 CCCCCCCCNC(=O)C(C)CC 1626a_100000229939_100011192722 [1,1,0,0,0,0|2,0,0]=4 9035 B14R0.181 CCCCCCCCNC(=O)C(C)CC 240690a_100000229939_100011192722 [1,1,0,0,0,0|2,0,0]=4 9036 B14R0.181 CCCCCCCCNC(=O)C(C)CC 527a_100000229939_100011192722 [1,1,0,0,0,0|2,0,0]=4 9037 B14R0.181 CCCCCCCCNC(=O)C(O)CC 240690a_100000229939_100011196387 [1,1,0,0,0,0|2,0,0]=4 9038 B14R0.181 CCCCCCCCNC(=O)N(C)CC 2708a_100000229939_100000225621 [1,1,0,0,0,0|2,0,0]=4 9039 B14R0.181 CCCCCCCCNC(=O)N(C)CC 273464a_100000229939_100000225621 [1,1,0,0,0,0|2,0,0]=4 9040 B14R0.181 CCCCCCCNCC(=O)N(C)CC 2230a_100000229938_100000738999 [1,1,0,0,0,0|2,0,0]=4 9041 B14R0.181 CCCCCCCOCC(=O)N(C)CC 34a_100000210272_100000738999 [1,1,0,0,0,0|2,0,0]=4 9042 B14R0.181 CCCCCCCOCC(=O)N(C)CC 7a_100000210272_100000738999 [1,1,0,0,0,0|2,0,0]=4 9043 B14R0.181 CCCCCCCSCC(=O)N(C)CC 62a_100000210614_100000738999 [1,1,0,0,0,0|2,0,0]=4 9044 B14R0.181 CCCCCCCSCC(=O)N(C)CC 62a_100000738999_100000210316 [1,1,0,0,0,0|2,0,0]=4 9045 B14R0.181 CCN(C)C(=O)CCCCCCCCO 240690a_100000225621_100000015970 [1,1,0,0,0,0|2,0,0]=4 9046 B14R0.199 CCCCCCC(=O)CCC(=O)NCC 1458a_100000199579_100000210757 [1,1,0,0,0,0|1,0,1]=4 9047 B14R0.199 CCCCCCC(=O)CCC(=O)OCC 1458a_100000183558_100000210757 [1,1,0,0,0,0|0,0,1]=3 9048 B14R0.199 CCCCCCC(=O)CNC(=O)OCC 1458a_100000190774_100000210757 [1,1,0,0,0,0|1,0,1]=4 9049 B14R0.199 CCCCCCC(=O)NCC(=O)OCC 188690a_100000741813_100102632555 [1,1,0,0,0,0|1,0,1]=4 9050 B14R0.199 CCCCCCC(C)NCC(=O)CCC 2230a_100000210919_100000747444 [1,1,0,0,0,0|2,0,0]=4 9051 B14R0.199 CCCCCCC(C)NCC(=O)NCC 2230a_100000210919_100000183381 [1,1,0,0,0,0|2,0,0]=4 9052 B14R0.199 CCCCCCC(C)NCC(=O)NCC 2230a_100016988866_100011215978 [1,1,0,0,0,0|2,0,0]=4 9053 B14R0.199 CCCCCCC(C)NCC(=O)NCC 270004a_100016988866_100000210826 [1,1,0,0,0,0|2,0,0]=4 9054 B14R0.199 CCCCCCC(C)NCC(=O)NCC 34a_100000210919_100000183381 [1,1,0,0,0,0|2,0,0]=4 9055 B14R0.199 CCCCCCC(C)NCC(=O)OCC 2230a_100000210919_100000188475 [1,1,0,0,0,0|1,0,0]=3 9056 B14R0.199 CCCCCCC(C)NCC(=O)OCC 34a_100000210919_100000188475 [1,1,0,0,0,0|1,0,0]=3 9057 B14R0.199 CCCCCCC(C)OCC(=O)CCC 7a_100000210265_100000747444 [1,1,0,0,0,0|2,0,0]=4 9058 B14R0.199 CCCCCCC(C)OCC(=O)NCC 34a_100000210265_100000183381 [1,1,0,0,0,0|2,0,0]=4 9059 B14R0.199 CCCCCCC(C)OCC(=O)NCC 7a_100000210265_100000183381 [1,1,0,0,0,0|2,0,0]=4 9060 B14R0.199 CCCCCCC(C)OCC(=O)OCC 34a_100000210265_100000188475 [1,1,0,0,0,0|1,0,0]=3 9061 B14R0.199 CCCCCCC(C)OCC(=O)OCC 7a_100000210265_100000188475 [1,1,0,0,0,0|1,0,0]=3 9062 B14R0.199 CCCCCCC(C)SCC(=O)CCC 62a_100000747444_100011215978 [1,1,0,0,0,0|2,0,0]=4 9063 B14R0.199 CCCCCCC(C)SCC(=O)CCC 62a_100011215978_100000747444 [1,1,0,0,0,0|2,0,0]=4 9064 B14R0.199 CCCCCCC(C)SCC(=O)NCC 62a_100000183381_100011215978 [1,1,0,0,0,0|2,0,0]=4 9065 B14R0.199 CCCCCCC(C)SCC(=O)NCC 62a_100011215978_100000183381 [1,1,0,0,0,0|2,0,0]=4 9066 B14R0.199 CCCCCCC(C)SCC(=O)OCC 62a_100000188475_100011215978 [1,1,0,0,0,0|1,0,0]=3 9067 B14R0.199 CCCCCCC(C)SCC(=O)OCC 62a_100011215978_100000188475 [1,1,0,0,0,0|1,0,0]=3 9068 B14R0.199 CCCCCCN(C)CCC(=O)NCC 2230a_106256046315_100000737597 [1,1,0,0,0,0|2,0,0]=4 9069 B14R0.199 CCCCCCN(C)CCC(=O)NCC 269982a_106256046315_100000737597 [1,1,0,0,0,0|2,0,0]=4 9070 B14R0.199 CCCCCCN(C)CCC(=O)OCC 2230a_100000745921_100000210314 [1,1,0,0,0,0|1,0,0]=3 9071 B14R0.199 CCCCCCN(C)CCC(=O)OCC 2230a_106256046315_100011206558 [1,1,0,0,0,0|1,0,0]=3 9072 B14R0.199 CCCCCCN(C)CCC(=O)OCC 269982a_100000745921_100000210757 [1,1,0,0,0,0|1,0,0]=3 9073 B14R0.199 CCCCCCN(C)CCC(=O)OCC 269982a_106256046315_100011206558 [1,1,0,0,0,0|1,0,0]=3 9074 B14R0.199 CCCCCNC(=O)CCC(=O)OCC 11a_100000209983_100000183558 [1,1,0,0,0,0|1,0,1]=4 9075 B14R0.199 CCCCCNC(=O)CCC(=O)OCC 1626a_100000209983_100000183558 [1,1,0,0,0,0|1,0,1]=4 9076 B14R0.199 CCCCCNC(=O)CCC(=O)OCC 240690a_100000209983_100000183558 [1,1,0,0,0,0|1,0,1]=4 9077 B14R0.199 CCCCCNC(C)CCC(=O)OCC 2230a_100000209983_100000748298 [1,1,0,0,0,0|1,0,0]=3 9078 B14R0.199 CCCCCOC(C)CCC(=O)OCC 34a_100000210253_100000748298 [1,1,0,0,0,0|1,0,0]=3 9079 B14R0.199 CCCCCOC(C)CCC(=O)OCC 7a_100000210253_100000748298 [1,1,0,0,0,0|1,0,0]=3 9080 B14R0.199 CCCCCSC(C)CCC(=O)OCC 62a_100000210326_100000748298 [1,1,0,0,0,0|1,0,0]=3 9081 B14R0.199 CCCCCSC(C)CCC(=O)OCC 62a_100000748298_100000210326 [1,1,0,0,0,0|1,0,0]=3 9082 B14R0.199 CCCCOCC(=O)CCC(=O)OCC 1458a_100000183558_100011995733 [1,1,0,0,0,0|1,0,1]=4 9083 B14R0.199 CCCCOCC(C)OCC(=O)OCC 34a_100011217071_100000188475 [1,1,0,0,0,0|2,0,0]=4 9084 B14R0.199 CCCCOCC(C)OCC(=O)OCC 7a_100011217071_100000188475 [1,1,0,0,0,0|2,0,0]=4 9085 B14R0.199 CCCCOCN(C)CCC(=O)OCC 2230a_100000745921_100011995733 [1,1,0,0,0,0|2,0,0]=4 9086 B14R0.199 CCCCOCN(C)CCC(=O)OCC 269982a_100000745921_100011995733 [1,1,0,0,0,0|2,0,0]=4 9087 B14R0.199 CCCOCCC(=O)CCC(=O)OCC 1458a_100000183558_100011215938 [1,1,0,0,0,0|1,0,1]=4 9088 B14R0.199 CCCOCCN(C)CCC(=O)OCC 2230a_100000745921_100011215938 [1,1,0,0,0,0|2,0,0]=4 9089 B14R0.199 CCCOCCN(C)CCC(=O)OCC 269982a_100000745921_100011215938 [1,1,0,0,0,0|2,0,0]=4 9090 B14R0.199 CCOC(=O)CCC(=O)CCCCCF 1458a_100000183558_100000729378 [1,1,0,0,0,0|1,0,1]=4 9091 B14R0.199 CCOC(=O)CCC(=O)CCCCCO 1458a_100000183558_100000746330 [1,1,0,0,0,0|1,0,1]=4 9092 B14R0.199 CCOC(=O)CCC(=O)CCCCOC 1458a_100000183558_100000755781 [1,1,0,0,0,0|1,0,1]=4 9093 B14R0.199 CCOC(=O)CCC(C)NCCCCO 2230a_100000750430_100000748298 [1,1,0,0,0,0|2,0,0]=4 9094 B14R0.199 CCOC(=O)CCC(C)NCCCCO 34a_100000750430_100000748298 [1,1,0,0,0,0|2,0,0]=4 9095 B14R0.199 CCOC(=O)CCC(C)NCCCOC 34a_100150723488_100000748298 [1,1,0,0,0,0|2,0,0]=4 9096 B14R0.199 CCOC(=O)CCC(C)NCCCSC 2230a_100000749238_100000748298 [1,1,0,0,0,0|2,0,0]=4 9097 B14R0.199 CCOC(=O)CCC(C)NCCSCC 2230a_100000106463_100000748298 [1,1,0,0,0,0|2,0,0]=4 9098 B14R0.199 CCOC(=O)CCC(C)OCCCCBr 34a_100011216708_100000748298 [1,1,0,0,0,0|2,0,0]=4 9099 B14R0.199 CCOC(=O)CCC(C)OCCCCCl 34a_100000210776_100000748298 [1,1,0,0,0,0|2,0,0]=4 9100 B14R0.199 CCOC(=O)CCC(C)OCCCCCl 7a_100000210776_100000748298 [1,1,0,0,0,0|2,0,0]=4 9101 B14R0.199 CCOC(=O)CCC(C)OCCCCF 34a_100011995726_100000748298 [1,1,0,0,0,0|2,0,0]=4 9102 B14R0.199 CCOC(=O)CCC(C)OCCCCF 7a_100011995726_100000748298 [1,1,0,0,0,0|2,0,0]=4 9103 B14R0.199 CCOC(=O)CCC(C)OCCCCI 34a_200012148704_100000748298 [1,1,0,0,0,0|2,0,0]=4 9104 B14R0.199 CCOC(=O)CCC(C)OCCCCN 34a_100000750430_100000748298 [1,1,0,0,0,0|2,0,0]=4 9105 B14R0.199 CCOC(=O)CCC(C)OCCCNC 34a_100000213112_100000748298 [1,1,0,0,0,0|2,0,0]=4 9106 B14R0.199 CCOC(=O)CCC(C)OCCCOC 34a_100000740835_100000748298 [1,1,0,0,0,0|2,0,0]=4 9107 B14R0.199 CCOC(=O)CCC(C)OCCCSC 34a_100000690336_100000748298 [1,1,0,0,0,0|2,0,0]=4 9108 B14R0.199 CCOC(=O)CCC(C)OCCCSC 7a_100000690336_100000748298 [1,1,0,0,0,0|2,0,0]=4 9109 B14R0.199 CCOC(=O)CCC(C)OCCSCC 34a_100000212035_100000748298 [1,1,0,0,0,0|2,0,0]=4 9110 B14R0.199 CCOC(=O)CCC(C)OCCSCC 7a_100000212035_100000748298 [1,1,0,0,0,0|2,0,0]=4 9111 B14R0.199 CCOC(=O)CCC(C)SCCCCF 62a_100000729493_100000748298 [1,1,0,0,0,0|2,0,0]=4 9112 B14R0.199 CCOC(=O)CCC(C)SCCCCF 62a_100000748298_100000729493 [1,1,0,0,0,0|2,0,0]=4 9113 B14R0.199 CCOC(=O)CCC(C)SCCCCO 62a_100000210776_100000748298 [1,1,0,0,0,0|2,0,0]=4 9114 B14R0.199 CCOC(=O)CCC(C)SCCCCO 62a_100000748298_100000210776 [1,1,0,0,0,0|2,0,0]=4 9115 B14R0.199 CCOC(=O)CCC(C)SCCCOC 62a_100000709357_100000748298 [1,1,0,0,0,0|2,0,0]=4 9116 B14R0.199 CCOC(=O)CCC(C)SCCCOC 62a_100000748298_100000709357 [1,1,0,0,0,0|2,0,0]=4 9117 B14R0.199 CCOC(=O)CCC(C)SCCSCC 62a_100000748298_100000757381 [1,1,0,0,0,0|2,0,0]=4 9118 B14R0.199 CCOC(=O)CCC(C)SCCSCC 62a_100000757381_100000748298 [1,1,0,0,0,0|2,0,0]=4 9119 B14R0.199 CCOC(=O)CCN(C)CCCCCF 2230a_100000745921_100000729378 [1,1,0,0,0,0|2,0,0]=4 9120 B14R0.199 CCOC(=O)CCN(C)CCCCCF 269982a_100000745921_100000729378 [1,1,0,0,0,0|2,0,0]=4 9121 B14R0.199 CCOC(=O)CCN(C)CCCCCO 2230a_100000722520_100011206558 [1,1,0,0,0,0|2,0,0]=4 9122 B14R0.199 CCOC(=O)CCN(C)CCCCCO 2230a_100000745921_100000746330 [1,1,0,0,0,0|2,0,0]=4 9123 B14R0.199 CCOC(=O)CCN(C)CCCCCO 269982a_100000722520_100011206558 [1,1,0,0,0,0|2,0,0]=4 9124 B14R0.199 CCOC(=O)CCN(C)CCCCCO 269982a_100000745921_100000746330 [1,1,0,0,0,0|2,0,0]=4 9125 B14R0.199 CCOC(=O)CCN(C)CCCCOC 2230a_100000745921_100000730899 [1,1,0,0,0,0|2,0,0]=4 9126 B14R0.199 CCOC(=O)CCN(C)CCCCOC 269982a_100000745921_100000730899 [1,1,0,0,0,0|2,0,0]=4 9127 B14R0.199 CCOCCCC(=O)CCC(=O)OCC 1458a_100000183558_100012232248 [1,1,0,0,0,0|1,0,1]=4 9128 B14R0.199 CCOCCCN(C)CCC(=O)OCC 2230a_100000745921_100012232248 [1,1,0,0,0,0|2,0,0]=4 9129 B14R0.199 CCOCCCN(C)CCC(=O)OCC 269982a_100000745921_100012232248 [1,1,0,0,0,0|2,0,0]=4 9130 B14R0.199 CCOCCNC(C)CCC(=O)OCC 2230a_102516460346_100000748298 [1,1,0,0,0,0|2,0,0]=4 9131 B14R0.199 CCOCCNC(C)CCC(=O)OCC 34a_102516460346_100000748298 [1,1,0,0,0,0|2,0,0]=4 9132 B14R0.199 CCOCCOC(C)CCC(=O)OCC 34a_100000210136_100000748298 [1,1,0,0,0,0|2,0,0]=4 9133 B14R0.199 CCOCCOC(C)CCC(=O)OCC 7a_100000210136_100000748298 [1,1,0,0,0,0|2,0,0]=4 9134 B14R0.199 CCOCCSC(C)CCC(=O)OCC 62a_100000210147_100000748298 [1,1,0,0,0,0|2,0,0]=4 9135 B14R0.199 CCOCCSC(C)CCC(=O)OCC 62a_100000748298_100011215890 [1,1,0,0,0,0|2,0,0]=4 9136 B14R0.391 C=C(C)CC(=O)CCCCCCCCC 1458a_100000210558_100000748629 [1,1,0,0,0,0|1,0,1]=4 9137 B14R0.391 CC(C)CC(=O)CCCCCCCCO 1458a_100000210554_100000033203 [1,1,0,0,0,0|2,0,0]=4 9138 B14R0.391 CC(C)NC(=O)CCCCCCCCO 240690a_100138425928_100000015970 [1,1,0,0,0,0|2,0,0]=4 9139 B14R0.391 CC(C)OC(=O)CCCCCNCCF 34a_100000724931_200010986244 [1,1,0,0,0,0|2,0,0]=4 9140 B14R0.391 CC(C)OC(=O)CCCCCNCCO 2230a_100016997473_200010986244 [1,1,0,0,0,0|2,0,0]=4 9141 B14R0.391 CC(C)OC(=O)CCCCCNCCO 34a_100016990907_200010986244 [1,1,0,0,0,0|2,0,0]=4 9142 B14R0.391 CC(C)OC(=O)CCCCCOCCBr 34a_100000211926_200010986244 [1,1,0,0,0,0|2,0,0]=4 9143 B14R0.391 CC(C)OC(=O)CCCCCOCCN 34a_100000210304_200010986244 [1,1,0,0,0,0|2,0,0]=4 9144 B14R0.391 CC(C)OC(=O)CCCCCSCCF 62a_100011217306_200010986244 [1,1,0,0,0,0|2,0,0]=4 9145 B14R0.391 CC(C)OC(=O)CCCCCSCCF 62a_200010986244_100011217306 [1,1,0,0,0,0|2,0,0]=4 9146 B14R0.391 CC(C)OC(=O)CCCCCSCCO 62a_100000211926_200010986244 [1,1,0,0,0,0|2,0,0]=4 9147 B14R0.391 CC(C)OC(=O)CCCCCSCCO 62a_200010986244_100000211926 [1,1,0,0,0,0|2,0,0]=4 9148 B14R0.391 CC(C)OC(=O)CCNCCCCCO 2230a_100000762737_100000760027 [1,1,0,0,0,0|2,0,0]=4 9149 B14R0.391 CC(C)OC(=O)CCOCCCCCBr 7a_100000746331_100000760027 [1,1,0,0,0,0|2,0,0]=4 9150 B14R0.391 CC(C)OC(=O)CCOCCCCCCl 7a_100000746330_100000760027 [1,1,0,0,0,0|2,0,0]=4 9151 B14R0.391 CC(C)OC(=O)CCOCCCCCI 7a_200012148887_100000760027 [1,1,0,0,0,0|2,0,0]=4 9152 B14R0.391 CC(C)OC(=O)CCSCCCCCF 62a_100000729378_100000760027 [1,1,0,0,0,0|2,0,0]=4 9153 B14R0.391 CC(C)OC(=O)CCSCCCCCF 62a_100000760027_100000729378 [1,1,0,0,0,0|2,0,0]=4 9154 B14R0.391 CC(C)OC(=O)CCSCCCCCO 62a_100000746330_100000760027 [1,1,0,0,0,0|2,0,0]=4 9155 B14R0.391 CC(C)OC(=O)CCSCCCCCO 62a_100000760027_100000746330 [1,1,0,0,0,0|2,0,0]=4 9156 B14R0.391 CC(C)OC(=O)CNCCCCCCO 2230a_100000686447_100011215430 [1,1,0,0,0,0|2,0,0]=4 9157 B14R0.391 CC(C)OC(=O)CNCCCCCCO 34a_100000686447_100011215430 [1,1,0,0,0,0|2,0,0]=4 9158 B14R0.391 CC(C)OC(=O)COCCCCCCBr 34a_100011215345_100011215430 [1,1,0,0,0,0|2,0,0]=4 9159 B14R0.391 CC(C)OC(=O)COCCCCCCBr 7a_100011215345_100011215430 [1,1,0,0,0,0|2,0,0]=4 9160 B14R0.391 CC(C)OC(=O)COCCCCCCCl 34a_100000766143_100011215430 [1,1,0,0,0,0|2,0,0]=4 9161 B14R0.391 CC(C)OC(=O)COCCCCCCCl 7a_100000766143_100011215430 [1,1,0,0,0,0|2,0,0]=4 9162 B14R0.391 CC(C)OC(=O)COCCCCCCF 34a_100000732779_100011215430 [1,1,0,0,0,0|2,0,0]=4 9163 B14R0.391 CC(C)OC(=O)COCCCCCCF 7a_100000732779_100011215430 [1,1,0,0,0,0|2,0,0]=4 9164 B14R0.391 CC(C)OC(=O)COCCCCCCN 34a_100000686447_100011215430 [1,1,0,0,0,0|2,0,0]=4 9165 B14R0.391 CC(C)OC(=O)CSCCCCCCF 62a_100011215430_100015922095 [1,1,0,0,0,0|2,0,0]=4 9166 B14R0.391 CC(C)OC(=O)CSCCCCCCF 62a_100015922095_100011215430 [1,1,0,0,0,0|2,0,0]=4 9167 B14R0.391 CC(C)OC(=O)CSCCCCCCO 62a_100000766143_100011215430 [1,1,0,0,0,0|2,0,0]=4 9168 B14R0.391 CC(C)OC(=O)CSCCCCCCO 62a_100011215430_100000766143 [1,1,0,0,0,0|2,0,0]=4 9169 B14R0.391 CCCCCCCCCC(=O)C=C(C)C 1458a_100000211388_100000210670 [1,1,0,0,0,0|1,0,1]=4 9170 B14R0.391 CCCCCCCCCC(=O)C=C(C)Cl 1458a_200042562850_100000210670 [1,1,0,0,0,0|1,0,1]=4 9171 B14R0.391 CCCCCCCCCC(=O)CC(C)C 1458a_100000210554_100000210670 [1,1,0,0,0,0|1,0,0]=3 9172 B14R0.391 CCCCCCCCCC(=O)CC(C)C 1458a_100000210558_100000210624 [1,1,0,0,0,0|1,0,0]=3 9173 B14R0.391 CCCCCCCCCC(=O)CC(C)O 1458a_100000210558_100011218427 [1,1,0,0,0,0|1,0,0]=3 9174 B14R0.391 CCCCCCCCCC(=O)CC(F)F 1458a_100000210558_100011934356 [1,1,0,0,0,0|2,0,0]=4 9175 B14R0.391 CCCCCCCCCC(=O)CN(C)C 1458a_100000750896_100000210670 [1,1,0,0,0,0|2,0,0]=4 9176 B14R0.391 CCCCCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100000210670 [1,1,0,0,0,0|1,0,0]=3 9177 B14R0.391 CCCCCCCCCC(=O)C[S+](C)C 1458a_200159257847_100000210670 [1,1,0,0,0,0|2,0,0]=4 9178 B14R0.391 CCCCCCCCCC(=O)NC(C)C 11a_100138425928_100000210558 [1,1,0,0,0,0|1,0,0]=3 9179 B14R0.391 CCCCCCCCCC(=O)NC(C)C 1626a_100138425928_100000210558 [1,1,0,0,0,0|1,0,0]=3 9180 B14R0.391 CCCCCCCCCC(=O)NC(C)C 240690a_100138425928_100000210558 [1,1,0,0,0,0|1,0,0]=3 9181 B14R0.391 CCCCCCCCCC(=O)NC(C)C 527a_100138425928_100000210558 [1,1,0,0,0,0|1,0,0]=3 9182 B14R0.391 CCCCCCCCCC(C)OC(C)C 34a_100011218016_100000210206 [1,1,0,0,0,0|1,0,1]=4 9183 B14R0.391 CCCCCCCCCC(C)OC(C)C 7a_100011218016_100000210206 [1,1,0,0,0,0|1,0,1]=4 9184 B14R0.391 CCCCCCCCNC(=O)CC(C)C 11a_100000229939_100000210554 [1,1,0,0,0,0|2,0,0]=4 9185 B14R0.391 CCCCCCCCNC(=O)CC(C)C 1626a_100000229939_100000210554 [1,1,0,0,0,0|2,0,0]=4 9186 B14R0.391 CCCCCCCCNC(=O)CC(C)C 240690a_100000229939_100000210554 [1,1,0,0,0,0|2,0,0]=4 9187 B14R0.391 CCCCCCCCNC(=O)CC(C)C 527a_100000229939_100000210554 [1,1,0,0,0,0|2,0,0]=4 9188 B14R0.391 CCCCCCCCNC(=O)C[C@@H](C)O 240690a_100000229939_100011933948 [1,1,0,0,0,0|2,0,0]=4 9189 B14R0.391 CCCCCCCCNC(=O)NC(C)C 2708a_100000229939_100138425928 [1,1,0,0,0,0|2,0,0]=4 9190 B14R0.391 CCCCCCCCNC(=O)NC(C)C 2708a_100138425928_100000229939 [1,1,0,0,0,0|2,0,0]=4 9191 B14R0.391 CCCCCCCCNC(=O)NC(C)C 273464a_100138425928_100000229939 [1,1,0,0,0,0|2,0,0]=4 9192 B14R0.391 CCCCCCCCNC(=O)NC(C)C 512a_100000229939_100138425928 [1,1,0,0,0,0|2,0,0]=4 9193 B14R0.391 CCCCCCCCNC(=O)NC(C)C 512a_100138425928_100000229939 [1,1,0,0,0,0|2,0,0]=4 9194 B14R0.391 CCCCCCCNCC(=O)NC(C)C 2230a_100000168517_100000210681 [1,1,0,0,0,0|2,0,0]=4 9195 B14R0.391 CCCCCCCNCC(=O)NC(C)C 2230a_100000229938_100000183996 [1,1,0,0,0,0|2,0,0]=4 9196 B14R0.391 CCCCCCCNCC(=O)OC(C)C 2230a_100000229938_100011215430 [1,1,0,0,0,0|1,0,0]=3 9197 B14R0.391 CCCCCCCOCC(=O)NC(C)C 34a_100000210272_100000183996 [1,1,0,0,0,0|2,0,0]=4 9198 B14R0.391 CCCCCCCOCC(=O)NC(C)C 7a_100000210272_100000183996 [1,1,0,0,0,0|2,0,0]=4 9199 B14R0.391 CCCCCCCOCC(=O)OC(C)C 34a_100000210272_100011215430 [1,1,0,0,0,0|1,0,0]=3 9200 B14R0.391 CCCCCCCOCC(=O)OC(C)C 7a_100000210272_100011215430 [1,1,0,0,0,0|1,0,0]=3 9201 B14R0.391 CCCCCCCSCC(=O)NC(C)C 62a_100000183996_100000210316 [1,1,0,0,0,0|2,0,0]=4 9202 B14R0.391 CCCCCCCSCC(=O)NC(C)C 62a_100000210614_100000183996 [1,1,0,0,0,0|2,0,0]=4 9203 B14R0.391 CCCCCCCSCC(=O)OC(C)C 62a_100000210614_100011215430 [1,1,0,0,0,0|1,0,0]=3 9204 B14R0.391 CCCCCCCSCC(=O)OC(C)C 62a_100011215430_100000210316 [1,1,0,0,0,0|1,0,0]=3 9205 B14R0.391 CCCCCCNCCC(=O)NC(C)C 2230a_100000210581_100000737564 [1,1,0,0,0,0|2,0,0]=4 9206 B14R0.391 CCCCCCNCCC(=O)OC(C)C 2230a_100000210581_100000760027 [1,1,0,0,0,0|1,0,0]=3 9207 B14R0.391 CCCCCCOCCC(=O)NC(C)C 7a_100000210259_100000737564 [1,1,0,0,0,0|2,0,0]=4 9208 B14R0.391 CCCCCCOCCC(=O)OC(C)C 7a_100000210259_100000760027 [1,1,0,0,0,0|1,0,0]=3 9209 B14R0.391 CCCCCCSCCC(=O)NC(C)C 62a_100000210314_100000737564 [1,1,0,0,0,0|2,0,0]=4 9210 B14R0.391 CCCCCCSCCC(=O)NC(C)C 62a_100000737564_100000210757 [1,1,0,0,0,0|2,0,0]=4 9211 B14R0.391 CCCCCCSCCC(=O)OC(C)C 62a_100000210314_100000760027 [1,1,0,0,0,0|1,0,0]=3 9212 B14R0.391 CCCCCCSCCC(=O)OC(C)C 62a_100000760027_100000210757 [1,1,0,0,0,0|1,0,0]=3 9213 B14R0.391 CCCCCCSCOC(=O)OC(C)C 62a_100000003507_100000210757 [1,1,0,0,0,0|2,0,0]=4 9214 B14R0.391 CCCCCCSCOC(=O)OC(C)C 62a_100000210314_100000003507 [1,1,0,0,0,0|2,0,0]=4 9215 B14R0.391 CCCCOCCOCC(=O)OC(C)C 34a_100000210238_100011215430 [1,1,0,0,0,0|2,0,0]=4 9216 B14R0.391 CCCCOCCOCC(=O)OC(C)C 7a_100000210238_100011215430 [1,1,0,0,0,0|2,0,0]=4 9217 B14R0.391 CCCCOCCSCC(=O)OC(C)C 62a_100000743108_100011215430 [1,1,0,0,0,0|2,0,0]=4 9218 B14R0.391 CCCCOCCSCC(=O)OC(C)C 62a_100011215430_100000743108 [1,1,0,0,0,0|2,0,0]=4 9219 B14R0.391 CCCCOCSCCC(=O)OC(C)C 62a_100000760027_100011995733 [1,1,0,0,0,0|2,0,0]=4 9220 B14R0.391 CCCCOCSCCC(=O)OC(C)C 62a_100011995733_100000760027 [1,1,0,0,0,0|2,0,0]=4 9221 B14R0.391 CCCCSCCNCC(=O)OC(C)C 2230a_100025743550_100011215430 [1,1,0,0,0,0|2,0,0]=4 9222 B14R0.391 CCCCSCCOCC(=O)OC(C)C 34a_200000230436_100011215430 [1,1,0,0,0,0|2,0,0]=4 9223 B14R0.391 CCCCSCCOCC(=O)OC(C)C 7a_200000230436_100011215430 [1,1,0,0,0,0|2,0,0]=4 9224 B14R0.391 CCCOCCCCCC(=O)OC(C)C 34a_100000210258_200010986244 [1,1,0,0,0,0|1,0,0]=3 9225 B14R0.391 CCCOCCCNCC(=O)OC(C)C 2230a_100011217757_100011215430 [1,1,0,0,0,0|2,0,0]=4 9226 B14R0.391 CCCOCCCNCC(=O)OC(C)C 34a_100011217757_100011215430 [1,1,0,0,0,0|2,0,0]=4 9227 B14R0.391 CCCOCCNCCC(=O)OC(C)C 2230a_100161115042_100000760027 [1,1,0,0,0,0|2,0,0]=4 9228 B14R0.391 CCCOCCOCCC(=O)OC(C)C 7a_100000752267_100000760027 [1,1,0,0,0,0|2,0,0]=4 9229 B14R0.391 CCCOCCSCCC(=O)OC(C)C 62a_100000760027_100011215938 [1,1,0,0,0,0|2,0,0]=4 9230 B14R0.391 CCCOCCSCCC(=O)OC(C)C 62a_100011215938_100000760027 [1,1,0,0,0,0|2,0,0]=4 9231 B14R0.391 CCCSCCCCCC(=O)OC(C)C 62a_100000210303_200010986244 [1,1,0,0,0,0|1,0,0]=3 9232 B14R0.391 CCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000210303 [1,1,0,0,0,0|1,0,0]=3 9233 B14R0.391 CCCSCCNCCC(=O)OC(C)C 2230a_100020603323_100000760027 [1,1,0,0,0,0|2,0,0]=4 9234 B14R0.391 CCCSCCOCCC(=O)OC(C)C 7a_200000230433_100000760027 [1,1,0,0,0,0|2,0,0]=4 9235 B14R0.391 CCOCCCNCCC(=O)OC(C)C 2230a_100000210961_100000760027 [1,1,0,0,0,0|2,0,0]=4 9236 B14R0.391 CCOCCCOCCC(=O)OC(C)C 7a_100000757476_100000760027 [1,1,0,0,0,0|2,0,0]=4 9237 B14R0.391 CCOCCCSCCC(=O)OC(C)C 62a_100000760027_100012232248 [1,1,0,0,0,0|2,0,0]=4 9238 B14R0.391 CCOCCCSCCC(=O)OC(C)C 62a_100012232248_100000760027 [1,1,0,0,0,0|2,0,0]=4 9239 B14R0.391 CCSCCCOCCC(=O)OC(C)C 7a_100011216438_100000760027 [1,1,0,0,0,0|2,0,0]=4 9240 B14R0.391 CNCCCCCOCC(=O)OC(C)C 34a_100000722520_100011215430 [1,1,0,0,0,0|2,0,0]=4 9241 B14R0.391 COCCCCCNCC(=O)OC(C)C 2230a_100000747528_100011215430 [1,1,0,0,0,0|2,0,0]=4 9242 B14R0.391 COCCCCCNCC(=O)OC(C)C 34a_100000747528_100011215430 [1,1,0,0,0,0|2,0,0]=4 9243 B14R0.391 COCCCCSCCC(=O)OC(C)C 62a_100000730899_100000760027 [1,1,0,0,0,0|2,0,0]=4 9244 B14R0.391 COCCCCSCCC(=O)OC(C)C 62a_100000760027_100000730899 [1,1,0,0,0,0|2,0,0]=4 9245 B14R0.391 COCSCCCCCC(=O)OC(C)C 62a_100000766300_200010986244 [1,1,0,0,0,0|2,0,0]=4 9246 B14R0.391 COCSCCCCCC(=O)OC(C)C 62a_200010986244_100000766300 [1,1,0,0,0,0|2,0,0]=4 9247 B14R0.391 CSCCCCOCCC(=O)OC(C)C 7a_100011217163_100000760027 [1,1,0,0,0,0|2,0,0]=4 9248 B14R0.391 CSCSCCCCCC(=O)OC(C)C 62a_100011218213_200010986244 [1,1,0,0,0,0|2,0,0]=4 9249 B14R0.391 CSCSCCCCCC(=O)OC(C)C 62a_200010986244_100011218213 [1,1,0,0,0,0|2,0,0]=4 9250 B14R0.391 C[C@@H](O)CC(=O)CCCCCCCCO 1458a_100011933948_100000033203 [1,1,0,0,0,0|2,0,0]=4 9251 B14R0.432 C=C(C)CCOCCCCC(=O)OCC 34a_100000764851_100000750268 [1,1,0,0,0,0|1,0,1]=4 9252 B14R0.432 C=C(C)CCSCCCCC(=O)OCC 62a_100000730704_100000750268 [1,1,0,0,0,0|1,0,1]=4 9253 B14R0.432 C=C(C)CCSCCCCC(=O)OCC 62a_100000750268_100000730704 [1,1,0,0,0,0|1,0,1]=4 9254 B14R0.432 C=C(C)COCCCCCC(=O)OCC 34a_100000210245_100000755133 [1,1,0,0,0,0|1,0,1]=4 9255 B14R0.432 C=C(C)COCCCCCC(=O)OCC 7a_100011214988_100000748629 [1,1,0,0,0,0|1,0,1]=4 9256 B14R0.432 C=C(C)CSCCCCCC(=O)OCC 62a_100000748629_100000755133 [1,1,0,0,0,0|1,0,1]=4 9257 B14R0.432 C=C(C)CSCCCCCC(=O)OCC 62a_100000755133_100000211660 [1,1,0,0,0,0|1,0,1]=4 9258 B14R0.432 CCCC(=O)CNCCCCCC(C)C 2230a_100011290863_100000747444 [1,1,0,0,0,0|2,0,0]=4 9259 B14R0.432 CCCC(=O)COCCCCCC(C)C 7a_100011995859_100000747444 [1,1,0,0,0,0|2,0,0]=4 9260 B14R0.432 CCCC(=O)CSCCCCCC(C)C 62a_100000210682_100000747444 [1,1,0,0,0,0|2,0,0]=4 9261 B14R0.432 CCCC(=O)CSCCCCCC(C)C 62a_100000747444_100000210682 [1,1,0,0,0,0|2,0,0]=4 9262 B14R0.432 CCCC(=O)NCCCCCCC(C)C 11a_100000211014_100000211992 [1,1,0,0,0,0|2,0,0]=4 9263 B14R0.432 CCCC(=O)NCCCCCCC(C)C 1626a_100000211014_100000211992 [1,1,0,0,0,0|2,0,0]=4 9264 B14R0.432 CCCC(=O)NCCCCCCC(C)C 240690a_100000211014_100000211992 [1,1,0,0,0,0|2,0,0]=4 9265 B14R0.432 CCCC(=O)NCCCCCCC(C)C 527a_100000211014_100000211992 [1,1,0,0,0,0|2,0,0]=4 9266 B14R0.432 CCNC(=O)CCNCCCCC(C)C 34a_100025743525_100011216152 [1,1,0,0,0,0|2,0,0]=4 9267 B14R0.432 CCNC(=O)CCOCCCCC(C)C 7a_100011214890_100000737597 [1,1,0,0,0,0|2,0,0]=4 9268 B14R0.432 CCNC(=O)CCSCCCCC(C)C 62a_100000737597_100011216152 [1,1,0,0,0,0|2,0,0]=4 9269 B14R0.432 CCNC(=O)CCSCCCCC(C)C 62a_100011216152_100000737597 [1,1,0,0,0,0|2,0,0]=4 9270 B14R0.432 CCNC(=O)CNCCCCCC(C)C 2230a_100011290863_100000183381 [1,1,0,0,0,0|2,0,0]=4 9271 B14R0.432 CCNC(=O)CNCCCCCC(C)C 2230a_100016988866_100000210682 [1,1,0,0,0,0|2,0,0]=4 9272 B14R0.432 CCNC(=O)CNCCCCCC(C)C 34a_100011290863_100000183381 [1,1,0,0,0,0|2,0,0]=4 9273 B14R0.432 CCNC(=O)COCCCCCC(C)C 34a_100011995859_100000183381 [1,1,0,0,0,0|2,0,0]=4 9274 B14R0.432 CCNC(=O)COCCCCCC(C)C 7a_100011995859_100000183381 [1,1,0,0,0,0|2,0,0]=4 9275 B14R0.432 CCNC(=O)CSCCCCCC(C)C 62a_100000183381_100000210682 [1,1,0,0,0,0|2,0,0]=4 9276 B14R0.432 CCNC(=O)CSCCCCCC(C)C 62a_100000210682_100000183381 [1,1,0,0,0,0|2,0,0]=4 9277 B14R0.432 CCNC(=O)NCCCCCCC(C)C 2708a_100000211014_100015525214 [1,1,0,0,0,0|2,0,0]=4 9278 B14R0.432 CCNC(=O)NCCCCCCC(C)C 2708a_100015525214_100000211014 [1,1,0,0,0,0|2,0,0]=4 9279 B14R0.432 CCNC(=O)NCCCCCCC(C)C 273464a_100000211014_100015525214 [1,1,0,0,0,0|2,0,0]=4 9280 B14R0.432 CCNC(=O)NCCCCCCC(C)C 273464a_100015525214_100000211014 [1,1,0,0,0,0|2,0,0]=4 9281 B14R0.432 CCNC(=O)NCCCCCCC(C)C 512a_100000211014_100015525214 [1,1,0,0,0,0|2,0,0]=4 9282 B14R0.432 CCNC(=O)NCCCCCCC(C)C 512a_100015525214_100000211014 [1,1,0,0,0,0|2,0,0]=4 9283 B14R0.432 CCOC(=O)CCCCCCCC(=O)C 1458a_100000070787_100009991516 [1,1,0,0,0,0|0,0,1]=3 9284 B14R0.432 CCOC(=O)CCCCCCCN(C)C 2230a_100102631434_100009991516 [1,1,0,0,0,0|1,0,0]=3 9285 B14R0.432 CCOC(=O)CCCCCCCN(C)C 269982a_100102631434_100009991516 [1,1,0,0,0,0|1,0,0]=3 9286 B14R0.432 CCOC(=O)CCCCCCNC(=O)C 188690a_100000741137_100015343762 [1,1,0,0,0,0|1,0,1]=4 9287 B14R0.432 CCOC(=O)CCCCCCNC(C)C 2230a_100138425928_100009814379 [1,1,0,0,0,0|1,0,0]=3 9288 B14R0.432 CCOC(=O)CCCCCCNC(C)C 34a_100138425928_100009814379 [1,1,0,0,0,0|1,0,0]=3 9289 B14R0.432 CCOC(=O)CCCCCCOC(C)C 34a_100000212225_100009814379 [1,1,0,0,0,0|1,0,0]=3 9290 B14R0.432 CCOC(=O)CCCCCCSC(C)C 62a_100000210206_100009814379 [1,1,0,0,0,0|1,0,0]=3 9291 B14R0.432 CCOC(=O)CCCCCNCC(C)C 2230a_100000210953_100000755133 [1,1,0,0,0,0|1,0,0]=3 9292 B14R0.432 CCOC(=O)CCCCCNCC(C)C 34a_100000210953_100000755133 [1,1,0,0,0,0|1,0,0]=3 9293 B14R0.432 CCOC(=O)CCCCCNCC(C)O 2230a_100000210904_100000755133 [1,1,0,0,0,0|1,0,0]=3 9294 B14R0.432 CCOC(=O)CCCCCNCC(C)O 34a_100000210904_100000755133 [1,1,0,0,0,0|1,0,0]=3 9295 B14R0.432 CCOC(=O)CCCCCNCC(F)F 34a_100000765723_100000755133 [1,1,0,0,0,0|2,0,0]=4 9296 B14R0.432 CCOC(=O)CCCCCOCC(=O)C 34a_100000211253_100000755133 [1,1,0,0,0,0|1,0,1]=4 9297 B14R0.432 CCOC(=O)CCCCCOCC(C)Br 34a_100012180447_100000755133 [1,1,0,0,0,0|1,0,0]=3 9298 B14R0.432 CCOC(=O)CCCCCOCC(C)C 34a_100000210257_100000755133 [1,1,0,0,0,0|1,0,0]=3 9299 B14R0.432 CCOC(=O)CCCCCOCC(C)C 7a_100011214988_100000210760 [1,1,0,0,0,0|1,0,0]=3 9300 B14R0.432 CCOC(=O)CCCCCOCC(C)F 34a_100015925927_100000755133 [1,1,0,0,0,0|1,0,0]=3 9301 B14R0.432 CCOC(=O)CCCCCOCC(C)O 7a_100011214988_100011218427 [1,1,0,0,0,0|1,0,0]=3 9302 B14R0.432 CCOC(=O)CCCCCOCC(F)F 34a_100000743014_100000755133 [1,1,0,0,0,0|2,0,0]=4 9303 B14R0.432 CCOC(=O)CCCCCOCC(F)F 7a_100011214988_100011934356 [1,1,0,0,0,0|2,0,0]=4 9304 B14R0.432 CCOC(=O)CCCCCOC[C@@H](C)Cl 34a_100016084084_100000755133 [1,1,0,0,0,0|1,0,0]=3 9305 B14R0.432 CCOC(=O)CCCCCOC[C@@H](C)N 34a_100000737577_100000755133 [1,1,0,0,0,0|1,0,0]=3 9306 B14R0.432 CCOC(=O)CCCCCOC[C@@H](C)O 7a_100011214988_100009817552 [1,1,0,0,0,0|1,0,0]=3 9307 B14R0.432 CCOC(=O)CCCCCSCC(C)C 62a_100000210624_100000755133 [1,1,0,0,0,0|1,0,0]=3 9308 B14R0.432 CCOC(=O)CCCCCSCC(C)C 62a_100000755133_100000210760 [1,1,0,0,0,0|1,0,0]=3 9309 B14R0.432 CCOC(=O)CCCCCSCC(C)O 62a_100000755133_100011218427 [1,1,0,0,0,0|1,0,0]=3 9310 B14R0.432 CCOC(=O)CCCCCSCC(C)O 62a_100011218427_100000755133 [1,1,0,0,0,0|1,0,0]=3 9311 B14R0.432 CCOC(=O)CCCCCSCC(F)F 62a_100000755133_100011934356 [1,1,0,0,0,0|2,0,0]=4 9312 B14R0.432 CCOC(=O)CCCCCSCC(F)F 62a_100011934356_100000755133 [1,1,0,0,0,0|2,0,0]=4 9313 B14R0.432 CCOC(=O)CCCCCSC[C@@H](C)O 62a_100000755133_100009817552 [1,1,0,0,0,0|1,0,0]=3 9314 B14R0.432 CCOC(=O)CCCCCSC[C@@H](C)O 62a_100009817552_100000755133 [1,1,0,0,0,0|1,0,0]=3 9315 B14R0.432 CCOC(=O)CCCCNCCC(C)O 2230a_200000755665_100000750268 [1,1,0,0,0,0|1,0,0]=3 9316 B14R0.432 CCOC(=O)CCCCOCCC(=O)C 34a_100000759926_100000750268 [1,1,0,0,0,0|1,0,1]=4 9317 B14R0.432 CCOC(=O)CCCCOCCC(=O)C 7a_100000759926_100000750268 [1,1,0,0,0,0|1,0,1]=4 9318 B14R0.432 CCOC(=O)CCCCOCCC(C)Br 34a_100009893172_100000750268 [1,1,0,0,0,0|1,0,0]=3 9319 B14R0.432 CCOC(=O)CCCCOCCC(C)C 34a_100000210254_100000750268 [1,1,0,0,0,0|1,0,0]=3 9320 B14R0.432 CCOC(=O)CCCCOCCC(C)C 7a_100000210254_100000750268 [1,1,0,0,0,0|1,0,0]=3 9321 B14R0.432 CCOC(=O)CCCCOCCC(F)F 34a_100103093639_100000750268 [1,1,0,0,0,0|2,0,0]=4 9322 B14R0.432 CCOC(=O)CCCCOCC[C@@H](C)N 34a_100000706166_100000750268 [1,1,0,0,0,0|1,0,0]=3 9323 B14R0.432 CCOC(=O)CCCCSCCC(=O)C 62a_100000053229_100000750268 [1,1,0,0,0,0|1,0,1]=4 9324 B14R0.432 CCOC(=O)CCCCSCCC(=O)C 62a_100000750268_100000053229 [1,1,0,0,0,0|1,0,1]=4 9325 B14R0.432 CCOC(=O)CCCCSCCC(C)C 62a_100000210312_100000750268 [1,1,0,0,0,0|1,0,0]=3 9326 B14R0.432 CCOC(=O)CCCCSCCC(C)C 62a_100000750268_100000210312 [1,1,0,0,0,0|1,0,0]=3 9327 B14R0.432 CCOC(=O)CCCCSCCC(C)O 62a_100000750268_100012276601 [1,1,0,0,0,0|1,0,0]=3 9328 B14R0.432 CCOC(=O)CCCCSCCC(C)O 62a_100012276601_100000750268 [1,1,0,0,0,0|1,0,0]=3 9329 B14R0.432 CCOC(=O)CCCCSCCN(C)C 62a_100000750268_100000755713 [1,1,0,0,0,0|2,0,0]=4 9330 B14R0.432 CCOC(=O)CCCCSCOC(C)C 62a_100000709892_100000750268 [1,1,0,0,0,0|2,0,0]=4 9331 B14R0.432 CCOC(=O)CCCCSCOC(C)C 62a_100000750268_100000709892 [1,1,0,0,0,0|2,0,0]=4 9332 B14R0.432 CCOC(=O)CCCNCCCC(C)C 2230a_200000737386_100009991533 [1,1,0,0,0,0|1,0,0]=3 9333 B14R0.432 CCOC(=O)CCCNCCCC(C)C 34a_200000737386_100009991533 [1,1,0,0,0,0|1,0,0]=3 9334 B14R0.432 CCOC(=O)CCCNCCCS(=O)C 2230a_200000753449_100009991533 [1,1,0,0,0,0|2,0,0]=4 9335 B14R0.432 CCOC(=O)CCCNCCOC(C)C 2230a_100000701111_100009991533 [1,1,0,0,0,0|2,0,0]=4 9336 B14R0.432 CCOC(=O)CCCNCCOC(C)C 34a_100000701111_100009991533 [1,1,0,0,0,0|2,0,0]=4 9337 B14R0.432 CCOC(=O)CCCNCCSC(C)C 2230a_100000731138_100009991533 [1,1,0,0,0,0|2,0,0]=4 9338 B14R0.432 CCOC(=O)CCCNCCSC(C)C 34a_100000731138_100009991533 [1,1,0,0,0,0|2,0,0]=4 9339 B14R0.432 CCOC(=O)CCCOCCCC(=O)C 34a_100000759063_100009991533 [1,1,0,0,0,0|1,0,1]=4 9340 B14R0.432 CCOC(=O)CCCOCCCC(=O)C 7a_100000759063_100011215271 [1,1,0,0,0,0|1,0,1]=4 9341 B14R0.432 CCOC(=O)CCCOCCCC(=O)C 7a_100012001163_100011215641 [1,1,0,0,0,0|1,0,1]=4 9342 B14R0.432 CCOC(=O)CCCOCCCC(C)C 34a_100000210774_100009991533 [1,1,0,0,0,0|1,0,0]=3 9343 B14R0.432 CCOC(=O)CCCOCCCC(C)C 7a_100000210774_100011215271 [1,1,0,0,0,0|1,0,0]=3 9344 B14R0.432 CCOC(=O)CCCOCCCC(C)C 7a_100012001163_100011214892 [1,1,0,0,0,0|1,0,0]=3 9345 B14R0.432 CCOC(=O)CCCOCCCC(C)O 7a_100012001163_200000718107 [1,1,0,0,0,0|1,0,0]=3 9346 B14R0.432 CCOC(=O)CCCOCCCN(C)C 7a_100012001163_100000757444 [1,1,0,0,0,0|2,0,0]=4 9347 B14R0.432 CCOC(=O)CCCOCCNC(C)C 34a_100000224655_100009991533 [1,1,0,0,0,0|2,0,0]=4 9348 B14R0.432 CCOC(=O)CCCOCCOC(C)C 34a_100000211219_100009991533 [1,1,0,0,0,0|2,0,0]=4 9349 B14R0.432 CCOC(=O)CCCOCCOC(C)C 7a_100000211219_100011215271 [1,1,0,0,0,0|2,0,0]=4 9350 B14R0.432 CCOC(=O)CCCOCCOC(C)C 7a_100012001163_100000211751 [1,1,0,0,0,0|2,0,0]=4 9351 B14R0.432 CCOC(=O)CCCOCCSC(C)C 34a_200011212901_100009991533 [1,1,0,0,0,0|2,0,0]=4 9352 B14R0.432 CCOC(=O)CCCOCCSC(C)C 7a_100012001163_100000730970 [1,1,0,0,0,0|2,0,0]=4 9353 B14R0.432 CCOC(=O)CCCOCCSC(C)C 7a_200011212901_100011215271 [1,1,0,0,0,0|2,0,0]=4 9354 B14R0.432 CCOC(=O)CCCSCCCC(=O)C 62a_100009991533_100011215641 [1,1,0,0,0,0|1,0,1]=4 9355 B14R0.432 CCOC(=O)CCCSCCCC(=O)C 62a_100011215641_100009991533 [1,1,0,0,0,0|1,0,1]=4 9356 B14R0.432 CCOC(=O)CCCSCCCC(C)C 62a_100009991533_100011214892 [1,1,0,0,0,0|1,0,0]=3 9357 B14R0.432 CCOC(=O)CCCSCCCC(C)C 62a_100011214892_100009991533 [1,1,0,0,0,0|1,0,0]=3 9358 B14R0.432 CCOC(=O)CCCSCCCC(C)O 62a_100009991533_200000718107 [1,1,0,0,0,0|1,0,0]=3 9359 B14R0.432 CCOC(=O)CCCSCCCC(C)O 62a_200000718107_100009991533 [1,1,0,0,0,0|1,0,0]=3 9360 B14R0.432 CCOC(=O)CCCSCCCN(C)C 62a_100009991533_100000757444 [1,1,0,0,0,0|2,0,0]=4 9361 B14R0.432 CCOC(=O)CCCSCCOC(C)C 62a_100000211751_100009991533 [1,1,0,0,0,0|2,0,0]=4 9362 B14R0.432 CCOC(=O)CCCSCCOC(C)C 62a_100009991533_100000211751 [1,1,0,0,0,0|2,0,0]=4 9363 B14R0.432 CCOC(=O)CCCSCCSC(C)C 62a_100000730970_100009991533 [1,1,0,0,0,0|2,0,0]=4 9364 B14R0.432 CCOC(=O)CCCSCCSC(C)C 62a_100009991533_100000730970 [1,1,0,0,0,0|2,0,0]=4 9365 B14R0.432 CCOC(=O)CCNCCCOC(C)C 2230a_100000737246_100011206558 [1,1,0,0,0,0|2,0,0]=4 9366 B14R0.432 CCOC(=O)CCNCCCOC(C)C 34a_100000737246_100000765890 [1,1,0,0,0,0|2,0,0]=4 9367 B14R0.432 CCOC(=O)CCOCCCCC(C)C 34a_100011214890_100000765890 [1,1,0,0,0,0|1,0,0]=3 9368 B14R0.432 CCOC(=O)CCOCCCCC(C)C 7a_100011214890_100011206558 [1,1,0,0,0,0|1,0,0]=3 9369 B14R0.432 CCOC(=O)CCOCCCNC(C)C 34a_100000182298_100000765890 [1,1,0,0,0,0|2,0,0]=4 9370 B14R0.432 CCOC(=O)CCOCCNCC(C)C 34a_100015185251_100000765890 [1,1,0,0,0,0|2,0,0]=4 9371 B14R0.432 CCOC(=O)CCOCCOCC(C)C 34a_100000703358_100000765890 [1,1,0,0,0,0|2,0,0]=4 9372 B14R0.432 CCOC(=O)CCOCCOCC(C)C 7a_100000703358_100011206558 [1,1,0,0,0,0|2,0,0]=4 9373 B14R0.432 CCOC(=O)CCOCCSCC(C)C 34a_200000230437_100000765890 [1,1,0,0,0,0|2,0,0]=4 9374 B14R0.432 CCOC(=O)CCOCCSCC(C)C 7a_200000230437_100011206558 [1,1,0,0,0,0|2,0,0]=4 9375 B14R0.432 CCOC(=O)CCSCCCCC(=O)C 62a_100000735457_100000765890 [1,1,0,0,0,0|1,0,1]=4 9376 B14R0.432 CCOC(=O)CCSCCCCC(=O)C 62a_100000765890_100000735457 [1,1,0,0,0,0|1,0,1]=4 9377 B14R0.432 CCOC(=O)CCSCCCCC(C)C 62a_100000765890_100011216152 [1,1,0,0,0,0|1,0,0]=3 9378 B14R0.432 CCOC(=O)CCSCCCCC(C)C 62a_100011216152_100000765890 [1,1,0,0,0,0|1,0,0]=3 9379 B14R0.432 CCOC(=O)CCSCCCCN(C)C 62a_100000765890_100000690147 [1,1,0,0,0,0|2,0,0]=4 9380 B14R0.432 CCOC(=O)CNCCCCCC(C)C 2230a_100011290863_100000188475 [1,1,0,0,0,0|1,0,0]=3 9381 B14R0.432 CCOC(=O)CNCCCCCC(C)C 34a_100011290863_100000188475 [1,1,0,0,0,0|1,0,0]=3 9382 B14R0.432 CCOC(=O)CNCCCOCC(C)C 2230a_100000205972_100000188475 [1,1,0,0,0,0|2,0,0]=4 9383 B14R0.432 CCOC(=O)CNCCCOCC(C)C 34a_100000205972_100000188475 [1,1,0,0,0,0|2,0,0]=4 9384 B14R0.432 CCOC(=O)COCCCCCC(C)C 34a_100011995859_100000188475 [1,1,0,0,0,0|1,0,0]=3 9385 B14R0.432 CCOC(=O)COCCCCCC(C)C 7a_100011995859_100000188475 [1,1,0,0,0,0|1,0,0]=3 9386 B14R0.432 CCOC(=O)COCCCCNC(C)C 34a_100011521146_100000188475 [1,1,0,0,0,0|2,0,0]=4 9387 B14R0.432 CCOC(=O)COCCCNCC(C)C 2230a_100000210953_100009893628 [1,1,0,0,0,0|2,0,0]=4 9388 B14R0.432 CCOC(=O)COCCCNCC(C)C 34a_100000210953_100009893628 [1,1,0,0,0,0|2,0,0]=4 9389 B14R0.432 CCOC(=O)COCCCNCC(C)O 2230a_100000210904_100009893628 [1,1,0,0,0,0|2,0,0]=4 9390 B14R0.432 CCOC(=O)COCCCNCC(C)O 34a_100000210904_100009893628 [1,1,0,0,0,0|2,0,0]=4 9391 B14R0.432 CCOC(=O)COCCCOCC(C)Br 34a_100012180447_100009893628 [1,1,0,0,0,0|2,0,0]=4 9392 B14R0.432 CCOC(=O)COCCCOCC(C)C 34a_100000210257_100009893628 [1,1,0,0,0,0|2,0,0]=4 9393 B14R0.432 CCOC(=O)COCCCOCC(C)F 34a_100015925927_100009893628 [1,1,0,0,0,0|2,0,0]=4 9394 B14R0.432 CCOC(=O)COCCCOC[C@@H](C)Cl 34a_100016084084_100009893628 [1,1,0,0,0,0|2,0,0]=4 9395 B14R0.432 CCOC(=O)COCCCOC[C@@H](C)N 34a_100000737577_100009893628 [1,1,0,0,0,0|2,0,0]=4 9396 B14R0.432 CCOC(=O)COCCCSCC(C)C 62a_100000210624_100009893628 [1,1,0,0,0,0|2,0,0]=4 9397 B14R0.432 CCOC(=O)COCCCSCC(C)C 62a_100009893628_100000210760 [1,1,0,0,0,0|2,0,0]=4 9398 B14R0.432 CCOC(=O)COCCCSCC(C)O 62a_100009893628_100011218427 [1,1,0,0,0,0|2,0,0]=4 9399 B14R0.432 CCOC(=O)COCCCSCC(C)O 62a_100011218427_100009893628 [1,1,0,0,0,0|2,0,0]=4 9400 B14R0.432 CCOC(=O)COCCCSC[C@@H](C)O 62a_100009817552_100009893628 [1,1,0,0,0,0|2,0,0]=4 9401 B14R0.432 CCOC(=O)COCCCSC[C@@H](C)O 62a_100009893628_100009817552 [1,1,0,0,0,0|2,0,0]=4 9402 B14R0.432 CCOC(=O)COCCNCCC(C)O 2230a_200000755665_100000088970 [1,1,0,0,0,0|2,0,0]=4 9403 B14R0.432 CCOC(=O)COCCOCCC(C)Br 34a_100009893172_100000088970 [1,1,0,0,0,0|2,0,0]=4 9404 B14R0.432 CCOC(=O)COCCOCCC(C)C 34a_100000210254_100000088970 [1,1,0,0,0,0|2,0,0]=4 9405 B14R0.432 CCOC(=O)COCCOCCC(C)C 7a_100000210254_100000088970 [1,1,0,0,0,0|2,0,0]=4 9406 B14R0.432 CCOC(=O)COCCOCC[C@@H](C)N 34a_100000706166_100000088970 [1,1,0,0,0,0|2,0,0]=4 9407 B14R0.432 CCOC(=O)COCCSCCC(C)C 62a_100000088970_100000210312 [1,1,0,0,0,0|2,0,0]=4 9408 B14R0.432 CCOC(=O)COCCSCCC(C)C 62a_100000210312_100000088970 [1,1,0,0,0,0|2,0,0]=4 9409 B14R0.432 CCOC(=O)COCCSCCC(C)O 62a_100000088970_100012276601 [1,1,0,0,0,0|2,0,0]=4 9410 B14R0.432 CCOC(=O)COCCSCCC(C)O 62a_100012276601_100000088970 [1,1,0,0,0,0|2,0,0]=4 9411 B14R0.432 CCOC(=O)CSCCCCCC(C)C 62a_100000188475_100000210682 [1,1,0,0,0,0|1,0,0]=3 9412 B14R0.432 CCOC(=O)CSCCCCCC(C)C 62a_100000210682_100000188475 [1,1,0,0,0,0|1,0,0]=3 9413 B14R0.432 CCOC(=O)CSCCOCCC(C)C 7a_200000230590_100000210626 [1,1,0,0,0,0|2,0,0]=4 9414 B14R0.432 CCOC(=O)CSCCOCCC(C)O 7a_200000230590_100012276601 [1,1,0,0,0,0|2,0,0]=4 9415 B14R0.432 CCOC(=O)NCCOCCCC(C)C 34a_100000158857_100011214892 [1,1,0,0,0,0|2,0,0]=4 9416 B14R0.432 CCOC(=O)NCCOCCCC(C)C 7a_100000210774_200011445536 [1,1,0,0,0,0|2,0,0]=4 9417 B14R0.432 CCOC(=O)NCCOCCCC(C)O 34a_100000158857_200000718107 [1,1,0,0,0,0|2,0,0]=4 9418 B14R0.432 CCOC(=O)NCCSCCCC(C)C 62a_100011214892_200011445536 [1,1,0,0,0,0|2,0,0]=4 9419 B14R0.432 CCOC(=O)NCCSCCCC(C)O 62a_200000718107_200011445536 [1,1,0,0,0,0|2,0,0]=4 9420 B14R0.432 CCOC(=O)OCSCCCCC(C)C 62a_100011216152_100000075025 [1,1,0,0,0,0|2,0,0]=4 9421 B14R0.493 C#CCCC(=O)CCCCCCCCC 1458a_100000210558_100000753159 [1,1,0,0,0,0|1,0,1]=4 9422 B14R0.493 C#CCCC(=O)CCCCCCCCC 1458a_100000692101_100000210670 [1,1,0,0,0,0|1,0,1]=4 9423 B14R0.493 C#CCCCCCCCC(=O)COCC 1458a_100000211967_100153394163 [1,1,0,0,0,0|0,0,2]=4 9424 B14R0.493 C#CCNC(=O)CCCCCCCCC 11a_100000212058_100000210558 [1,1,0,0,0,0|1,0,1]=4 9425 B14R0.493 C#CCNC(=O)CCCCCCCCC 1626a_100000212058_100000210558 [1,1,0,0,0,0|1,0,1]=4 9426 B14R0.493 C#CCNC(=O)CCCCCCCCC 240690a_100000212058_100000210558 [1,1,0,0,0,0|1,0,1]=4 9427 B14R0.493 C#CCNC(=O)CCCCCCCCC 527a_100000212058_100000210558 [1,1,0,0,0,0|1,0,1]=4 9428 B14R0.493 C/C=C/CC(=O)CCCCCCCCC 1458a_100000210558_100102629194 [1,1,0,0,0,0|1,0,1]=4 9429 B14R0.493 C=C(COCCCCCCC)OCOC 34a_100000210272_100000042856 [1,1,0,0,0,0|2,0,0]=4 9430 B14R0.493 C=C(CSCCCCCCC)OCOC 62a_100000042856_100000210316 [1,1,0,0,0,0|2,0,0]=4 9431 B14R0.493 C=C(CSCCCCCCC)OCOC 62a_100000210614_100000042856 [1,1,0,0,0,0|2,0,0]=4 9432 B14R0.493 C=CCCC(=O)CCCCCCCCC 1458a_100000210558_100000754431 [1,1,0,0,0,0|1,0,1]=4 9433 B14R0.493 C=CCCC(=O)CCCCCCCCC 1458a_100000749702_100000210670 [1,1,0,0,0,0|1,0,1]=4 9434 B14R0.493 C=CCCCCCCCC(=O)COCC 1458a_100000211967_100012355270 [1,1,0,0,0,0|0,0,2]=4 9435 B14R0.493 C=CCNC(=O)CCCCCCCCC 1626a_100020586998_100000210558 [1,1,0,0,0,0|1,0,1]=4 9436 B14R0.493 C=CCNC(=O)CCCCCCCCC 240690a_100020586998_100000210558 [1,1,0,0,0,0|1,0,1]=4 9437 B14R0.493 C=CCNC(=O)CCCCCCCCC 527a_100020586998_100000210558 [1,1,0,0,0,0|1,0,1]=4 9438 B14R0.493 C=CCOC(=O)CNCCCCCCC 2230a_100000229938_100000033060 [1,1,0,0,0,0|1,0,1]=4 9439 B14R0.493 C=CCOC(=O)COCCCCCCC 34a_100000210272_100000033060 [1,1,0,0,0,0|1,0,1]=4 9440 B14R0.493 C=CCOC(=O)COCCCCCCC 7a_100000210272_100000033060 [1,1,0,0,0,0|1,0,1]=4 9441 B14R0.493 C=CCOC(=O)CSCCCCCCC 62a_100000033060_100000210316 [1,1,0,0,0,0|1,0,1]=4 9442 B14R0.493 C=CCOC(=O)CSCCCCCCC 62a_100000210614_100000033060 [1,1,0,0,0,0|1,0,1]=4 9443 B14R0.493 CC#CCC(=O)CCCCCCCCC 1458a_100000210558_100000748600 [1,1,0,0,0,0|1,0,1]=4 9444 B14R0.493 CC=CCC(=O)CCCCCCCCC 1458a_100000210558_100000070051 [1,1,0,0,0,0|1,0,1]=4 9445 B14R0.493 CC=CCC(=O)CCCCCCCCC 1458a_100121576822_100000210670 [1,1,0,0,0,0|1,0,1]=4 9446 B14R0.493 CC=NNC(=O)CCCCCCCCC 4a_100011221126_200000210099 [1,1,0,0,0,0|1,0,1]=4 9447 B14R0.493 CCC#CC(=O)CCCCCCCCC 1458a_100011827653_100000210670 [1,1,0,0,0,0|1,0,0]=3 9448 B14R0.493 CCC#CC(=O)CCCCCCCCO 1458a_100011827653_100000033203 [1,1,0,0,0,0|2,0,0]=4 9449 B14R0.493 CCC=CC(=O)CCCCCCCCC 1458a_100000212282_100000210670 [1,1,0,0,0,0|1,0,0]=3 9450 B14R0.493 CCC=CC(=O)CCCCCCCCO 1458a_100000212282_100000033203 [1,1,0,0,0,0|2,0,0]=4 9451 B14R0.493 CCC=CC(=O)NCCCCCCCC 11a_100000229939_100000212282 [1,1,0,0,0,0|2,0,0]=4 9452 B14R0.493 CCC=CC(=O)NCCCCCCCC 1626a_100000229939_100000212282 [1,1,0,0,0,0|2,0,0]=4 9453 B14R0.493 CCC=CC(=O)NCCCCCCCC 240690a_100000229939_100000212282 [1,1,0,0,0,0|2,0,0]=4 9454 B14R0.493 CCCCC#CCCCC(=O)COCC 1458a_100000211967_200000047210 [1,1,0,0,0,0|0,0,2]=4 9455 B14R0.493 CCCCC(=O)CCCCCCCCO 1458a_100000210183_100000033203 [1,1,0,0,0,0|2,0,0]=4 9456 B14R0.493 CCCCCCCCCC(=NNCC)C 4a_100000756455_100011215753 [1,1,0,0,0,0|2,0,0]=4 9457 B14R0.493 CCCCCCCCCC(=O)C#CCO 1458a_100000049017_100000210670 [1,1,0,0,0,0|1,0,1]=4 9458 B14R0.493 CCCCCCCCCC(=O)C=COC 1458a_100016268678_100000210670 [1,1,0,0,0,0|1,0,1]=4 9459 B14R0.493 CCCCCCCCCC(=O)CCC#N 1458a_100000210558_100011215226 [1,1,0,0,0,0|1,0,1]=4 9460 B14R0.493 CCCCCCCCCC(=O)CCC#N 1458a_100011934036_100000210670 [1,1,0,0,0,0|1,0,1]=4 9461 B14R0.493 CCCCCCCCCC(=O)CCCC 1458a_100000210183_100000210670 [1,1,0,0,0,0|1,0,0]=3 9462 B14R0.493 CCCCCCCCCC(=O)CCCC 1458a_100000210558_100000210211 [1,1,0,0,0,0|1,0,0]=3 9463 B14R0.493 CCCCCCCCCC(=O)CCCF 1458a_100000210558_100011934791 [1,1,0,0,0,0|1,0,0]=3 9464 B14R0.493 CCCCCCCCCC(=O)CCCO 1458a_100000210558_100011215043 [1,1,0,0,0,0|1,0,0]=3 9465 B14R0.493 CCCCCCCCCC(=O)CCOC 1458a_100000210558_100000233755 [1,1,0,0,0,0|1,0,0]=3 9466 B14R0.493 CCCCCCCCCC(=O)CCOC 1458a_100000749529_100000210670 [1,1,0,0,0,0|1,0,0]=3 9467 B14R0.493 CCCCCCCCCC(=O)CCSC 1458a_100000174002_100000210670 [1,1,0,0,0,0|1,0,0]=3 9468 B14R0.493 CCCCCCCCCC(=O)CCSC 1458a_100000210558_100000751147 [1,1,0,0,0,0|1,0,0]=3 9469 B14R0.493 CCCCCCCCCC(=O)COCC 1458a_100000211967_100000210670 [1,1,0,0,0,0|0,0,0]=2 9470 B14R0.493 CCCCCCCCCC(=O)CSCC 1458a_100000230394_100000210670 [1,1,0,0,0,0|0,1,0]=3 9471 B14R0.493 CCCCCCCCCC(=O)NCC#N 1626a_100000734998_100000210558 [1,1,0,0,0,0|1,0,1]=4 9472 B14R0.493 CCCCCCCCCC(=O)NCC#N 527a_100000734998_100000210558 [1,1,0,0,0,0|1,0,1]=4 9473 B14R0.493 CCCCCCCCCC(=O)NCCC 11a_100020643023_100000210558 [1,1,0,0,0,0|1,0,0]=3 9474 B14R0.493 CCCCCCCCCC(=O)NCCC 1626a_100020643023_100000210558 [1,1,0,0,0,0|1,0,0]=3 9475 B14R0.493 CCCCCCCCCC(=O)NCCC 240690a_100020643023_100000210558 [1,1,0,0,0,0|1,0,0]=3 9476 B14R0.493 CCCCCCCCCC(=O)NCCC 527a_100020643023_100000210558 [1,1,0,0,0,0|1,0,0]=3 9477 B14R0.493 CCCCCCCCCC(=O)NCCF 11a_100000724931_100000210558 [1,1,0,0,0,0|1,0,0]=3 9478 B14R0.493 CCCCCCCCCC(=O)NCCF 1626a_100000724931_100000210558 [1,1,0,0,0,0|1,0,0]=3 9479 B14R0.493 CCCCCCCCCC(=O)NCCF 240690a_100000724931_100000210558 [1,1,0,0,0,0|1,0,0]=3 9480 B14R0.493 CCCCCCCCCC(=O)NCCF 527a_100000724931_100000210558 [1,1,0,0,0,0|1,0,0]=3 9481 B14R0.493 CCCCCCCCCC(=O)NCCO 240690a_100000210304_100000210558 [1,1,0,0,0,0|1,0,0]=3 9482 B14R0.493 CCCCCCCCCC(=O)NCCO 527a_100000210304_100000210558 [1,1,0,0,0,0|1,0,0]=3 9483 B14R0.493 CCCCCCCCCC(=O)NNCC 22a_100000756455_100000210558 [1,1,0,0,0,0|1,0,0]=3 9484 B14R0.493 CCCCCCCCCC(=O)OCNC 2230a_106832991635_200010990708 [1,1,0,0,0,0|0,0,0]=2 9485 B14R0.493 CCCCCCCCCC(=O)OCNC 34a_100102657272_200010990708 [1,1,0,0,0,0|0,0,0]=2 9486 B14R0.493 CCCCCCCCCC(=O)OCNC 7a_106832991635_200010990708 [1,1,0,0,0,0|0,0,0]=2 9487 B14R0.493 CCCCCCCCCC(=O)OCOC 34a_100138415774_200010990708 [1,1,0,0,0,0|0,0,0]=2 9488 B14R0.493 CCCCCCCCCC(=O)OCSC 62a_200000210301_200010990708 [1,1,0,0,0,0|0,0,0]=2 9489 B14R0.493 CCCCCCCCCC(=O)OCS[13CH3] 62a_200025704644_200010990708 [1,1,0,0,0,0|0,0,0]=2 9490 B14R0.493 CCCCCCCCCC(C)OCCC 34a_100011218016_100000210303 [1,1,0,0,0,0|1,0,1]=4 9491 B14R0.493 CCCCCCCCCC(C)OCCC 7a_100011218016_100000210303 [1,1,0,0,0,0|1,0,1]=4 9492 B14R0.493 CCCCCCCCCC(C)OCCF 34a_100011218016_100011217306 [1,1,0,0,0,0|1,0,1]=4 9493 B14R0.493 CCCCCCCCCC(C)OCCF 7a_100011218016_100011217306 [1,1,0,0,0,0|1,0,1]=4 9494 B14R0.493 CCCCCCCCCC(C)OCCO 34a_100011218016_100000211926 [1,1,0,0,0,0|1,0,1]=4 9495 B14R0.493 CCCCCCCCCC(C)OCCO 7a_100011218016_100000211926 [1,1,0,0,0,0|1,0,1]=4 9496 B14R0.493 CCCCCCCCCC(C)OCSC 34a_100011218016_100011218213 [1,1,0,0,0,0|1,0,1]=4 9497 B14R0.493 CCCCCCCCCN(C)COCC 269982a_100000232482_100000739092 [1,1,0,0,0,0|2,0,0]=4 9498 B14R0.493 CCCCCCCCNC(=O)CCCC 11a_100000229939_100000210183 [1,1,0,0,0,0|2,0,0]=4 9499 B14R0.493 CCCCCCCCNC(=O)CCCC 1626a_100000229939_100000210183 [1,1,0,0,0,0|2,0,0]=4 9500 B14R0.493 CCCCCCCCNC(=O)CCCC 240690a_100000229939_100000210183 [1,1,0,0,0,0|2,0,0]=4 9501 B14R0.493 CCCCCCCCNC(=O)CCCC 527a_100000229939_100000210183 [1,1,0,0,0,0|2,0,0]=4 9502 B14R0.493 CCCCCCCCNC(=O)CCOC 11a_100000229939_100000749529 [1,1,0,0,0,0|2,0,0]=4 9503 B14R0.493 CCCCCCCCNC(=O)CCOC 1626a_100000229939_100000749529 [1,1,0,0,0,0|2,0,0]=4 9504 B14R0.493 CCCCCCCCNC(=O)CCOC 240690a_100000229939_100000749529 [1,1,0,0,0,0|2,0,0]=4 9505 B14R0.493 CCCCCCCCNC(=O)CCOC 527a_100000229939_100000749529 [1,1,0,0,0,0|2,0,0]=4 9506 B14R0.493 CCCCCCCCNC(=O)CCSC 11a_100000229939_100000174002 [1,1,0,0,0,0|2,0,0]=4 9507 B14R0.493 CCCCCCCCNC(=O)CCSC 1626a_100000229939_100000174002 [1,1,0,0,0,0|2,0,0]=4 9508 B14R0.493 CCCCCCCCNC(=O)CCSC 240690a_100000229939_100000174002 [1,1,0,0,0,0|2,0,0]=4 9509 B14R0.493 CCCCCCCCNC(=O)CCSC 527a_100000229939_100000174002 [1,1,0,0,0,0|2,0,0]=4 9510 B14R0.493 CCCCCCCCNC(=O)COCC 11a_100000229939_100000211967 [1,1,0,0,0,0|1,0,0]=3 9511 B14R0.493 CCCCCCCCNC(=O)COCC 1626a_100000229939_100000211967 [1,1,0,0,0,0|1,0,0]=3 9512 B14R0.493 CCCCCCCCNC(=O)COCC 240690a_100000229939_100000211967 [1,1,0,0,0,0|1,0,0]=3 9513 B14R0.493 CCCCCCCCNC(=O)COCC 527a_100000229939_100000211967 [1,1,0,0,0,0|1,0,0]=3 9514 B14R0.493 CCCCCCCCNC(=O)CSCC 11a_100000229939_100000230394 [1,1,0,0,0,0|1,1,0]=4 9515 B14R0.493 CCCCCCCCNC(=O)CSCC 1626a_100000229939_100000230394 [1,1,0,0,0,0|1,1,0]=4 9516 B14R0.493 CCCCCCCCNC(=O)CSCC 240690a_100000229939_100000230394 [1,1,0,0,0,0|1,1,0]=4 9517 B14R0.493 CCCCCCCCNC(=O)CSCC 527a_100000229939_100000230394 [1,1,0,0,0,0|1,1,0]=4 9518 B14R0.493 CCCCCCCCNC(=O)NCCC 2708a_100000229939_100020643023 [1,1,0,0,0,0|2,0,0]=4 9519 B14R0.493 CCCCCCCCNC(=O)NCCC 2708a_100020643023_100000229939 [1,1,0,0,0,0|2,0,0]=4 9520 B14R0.493 CCCCCCCCNC(=O)NCCC 273464a_100000229939_100020643023 [1,1,0,0,0,0|2,0,0]=4 9521 B14R0.493 CCCCCCCCNC(=O)NCCC 273464a_100020643023_100000229939 [1,1,0,0,0,0|2,0,0]=4 9522 B14R0.493 CCCCCCCCNC(=O)NCCC 512a_100000229939_100020643023 [1,1,0,0,0,0|2,0,0]=4 9523 B14R0.493 CCCCCCCCNC(=O)NCCC 512a_100020643023_100000229939 [1,1,0,0,0,0|2,0,0]=4 9524 B14R0.493 CCCCCCCCNC(=O)NCCF 2708a_100000229939_100000724931 [1,1,0,0,0,0|2,0,0]=4 9525 B14R0.493 CCCCCCCCNC(=O)NCCF 273464a_100000229939_100000724931 [1,1,0,0,0,0|2,0,0]=4 9526 B14R0.493 CCCCCCCCNC(=O)NCCF 273464a_100000724931_100000229939 [1,1,0,0,0,0|2,0,0]=4 9527 B14R0.493 CCCCCCCCNC(=O)NCCF 512a_100000229939_100000724931 [1,1,0,0,0,0|2,0,0]=4 9528 B14R0.493 CCCCCCCCNC(=O)NCCO 2708a_100000229939_100000210304 [1,1,0,0,0,0|2,0,0]=4 9529 B14R0.493 CCCCCCCCNC(=O)NCCO 273464a_100000210304_100000229939 [1,1,0,0,0,0|2,0,0]=4 9530 B14R0.493 CCCCCCCCNC(=O)NCCO 273464a_100000229939_100000210304 [1,1,0,0,0,0|2,0,0]=4 9531 B14R0.493 CCCCCCCCNC(=O)NCCO 512a_100000229939_100000210304 [1,1,0,0,0,0|2,0,0]=4 9532 B14R0.493 CCCCCCCCNC(=O)NNCC 273464a_100000229939_100000756455 [1,1,0,0,0,0|2,0,0]=4 9533 B14R0.493 CCCCCCCCNC(=O)NNCC 512a_100000229939_100000756455 [1,1,0,0,0,0|2,0,0]=4 9534 B14R0.493 CCCCCCCCNC(=O)NNCC 512a_100000756455_100000229939 [1,1,0,0,0,0|2,0,0]=4 9535 B14R0.493 CCCCCCCNCC(=O)NCCC 2230a_100000174927_100000210681 [1,1,0,0,0,0|2,0,0]=4 9536 B14R0.493 CCCCCCCNCC(=O)NCCC 2230a_100000229938_100000183358 [1,1,0,0,0,0|2,0,0]=4 9537 B14R0.493 CCCCCCCNCC(=O)NCCF 2230a_100000725713_100000210681 [1,1,0,0,0,0|2,0,0]=4 9538 B14R0.493 CCCCCCCNCC(=O)OCCC 2230a_100000229938_200011215008 [1,1,0,0,0,0|1,0,0]=3 9539 B14R0.493 CCCCCCCOCC(=O)NCCC 34a_100000210272_100000183358 [1,1,0,0,0,0|2,0,0]=4 9540 B14R0.493 CCCCCCCOCC(=O)NCCC 7a_100000210272_100000183358 [1,1,0,0,0,0|2,0,0]=4 9541 B14R0.493 CCCCCCCOCC(=O)OCCC 34a_100000210272_200011215008 [1,1,0,0,0,0|1,0,0]=3 9542 B14R0.493 CCCCCCCOCC(=O)OCCC 7a_100000210272_200011215008 [1,1,0,0,0,0|1,0,0]=3 9543 B14R0.493 CCCCCCCSCC(=O)NCCC 62a_100000183358_100000210316 [1,1,0,0,0,0|2,0,0]=4 9544 B14R0.493 CCCCCCCSCC(=O)NCCC 62a_100000210614_100000183358 [1,1,0,0,0,0|2,0,0]=4 9545 B14R0.493 CCCCCCCSCC(=O)OCCC 62a_100000210614_200011215008 [1,1,0,0,0,0|1,0,0]=3 9546 B14R0.493 CCCCCCCSCC(=O)OCCC 62a_200011215008_100000210316 [1,1,0,0,0,0|1,0,0]=3 9547 B14R0.493 CCCCCCOCOC(=O)OCCC 34a_100000210259_200000139673 [1,1,0,0,0,0|2,0,0]=4 9548 B14R0.493 CCCCCCOCOC(=O)OCCC 7a_100000210259_200000139673 [1,1,0,0,0,0|2,0,0]=4 9549 B14R0.493 CCCCCCSCOC(=O)OCCC 62a_100000210314_200000139673 [1,1,0,0,0,0|2,0,0]=4 9550 B14R0.493 CCCCCNCCCC(=O)NCCC 2230a_100000209983_100011194427 [1,1,0,0,0,0|2,0,0]=4 9551 B14R0.493 CCCCCOCCCC(=O)NCCC 7a_100000210253_100011194427 [1,1,0,0,0,0|2,0,0]=4 9552 B14R0.493 CCCCCSCCCC(=O)NCCC 62a_100000210326_100011194427 [1,1,0,0,0,0|2,0,0]=4 9553 B14R0.493 CCCCCSCCCC(=O)NCCC 62a_100011194427_100000210326 [1,1,0,0,0,0|2,0,0]=4 9554 B14R0.493 CCCCOCCCNC(=O)COCC 1626a_200000211371_100000211967 [1,1,0,0,0,0|2,0,0]=4 9555 B14R0.493 CCCCOCCCNC(=O)COCC 240690a_200000211371_100000211967 [1,1,0,0,0,0|2,0,0]=4 9556 B14R0.493 CCCCOCCCNC(=O)COCC 527a_200000211371_100000211967 [1,1,0,0,0,0|2,0,0]=4 9557 B14R0.493 CCCCOCCOCC(=O)OCCC 34a_100000210238_200011215008 [1,1,0,0,0,0|2,0,0]=4 9558 B14R0.493 CCCCOCCOCC(=O)OCCC 7a_100000210238_200011215008 [1,1,0,0,0,0|2,0,0]=4 9559 B14R0.493 CCCCOCCSCC(=O)OCCC 62a_100000743108_200011215008 [1,1,0,0,0,0|2,0,0]=4 9560 B14R0.493 CCCCOCCSCC(=O)OCCC 62a_200011215008_100000743108 [1,1,0,0,0,0|2,0,0]=4 9561 B14R0.493 CCCCSCCNCC(=O)OCCC 2230a_100025743550_200011215008 [1,1,0,0,0,0|2,0,0]=4 9562 B14R0.493 CCCCSCCOCC(=O)OCCC 34a_200000230436_200011215008 [1,1,0,0,0,0|2,0,0]=4 9563 B14R0.493 CCCCSCCOCC(=O)OCCC 7a_200000230436_200011215008 [1,1,0,0,0,0|2,0,0]=4 9564 B14R0.493 CCCNC(=O)CCCCCCCCO 240690a_100020643023_100000015970 [1,1,0,0,0,0|2,0,0]=4 9565 B14R0.493 CCCOC(=O)CNCCCCCCO 2230a_100000686447_200011215008 [1,1,0,0,0,0|2,0,0]=4 9566 B14R0.493 CCCOC(=O)CNCCCCCCO 34a_100000686447_200011215008 [1,1,0,0,0,0|2,0,0]=4 9567 B14R0.493 CCCOC(=O)CNCCCCCOC 2230a_100000747528_200011215008 [1,1,0,0,0,0|2,0,0]=4 9568 B14R0.493 CCCOC(=O)CNCCCCCOC 34a_100000747528_200011215008 [1,1,0,0,0,0|2,0,0]=4 9569 B14R0.493 CCCOC(=O)COCCCCCCBr 34a_100011215345_200011215008 [1,1,0,0,0,0|2,0,0]=4 9570 B14R0.493 CCCOC(=O)COCCCCCCBr 7a_100011215345_200011215008 [1,1,0,0,0,0|2,0,0]=4 9571 B14R0.493 CCCOC(=O)COCCCCCCCl 34a_100000766143_200011215008 [1,1,0,0,0,0|2,0,0]=4 9572 B14R0.493 CCCOC(=O)COCCCCCCCl 7a_100000766143_200011215008 [1,1,0,0,0,0|2,0,0]=4 9573 B14R0.493 CCCOC(=O)COCCCCCCF 34a_100000732779_200011215008 [1,1,0,0,0,0|2,0,0]=4 9574 B14R0.493 CCCOC(=O)COCCCCCCF 7a_100000732779_200011215008 [1,1,0,0,0,0|2,0,0]=4 9575 B14R0.493 CCCOC(=O)COCCCCCCN 34a_100000686447_200011215008 [1,1,0,0,0,0|2,0,0]=4 9576 B14R0.493 CCCOC(=O)COCCCCCNC 34a_100000722520_200011215008 [1,1,0,0,0,0|2,0,0]=4 9577 B14R0.493 CCCOC(=O)CSCCCCCCF 62a_100015922095_200011215008 [1,1,0,0,0,0|2,0,0]=4 9578 B14R0.493 CCCOC(=O)CSCCCCCCF 62a_200011215008_100015922095 [1,1,0,0,0,0|2,0,0]=4 9579 B14R0.493 CCCOC(=O)CSCCCCCCO 62a_100000766143_200011215008 [1,1,0,0,0,0|2,0,0]=4 9580 B14R0.493 CCCOC(=O)CSCCCCCCO 62a_200011215008_100000766143 [1,1,0,0,0,0|2,0,0]=4 9581 B14R0.493 CCCOCCCNCC(=O)OCCC 2230a_100011217757_200011215008 [1,1,0,0,0,0|2,0,0]=4 9582 B14R0.493 CCCOCCCNCC(=O)OCCC 34a_100011217757_200011215008 [1,1,0,0,0,0|2,0,0]=4 9583 B14R0.493 CCNNC(=O)CCCCCCCCO 22a_100000756455_100000015970 [1,1,0,0,0,0|2,0,0]=4 9584 B14R0.493 CCOCC(=O)CCCCCCCCO 1458a_100000211967_100000033203 [1,1,0,0,0,0|1,0,0]=3 9585 B14R0.493 CCOCC(=O)NCCCCCCCO 240690a_100011996573_100000211967 [1,1,0,0,0,0|2,0,0]=4 9586 B14R0.493 CCSCC(=O)CCCCCCCCO 1458a_100000230394_100000033203 [1,1,0,0,0,0|1,1,0]=4 9587 B14R0.493 COCCC(=O)CCCCCCCCO 1458a_100000749529_100000033203 [1,1,0,0,0,0|2,0,0]=4 9588 B14R0.493 CSCCC(=O)CCCCCCCCO 1458a_100000174002_100000033203 [1,1,0,0,0,0|2,0,0]=4 9589 B14R0.493 O=C(CCCCCCCCO)NCCF 240690a_100000724931_100000015970 [1,1,0,0,0,0|2,0,0]=4 9590 B14R0.493 O=C(CCCCCCCCO)NCCO 240690a_100000210304_100000015970 [1,1,0,0,0,0|2,0,0]=4 9591 B14R0.2432 CCCCCC(=O)CCCC(=O)NCC 1458a_100000199580_100000210326 [1,1,0,0,0,0|1,0,1]=4 9592 B14R0.2432 CCCCCC(=O)CCCC(=O)OCC 1458a_100000210991_100000210326 [1,1,0,0,0,0|0,0,1]=3 9593 B14R0.2432 CCCCCC(=O)CCCC(=O)OCC 1458a_100000212188_100011215271 [1,1,0,0,0,0|0,0,1]=3 9594 B14R0.2432 CCCCCC(=O)CCNC(=O)OCC 1458a_100000212188_200011445536 [1,1,0,0,0,0|1,0,1]=4 9595 B14R0.2432 CCCCCC(=O)CSCC(=O)OCC 62a_100000188475_200012276598 [1,1,0,0,0,0|1,0,1]=4 9596 B14R0.2432 CCCCCC(=O)CSCC(=O)OCC 62a_200012276598_100000188475 [1,1,0,0,0,0|1,0,1]=4 9597 B14R0.2432 CCCCCC(=O)NCCC(=O)OCC 188690a_100000746078_100000212188 [1,1,0,0,0,0|1,0,1]=4 9598 B14R0.2432 CCCCCC(C)NCCC(=O)NCC 2230a_100000211957_100000737597 [1,1,0,0,0,0|2,0,0]=4 9599 B14R0.2432 CCCCCC(C)NCCC(=O)NCC 270004a_100025743525_100000211708 [1,1,0,0,0,0|2,0,0]=4 9600 B14R0.2432 CCCCCC(C)NCCC(=O)NCC 34a_100025743525_200011218191 [1,1,0,0,0,0|2,0,0]=4 9601 B14R0.2432 CCCCCC(C)NCCC(=O)OCC 2230a_100000211957_100011206558 [1,1,0,0,0,0|1,0,0]=3 9602 B14R0.2432 CCCCCC(C)OCCC(=O)NCC 7a_100011215632_100000737597 [1,1,0,0,0,0|2,0,0]=4 9603 B14R0.2432 CCCCCC(C)OCCC(=O)OCC 34a_100011215632_100000765890 [1,1,0,0,0,0|1,0,0]=3 9604 B14R0.2432 CCCCCC(C)OCCC(=O)OCC 7a_100011215632_100011206558 [1,1,0,0,0,0|1,0,0]=3 9605 B14R0.2432 CCCCCC(C)SCCC(=O)NCC 62a_100000737597_200011218191 [1,1,0,0,0,0|2,0,0]=4 9606 B14R0.2432 CCCCCC(C)SCCC(=O)NCC 62a_200011218191_100000737597 [1,1,0,0,0,0|2,0,0]=4 9607 B14R0.2432 CCCCCC(C)SCCC(=O)OCC 62a_100000765890_200011218191 [1,1,0,0,0,0|1,0,0]=3 9608 B14R0.2432 CCCCCC(C)SCCC(=O)OCC 62a_200011218191_100000765890 [1,1,0,0,0,0|1,0,0]=3 9609 B14R0.2432 CCCCCC(C)SCOC(=O)OCC 62a_200011218191_100000075025 [1,1,0,0,0,0|2,0,0]=4 9610 B14R0.2432 CCCCCC(O)CCCC(=O)NCC 240690a_100015525214_100020618878 [1,1,0,0,0,0|1,0,0]=3 9611 B14R0.2432 CCCCCC(O)CCCC(=O)NCC 527a_100015525214_100020618878 [1,1,0,0,0,0|1,0,0]=3 9612 B14R0.2432 CCCCCC(O)CCCC(=O)NNC 22a_100016993582_100020618878 [1,1,0,0,0,0|2,0,0]=4 9613 B14R0.2432 CCCCCN(C)CCCC(=O)OCC 2230a_100000223495_100009991533 [1,1,0,0,0,0|1,0,0]=3 9614 B14R0.2432 CCCCCN(C)CCCC(=O)OCC 269982a_100000223495_100009991533 [1,1,0,0,0,0|1,0,0]=3 9615 B14R0.2432 CCCCCN(C)CCNC(=O)OCC 269982a_100000223495_200011445536 [1,1,0,0,0,0|2,0,0]=4 9616 B14R0.2432 CCCCNC(=O)CCCC(=O)OCC 11a_100000102301_100000210991 [1,1,0,0,0,0|1,0,1]=4 9617 B14R0.2432 CCCCNC(=O)CCCC(=O)OCC 1626a_100000102301_100000210991 [1,1,0,0,0,0|1,0,1]=4 9618 B14R0.2432 CCCCNC(=O)CCCC(=O)OCC 240690a_100000102301_100000210991 [1,1,0,0,0,0|1,0,1]=4 9619 B14R0.2432 CCCCNC(=O)CCCC(=O)OCC 527a_100000102301_100000210991 [1,1,0,0,0,0|1,0,1]=4 9620 B14R0.2432 CCCOCC(=O)CCCC(=O)OCC 1458a_100000745993_100011215271 [1,1,0,0,0,0|1,0,1]=4 9621 B14R0.2432 CCCSCC(=O)CCCC(=O)OCC 1458a_100000217233_100011215271 [1,1,0,0,0,0|1,0,1]=4 9622 B14R0.2432 CCOC(=O)CCCC(=O)CCCCF 1458a_100000210991_100000729493 [1,1,0,0,0,0|1,0,1]=4 9623 B14R0.2432 CCOC(=O)CCCC(=O)CCCCO 1458a_100000210991_100000210776 [1,1,0,0,0,0|1,0,1]=4 9624 B14R0.2432 CCOC(=O)CCCC(=O)CCCCO 1458a_100000695505_100011215271 [1,1,0,0,0,0|1,0,1]=4 9625 B14R0.2432 CCOC(=O)CCCC(=O)CCCOC 1458a_100000210991_100000740836 [1,1,0,0,0,0|1,0,1]=4 9626 B14R0.2432 CCOC(=O)CCCC(=O)CCCOC 1458a_100000741012_100011215271 [1,1,0,0,0,0|1,0,1]=4 9627 B14R0.2432 CCOC(=O)CCCC(=O)CCCSC 1458a_100000173376_100011215271 [1,1,0,0,0,0|1,0,1]=4 9628 B14R0.2432 CCOC(=O)CCCC(=O)CCSCC 1458a_100000210991_100000757381 [1,1,0,0,0,0|1,0,1]=4 9629 B14R0.2432 CCOC(=O)CCCC(=O)CCSCC 1458a_100000230768_100011215271 [1,1,0,0,0,0|1,0,1]=4 9630 B14R0.2432 CCOC(=O)CCCN(C)CCCCO 2230a_100000717598_100009991533 [1,1,0,0,0,0|2,0,0]=4 9631 B14R0.2432 CCOC(=O)CCCN(C)CCCCO 269982a_100000717598_100009991533 [1,1,0,0,0,0|2,0,0]=4 9632 B14R0.2432 CCOC(=O)CCCN(C)CCCOC 2230a_100000224831_100009991533 [1,1,0,0,0,0|2,0,0]=4 9633 B14R0.2432 CCOC(=O)CCCN(C)CCCOC 269982a_100000224831_100009991533 [1,1,0,0,0,0|2,0,0]=4 9634 B14R0.2432 CCOC(=O)CCOC(C)CCCOC 34a_200011539412_100000765890 [1,1,0,0,0,0|2,0,0]=4 9635 B14R0.2432 CCOC(=O)CCOC(C)CCCOC 7a_200011539412_100011206558 [1,1,0,0,0,0|2,0,0]=4 9636 B14R0.2432 CCOC(=O)COC[C@@H](N)CCCCN 34a_100016993712_100000188475 [1,1,0,0,0,0|2,0,0]=4 9637 B14R0.2432 CCOCCC(=O)CCCC(=O)OCC 1458a_100000210991_100011215890 [1,1,0,0,0,0|1,0,1]=4 9638 B14R0.2432 CCOCCC(=O)CCCC(=O)OCC 1458a_100000749530_100011215271 [1,1,0,0,0,0|1,0,1]=4 9639 B14R0.12 CCCCCCC(=O)CCCC(=O)NC 1458a_100102632555_100000741757 [1,1,0,0,0,0|1,0,1]=4 9640 B14R0.12 CCCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100000210757 [1,1,0,0,0,0|0,0,1]=3 9641 B14R0.12 CCCCCCC(=O)CCCC(=O)OC 1458a_100102632555_100011218270 [1,1,0,0,0,0|0,0,1]=3 9642 B14R0.12 CCCCCCC(=O)CSCC(=O)OC 1458a_100000191316_100000210757 [1,1,0,0,0,0|1,0,1]=4 9643 B14R0.12 CCCCCCC(=O)NCCC(=O)OC 188690a_100000683876_100102632555 [1,1,0,0,0,0|1,0,1]=4 9644 B14R0.12 CCCCCCC(C)NCCC(=O)NC 2230a_100000210919_100000737683 [1,1,0,0,0,0|2,0,0]=4 9645 B14R0.12 CCCCCCC(C)NCCC(=O)NC 2230a_100000738227_100011215978 [1,1,0,0,0,0|2,0,0]=4 9646 B14R0.12 CCCCCCC(C)NCCC(=O)NC 270004a_100000738227_100000210826 [1,1,0,0,0,0|2,0,0]=4 9647 B14R0.12 CCCCCCC(C)NCCC(=O)NC 34a_100000210919_100012179268 [1,1,0,0,0,0|2,0,0]=4 9648 B14R0.12 CCCCCCC(C)NCCC(=O)NC 34a_100000738227_100011215978 [1,1,0,0,0,0|2,0,0]=4 9649 B14R0.12 CCCCCCC(C)NCCC(=O)OC 2230a_100000210919_100000204255 [1,1,0,0,0,0|1,0,0]=3 9650 B14R0.12 CCCCCCC(C)NCCC(=O)OC 34a_100000210919_100000742370 [1,1,0,0,0,0|1,0,0]=3 9651 B14R0.12 CCCCCCC(C)OCCC(=O)NC 34a_100000210265_100012179268 [1,1,0,0,0,0|2,0,0]=4 9652 B14R0.12 CCCCCCC(C)OCCC(=O)NC 34a_100000754576_100011215978 [1,1,0,0,0,0|2,0,0]=4 9653 B14R0.12 CCCCCCC(C)OCCC(=O)NC 7a_100000210265_100000737683 [1,1,0,0,0,0|2,0,0]=4 9654 B14R0.12 CCCCCCC(C)OCCC(=O)OC 34a_100000210265_100000742370 [1,1,0,0,0,0|1,0,0]=3 9655 B14R0.12 CCCCCCC(C)OCCC(=O)OC 7a_100000210265_100000204255 [1,1,0,0,0,0|1,0,0]=3 9656 B14R0.12 CCCCCCC(C)SCCC(=O)NC 62a_100000737683_100011215978 [1,1,0,0,0,0|2,0,0]=4 9657 B14R0.12 CCCCCCC(C)SCCC(=O)NC 62a_100011215978_100000737683 [1,1,0,0,0,0|2,0,0]=4 9658 B14R0.12 CCCCCCC(C)SCCC(=O)OC 62a_100000204255_100011215978 [1,1,0,0,0,0|1,0,0]=3 9659 B14R0.12 CCCCCCC(C)SCCC(=O)OC 62a_100011215978_100000204255 [1,1,0,0,0,0|1,0,0]=3 9660 B14R0.12 CCCCCCC(C)SCOC(=O)OC 62a_100011215978_100000139417 [1,1,0,0,0,0|2,0,0]=4 9661 B14R0.12 CCCCCCN(C)CCCC(=O)NC 2230a_106256046315_100000741757 [1,1,0,0,0,0|2,0,0]=4 9662 B14R0.12 CCCCCCN(C)CCCC(=O)NC 269982a_106256046315_100000741757 [1,1,0,0,0,0|2,0,0]=4 9663 B14R0.12 CCCCCCN(C)CCCC(=O)OC 2230a_106256046315_100011218270 [1,1,0,0,0,0|1,0,0]=3 9664 B14R0.12 CCCCCCN(C)CCCC(=O)OC 269982a_100000739225_100000210757 [1,1,0,0,0,0|1,0,0]=3 9665 B14R0.12 CCCCCCN(C)CCCC(=O)OC 269982a_106256046315_100011218270 [1,1,0,0,0,0|1,0,0]=3 9666 B14R0.12 CCCCCNC(=O)CCCC(=O)OC 11a_100000209983_100000239890 [1,1,0,0,0,0|1,0,1]=4 9667 B14R0.12 CCCCCNC(=O)CCCC(=O)OC 1626a_100000209983_100000239890 [1,1,0,0,0,0|1,0,1]=4 9668 B14R0.12 CCCCCNC(=O)CCCC(=O)OC 240690a_100000209983_100000239890 [1,1,0,0,0,0|1,0,1]=4 9669 B14R0.12 CCCCCNC(=O)CCCC(=O)OC 527a_100000209983_100000239890 [1,1,0,0,0,0|1,0,1]=4 9670 B14R0.12 CCCCOCC(=O)CCCC(=O)OC 1458a_100000239890_100011995733 [1,1,0,0,0,0|1,0,1]=4 9671 B14R0.12 CCCCOCC(=O)CCCC(=O)OC 1458a_100000757543_100011218270 [1,1,0,0,0,0|1,0,1]=4 9672 B14R0.12 CCCCOCC(C)OCCC(=O)OC 34a_100011217071_100000742370 [1,1,0,0,0,0|2,0,0]=4 9673 B14R0.12 CCCCOCC(C)OCCC(=O)OC 7a_100011217071_100000204255 [1,1,0,0,0,0|2,0,0]=4 9674 B14R0.12 CCCCOCN(C)CCCC(=O)OC 269982a_100000739225_100011995733 [1,1,0,0,0,0|2,0,0]=4 9675 B14R0.12 CCCCSCC(=O)CCCC(=O)OC 1458a_100000191162_100011218270 [1,1,0,0,0,0|1,0,1]=4 9676 B14R0.12 CCCOCCC(=O)CCCC(=O)OC 1458a_100000239890_100011215938 [1,1,0,0,0,0|1,0,1]=4 9677 B14R0.12 CCCOCCN(C)CCCC(=O)OC 269982a_100000739225_100011215938 [1,1,0,0,0,0|2,0,0]=4 9678 B14R0.12 CCOCCCC(=O)CCCC(=O)OC 1458a_100000239890_100012232248 [1,1,0,0,0,0|1,0,1]=4 9679 B14R0.12 CCOCCCN(C)CCCC(=O)OC 269982a_100000739225_100012232248 [1,1,0,0,0,0|2,0,0]=4 9680 B14R0.12 COC(=O)CCCC(=O)CCCCCF 1458a_100000239890_100000729378 [1,1,0,0,0,0|1,0,1]=4 9681 B14R0.12 COC(=O)CCCC(=O)CCCCCO 1458a_100000239890_100000746330 [1,1,0,0,0,0|1,0,1]=4 9682 B14R0.12 COC(=O)CCCC(=O)CCCCCO 1458a_100102619762_100011218270 [1,1,0,0,0,0|1,0,1]=4 9683 B14R0.12 COC(=O)CCCN(C)CCCCCF 269982a_100000739225_100000729378 [1,1,0,0,0,0|2,0,0]=4 9684 B14R0.12 COC(=O)CCCN(C)CCCCCO 2230a_100000722520_100011218270 [1,1,0,0,0,0|2,0,0]=4 9685 B14R0.12 COC(=O)CCCN(C)CCCCCO 269982a_100000722520_100011218270 [1,1,0,0,0,0|2,0,0]=4 9686 B14R0.12 COC(=O)CCCN(C)CCCCCO 269982a_100000739225_100000746330 [1,1,0,0,0,0|2,0,0]=4 9687 B14R0.12 COCCCCC(=O)CCCC(=O)OC 1458a_100000239890_100000755781 [1,1,0,0,0,0|1,0,1]=4 9688 B14R0.12 COCCCCN(C)CCCC(=O)OC 269982a_100000739225_100000730899 [1,1,0,0,0,0|2,0,0]=4 9689 B14R0.82 CCC(=O)CC(=O)CCCCCCCO 1458a_100011219782_100000747405 [1,1,0,0,0,0|1,0,1]=4 9690 B14R0.82 CCCCCCCCC(=O)CC(=O)CC 1458a_100000210188_100000747405 [1,1,0,0,0,0|0,0,1]=3 9691 B14R0.82 CCCCCCCCC(=O)CC(=O)NC 1458a_100000210188_100000183359 [1,1,0,0,0,0|1,0,1]=4 9692 B14R0.82 CCCCCCCCC(=O)CC(=O)OC 1458a_100000210188_100000747449 [1,1,0,0,0,0|0,0,1]=3 9693 B14R0.82 CCCCCCCCC(=O)CC(=O)OC 1458a_100000211351_100000210759 [1,1,0,0,0,0|0,0,1]=3 9694 B14R0.82 CCCCCCCCN(C)CC(=O)CC 269982a_100000207567_100000747405 [1,1,0,0,0,0|1,0,0]=3 9695 B14R0.82 CCCCCCCCN(C)CC(=O)NC 2230a_100000189611_100000210759 [1,1,0,0,0,0|2,0,0]=4 9696 B14R0.82 CCCCCCCCN(C)CC(=O)NC 2230a_100000207567_100000183359 [1,1,0,0,0,0|2,0,0]=4 9697 B14R0.82 CCCCCCCCN(C)CC(=O)NC 269982a_100000207567_100000183359 [1,1,0,0,0,0|2,0,0]=4 9698 B14R0.82 CCCCCCCCN(C)CC(=O)OC 2230a_100000198492_100000210759 [1,1,0,0,0,0|1,0,0]=3 9699 B14R0.82 CCCCCCCCN(C)CC(=O)OC 2230a_100000207567_100000747449 [1,1,0,0,0,0|1,0,0]=3 9700 B14R0.82 CCCCCCCCN(C)CC(=O)OC 269982a_100000207567_100000747449 [1,1,0,0,0,0|1,0,0]=3 9701 B14R0.82 CCCCCCCNC(=O)CC(=O)OC 240690a_100000229938_100000211351 [1,1,0,0,0,0|1,0,1]=4 9702 B14R0.82 CCCCCCCNC(C)CC(=O)OC 2230a_100000229938_100009817358 [1,1,0,0,0,0|1,0,0]=3 9703 B14R0.82 CCCCCCCOC(C)CC(=O)OC 34a_100000210272_100009817358 [1,1,0,0,0,0|1,0,0]=3 9704 B14R0.82 CCCCCCCOC(C)CC(=O)OC 7a_100000210272_100009817358 [1,1,0,0,0,0|1,0,0]=3 9705 B14R0.82 CCCCCCCSC(C)CC(=O)OC 62a_100000210614_100009817358 [1,1,0,0,0,0|1,0,0]=3 9706 B14R0.82 CCCCCCCSC(C)CC(=O)OC 62a_100009817358_100000210316 [1,1,0,0,0,0|1,0,0]=3 9707 B14R0.82 CCCCCCOC[C@H](O)CC(=O)OC 34a_100000210259_100000754131 [1,1,0,0,0,0|1,0,0]=3 9708 B14R0.82 CCCCCCOC[C@H](O)CC(=O)OC 7a_100000210259_100000754131 [1,1,0,0,0,0|1,0,0]=3 9709 B14R0.82 CCCCCCSCC(=O)CC(=O)OC 62a_100000210314_100000210525 [1,1,0,0,0,0|1,0,1]=4 9710 B14R0.82 CCCCCCSCC(=O)CC(=O)OC 62a_100000210525_100000210757 [1,1,0,0,0,0|1,0,1]=4 9711 B14R0.82 CCCCCCSC[C@H](O)CC(=O)OC 62a_100000210314_100000754131 [1,1,0,0,0,0|1,0,0]=3 9712 B14R0.82 CCCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100000210757 [1,1,0,0,0,0|1,0,0]=3 9713 B14R0.82 CCCCOCCOC(C)CC(=O)OC 34a_100000210238_100009817358 [1,1,0,0,0,0|2,0,0]=4 9714 B14R0.82 CCCCOCCOC(C)CC(=O)OC 7a_100000210238_100009817358 [1,1,0,0,0,0|2,0,0]=4 9715 B14R0.82 CCCCOCCSC(C)CC(=O)OC 62a_100000743108_100009817358 [1,1,0,0,0,0|2,0,0]=4 9716 B14R0.82 CCCCOCCSC(C)CC(=O)OC 62a_100009817358_100000743108 [1,1,0,0,0,0|2,0,0]=4 9717 B14R0.82 CCCCOCSC[C@H](O)CC(=O)OC 62a_100000754131_100011995733 [1,1,0,0,0,0|2,0,0]=4 9718 B14R0.82 CCCCOCSC[C@H](O)CC(=O)OC 62a_100011995733_100000754131 [1,1,0,0,0,0|2,0,0]=4 9719 B14R0.82 CCCCSCCNC(C)CC(=O)OC 2230a_100025743550_100009817358 [1,1,0,0,0,0|2,0,0]=4 9720 B14R0.82 CCCCSCCOC(C)CC(=O)OC 34a_200000230436_100009817358 [1,1,0,0,0,0|2,0,0]=4 9721 B14R0.82 CCCCSCCOC(C)CC(=O)OC 7a_200000230436_100009817358 [1,1,0,0,0,0|2,0,0]=4 9722 B14R0.82 CCCOCCCNC(C)CC(=O)OC 2230a_100011217757_100009817358 [1,1,0,0,0,0|2,0,0]=4 9723 B14R0.82 CCCOCCCNC(C)CC(=O)OC 34a_100011217757_100009817358 [1,1,0,0,0,0|2,0,0]=4 9724 B14R0.82 CCCOCCNC[C@H](O)CC(=O)OC 34a_100161115042_100000754131 [1,1,0,0,0,0|2,0,0]=4 9725 B14R0.82 CCCOCCOC[C@H](O)CC(=O)OC 34a_100000752267_100000754131 [1,1,0,0,0,0|2,0,0]=4 9726 B14R0.82 CCCOCCOC[C@H](O)CC(=O)OC 7a_100000752267_100000754131 [1,1,0,0,0,0|2,0,0]=4 9727 B14R0.82 CCCOCCSC[C@H](O)CC(=O)OC 62a_100000754131_100011215938 [1,1,0,0,0,0|2,0,0]=4 9728 B14R0.82 CCCOCCSC[C@H](O)CC(=O)OC 62a_100011215938_100000754131 [1,1,0,0,0,0|2,0,0]=4 9729 B14R0.82 CCCSCCOC[C@H](O)CC(=O)OC 34a_200000230433_100000754131 [1,1,0,0,0,0|2,0,0]=4 9730 B14R0.82 CCCSCCOC[C@H](O)CC(=O)OC 7a_200000230433_100000754131 [1,1,0,0,0,0|2,0,0]=4 9731 B14R0.82 CCOCCCNC[C@H](O)CC(=O)OC 34a_100000210961_100000754131 [1,1,0,0,0,0|2,0,0]=4 9732 B14R0.82 CCOCCCOC[C@H](O)CC(=O)OC 34a_100000757476_100000754131 [1,1,0,0,0,0|2,0,0]=4 9733 B14R0.82 CCOCCCOC[C@H](O)CC(=O)OC 7a_100000757476_100000754131 [1,1,0,0,0,0|2,0,0]=4 9734 B14R0.82 CCOCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100012232248 [1,1,0,0,0,0|2,0,0]=4 9735 B14R0.82 CCOCCCSC[C@H](O)CC(=O)OC 62a_100012232248_100000754131 [1,1,0,0,0,0|2,0,0]=4 9736 B14R0.82 CCSCCCOC[C@H](O)CC(=O)OC 34a_100011216438_100000754131 [1,1,0,0,0,0|2,0,0]=4 9737 B14R0.82 CCSCCCOC[C@H](O)CC(=O)OC 7a_100011216438_100000754131 [1,1,0,0,0,0|2,0,0]=4 9738 B14R0.82 CNCCCCCOC(C)CC(=O)OC 34a_100000722520_100009817358 [1,1,0,0,0,0|2,0,0]=4 9739 B14R0.82 COC(=O)CC(=O)CCCCCCCO 1458a_100000211351_100000760002 [1,1,0,0,0,0|1,0,1]=4 9740 B14R0.82 COC(=O)CC(=O)CCCCCCCO 1458a_100011219782_100000747449 [1,1,0,0,0,0|1,0,1]=4 9741 B14R0.82 COC(=O)CC(C)NCCCCCCO 2230a_100000686447_100009817358 [1,1,0,0,0,0|2,0,0]=4 9742 B14R0.82 COC(=O)CC(C)NCCCCCCO 34a_100000686447_100009817358 [1,1,0,0,0,0|2,0,0]=4 9743 B14R0.82 COC(=O)CC(C)OCCCCCCBr 34a_100011215345_100009817358 [1,1,0,0,0,0|2,0,0]=4 9744 B14R0.82 COC(=O)CC(C)OCCCCCCBr 7a_100011215345_100009817358 [1,1,0,0,0,0|2,0,0]=4 9745 B14R0.82 COC(=O)CC(C)OCCCCCCCl 34a_100000766143_100009817358 [1,1,0,0,0,0|2,0,0]=4 9746 B14R0.82 COC(=O)CC(C)OCCCCCCCl 7a_100000766143_100009817358 [1,1,0,0,0,0|2,0,0]=4 9747 B14R0.82 COC(=O)CC(C)OCCCCCCF 34a_100000732779_100009817358 [1,1,0,0,0,0|2,0,0]=4 9748 B14R0.82 COC(=O)CC(C)OCCCCCCF 7a_100000732779_100009817358 [1,1,0,0,0,0|2,0,0]=4 9749 B14R0.82 COC(=O)CC(C)OCCCCCCN 34a_100000686447_100009817358 [1,1,0,0,0,0|2,0,0]=4 9750 B14R0.82 COC(=O)CC(C)SCCCCCCF 62a_100009817358_100015922095 [1,1,0,0,0,0|2,0,0]=4 9751 B14R0.82 COC(=O)CC(C)SCCCCCCF 62a_100015922095_100009817358 [1,1,0,0,0,0|2,0,0]=4 9752 B14R0.82 COC(=O)CC(C)SCCCCCCO 62a_100000766143_100009817358 [1,1,0,0,0,0|2,0,0]=4 9753 B14R0.82 COC(=O)CC(C)SCCCCCCO 62a_100009817358_100000766143 [1,1,0,0,0,0|2,0,0]=4 9754 B14R0.82 COC(=O)CN(C)CCCCCCCO 2230a_100000198492_100000760002 [1,1,0,0,0,0|2,0,0]=4 9755 B14R0.82 COC(=O)C[C@@H](O)CNCCCCCO 34a_100000762737_100000754131 [1,1,0,0,0,0|2,0,0]=4 9756 B14R0.82 COC(=O)C[C@@H](O)COCCCCCBr 34a_100000746331_100000754131 [1,1,0,0,0,0|2,0,0]=4 9757 B14R0.82 COC(=O)C[C@@H](O)COCCCCCBr 7a_100000746331_100000754131 [1,1,0,0,0,0|2,0,0]=4 9758 B14R0.82 COC(=O)C[C@@H](O)COCCCCCCl 34a_100000746330_100000754131 [1,1,0,0,0,0|2,0,0]=4 9759 B14R0.82 COC(=O)C[C@@H](O)COCCCCCCl 7a_100000746330_100000754131 [1,1,0,0,0,0|2,0,0]=4 9760 B14R0.82 COC(=O)C[C@@H](O)COCCCCCI 34a_200012148887_100000754131 [1,1,0,0,0,0|2,0,0]=4 9761 B14R0.82 COC(=O)C[C@@H](O)COCCCCCI 7a_200012148887_100000754131 [1,1,0,0,0,0|2,0,0]=4 9762 B14R0.82 COC(=O)C[C@@H](O)COCCCCCN 34a_100000762737_100000754131 [1,1,0,0,0,0|2,0,0]=4 9763 B14R0.82 COC(=O)C[C@@H](O)COCCCCSC 34a_100011217163_100000754131 [1,1,0,0,0,0|2,0,0]=4 9764 B14R0.82 COC(=O)C[C@@H](O)COCCCCSC 7a_100011217163_100000754131 [1,1,0,0,0,0|2,0,0]=4 9765 B14R0.82 COC(=O)C[C@@H](O)CSCCCCCF 62a_100000729378_100000754131 [1,1,0,0,0,0|2,0,0]=4 9766 B14R0.82 COC(=O)C[C@@H](O)CSCCCCCF 62a_100000754131_100000729378 [1,1,0,0,0,0|2,0,0]=4 9767 B14R0.82 COC(=O)C[C@@H](O)CSCCCCCO 62a_100000746330_100000754131 [1,1,0,0,0,0|2,0,0]=4 9768 B14R0.82 COC(=O)C[C@@H](O)CSCCCCCO 62a_100000754131_100000746330 [1,1,0,0,0,0|2,0,0]=4 9769 B14R0.82 COCCCCCCC(=O)CC(=O)OC 1458a_100000211351_100011998445 [1,1,0,0,0,0|1,0,1]=4 9770 B14R0.82 COCCCCCCN(C)CC(=O)OC 2230a_100000198492_100011998445 [1,1,0,0,0,0|2,0,0]=4 9771 B14R0.82 COCCCCCNC(C)CC(=O)OC 2230a_100000747528_100009817358 [1,1,0,0,0,0|2,0,0]=4 9772 B14R0.82 COCCCCCNC(C)CC(=O)OC 34a_100000747528_100009817358 [1,1,0,0,0,0|2,0,0]=4 9773 B14R0.82 COCCCCOC[C@H](O)CC(=O)OC 34a_100000740925_100000754131 [1,1,0,0,0,0|2,0,0]=4 9774 B14R0.82 COCCCCSC[C@H](O)CC(=O)OC 62a_100000730899_100000754131 [1,1,0,0,0,0|2,0,0]=4 9775 B14R0.82 COCCCCSC[C@H](O)CC(=O)OC 62a_100000754131_100000730899 [1,1,0,0,0,0|2,0,0]=4 9776 B14R0.140 CCCCCCCC(=O)CCC(=O)NC 1458a_100011309844_100000210614 [1,1,0,0,0,0|1,0,1]=4 9777 B14R0.140 CCCCCCCC(=O)CCC(=O)OC 1458a_100000187943_100000210614 [1,1,0,0,0,0|0,0,1]=3 9778 B14R0.140 CCCCCCCC(=O)CCS(=O)CC 1458a_100011387550_100000210614 [1,1,0,0,0,0|1,0,1]=4 9779 B14R0.140 CCCCCCCC(=O)CNC(=O)CC 1458a_100000194589_100000210614 [1,1,0,0,0,0|1,0,1]=4 9780 B14R0.140 CCCCCCCC(=O)CNC(=O)OC 1458a_100000215747_100000210614 [1,1,0,0,0,0|1,0,1]=4 9781 B14R0.140 CCCCCCCC(=O)NCC(=O)CC 1458a_100000691742_100000210202 [1,1,0,0,0,0|1,0,1]=4 9782 B14R0.140 CCCCCCCC(=O)NCC(=O)OC 188690a_100000185156_100000211969 [1,1,0,0,0,0|1,0,1]=4 9783 B14R0.140 CCCCCCCC(=O)OCC(=O)CC 1458a_100000210414_100009852258 [1,1,0,0,0,0|1,0,1]=4 9784 B14R0.140 CCCCCCCC(C)NCC(=O)NC 2230a_100000693194_200011218727 [1,1,0,0,0,0|2,0,0]=4 9785 B14R0.140 CCCCCCCC(C)NCC(=O)NC 270004a_100000693194_100000210596 [1,1,0,0,0,0|2,0,0]=4 9786 B14R0.140 CCCCCCCC(C)OCC(=O)CC 34a_100000725409_200011218727 [1,1,0,0,0,0|1,0,0]=3 9787 B14R0.140 CCCCCCCC(C)OCC(=O)CC 7a_200011215852_100000747405 [1,1,0,0,0,0|1,0,0]=3 9788 B14R0.140 CCCCCCCC(C)OCC(=O)NC 34a_100000750040_200011218727 [1,1,0,0,0,0|2,0,0]=4 9789 B14R0.140 CCCCCCCC(C)OCC(=O)NC 34a_200011215852_100000183359 [1,1,0,0,0,0|2,0,0]=4 9790 B14R0.140 CCCCCCCC(C)OCC(=O)NC 7a_200011215852_100000183359 [1,1,0,0,0,0|2,0,0]=4 9791 B14R0.140 CCCCCCCC(C)OCC(=O)OC 34a_200011215852_100000747449 [1,1,0,0,0,0|1,0,0]=3 9792 B14R0.140 CCCCCCCC(C)OCC(=O)OC 7a_200011215852_100000747449 [1,1,0,0,0,0|1,0,0]=3 9793 B14R0.140 CCCCCCCC(C)SCC(=O)CC 62a_100000747405_200011218727 [1,1,0,0,0,0|1,0,0]=3 9794 B14R0.140 CCCCCCCC(C)SCC(=O)CC 62a_200011218727_100000747405 [1,1,0,0,0,0|1,0,0]=3 9795 B14R0.140 CCCCCCCC(C)SCC(=O)NC 62a_100000183359_200011218727 [1,1,0,0,0,0|2,0,0]=4 9796 B14R0.140 CCCCCCCC(C)SCC(=O)NC 62a_200011218727_100000183359 [1,1,0,0,0,0|2,0,0]=4 9797 B14R0.140 CCCCCCCC(C)SCC(=O)OC 62a_100000747449_200011218727 [1,1,0,0,0,0|1,0,0]=3 9798 B14R0.140 CCCCCCCC(C)SCC(=O)OC 62a_200011218727_100000747449 [1,1,0,0,0,0|1,0,0]=3 9799 B14R0.140 CCCCCCCN(C)CCC(=O)NC 2230a_100000228206_100000737683 [1,1,0,0,0,0|2,0,0]=4 9800 B14R0.140 CCCCCCCN(C)CCC(=O)NC 2230a_100000750875_100000210681 [1,1,0,0,0,0|2,0,0]=4 9801 B14R0.140 CCCCCCCN(C)CCC(=O)NC 269982a_100000228206_100000737683 [1,1,0,0,0,0|2,0,0]=4 9802 B14R0.140 CCCCCCCN(C)CCC(=O)NC 269982a_100000750875_100000210681 [1,1,0,0,0,0|2,0,0]=4 9803 B14R0.140 CCCCCCCN(C)CCC(=O)OC 2230a_100000228206_100000204255 [1,1,0,0,0,0|1,0,0]=3 9804 B14R0.140 CCCCCCCN(C)CCC(=O)OC 269982a_100000228206_100000204255 [1,1,0,0,0,0|1,0,0]=3 9805 B14R0.140 CCCCCCCN(C)CCC(=O)OC 269982a_100025711912_100000210681 [1,1,0,0,0,0|1,0,0]=3 9806 B14R0.140 CCCCCCNC(=O)CCC(=O)OC 11a_100000210581_100000187943 [1,1,0,0,0,0|1,0,1]=4 9807 B14R0.140 CCCCCCNC(=O)CCC(=O)OC 1626a_100000210581_100000187943 [1,1,0,0,0,0|1,0,1]=4 9808 B14R0.140 CCCCCCNC(=O)CCC(=O)OC 240690a_100000210581_100000187943 [1,1,0,0,0,0|1,0,1]=4 9809 B14R0.140 CCCCCCNC(=O)CCC(=O)OC 527a_100000210581_100000187943 [1,1,0,0,0,0|1,0,1]=4 9810 B14R0.140 CCCCCNCC(=O)CCC(=O)OC 2230a_100000209983_100000691467 [1,1,0,0,0,0|1,0,1]=4 9811 B14R0.140 CCCCCOCC(=O)CCC(=O)OC 34a_100000210253_100000691467 [1,1,0,0,0,0|1,0,1]=4 9812 B14R0.140 CCCCCOCC(=O)CCC(=O)OC 7a_100000210253_100000691467 [1,1,0,0,0,0|1,0,1]=4 9813 B14R0.140 CCCCCSCC(=O)CCC(=O)OC 62a_100000210326_100000691467 [1,1,0,0,0,0|1,0,1]=4 9814 B14R0.140 CCCCCSCC(=O)CCC(=O)OC 62a_100000691467_100000210326 [1,1,0,0,0,0|1,0,1]=4 9815 B14R0.140 CCCCOCCC(=O)CCC(=O)OC 1458a_100000187943_100000743108 [1,1,0,0,0,0|1,0,1]=4 9816 B14R0.140 CCCCOCCN(C)CCC(=O)OC 269982a_100025711912_100000743108 [1,1,0,0,0,0|2,0,0]=4 9817 B14R0.140 COC(=O)CCC(=O)CCCCCCF 1458a_100000187943_100015922095 [1,1,0,0,0,0|1,0,1]=4 9818 B14R0.140 COC(=O)CCC(=O)CCCCCCO 1458a_100000187943_100000766143 [1,1,0,0,0,0|1,0,1]=4 9819 B14R0.140 COC(=O)CCN(C)CCCCCCF 269982a_100025711912_100015922095 [1,1,0,0,0,0|2,0,0]=4 9820 B14R0.140 COC(=O)CCN(C)CCCCCCO 269982a_100025711912_100000766143 [1,1,0,0,0,0|2,0,0]=4 9821 B14R0.152 CCCCC(=O)CCCCCC(=O)OC 1458a_100000210183_100009816466 [1,1,0,0,0,0|0,0,1]=3 9822 B14R0.152 CCCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000210211 [1,1,0,0,0,0|0,0,1]=3 9823 B14R0.152 CCCCC(=O)NCCCCC(=O)OC 188690a_100000746077_100000210183 [1,1,0,0,0,0|1,0,1]=4 9824 B14R0.152 CCCCC(C)COCCCC(=O)NC 34a_100011995851_100000741757 [1,1,0,0,0,0|2,0,0]=4 9825 B14R0.152 CCCCC(C)COCCCC(=O)NC 7a_100011995851_100000741757 [1,1,0,0,0,0|2,0,0]=4 9826 B14R0.152 CCCCC(C)COCCCC(=O)OC 34a_100011995851_100000742333 [1,1,0,0,0,0|1,0,0]=3 9827 B14R0.152 CCCCC(C)COCCCC(=O)OC 7a_100011995851_100011218270 [1,1,0,0,0,0|1,0,0]=3 9828 B14R0.152 CCCCC(C)NCCCCC(=O)OC 2230a_100000126638_100000204269 [1,1,0,0,0,0|1,0,0]=3 9829 B14R0.152 CCCCC(C)NCCOCC(=O)OC 2230a_100000126638_100000090808 [1,1,0,0,0,0|2,0,0]=4 9830 B14R0.152 CCCCC(C)OCCCCC(=O)OC 34a_100000059025_200011215066 [1,1,0,0,0,0|1,0,0]=3 9831 B14R0.152 CCCCC(C)OCCCCC(=O)OC 34a_100000687866_100000204269 [1,1,0,0,0,0|1,0,0]=3 9832 B14R0.152 CCCCC(C)OCCCCC(=O)OC 7a_100000059025_200011215066 [1,1,0,0,0,0|1,0,0]=3 9833 B14R0.152 CCCCC(C)OCCCCC(=O)OC 7a_100000687866_100000204269 [1,1,0,0,0,0|1,0,0]=3 9834 B14R0.152 CCCCC(C)OCCOCC(=O)OC 34a_100000687866_100000090808 [1,1,0,0,0,0|2,0,0]=4 9835 B14R0.152 CCCCC(C)OCCOCC(=O)OC 7a_100000687866_100000090808 [1,1,0,0,0,0|2,0,0]=4 9836 B14R0.152 CCCCC(C)SCCCCC(=O)OC 62a_100000204269_200011215066 [1,1,0,0,0,0|1,0,0]=3 9837 B14R0.152 CCCCC(C)SCCCCC(=O)OC 62a_200011215066_100000204269 [1,1,0,0,0,0|1,0,0]=3 9838 B14R0.152 CCCCC(C)SCCOCC(=O)OC 62a_100000090808_200011215066 [1,1,0,0,0,0|2,0,0]=4 9839 B14R0.152 CCCCC(C)SCCOCC(=O)OC 62a_200011215066_100000090808 [1,1,0,0,0,0|2,0,0]=4 9840 B14R0.152 CCCCN(C)CCCCCC(=O)OC 2230a_100000207549_100009816466 [1,1,0,0,0,0|1,0,0]=3 9841 B14R0.152 CCCCN(C)CCCCCC(=O)OC 269982a_100000207549_100009816466 [1,1,0,0,0,0|1,0,0]=3 9842 B14R0.152 CCCC[C@H](N)COCCCC(=O)NC 34a_100011934283_100000741757 [1,1,0,0,0,0|2,0,0]=4 9843 B14R0.152 CCCC[C@H](N)COCCCC(=O)OC 34a_100011934283_100000742333 [1,1,0,0,0,0|1,0,0]=3 9844 B14R0.152 CCCNC(=O)CCCCCC(=O)OC 11a_100020643023_100009848860 [1,1,0,0,0,0|1,0,1]=4 9845 B14R0.152 CCCNC(=O)CCCCCC(=O)OC 1626a_100020643023_100009848860 [1,1,0,0,0,0|1,0,1]=4 9846 B14R0.152 CCCNC(=O)CCCCCC(=O)OC 240690a_100020643023_100009848860 [1,1,0,0,0,0|1,0,1]=4 9847 B14R0.152 CCCOC(C)CNCCCC(=O)OC 2230a_100015185124_100011218270 [1,1,0,0,0,0|2,0,0]=4 9848 B14R0.152 CCCOC(C)CNCCCC(=O)OC 34a_100015185124_100000742333 [1,1,0,0,0,0|2,0,0]=4 9849 B14R0.152 CCOCC(=O)CCCCCC(=O)OC 1458a_100000211967_100009816466 [1,1,0,0,0,0|1,0,1]=4 9850 B14R0.152 CCOCC(C)OCCCCC(=O)OC 34a_100000718985_100000204269 [1,1,0,0,0,0|2,0,0]=4 9851 B14R0.152 CCOCC(C)OCCCCC(=O)OC 7a_100000718985_100000204269 [1,1,0,0,0,0|2,0,0]=4 9852 B14R0.152 CCOCC(O)CNCCCC(=O)OC 2230a_102515437182_100011218270 [1,1,0,0,0,0|2,0,0]=4 9853 B14R0.152 CCOCC(O)CNCCCC(=O)OC 34a_102515437182_100000742333 [1,1,0,0,0,0|2,0,0]=4 9854 B14R0.152 CCSCC(=O)CCCCCC(=O)OC 1458a_100000230394_100009816466 [1,1,0,0,0,0|1,0,1]=4 9855 B14R0.152 COC(=O)CCCCCC(=O)CCCF 1458a_100009848860_100011934791 [1,1,0,0,0,0|1,0,1]=4 9856 B14R0.152 COC(=O)CCCCCC(=O)CCCO 1458a_100009848860_100011215043 [1,1,0,0,0,0|1,0,1]=4 9857 B14R0.152 COC(=O)CCCCCC(=O)CCSC 1458a_100000174002_100009816466 [1,1,0,0,0,0|1,0,1]=4 9858 B14R0.152 COC(=O)CCCCCC(=O)CCSC 1458a_100009848860_100000751147 [1,1,0,0,0,0|1,0,1]=4 9859 B14R0.152 COC(=O)CCCCCN(C)CCCO 2230a_100000213112_100009816466 [1,1,0,0,0,0|2,0,0]=4 9860 B14R0.152 COC(=O)CCCCCN(C)CCCO 269982a_100000213112_100009816466 [1,1,0,0,0,0|2,0,0]=4 9861 B14R0.152 COC(=O)CCCCCN(C)CCSC 2230a_100000686725_100009816466 [1,1,0,0,0,0|2,0,0]=4 9862 B14R0.152 COC(=O)CCCCCN(C)CCSC 269982a_100000686725_100009816466 [1,1,0,0,0,0|2,0,0]=4 9863 B14R0.152 COC(=O)CCCCOC(C)CCCCl 34a_200000718107_100000204269 [1,1,0,0,0,0|2,0,0]=4 9864 B14R0.152 COC(=O)CCCCOC(C)CCCCl 7a_200000718107_100000204269 [1,1,0,0,0,0|2,0,0]=4 9865 B14R0.152 COC(=O)CCCNC[C@H](C)CCCO 2230a_100160569302_100011218270 [1,1,0,0,0,0|2,0,0]=4 9866 B14R0.152 COC(=O)CCCNC[C@H](C)CCCO 34a_100160569302_100000742333 [1,1,0,0,0,0|2,0,0]=4 9867 B14R0.152 COC(=O)CCCOC[C@@H](N)CCSC 34a_100011827619_100000742333 [1,1,0,0,0,0|2,0,0]=4 9868 B14R0.152 COCCC(=O)CCCCCC(=O)OC 1458a_100000749529_100009816466 [1,1,0,0,0,0|1,0,1]=4 9869 B14R0.152 COCCC(=O)CCCCCC(=O)OC 1458a_100009848860_100000233755 [1,1,0,0,0,0|1,0,1]=4 9870 B14R0.152 COCCN(C)CCCCCC(=O)OC 2230a_100000743101_100009816466 [1,1,0,0,0,0|2,0,0]=4 9871 B14R0.152 COCCN(C)CCCCCC(=O)OC 269982a_100000743101_100009816466 [1,1,0,0,0,0|2,0,0]=4 9872 B14R0.197 CCC(=O)CCCCCCCC(=O)OC 1458a_100000033222_100000210202 [1,1,0,0,0,0|0,0,1]=3 9873 B14R0.197 CCC(=O)CCCCCCCC(=O)OC 1458a_100000210414_100010004213 [1,1,0,0,0,0|0,0,1]=3 9874 B14R0.197 CCC(=O)COCCCCCC(=O)OC 34a_100000725409_100009816466 [1,1,0,0,0,0|1,0,1]=4 9875 B14R0.197 CCC(=O)COCCCCCC(=O)OC 7a_100000074720_100000747405 [1,1,0,0,0,0|1,0,1]=4 9876 B14R0.197 CCC(=O)COCCCCCC(C)CC 7a_200000035636_100000747405 [1,1,0,0,0,0|1,0,0]=3 9877 B14R0.197 CCC(=O)CSCCCCCC(=O)OC 62a_100000747405_100009816466 [1,1,0,0,0,0|1,0,1]=4 9878 B14R0.197 CCC(=O)CSCCCCCC(=O)OC 62a_100009816466_100000747405 [1,1,0,0,0,0|1,0,1]=4 9879 B14R0.197 CCC(=O)NCCCCCCC(=O)OC 188690a_100000739044_100000210414 [1,1,0,0,0,0|1,0,1]=4 9880 B14R0.197 CCC(C)CCCCCOCC(=O)NC 7a_200000035636_100000183359 [1,1,0,0,0,0|2,0,0]=4 9881 B14R0.197 CCC(C)CCCCCOCC(=O)OC 7a_200000035636_100000747449 [1,1,0,0,0,0|1,0,0]=3 9882 B14R0.197 CCC(C)CCCOCCCC(=O)NC 7a_100011216074_100000741757 [1,1,0,0,0,0|2,0,0]=4 9883 B14R0.197 CCC(C)CCCOCCCC(=O)OC 7a_100011216074_100011218270 [1,1,0,0,0,0|1,0,0]=3 9884 B14R0.197 CCC(C)CCNCCCCC(=O)OC 2230a_100020591266_100000204269 [1,1,0,0,0,0|1,0,0]=3 9885 B14R0.197 CCC(C)CCNCCOCC(=O)OC 2230a_100020591266_100000090808 [1,1,0,0,0,0|2,0,0]=4 9886 B14R0.197 CCC(C)CCOCCCCC(=O)OC 7a_100011215188_100000204269 [1,1,0,0,0,0|1,0,0]=3 9887 B14R0.197 CCC(C)CCOCCOCC(=O)OC 7a_100011215188_100000090808 [1,1,0,0,0,0|2,0,0]=4 9888 B14R0.197 CCC(C)CNCCCCCC(=O)OC 2230a_100020588543_100009816466 [1,1,0,0,0,0|1,0,0]=3 9889 B14R0.197 CCC(C)COCCCCCC(=O)OC 34a_100000074720_100000748023 [1,1,0,0,0,0|1,0,0]=3 9890 B14R0.197 CCC(C)COCCCCCC(=O)OC 7a_100000074720_100000748023 [1,1,0,0,0,0|1,0,0]=3 9891 B14R0.197 CCC(C)CSCCCCCC(=O)OC 62a_100000748023_100009816466 [1,1,0,0,0,0|1,0,0]=3 9892 B14R0.197 CCC(C)CSCCCCCC(=O)OC 62a_100009816466_100000748023 [1,1,0,0,0,0|1,0,0]=3 9893 B14R0.197 CCC(C)NCCCCCCC(=O)OC 2230a_100000209981_100009815986 [1,1,0,0,0,0|1,0,0]=3 9894 B14R0.197 CCC(C)OCCCCCCC(=O)OC 34a_100009863599_100011215416 [1,1,0,0,0,0|1,0,0]=3 9895 B14R0.197 CCC(C)OCCCCCCC(=O)OC 7a_100000210228_100009815986 [1,1,0,0,0,0|1,0,0]=3 9896 B14R0.197 CCC(C)OCCCCCCC(=O)OC 7a_100009863599_100000758301 [1,1,0,0,0,0|1,0,0]=3 9897 B14R0.197 CCC(C)SCCCCCCC(=O)OC 62a_100000758301_100009815986 [1,1,0,0,0,0|1,0,0]=3 9898 B14R0.197 CCC(C)SCCCCCCC(=O)OC 62a_100009815986_100000758301 [1,1,0,0,0,0|1,0,0]=3 9899 B14R0.197 CCC(O)CNCCCCCC(=O)OC 2230a_100011218483_100009816466 [1,1,0,0,0,0|1,0,0]=3 9900 B14R0.197 CCC(O)COCCCCCC(=O)OC 34a_100000074720_100011218378 [1,1,0,0,0,0|1,0,0]=3 9901 B14R0.197 CCC(O)COCCCCCC(=O)OC 7a_100000074720_100011218378 [1,1,0,0,0,0|1,0,0]=3 9902 B14R0.197 CCC(O)CSCCCCCC(=O)OC 62a_100009816466_100011218378 [1,1,0,0,0,0|1,0,0]=3 9903 B14R0.197 CCC(O)CSCCCCCC(=O)OC 62a_100011218378_100009816466 [1,1,0,0,0,0|1,0,0]=3 9904 B14R0.197 CCN(C)CCCCCCCC(=O)OC 2230a_100000225621_100010004213 [1,1,0,0,0,0|1,0,0]=3 9905 B14R0.197 CCN(C)CCCCCCCC(=O)OC 269982a_100000225621_100010004213 [1,1,0,0,0,0|1,0,0]=3 9906 B14R0.197 CCN(C)CCCSCCCC(=O)OC 62a_100011218270_100015186262 [1,1,0,0,0,0|2,0,0]=4 9907 B14R0.197 CC[C@H](C)COCCCCCC(=O)OC 34a_100000074720_100009816398 [1,1,0,0,0,0|1,0,0]=3 9908 B14R0.197 CC[C@H](C)COCCCCCC(=O)OC 7a_100000074720_100009816398 [1,1,0,0,0,0|1,0,0]=3 9909 B14R0.197 CC[C@H](C)COCCCCCC(=O)OC 7a_100009816381_100009816466 [1,1,0,0,0,0|1,0,0]=3 9910 B14R0.197 CC[C@H](C)CSCCCCCC(=O)OC 62a_100009816398_100009816466 [1,1,0,0,0,0|1,0,0]=3 9911 B14R0.197 CC[C@H](C)CSCCCCCC(=O)OC 62a_100009816466_100009816398 [1,1,0,0,0,0|1,0,0]=3 9912 B14R0.197 CNC(=O)CCCCCCCC(=O)OC 11a_106832991635_100000033222 [1,1,0,0,0,0|1,0,1]=4 9913 B14R0.197 CNC(=O)CCCCCCCC(=O)OC 1626a_100102657272_100000033222 [1,1,0,0,0,0|1,0,1]=4 9914 B14R0.197 CNC(=O)CCCCCCCC(=O)OC 240690a_100102657272_100000033222 [1,1,0,0,0,0|1,0,1]=4 9915 B14R0.197 COC(=O)CCCCCCCC(=O)CF 1458a_100000033222_100015361967 [1,1,0,0,0,0|1,0,1]=4 9916 B14R0.197 COC(=O)CCCCCCCC(=O)CO 1458a_100000210174_100010004213 [1,1,0,0,0,0|1,0,1]=4 9917 B14R0.197 COC(=O)CCCCCCN[C@H](C)CO 2230a_100000737577_100009815986 [1,1,0,0,0,0|2,0,0]=4 9918 B14R0.197 COC(=O)CCCCCCOC(C)CF 34a_100016041109_100009815986 [1,1,0,0,0,0|2,0,0]=4 9919 B14R0.197 COC(=O)CCCCCCOC(C)CF 7a_100016041109_100009815986 [1,1,0,0,0,0|2,0,0]=4 9920 B14R0.197 COC(=O)CCCCCCOC(C)CN 34a_100000210904_100009815986 [1,1,0,0,0,0|2,0,0]=4 9921 B14R0.197 COC(=O)CCCCCCOC(C)CO 34a_100009863599_100012180447 [1,1,0,0,0,0|2,0,0]=4 9922 B14R0.197 COC(=O)CCCCCCOC(C)CO 7a_100009863599_100012180447 [1,1,0,0,0,0|2,0,0]=4 9923 B14R0.197 COC(=O)CCCCCCSC(C)CO 62a_100012180447_100009815986 [1,1,0,0,0,0|2,0,0]=4 9924 B14R0.197 COC(=O)CCCCCCSC(C)OC 62a_100009815986_100009879195 [1,1,0,0,0,0|2,0,0]=4 9925 B14R0.197 COC(=O)CCCCCCSC(C)OC 62a_100009879195_100009815986 [1,1,0,0,0,0|2,0,0]=4 9926 B14R0.197 COC(=O)CCCCCCS[C@H](C)CO 62a_100009815986_100016084084 [1,1,0,0,0,0|2,0,0]=4 9927 B14R0.197 COC(=O)CCCCCCS[C@H](C)CO 62a_100016084084_100009815986 [1,1,0,0,0,0|2,0,0]=4 9928 B14R0.197 COC(=O)CCCCCNCC(C)CO 34a_100000744482_100009816466 [1,1,0,0,0,0|2,0,0]=4 9929 B14R0.197 COC(=O)CCCCCNC[C@@H](C)OC 2230a_100020591295_100009816466 [1,1,0,0,0,0|2,0,0]=4 9930 B14R0.197 COC(=O)CCCCCNC[C@@H](F)CO 34a_100015665980_100009816466 [1,1,0,0,0,0|2,0,0]=4 9931 B14R0.197 COC(=O)CCCCCNC[C@H](O)CO 2230a_100020644852_100009816466 [1,1,0,0,0,0|2,0,0]=4 9932 B14R0.197 COC(=O)CCCCCOCC(C)CN 34a_100000744482_100009816466 [1,1,0,0,0,0|2,0,0]=4 9933 B14R0.197 COC(=O)CCCCCOCC(C)OC 34a_100000690652_100009816466 [1,1,0,0,0,0|2,0,0]=4 9934 B14R0.197 COC(=O)CCCCCOCC(Cl)CCl 34a_100000033668_100009816466 [1,1,0,0,0,0|2,0,0]=4 9935 B14R0.197 COC(=O)CCCCCOCC(O)CO 34a_100000074720_100011219619 [1,1,0,0,0,0|2,0,0]=4 9936 B14R0.197 COC(=O)CCCCCOCC(O)CO 7a_100000074720_100011219619 [1,1,0,0,0,0|2,0,0]=4 9937 B14R0.197 COC(=O)CCCCCOC[C@@H](C)CO 34a_100000074720_100000059175 [1,1,0,0,0,0|2,0,0]=4 9938 B14R0.197 COC(=O)CCCCCOC[C@@H](C)CO 7a_100000074720_100000059175 [1,1,0,0,0,0|2,0,0]=4 9939 B14R0.197 COC(=O)CCCCCOC[C@@H](O)CF 34a_100000074720_100015614560 [1,1,0,0,0,0|2,0,0]=4 9940 B14R0.197 COC(=O)CCCCCOC[C@@H](O)CF 7a_100000074720_100015614560 [1,1,0,0,0,0|2,0,0]=4 9941 B14R0.197 COC(=O)CCCCCOC[C@@H](O)CO 34a_100000074720_100009815848 [1,1,0,0,0,0|2,0,0]=4 9942 B14R0.197 COC(=O)CCCCCOC[C@@H](O)CO 7a_100000074720_100009815848 [1,1,0,0,0,0|2,0,0]=4 9943 B14R0.197 COC(=O)CCCCCOC[C@H](F)CN 34a_100015665980_100009816466 [1,1,0,0,0,0|2,0,0]=4 9944 B14R0.197 COC(=O)CCCCCSCC(O)CO 62a_100009816466_100011219619 [1,1,0,0,0,0|2,0,0]=4 9945 B14R0.197 COC(=O)CCCCCSCC(O)CO 62a_100011219619_100009816466 [1,1,0,0,0,0|2,0,0]=4 9946 B14R0.197 COC(=O)CCCCCSC[C@@H](C)CO 62a_100000059175_100009816466 [1,1,0,0,0,0|2,0,0]=4 9947 B14R0.197 COC(=O)CCCCCSC[C@@H](C)CO 62a_100009816466_100000059175 [1,1,0,0,0,0|2,0,0]=4 9948 B14R0.197 COC(=O)CCCCCSC[C@@H](O)CF 62a_100009816466_100015614560 [1,1,0,0,0,0|2,0,0]=4 9949 B14R0.197 COC(=O)CCCCCSC[C@@H](O)CF 62a_100015614560_100009816466 [1,1,0,0,0,0|2,0,0]=4 9950 B14R0.197 COC(=O)CCCCCSC[C@@H](O)CO 62a_100009815848_100009816466 [1,1,0,0,0,0|2,0,0]=4 9951 B14R0.197 COC(=O)CCCCCSC[C@@H](O)CO 62a_100009816466_100009815848 [1,1,0,0,0,0|2,0,0]=4 9952 B14R0.197 COC(=O)CCCCNCCC(C)CO 2230a_106354213184_100000204269 [1,1,0,0,0,0|2,0,0]=4 9953 B14R0.197 COC(=O)CCCCNCCC(C)CO 34a_106354213184_100000204269 [1,1,0,0,0,0|2,0,0]=4 9954 B14R0.197 COC(=O)CCCCOCCC(C)OC 7a_100000764861_100000204269 [1,1,0,0,0,0|2,0,0]=4 9955 B14R0.197 COC(=O)CCCOCCC[C@@H](C)CN 34a_100160569302_100000742333 [1,1,0,0,0,0|2,0,0]=4 9956 B14R0.226 CCCCCC(=O)CCCCC(=O)OC 1458a_100000212188_100000204269 [1,1,0,0,0,0|0,0,1]=3 9957 B14R0.226 CCCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100000210326 [1,1,0,0,0,0|0,0,1]=3 9958 B14R0.226 CCCCCC(=O)CCCNC(=O)OC 1458a_100000753017_100000210326 [1,1,0,0,0,0|1,0,1]=4 9959 B14R0.226 CCCCCC(=O)CCOCC(=O)OC 1458a_100000212188_100000090808 [1,1,0,0,0,0|1,0,1]=4 9960 B14R0.226 CCCCCC(=O)CSCCC(=O)OC 62a_100000204255_200012276598 [1,1,0,0,0,0|1,0,1]=4 9961 B14R0.226 CCCCCC(=O)CSCCC(=O)OC 62a_200012276598_100000204255 [1,1,0,0,0,0|1,0,1]=4 9962 B14R0.226 CCCCCC(=O)NCCCC(=O)OC 188690a_100000184769_100000212188 [1,1,0,0,0,0|1,0,1]=4 9963 B14R0.226 CCCCCC(C)NCCCC(=O)NC 2230a_100000211957_100000741757 [1,1,0,0,0,0|2,0,0]=4 9964 B14R0.226 CCCCCC(C)NCCCC(=O)NC 2230a_100000740002_200011218191 [1,1,0,0,0,0|2,0,0]=4 9965 B14R0.226 CCCCCC(C)NCCCC(=O)NC 270004a_100000740002_100000211708 [1,1,0,0,0,0|2,0,0]=4 9966 B14R0.226 CCCCCC(C)NCCCC(=O)NC 34a_100000740002_200011218191 [1,1,0,0,0,0|2,0,0]=4 9967 B14R0.226 CCCCCC(C)NCCCC(=O)OC 2230a_100000211957_100011218270 [1,1,0,0,0,0|1,0,0]=3 9968 B14R0.226 CCCCCC(C)NCCNC(=O)CC 270004a_100132302217_100000211708 [1,1,0,0,0,0|2,0,0]=4 9969 B14R0.226 CCCCCC(C)NCCNC(=O)CC 34a_100132302217_200011218191 [1,1,0,0,0,0|2,0,0]=4 9970 B14R0.226 CCCCCC(C)OCCCC(=O)NC 34a_100011215632_100000741757 [1,1,0,0,0,0|2,0,0]=4 9971 B14R0.226 CCCCCC(C)OCCCC(=O)NC 7a_100011215632_100000741757 [1,1,0,0,0,0|2,0,0]=4 9972 B14R0.226 CCCCCC(C)OCCCC(=O)OC 34a_100011215632_100000742333 [1,1,0,0,0,0|1,0,0]=3 9973 B14R0.226 CCCCCC(C)OCCCC(=O)OC 7a_100011215632_100011218270 [1,1,0,0,0,0|1,0,0]=3 9974 B14R0.226 CCCCCC(C)OCCNC(=O)CC 34a_200000158885_200011218191 [1,1,0,0,0,0|2,0,0]=4 9975 B14R0.226 CCCCCC(C)OCCNC(=O)CC 7a_200000158885_200011218191 [1,1,0,0,0,0|2,0,0]=4 9976 B14R0.226 CCCCCC(C)OCCNC(=O)OC 34a_100000757965_200011218191 [1,1,0,0,0,0|2,0,0]=4 9977 B14R0.226 CCCCCC(C)OCCOC(=O)CC 7a_200000031056_200011218191 [1,1,0,0,0,0|2,0,0]=4 9978 B14R0.226 CCCCCC(C)OCCOC(=O)OC 34a_100010262106_200011218191 [1,1,0,0,0,0|2,0,0]=4 9979 B14R0.226 CCCCCC(C)SCCCC(=O)NC 62a_100000741757_200011218191 [1,1,0,0,0,0|2,0,0]=4 9980 B14R0.226 CCCCCC(C)SCCCC(=O)NC 62a_200011218191_100000741757 [1,1,0,0,0,0|2,0,0]=4 9981 B14R0.226 CCCCCC(C)SCCCC(=O)OC 62a_100011218270_200011218191 [1,1,0,0,0,0|1,0,0]=3 9982 B14R0.226 CCCCCC(C)SCCCC(=O)OC 62a_200011218191_100011218270 [1,1,0,0,0,0|1,0,0]=3 9983 B14R0.226 CCCCCN(C)CCCCC(=O)OC 2230a_100000223495_100000204269 [1,1,0,0,0,0|1,0,0]=3 9984 B14R0.226 CCCCCN(C)CCCCC(=O)OC 269982a_100000223495_100000204269 [1,1,0,0,0,0|1,0,0]=3 9985 B14R0.226 CCCCCN(C)CCOCC(=O)OC 2230a_100000223495_100000090808 [1,1,0,0,0,0|2,0,0]=4 9986 B14R0.226 CCCCNC(=O)CCCCC(=O)OC 11a_100000102301_100000695723 [1,1,0,0,0,0|1,0,1]=4 9987 B14R0.226 CCCCNC(=O)CCCCC(=O)OC 1626a_100000102301_100000695723 [1,1,0,0,0,0|1,0,1]=4 9988 B14R0.226 CCCCNC(=O)CCCCC(=O)OC 240690a_100000102301_100000695723 [1,1,0,0,0,0|1,0,1]=4 9989 B14R0.226 CCCCNC(=O)CCCCC(=O)OC 527a_100000102301_100000695723 [1,1,0,0,0,0|1,0,1]=4 9990 B14R0.226 CCCOCC(=O)CCCCC(=O)OC 1458a_100000745993_100000204269 [1,1,0,0,0,0|1,0,1]=4 9991 B14R0.226 CCCSCC(=O)CCCCC(=O)OC 1458a_100000217233_100000204269 [1,1,0,0,0,0|1,0,1]=4 9992 B14R0.226 CCOCCC(=O)CCCCC(=O)OC 1458a_100000695723_100011215890 [1,1,0,0,0,0|1,0,1]=4 9993 B14R0.226 CCOCCC(=O)CCCCC(=O)OC 1458a_100000749530_100000204269 [1,1,0,0,0,0|1,0,1]=4 9994 B14R0.226 CCSCCC(=O)CCCCC(=O)OC 1458a_100000230768_100000204269 [1,1,0,0,0,0|1,0,1]=4 9995 B14R0.226 CCSCCC(=O)CCCCC(=O)OC 1458a_100000695723_100000757381 [1,1,0,0,0,0|1,0,1]=4 9996 B14R0.226 COC(=O)CCCCC(=O)CCCCF 1458a_100000695723_100000729493 [1,1,0,0,0,0|1,0,1]=4 9997 B14R0.226 COC(=O)CCCCC(=O)CCCCO 1458a_100000695505_100000204269 [1,1,0,0,0,0|1,0,1]=4 9998 B14R0.226 COC(=O)CCCCC(=O)CCCCO 1458a_100000695723_100000210776 [1,1,0,0,0,0|1,0,1]=4 9999 B14R0.226 COC(=O)CCCCC(=O)CCCSC 1458a_100000173376_100000204269 [1,1,0,0,0,0|1,0,1]=4 10000 B14R0.226 COC(=O)CCCCN(C)CCCCO 2230a_100000717598_100000204269 [1,1,0,0,0,0|2,0,0]=4 10001 B14R0.226 COC(=O)CCCCN(C)CCCCO 269982a_100000717598_100000204269 [1,1,0,0,0,0|2,0,0]=4 10002 B14R0.226 COC(=O)CCOC[C@@H](N)CCCCN 34a_100016993712_100000742370 [1,1,0,0,0,0|2,0,0]=4 10003 B14R0.226 COCCCC(=O)CCCCC(=O)OC 1458a_100000695723_100000740836 [1,1,0,0,0,0|1,0,1]=4 10004 B14R0.226 COCCCC(=O)CCCCC(=O)OC 1458a_100000741012_100000204269 [1,1,0,0,0,0|1,0,1]=4 10005 B14R0.226 COCCCC(C)OCCCC(=O)OC 34a_200011539412_100000742333 [1,1,0,0,0,0|2,0,0]=4 10006 B14R0.226 COCCCC(C)OCCCC(=O)OC 7a_200011539412_100011218270 [1,1,0,0,0,0|2,0,0]=4 10007 B14R0.226 COCCCN(C)CCCCC(=O)OC 2230a_100000224831_100000204269 [1,1,0,0,0,0|2,0,0]=4 10008 B14R0.226 COCCCN(C)CCCCC(=O)OC 269982a_100000224831_100000204269 [1,1,0,0,0,0|2,0,0]=4 10009 B14R0.305 C=C(C)CCOCCCCCC(=O)OC 34a_100000074720_100000730704 [1,1,0,0,0,0|1,0,1]=4 10010 B14R0.305 C=C(C)CCOCCCCCC(=O)OC 34a_100000764851_100009816466 [1,1,0,0,0,0|1,0,1]=4 10011 B14R0.305 C=C(C)CCOCCCCCC(=O)OC 7a_100000074720_100000730704 [1,1,0,0,0,0|1,0,1]=4 10012 B14R0.305 C=C(C)CCSCCCCCC(=O)OC 62a_100000730704_100009816466 [1,1,0,0,0,0|1,0,1]=4 10013 B14R0.305 C=C(C)CCSCCCCCC(=O)OC 62a_100009816466_100000730704 [1,1,0,0,0,0|1,0,1]=4 10014 B14R0.305 C=C(C)COCCCCCCC(=O)OC 34a_100000210245_100009815986 [1,1,0,0,0,0|1,0,1]=4 10015 B14R0.305 C=C(C)COCCCCCCC(=O)OC 34a_100009863599_100000748629 [1,1,0,0,0,0|1,0,1]=4 10016 B14R0.305 C=C(C)COCCCCCCC(=O)OC 7a_100009863599_100000748629 [1,1,0,0,0,0|1,0,1]=4 10017 B14R0.305 C=C(C)CSCCCCCCC(=O)OC 62a_100000748629_100009815986 [1,1,0,0,0,0|1,0,1]=4 10018 B14R0.305 C=C(C)CSCCCCCCC(=O)OC 62a_100009815986_100000211660 [1,1,0,0,0,0|1,0,1]=4 10019 B14R0.305 CCC(=O)NCCNCCCCC(C)C 34a_100132302217_100011216152 [1,1,0,0,0,0|2,0,0]=4 10020 B14R0.305 CCC(=O)NCCOCCCCC(C)C 34a_200000158885_100011216152 [1,1,0,0,0,0|2,0,0]=4 10021 B14R0.305 CCC(=O)NCCOCCCCC(C)C 7a_200000158885_100011216152 [1,1,0,0,0,0|2,0,0]=4 10022 B14R0.305 CCC(=O)OCCOCCCCC(C)C 7a_200000031056_100011216152 [1,1,0,0,0,0|2,0,0]=4 10023 B14R0.305 CNC(=O)CCCNCCCCC(C)C 2230a_100000740002_100011216152 [1,1,0,0,0,0|2,0,0]=4 10024 B14R0.305 CNC(=O)CCCNCCCCC(C)C 34a_100000740002_100011216152 [1,1,0,0,0,0|2,0,0]=4 10025 B14R0.305 CNC(=O)CCCOCCCCC(C)C 34a_100011214890_100000741757 [1,1,0,0,0,0|2,0,0]=4 10026 B14R0.305 CNC(=O)CCCOCCCCC(C)C 7a_100011214890_100000741757 [1,1,0,0,0,0|2,0,0]=4 10027 B14R0.305 CNC(=O)CCCSCCCCC(C)C 62a_100000741757_100011216152 [1,1,0,0,0,0|2,0,0]=4 10028 B14R0.305 CNC(=O)CCCSCCCCC(C)C 62a_100011216152_100000741757 [1,1,0,0,0,0|2,0,0]=4 10029 B14R0.305 CNC(=O)CCNCCCCCC(C)C 2230a_100000738227_100000210682 [1,1,0,0,0,0|2,0,0]=4 10030 B14R0.305 CNC(=O)CCNCCCCCC(C)C 2230a_100011290863_100000737683 [1,1,0,0,0,0|2,0,0]=4 10031 B14R0.305 CNC(=O)CCNCCCCCC(C)C 34a_100000738227_100000210682 [1,1,0,0,0,0|2,0,0]=4 10032 B14R0.305 CNC(=O)CCNCCCCCC(C)C 34a_100011290863_100012179268 [1,1,0,0,0,0|2,0,0]=4 10033 B14R0.305 CNC(=O)CCOCCCCCC(C)C 34a_100000754576_100000210682 [1,1,0,0,0,0|2,0,0]=4 10034 B14R0.305 CNC(=O)CCOCCCCCC(C)C 34a_100011995859_100012179268 [1,1,0,0,0,0|2,0,0]=4 10035 B14R0.305 CNC(=O)CCOCCCCCC(C)C 7a_100011995859_100000737683 [1,1,0,0,0,0|2,0,0]=4 10036 B14R0.305 CNC(=O)CCSCCCCCC(C)C 62a_100000210682_100000737683 [1,1,0,0,0,0|2,0,0]=4 10037 B14R0.305 CNC(=O)CCSCCCCCC(C)C 62a_100000737683_100000210682 [1,1,0,0,0,0|2,0,0]=4 10038 B14R0.305 CNC(=O)CNCCCCCCC(C)C 2230a_100000211014_100000183359 [1,1,0,0,0,0|2,0,0]=4 10039 B14R0.305 CNC(=O)CNCCCCCCC(C)C 34a_100000211014_100000183359 [1,1,0,0,0,0|2,0,0]=4 10040 B14R0.305 COC(=O)CCCCCCCCC(=O)C 1458a_100000036616_200000210301 [1,1,0,0,0,0|0,0,1]=3 10041 B14R0.305 COC(=O)CCCCCCCCC(=O)C 1458a_100000070787_100010282707 [1,1,0,0,0,0|0,0,1]=3 10042 B14R0.305 COC(=O)CCCCCCCCC(=O)[13CH3] 1458a_100000036616_200025704644 [1,1,0,0,0,0|0,0,1]=3 10043 B14R0.305 COC(=O)CCCCCCCCN(C)C 2230a_100102631434_100010282707 [1,1,0,0,0,0|1,0,0]=3 10044 B14R0.305 COC(=O)CCCCCCCCN(C)C 269982a_100102631434_100010282707 [1,1,0,0,0,0|1,0,0]=3 10045 B14R0.305 COC(=O)CCCCCCCNC(=O)C 188690a_100000687944_100015343762 [1,1,0,0,0,0|1,0,1]=4 10046 B14R0.305 COC(=O)CCCCCCCNC(C)C 2230a_100138425928_100010004213 [1,1,0,0,0,0|1,0,0]=3 10047 B14R0.305 COC(=O)CCCCCCCNC(C)C 34a_100138425928_100010004213 [1,1,0,0,0,0|1,0,0]=3 10048 B14R0.305 COC(=O)CCCCCCCOC(C)C 34a_100000212225_100010004213 [1,1,0,0,0,0|1,0,0]=3 10049 B14R0.305 COC(=O)CCCCCCCOC(C)C 34a_100011022521_100000210206 [1,1,0,0,0,0|1,0,0]=3 10050 B14R0.305 COC(=O)CCCCCCCOC(C)C 7a_100011022521_100000210206 [1,1,0,0,0,0|1,0,0]=3 10051 B14R0.305 COC(=O)CCCCCCCSC(C)C 62a_100000210206_100010004213 [1,1,0,0,0,0|1,0,0]=3 10052 B14R0.305 COC(=O)CCCCCCCSC(C)C 62a_100010004213_100000210206 [1,1,0,0,0,0|1,0,0]=3 10053 B14R0.305 COC(=O)CCCCCCNCC(C)C 2230a_100000210953_100009815986 [1,1,0,0,0,0|1,0,0]=3 10054 B14R0.305 COC(=O)CCCCCCNCC(C)C 34a_100000210953_100009815986 [1,1,0,0,0,0|1,0,0]=3 10055 B14R0.305 COC(=O)CCCCCCNCC(C)O 2230a_100000210904_100009815986 [1,1,0,0,0,0|1,0,0]=3 10056 B14R0.305 COC(=O)CCCCCCNCC(C)O 34a_100000210904_100009815986 [1,1,0,0,0,0|1,0,0]=3 10057 B14R0.305 COC(=O)CCCCCCNCC(F)F 34a_100000765723_100009815986 [1,1,0,0,0,0|2,0,0]=4 10058 B14R0.305 COC(=O)CCCCCCOCC(=O)C 34a_100000211253_100009815986 [1,1,0,0,0,0|1,0,1]=4 10059 B14R0.305 COC(=O)CCCCCCOCC(C)Br 34a_100012180447_100009815986 [1,1,0,0,0,0|1,0,0]=3 10060 B14R0.305 COC(=O)CCCCCCOCC(C)C 34a_100000210257_100009815986 [1,1,0,0,0,0|1,0,0]=3 10061 B14R0.305 COC(=O)CCCCCCOCC(C)C 34a_100009863599_100000210624 [1,1,0,0,0,0|1,0,0]=3 10062 B14R0.305 COC(=O)CCCCCCOCC(C)C 7a_100009863599_100000210760 [1,1,0,0,0,0|1,0,0]=3 10063 B14R0.305 COC(=O)CCCCCCOCC(C)F 34a_100015925927_100009815986 [1,1,0,0,0,0|1,0,0]=3 10064 B14R0.305 COC(=O)CCCCCCOCC(C)O 34a_100009863599_100011218427 [1,1,0,0,0,0|1,0,0]=3 10065 B14R0.305 COC(=O)CCCCCCOCC(C)O 7a_100009863599_100011218427 [1,1,0,0,0,0|1,0,0]=3 10066 B14R0.305 COC(=O)CCCCCCOCC(F)F 34a_100000743014_100009815986 [1,1,0,0,0,0|2,0,0]=4 10067 B14R0.305 COC(=O)CCCCCCOCC(F)F 34a_100009863599_100011934356 [1,1,0,0,0,0|2,0,0]=4 10068 B14R0.305 COC(=O)CCCCCCOCC(F)F 7a_100009863599_100011934356 [1,1,0,0,0,0|2,0,0]=4 10069 B14R0.305 COC(=O)CCCCCCOC[C@@H](C)Cl 34a_100016084084_100009815986 [1,1,0,0,0,0|1,0,0]=3 10070 B14R0.305 COC(=O)CCCCCCOC[C@@H](C)N 34a_100000737577_100009815986 [1,1,0,0,0,0|1,0,0]=3 10071 B14R0.305 COC(=O)CCCCCCOC[C@@H](C)O 34a_100009863599_100009817552 [1,1,0,0,0,0|1,0,0]=3 10072 B14R0.305 COC(=O)CCCCCCOC[C@@H](C)O 7a_100009863599_100009817552 [1,1,0,0,0,0|1,0,0]=3 10073 B14R0.305 COC(=O)CCCCCCSCC(C)C 62a_100000210624_100009815986 [1,1,0,0,0,0|1,0,0]=3 10074 B14R0.305 COC(=O)CCCCCCSCC(C)C 62a_100009815986_100000210760 [1,1,0,0,0,0|1,0,0]=3 10075 B14R0.305 COC(=O)CCCCCCSCC(C)O 62a_100009815986_100011218427 [1,1,0,0,0,0|1,0,0]=3 10076 B14R0.305 COC(=O)CCCCCCSCC(C)O 62a_100011218427_100009815986 [1,1,0,0,0,0|1,0,0]=3 10077 B14R0.305 COC(=O)CCCCCCSCC(F)F 62a_100009815986_100011934356 [1,1,0,0,0,0|2,0,0]=4 10078 B14R0.305 COC(=O)CCCCCCSCC(F)F 62a_100011934356_100009815986 [1,1,0,0,0,0|2,0,0]=4 10079 B14R0.305 COC(=O)CCCCCCSC[C@@H](C)O 62a_100009815986_100009817552 [1,1,0,0,0,0|1,0,0]=3 10080 B14R0.305 COC(=O)CCCCCCSC[C@@H](C)O 62a_100009817552_100009815986 [1,1,0,0,0,0|1,0,0]=3 10081 B14R0.305 COC(=O)CCCCCNCCC(C)O 2230a_200000755665_100009816466 [1,1,0,0,0,0|1,0,0]=3 10082 B14R0.305 COC(=O)CCCCCOCCC(=O)C 34a_100000759926_100009816466 [1,1,0,0,0,0|1,0,1]=4 10083 B14R0.305 COC(=O)CCCCCOCCC(=O)C 7a_100000074720_100000053229 [1,1,0,0,0,0|1,0,1]=4 10084 B14R0.305 COC(=O)CCCCCOCCC(=O)C 7a_100000759926_100009816466 [1,1,0,0,0,0|1,0,1]=4 10085 B14R0.305 COC(=O)CCCCCOCCC(C)Br 34a_100009893172_100009816466 [1,1,0,0,0,0|1,0,0]=3 10086 B14R0.305 COC(=O)CCCCCOCCC(C)C 34a_100000074720_100000210312 [1,1,0,0,0,0|1,0,0]=3 10087 B14R0.305 COC(=O)CCCCCOCCC(C)C 34a_100000210254_100009816466 [1,1,0,0,0,0|1,0,0]=3 10088 B14R0.305 COC(=O)CCCCCOCCC(C)C 7a_100000074720_100000210626 [1,1,0,0,0,0|1,0,0]=3 10089 B14R0.305 COC(=O)CCCCCOCCC(C)C 7a_100000210254_100009816466 [1,1,0,0,0,0|1,0,0]=3 10090 B14R0.305 COC(=O)CCCCCOCCC(C)O 34a_100000074720_100012276601 [1,1,0,0,0,0|1,0,0]=3 10091 B14R0.305 COC(=O)CCCCCOCCC(C)O 7a_100000074720_100012276601 [1,1,0,0,0,0|1,0,0]=3 10092 B14R0.305 COC(=O)CCCCCOCCC(F)F 34a_100103093639_100009816466 [1,1,0,0,0,0|2,0,0]=4 10093 B14R0.305 COC(=O)CCCCCOCCN(C)C 7a_100000074720_100000755713 [1,1,0,0,0,0|2,0,0]=4 10094 B14R0.305 COC(=O)CCCCCOCC[C@@H](C)N 34a_100000706166_100009816466 [1,1,0,0,0,0|1,0,0]=3 10095 B14R0.305 COC(=O)CCCCCOCOC(C)C 34a_100000074720_100000709892 [1,1,0,0,0,0|2,0,0]=4 10096 B14R0.305 COC(=O)CCCCCSCCC(=O)C 62a_100000053229_100009816466 [1,1,0,0,0,0|1,0,1]=4 10097 B14R0.305 COC(=O)CCCCCSCCC(=O)C 62a_100009816466_100000053229 [1,1,0,0,0,0|1,0,1]=4 10098 B14R0.305 COC(=O)CCCCCSCCC(C)C 62a_100000210312_100009816466 [1,1,0,0,0,0|1,0,0]=3 10099 B14R0.305 COC(=O)CCCCCSCCC(C)C 62a_100009816466_100000210312 [1,1,0,0,0,0|1,0,0]=3 10100 B14R0.305 COC(=O)CCCCCSCCC(C)O 62a_100009816466_100012276601 [1,1,0,0,0,0|1,0,0]=3 10101 B14R0.305 COC(=O)CCCCCSCCC(C)O 62a_100012276601_100009816466 [1,1,0,0,0,0|1,0,0]=3 10102 B14R0.305 COC(=O)CCCCCSCCN(C)C 62a_100009816466_100000755713 [1,1,0,0,0,0|2,0,0]=4 10103 B14R0.305 COC(=O)CCCCCSCOC(C)C 62a_100000709892_100009816466 [1,1,0,0,0,0|2,0,0]=4 10104 B14R0.305 COC(=O)CCCCCSCOC(C)C 62a_100009816466_100000709892 [1,1,0,0,0,0|2,0,0]=4 10105 B14R0.305 COC(=O)CCCCNCCCC(C)C 2230a_200000737386_100000204269 [1,1,0,0,0,0|1,0,0]=3 10106 B14R0.305 COC(=O)CCCCNCCCC(C)C 34a_200000737386_100000204269 [1,1,0,0,0,0|1,0,0]=3 10107 B14R0.305 COC(=O)CCCCNCCCS(=O)C 2230a_200000753449_100000204269 [1,1,0,0,0,0|2,0,0]=4 10108 B14R0.305 COC(=O)CCCCNCCOC(C)C 2230a_100000701111_100000204269 [1,1,0,0,0,0|2,0,0]=4 10109 B14R0.305 COC(=O)CCCCNCCOC(C)C 34a_100000701111_100000204269 [1,1,0,0,0,0|2,0,0]=4 10110 B14R0.305 COC(=O)CCCCNCCSC(C)C 2230a_100000731138_100000204269 [1,1,0,0,0,0|2,0,0]=4 10111 B14R0.305 COC(=O)CCCCNCCSC(C)C 34a_100000731138_100000204269 [1,1,0,0,0,0|2,0,0]=4 10112 B14R0.305 COC(=O)CCCCOCCCC(=O)C 34a_100000059025_100000685027 [1,1,0,0,0,0|1,0,1]=4 10113 B14R0.305 COC(=O)CCCCOCCCC(=O)C 34a_100000759063_100000204269 [1,1,0,0,0,0|1,0,1]=4 10114 B14R0.305 COC(=O)CCCCOCCCC(=O)C 7a_100000059025_100011215641 [1,1,0,0,0,0|1,0,1]=4 10115 B14R0.305 COC(=O)CCCCOCCCC(=O)C 7a_100000759063_100000204269 [1,1,0,0,0,0|1,0,1]=4 10116 B14R0.305 COC(=O)CCCCOCCCC(C)C 34a_100000059025_100011214892 [1,1,0,0,0,0|1,0,0]=3 10117 B14R0.305 COC(=O)CCCCOCCCC(C)C 34a_100000210774_100000204269 [1,1,0,0,0,0|1,0,0]=3 10118 B14R0.305 COC(=O)CCCCOCCCC(C)C 7a_100000059025_100011214892 [1,1,0,0,0,0|1,0,0]=3 10119 B14R0.305 COC(=O)CCCCOCCCC(C)C 7a_100000210774_100000204269 [1,1,0,0,0,0|1,0,0]=3 10120 B14R0.305 COC(=O)CCCCOCCCC(C)O 34a_100000059025_200000718107 [1,1,0,0,0,0|1,0,0]=3 10121 B14R0.305 COC(=O)CCCCOCCCC(C)O 7a_100000059025_200000718107 [1,1,0,0,0,0|1,0,0]=3 10122 B14R0.305 COC(=O)CCCCOCCCN(C)C 7a_100000059025_100000757444 [1,1,0,0,0,0|2,0,0]=4 10123 B14R0.305 COC(=O)CCCCOCCNC(C)C 34a_100000224655_100000204269 [1,1,0,0,0,0|2,0,0]=4 10124 B14R0.305 COC(=O)CCCCOCCOC(C)C 34a_100000059025_100000211751 [1,1,0,0,0,0|2,0,0]=4 10125 B14R0.305 COC(=O)CCCCOCCOC(C)C 34a_100000211219_100000204269 [1,1,0,0,0,0|2,0,0]=4 10126 B14R0.305 COC(=O)CCCCOCCOC(C)C 7a_100000059025_100000211751 [1,1,0,0,0,0|2,0,0]=4 10127 B14R0.305 COC(=O)CCCCOCCOC(C)C 7a_100000211219_100000204269 [1,1,0,0,0,0|2,0,0]=4 10128 B14R0.305 COC(=O)CCCCOCCSC(C)C 34a_100000059025_100000730970 [1,1,0,0,0,0|2,0,0]=4 10129 B14R0.305 COC(=O)CCCCOCCSC(C)C 34a_200011212901_100000204269 [1,1,0,0,0,0|2,0,0]=4 10130 B14R0.305 COC(=O)CCCCOCCSC(C)C 7a_100000059025_100000730970 [1,1,0,0,0,0|2,0,0]=4 10131 B14R0.305 COC(=O)CCCCOCCSC(C)C 7a_200011212901_100000204269 [1,1,0,0,0,0|2,0,0]=4 10132 B14R0.305 COC(=O)CCCCSCCCC(=O)C 62a_100000204269_100011215641 [1,1,0,0,0,0|1,0,1]=4 10133 B14R0.305 COC(=O)CCCCSCCCC(=O)C 62a_100011215641_100000204269 [1,1,0,0,0,0|1,0,1]=4 10134 B14R0.305 COC(=O)CCCCSCCCC(C)C 62a_100000204269_100011214892 [1,1,0,0,0,0|1,0,0]=3 10135 B14R0.305 COC(=O)CCCCSCCCC(C)C 62a_100011214892_100000204269 [1,1,0,0,0,0|1,0,0]=3 10136 B14R0.305 COC(=O)CCCCSCCCC(C)O 62a_100000204269_200000718107 [1,1,0,0,0,0|1,0,0]=3 10137 B14R0.305 COC(=O)CCCCSCCCC(C)O 62a_200000718107_100000204269 [1,1,0,0,0,0|1,0,0]=3 10138 B14R0.305 COC(=O)CCCCSCCCN(C)C 62a_100000204269_100000757444 [1,1,0,0,0,0|2,0,0]=4 10139 B14R0.305 COC(=O)CCCCSCCOC(C)C 62a_100000204269_100000211751 [1,1,0,0,0,0|2,0,0]=4 10140 B14R0.305 COC(=O)CCCCSCCOC(C)C 62a_100000211751_100000204269 [1,1,0,0,0,0|2,0,0]=4 10141 B14R0.305 COC(=O)CCCCSCCSC(C)C 62a_100000204269_100000730970 [1,1,0,0,0,0|2,0,0]=4 10142 B14R0.305 COC(=O)CCCCSCCSC(C)C 62a_100000730970_100000204269 [1,1,0,0,0,0|2,0,0]=4 10143 B14R0.305 COC(=O)CCCNCCCOC(C)C 2230a_100000737246_100011218270 [1,1,0,0,0,0|2,0,0]=4 10144 B14R0.305 COC(=O)CCCNCCCOC(C)C 34a_100000737246_100000742333 [1,1,0,0,0,0|2,0,0]=4 10145 B14R0.305 COC(=O)CCCOCCCCC(C)C 34a_100011214890_100000742333 [1,1,0,0,0,0|1,0,0]=3 10146 B14R0.305 COC(=O)CCCOCCCCC(C)C 7a_100011214890_100011218270 [1,1,0,0,0,0|1,0,0]=3 10147 B14R0.305 COC(=O)CCCOCCCNC(C)C 34a_100000182298_100000742333 [1,1,0,0,0,0|2,0,0]=4 10148 B14R0.305 COC(=O)CCCOCCNCC(C)C 34a_100015185251_100000742333 [1,1,0,0,0,0|2,0,0]=4 10149 B14R0.305 COC(=O)CCCOCCOCC(C)C 34a_100000703358_100000742333 [1,1,0,0,0,0|2,0,0]=4 10150 B14R0.305 COC(=O)CCCOCCOCC(C)C 7a_100000703358_100011218270 [1,1,0,0,0,0|2,0,0]=4 10151 B14R0.305 COC(=O)CCCOCCSCC(C)C 34a_200000230437_100000742333 [1,1,0,0,0,0|2,0,0]=4 10152 B14R0.305 COC(=O)CCCOCCSCC(C)C 7a_200000230437_100011218270 [1,1,0,0,0,0|2,0,0]=4 10153 B14R0.305 COC(=O)CCCSCCCCC(=O)C 62a_100000735457_100011218270 [1,1,0,0,0,0|1,0,1]=4 10154 B14R0.305 COC(=O)CCCSCCCCC(=O)C 62a_100011218270_100000735457 [1,1,0,0,0,0|1,0,1]=4 10155 B14R0.305 COC(=O)CCCSCCCCC(C)C 62a_100011216152_100011218270 [1,1,0,0,0,0|1,0,0]=3 10156 B14R0.305 COC(=O)CCCSCCCCC(C)C 62a_100011218270_100011216152 [1,1,0,0,0,0|1,0,0]=3 10157 B14R0.305 COC(=O)CCCSCCCCN(C)C 62a_100011218270_100000690147 [1,1,0,0,0,0|2,0,0]=4 10158 B14R0.305 COC(=O)CCNCCCCCC(C)C 2230a_100011290863_100000204255 [1,1,0,0,0,0|1,0,0]=3 10159 B14R0.305 COC(=O)CCNCCCCCC(C)C 34a_100011290863_100000742370 [1,1,0,0,0,0|1,0,0]=3 10160 B14R0.305 COC(=O)CCNCCCOCC(C)C 2230a_100000205972_100000204255 [1,1,0,0,0,0|2,0,0]=4 10161 B14R0.305 COC(=O)CCNCCCOCC(C)C 34a_100000205972_100000742370 [1,1,0,0,0,0|2,0,0]=4 10162 B14R0.305 COC(=O)CCOCCCCCC(C)C 34a_100011995859_100000742370 [1,1,0,0,0,0|1,0,0]=3 10163 B14R0.305 COC(=O)CCOCCCCCC(C)C 7a_100011995859_100000204255 [1,1,0,0,0,0|1,0,0]=3 10164 B14R0.305 COC(=O)CCOCCCCNC(C)C 34a_100011521146_100000742370 [1,1,0,0,0,0|2,0,0]=4 10165 B14R0.305 COC(=O)CCSCCCCCC(C)C 62a_100000204255_100000210682 [1,1,0,0,0,0|1,0,0]=3 10166 B14R0.305 COC(=O)CCSCCCCCC(C)C 62a_100000210682_100000204255 [1,1,0,0,0,0|1,0,0]=3 10167 B14R0.305 COC(=O)CNCCCCCCC(C)C 2230a_100000211014_100000747449 [1,1,0,0,0,0|1,0,0]=3 10168 B14R0.305 COC(=O)CNCCCCCCC(C)C 34a_100000211014_100000747449 [1,1,0,0,0,0|1,0,0]=3 10169 B14R0.305 COC(=O)COCCCCCNC(C)C 34a_100011629493_100000747449 [1,1,0,0,0,0|2,0,0]=4 10170 B14R0.305 COC(=O)COCCNCCCC(C)C 2230a_200000737386_100000090808 [1,1,0,0,0,0|2,0,0]=4 10171 B14R0.305 COC(=O)COCCNCCCC(C)C 34a_200000737386_100000090808 [1,1,0,0,0,0|2,0,0]=4 10172 B14R0.305 COC(=O)COCCOCCCC(C)C 34a_100000210774_100000090808 [1,1,0,0,0,0|2,0,0]=4 10173 B14R0.305 COC(=O)COCCOCCCC(C)C 7a_100000210774_100000090808 [1,1,0,0,0,0|2,0,0]=4 10174 B14R0.305 COC(=O)COCCSCCCC(C)C 62a_100000090808_100011214892 [1,1,0,0,0,0|2,0,0]=4 10175 B14R0.305 COC(=O)COCCSCCCC(C)C 62a_100011214892_100000090808 [1,1,0,0,0,0|2,0,0]=4 10176 B14R0.305 COC(=O)COCCSCCCC(C)O 62a_100000090808_200000718107 [1,1,0,0,0,0|2,0,0]=4 10177 B14R0.305 COC(=O)COCCSCCCC(C)O 62a_200000718107_100000090808 [1,1,0,0,0,0|2,0,0]=4 10178 B14R0.305 COC(=O)NCCOCCCCC(C)C 34a_100000757965_100011216152 [1,1,0,0,0,0|2,0,0]=4 10179 B14R0.305 COC(=O)OCCOCCCCC(C)C 34a_100010262106_100011216152 [1,1,0,0,0,0|2,0,0]=4 10180 B14R0.305 COC(=O)OCSCCCCCC(C)C 62a_100000210682_100000139417 [1,1,0,0,0,0|2,0,0]=4 10181 B14R0.337 C#CC(=O)CCCCCCCCCCC 1458a_100000211873_100011215454 [1,1,0,0,0,0|0,0,2]=4 10182 B14R0.337 C#CC(=O)CCCCCCCCCCO 1458a_100000211873_100009813290 [1,1,0,0,0,0|0,0,2]=4 10183 B14R0.337 C#CCCCCCCCOCC(=O)CC 34a_100000725409_100153394163 [1,1,0,0,0,0|0,0,2]=4 10184 B14R0.337 C#CCCCCCCCOCC(=O)CC 7a_100000054614_100000747405 [1,1,0,0,0,0|0,0,2]=4 10185 B14R0.337 C#CCCCCCCCOCC(=O)OC 34a_100000054614_100000747449 [1,1,0,0,0,0|0,0,2]=4 10186 B14R0.337 C#CCCCCCCCOCC(=O)OC 7a_100000054614_100000747449 [1,1,0,0,0,0|0,0,2]=4 10187 B14R0.337 C#CCCCCCCCSCC(=O)CC 62a_100000747405_100153394163 [1,1,0,0,0,0|0,0,2]=4 10188 B14R0.337 C#CCCCCCCCSCC(=O)CC 62a_100153394163_100000747405 [1,1,0,0,0,0|0,0,2]=4 10189 B14R0.337 C#CCCCCCCCSCC(=O)OC 62a_100000747449_100153394163 [1,1,0,0,0,0|0,0,2]=4 10190 B14R0.337 C#CCCCCCCCSCC(=O)OC 62a_100153394163_100000747449 [1,1,0,0,0,0|0,0,2]=4 10191 B14R0.337 C#CCCCCCCOCCC(=O)OC 34a_100011217361_100000742370 [1,1,0,0,0,0|0,0,2]=4 10192 B14R0.337 C#CCCCCCCOCCC(=O)OC 7a_100011217361_100000204255 [1,1,0,0,0,0|0,0,2]=4 10193 B14R0.337 C#CCCCCCCSCCC(=O)OC 62a_100000204255_100012276617 [1,1,0,0,0,0|0,0,2]=4 10194 B14R0.337 C#CCCCCCCSCCC(=O)OC 62a_100012276617_100000204255 [1,1,0,0,0,0|0,0,2]=4 10195 B14R0.337 C#CCCCCCOCCCC(=O)OC 34a_100000766912_100000742333 [1,1,0,0,0,0|0,0,2]=4 10196 B14R0.337 C#CCCCCCOCCCC(=O)OC 7a_100000766912_100011218270 [1,1,0,0,0,0|0,0,2]=4 10197 B14R0.337 C#CCCCCCSCCCC(=O)OC 62a_100011218270_100012094781 [1,1,0,0,0,0|0,0,2]=4 10198 B14R0.337 C#CCCCCCSCCCC(=O)OC 62a_100012094781_100011218270 [1,1,0,0,0,0|0,0,2]=4 10199 B14R0.337 C#CCCCCNCCCCC(=O)OC 2230a_100000706060_100000204269 [1,1,0,0,0,0|0,0,2]=4 10200 B14R0.337 C#CCCCCNCCCCC(=O)OC 34a_100000706060_100000204269 [1,1,0,0,0,0|0,0,2]=4 10201 B14R0.337 C#CCCCCOCCCCC(=O)OC 34a_100000059025_100010269958 [1,1,0,0,0,0|0,0,2]=4 10202 B14R0.337 C#CCCCCOCCCCC(=O)OC 34a_100000766709_100000204269 [1,1,0,0,0,0|0,0,2]=4 10203 B14R0.337 C#CCCCCOCCCCC(=O)OC 7a_100000059025_100010269958 [1,1,0,0,0,0|0,0,2]=4 10204 B14R0.337 C#CCCCCOCCCCC(=O)OC 7a_100000766709_100000204269 [1,1,0,0,0,0|0,0,2]=4 10205 B14R0.337 C#CCCCCSCCCCC(=O)OC 62a_100000204269_100010269958 [1,1,0,0,0,0|0,0,2]=4 10206 B14R0.337 C#CCCCCSCCCCC(=O)OC 62a_100010269958_100000204269 [1,1,0,0,0,0|0,0,2]=4 10207 B14R0.337 C#CCCCNCCCCCC(=O)OC 34a_100000718082_100009816466 [1,1,0,0,0,0|0,0,2]=4 10208 B14R0.337 C#CCCCOCCCCCC(=O)OC 34a_100000074720_100000695029 [1,1,0,0,0,0|0,0,2]=4 10209 B14R0.337 C#CCCCOCCCCCC(=O)OC 34a_100000215630_100009816466 [1,1,0,0,0,0|0,0,2]=4 10210 B14R0.337 C#CCCCOCCCCCC(=O)OC 7a_100000074720_100011215417 [1,1,0,0,0,0|0,0,2]=4 10211 B14R0.337 C#CCCCOCCCCCC(=O)OC 7a_100000215630_100009816466 [1,1,0,0,0,0|0,0,2]=4 10212 B14R0.337 C#CCCCSCCCCCC(=O)OC 62a_100009816466_100011215417 [1,1,0,0,0,0|0,0,2]=4 10213 B14R0.337 C#CCCCSCCCCCC(=O)OC 62a_100011215417_100009816466 [1,1,0,0,0,0|0,0,2]=4 10214 B14R0.337 C#CCCNCCCCCCC(=O)OC 34a_100000755551_100009815986 [1,1,0,0,0,0|0,0,2]=4 10215 B14R0.337 C#CCCOCCCCCCC(=O)OC 34a_100009863599_100000688953 [1,1,0,0,0,0|0,0,2]=4 10216 B14R0.337 C#CCCOCCCCCCC(=O)OC 34a_100011215631_100009815986 [1,1,0,0,0,0|0,0,2]=4 10217 B14R0.337 C#CCCOCCCCCCC(=O)OC 7a_100009863599_100000688953 [1,1,0,0,0,0|0,0,2]=4 10218 B14R0.337 C#CCCSCCCCCCC(=O)OC 62a_100000688953_100009815986 [1,1,0,0,0,0|0,0,2]=4 10219 B14R0.337 C#CCCSCCCCCCC(=O)OC 62a_100009815986_100000688953 [1,1,0,0,0,0|0,0,2]=4 10220 B14R0.337 C#CCNCCCCCCCC(=O)OC 34a_100000212058_100010004213 [1,1,0,0,0,0|0,0,2]=4 10221 B14R0.337 C#CCOCCCCCCCC(=O)OC 34a_100000210247_100010004213 [1,1,0,0,0,0|0,0,2]=4 10222 B14R0.337 C#CCOCCCCCCCC(=O)OC 34a_100011022521_100000184674 [1,1,0,0,0,0|0,0,2]=4 10223 B14R0.337 C#CCOCCCCCCCC(=O)OC 7a_100011022521_100000038162 [1,1,0,0,0,0|0,0,2]=4 10224 B14R0.337 C#CCSCCCCCCCC(=O)OC 62a_100000038162_100010004213 [1,1,0,0,0,0|0,0,2]=4 10225 B14R0.337 C/C=C/CCOCCCCCC(=O)OC 34a_100016278192_100009816466 [1,1,0,0,0,0|0,0,2]=4 10226 B14R0.337 C/C=C/COCCCCCCC(=O)OC 34a_100009863599_100102629194 [1,1,0,0,0,0|0,0,2]=4 10227 B14R0.337 C/C=C/COCCCCCCC(=O)OC 34a_100016270725_100009815986 [1,1,0,0,0,0|0,0,2]=4 10228 B14R0.337 C/C=C/COCCCCCCC(=O)OC 7a_100009863599_100102629194 [1,1,0,0,0,0|0,0,2]=4 10229 B14R0.337 C/C=C/CSCCCCCCC(=O)OC 62a_100009815986_100102629194 [1,1,0,0,0,0|0,0,2]=4 10230 B14R0.337 C/C=C/CSCCCCCCC(=O)OC 62a_100102629194_100009815986 [1,1,0,0,0,0|0,0,2]=4 10231 B14R0.337 C=CC(=O)CCCCCCCCCCC 1458a_100000185746_100011215454 [1,1,0,0,0,0|0,0,2]=4 10232 B14R0.337 C=CC(=O)CCCCCCCCCCO 1458a_100000185746_100009813290 [1,1,0,0,0,0|0,0,2]=4 10233 B14R0.337 C=CC(=O)NCCCCCCCCCC 1626a_100000684558_100000185746 [1,1,0,0,0,0|0,0,2]=4 10234 B14R0.337 C=CC(=O)NCCCCCCCCCC 240690a_100000684558_200121576911 [1,1,0,0,0,0|0,0,2]=4 10235 B14R0.337 C=CCCCCCCCCCC(=O)CC 1458a_100000210414_100009814027 [1,1,0,0,0,0|0,0,1]=3 10236 B14R0.337 C=CCCCCCCCCCC(=O)CO 1458a_100000210174_100009814027 [1,1,0,0,0,0|1,0,1]=4 10237 B14R0.337 C=CCCCCCCCOCC(=O)CC 34a_100000725409_100012355270 [1,1,0,0,0,0|0,0,2]=4 10238 B14R0.337 C=CCCCCCCCOCC(=O)CC 7a_100000730831_100000747405 [1,1,0,0,0,0|0,0,2]=4 10239 B14R0.337 C=CCCCCCCCOCC(=O)OC 34a_100000730831_100000747449 [1,1,0,0,0,0|0,0,2]=4 10240 B14R0.337 C=CCCCCCCCOCC(=O)OC 7a_100000730831_100000747449 [1,1,0,0,0,0|0,0,2]=4 10241 B14R0.337 C=CCCCCCCCSCC(=O)CC 62a_100000747405_100012355270 [1,1,0,0,0,0|0,0,2]=4 10242 B14R0.337 C=CCCCCCCCSCC(=O)CC 62a_100012355270_100000747405 [1,1,0,0,0,0|0,0,2]=4 10243 B14R0.337 C=CCCCCCCCSCC(=O)OC 62a_100000747449_100012355270 [1,1,0,0,0,0|0,0,2]=4 10244 B14R0.337 C=CCCCCCCCSCC(=O)OC 62a_100012355270_100000747449 [1,1,0,0,0,0|0,0,2]=4 10245 B14R0.337 C=CCCCCCCOCCC(=O)OC 34a_200011216477_100000742370 [1,1,0,0,0,0|0,0,2]=4 10246 B14R0.337 C=CCCCCCCOCCC(=O)OC 7a_200011216477_100000204255 [1,1,0,0,0,0|0,0,2]=4 10247 B14R0.337 C=CCCCCCCSCCC(=O)OC 62a_100000204255_100011215473 [1,1,0,0,0,0|0,0,2]=4 10248 B14R0.337 C=CCCCCCCSCCC(=O)OC 62a_100011215473_100000204255 [1,1,0,0,0,0|0,0,2]=4 10249 B14R0.337 C=CCCCCCOCCCC(=O)OC 34a_100011216702_100000742333 [1,1,0,0,0,0|0,0,2]=4 10250 B14R0.337 C=CCCCCCOCCCC(=O)OC 7a_100011216702_100011218270 [1,1,0,0,0,0|0,0,2]=4 10251 B14R0.337 C=CCCCCCSCCCC(=O)OC 62a_100000700193_100011218270 [1,1,0,0,0,0|0,0,2]=4 10252 B14R0.337 C=CCCCCCSCCCC(=O)OC 62a_100011218270_100000700193 [1,1,0,0,0,0|0,0,2]=4 10253 B14R0.337 C=CCCCCNCCCCC(=O)OC 2230a_100000703577_100000204269 [1,1,0,0,0,0|0,0,2]=4 10254 B14R0.337 C=CCCCCNCCCCC(=O)OC 34a_100000703577_100000204269 [1,1,0,0,0,0|0,0,2]=4 10255 B14R0.337 C=CCCCCOCCCCC(=O)OC 34a_100000059025_100011215482 [1,1,0,0,0,0|0,0,2]=4 10256 B14R0.337 C=CCCCCOCCCCC(=O)OC 34a_100000766645_100000204269 [1,1,0,0,0,0|0,0,2]=4 10257 B14R0.337 C=CCCCCOCCCCC(=O)OC 7a_100000059025_100011215482 [1,1,0,0,0,0|0,0,2]=4 10258 B14R0.337 C=CCCCCOCCCCC(=O)OC 7a_100000766645_100000204269 [1,1,0,0,0,0|0,0,2]=4 10259 B14R0.337 C=CCCCCSCCCCC(=O)OC 62a_100000204269_100011215482 [1,1,0,0,0,0|0,0,2]=4 10260 B14R0.337 C=CCCCCSCCCCC(=O)OC 62a_100011215482_100000204269 [1,1,0,0,0,0|0,0,2]=4 10261 B14R0.337 C=CCCCNCCCCCC(=O)OC 2230a_100000700776_100009816466 [1,1,0,0,0,0|0,0,2]=4 10262 B14R0.337 C=CCCCNCCCCCC(=O)OC 34a_100000700776_100009816466 [1,1,0,0,0,0|0,0,2]=4 10263 B14R0.337 C=CCCCOCCCCCC(=O)OC 34a_100000074720_100000757094 [1,1,0,0,0,0|0,0,2]=4 10264 B14R0.337 C=CCCCOCCCCCC(=O)OC 34a_100000758997_100009816466 [1,1,0,0,0,0|0,0,2]=4 10265 B14R0.337 C=CCCCOCCCCCC(=O)OC 7a_100000074720_100000757094 [1,1,0,0,0,0|0,0,2]=4 10266 B14R0.337 C=CCCCOCCCCCC(=O)OC 7a_100000758997_100009816466 [1,1,0,0,0,0|0,0,2]=4 10267 B14R0.337 C=CCCCSCCCCCC(=O)OC 62a_100009816466_100000757094 [1,1,0,0,0,0|0,0,2]=4 10268 B14R0.337 C=CCCCSCCCCCC(=O)OC 62a_100011713584_100009816466 [1,1,0,0,0,0|0,0,2]=4 10269 B14R0.337 C=CCCNCCCCCCC(=O)OC 2230a_100015191253_100009815986 [1,1,0,0,0,0|0,0,2]=4 10270 B14R0.337 C=CCCOCCCCCCC(=O)OC 34a_100009863599_100000754431 [1,1,0,0,0,0|0,0,2]=4 10271 B14R0.337 C=CCCOCCCCCCC(=O)OC 34a_100011205117_100009815986 [1,1,0,0,0,0|0,0,2]=4 10272 B14R0.337 C=CCCOCCCCCCC(=O)OC 7a_100009863599_100000754431 [1,1,0,0,0,0|0,0,2]=4 10273 B14R0.337 C=CCCSCCCCCCC(=O)OC 62a_100000754431_100009815986 [1,1,0,0,0,0|0,0,2]=4 10274 B14R0.337 C=CCCSCCCCCCC(=O)OC 62a_100009815986_100000754431 [1,1,0,0,0,0|0,0,2]=4 10275 B14R0.337 C=CCNCCCCCCCC(=O)OC 2230a_100020586998_100010004213 [1,1,0,0,0,0|0,0,2]=4 10276 B14R0.337 C=CCOCCCCCCCC(=O)OC 34a_100011022521_100015514636 [1,1,0,0,0,0|0,0,2]=4 10277 B14R0.337 C=CCOCCCCCCCC(=O)OC 34a_200000210373_100010004213 [1,1,0,0,0,0|0,0,2]=4 10278 B14R0.337 C=CCOCCCCCCCC(=O)OC 7a_100011022521_100015514636 [1,1,0,0,0,0|0,0,2]=4 10279 B14R0.337 C=CCSCCCCCCCC(=O)OC 62a_100000210623_100010004213 [1,1,0,0,0,0|0,0,2]=4 10280 B14R0.337 C=CCSCCCCCCCC(=O)OC 62a_100010004213_100000210623 [1,1,0,0,0,0|0,0,2]=4 10281 B14R0.337 CC#CCCOCCCCCC(=O)OC 34a_100000750427_100009816466 [1,1,0,0,0,0|0,0,2]=4 10282 B14R0.337 CC#CCNCCCCCCC(=O)OC 2230a_100000685387_100009815986 [1,1,0,0,0,0|0,0,2]=4 10283 B14R0.337 CC#CCNCCCCCCC(=O)OC 34a_100000685387_100009815986 [1,1,0,0,0,0|0,0,2]=4 10284 B14R0.337 CC#CCOCCCCCCC(=O)OC 34a_100000761923_100009815986 [1,1,0,0,0,0|0,0,2]=4 10285 B14R0.337 CC#CCOCCCCCCC(=O)OC 34a_100009863599_100000748600 [1,1,0,0,0,0|0,0,2]=4 10286 B14R0.337 CC#CCOCCCCCCC(=O)OC 7a_100009863599_100000748600 [1,1,0,0,0,0|0,0,2]=4 10287 B14R0.337 CC#CCSCCCCCCC(=O)OC 62a_100000748600_100009815986 [1,1,0,0,0,0|0,0,2]=4 10288 B14R0.337 CC#CCSCCCCCCC(=O)OC 62a_100009815986_100000748600 [1,1,0,0,0,0|0,0,2]=4 10289 B14R0.337 CC/C=C/CCCOCCCC(=O)OC 34a_100016287902_100000742333 [1,1,0,0,0,0|0,0,2]=4 10290 B14R0.337 CC/C=C/CCCOCCCC(=O)OC 7a_100016287902_100011218270 [1,1,0,0,0,0|0,0,2]=4 10291 B14R0.337 CC/C=C\CCCCCOCC(=O)CC 7a_100016268722_100000747405 [1,1,0,0,0,0|0,0,2]=4 10292 B14R0.337 CC/C=C\CCCCCOCC(=O)OC 34a_100016268722_100000747449 [1,1,0,0,0,0|0,0,2]=4 10293 B14R0.337 CC/C=C\CCCCCOCC(=O)OC 7a_100016268722_100000747449 [1,1,0,0,0,0|0,0,2]=4 10294 B14R0.337 CC/C=C\CCCCOCCC(=O)OC 34a_100016287862_100000742370 [1,1,0,0,0,0|0,0,2]=4 10295 B14R0.337 CC/C=C\CCCCOCCC(=O)OC 7a_100016287862_100000204255 [1,1,0,0,0,0|0,0,2]=4 10296 B14R0.337 CC/C=C\CCOCCCCC(=O)OC 34a_100000059025_100015370543 [1,1,0,0,0,0|0,0,2]=4 10297 B14R0.337 CC/C=C\CCOCCCCC(=O)OC 34a_100016288707_100000204269 [1,1,0,0,0,0|0,0,2]=4 10298 B14R0.337 CC/C=C\CCOCCCCC(=O)OC 7a_100000059025_100015370543 [1,1,0,0,0,0|0,0,2]=4 10299 B14R0.337 CC/C=C\CCOCCCCC(=O)OC 7a_100016288707_100000204269 [1,1,0,0,0,0|0,0,2]=4 10300 B14R0.337 CC/C=C\CCSCCCCC(=O)OC 62a_100000204269_100015370543 [1,1,0,0,0,0|0,0,2]=4 10301 B14R0.337 CC/C=C\CCSCCCCC(=O)OC 62a_100015370543_100000204269 [1,1,0,0,0,0|0,0,2]=4 10302 B14R0.337 CC/C=C\COCCCCCC(=O)OC 34a_100000074720_100103147603 [1,1,0,0,0,0|0,0,2]=4 10303 B14R0.337 CC/C=C\COCCCCCC(=O)OC 34a_100016268518_100009816466 [1,1,0,0,0,0|0,0,2]=4 10304 B14R0.337 CC/C=C\COCCCCCC(=O)OC 7a_100000074720_100103147603 [1,1,0,0,0,0|0,0,2]=4 10305 B14R0.337 CC/C=C\CSCCCCCC(=O)OC 62a_100009816466_100103147603 [1,1,0,0,0,0|0,0,2]=4 10306 B14R0.337 CC/C=C\CSCCCCCC(=O)OC 62a_100103147603_100009816466 [1,1,0,0,0,0|0,0,2]=4 10307 B14R0.337 CC=CCCCOCCCCC(=O)OC 34a_100020645299_100000204269 [1,1,0,0,0,0|0,0,2]=4 10308 B14R0.337 CC=CCOCCCCCCC(=O)OC 34a_100009863599_100000070051 [1,1,0,0,0,0|0,0,2]=4 10309 B14R0.337 CC=CCOCCCCCCC(=O)OC 7a_100009863599_100000070051 [1,1,0,0,0,0|0,0,2]=4 10310 B14R0.337 CC=CCSCCCCCCC(=O)OC 62a_100000070051_100009815986 [1,1,0,0,0,0|0,0,2]=4 10311 B14R0.337 CC=CCSCCCCCCC(=O)OC 62a_100009815986_100000070051 [1,1,0,0,0,0|0,0,2]=4 10312 B14R0.337 CCC#CCCOCCCCC(=O)OC 34a_100000036655_100000204269 [1,1,0,0,0,0|0,0,2]=4 10313 B14R0.337 CCC#CCCOCCCCC(=O)OC 7a_100000036655_100000204269 [1,1,0,0,0,0|0,0,2]=4 10314 B14R0.337 CCC#CCOCCCCCC(=O)OC 34a_100000032950_100009816466 [1,1,0,0,0,0|0,0,2]=4 10315 B14R0.337 CCC#CCOCCCCCC(=O)OC 34a_100000074720_100009813939 [1,1,0,0,0,0|0,0,2]=4 10316 B14R0.337 CCC#CCOCCCCCC(=O)OC 7a_100000074720_100009813939 [1,1,0,0,0,0|0,0,2]=4 10317 B14R0.337 CCC#CCSCCCCCC(=O)OC 62a_100009813939_100009816466 [1,1,0,0,0,0|0,0,2]=4 10318 B14R0.337 CCC#CCSCCCCCC(=O)OC 62a_100009816466_100009813939 [1,1,0,0,0,0|0,0,2]=4 10319 B14R0.337 CCC(=O)CCCCCCCCCCO 1458a_100000210414_100009813290 [1,1,0,0,0,0|0,0,0]=2 10320 B14R0.337 CCC(=O)COCCCCCCCCBr 7a_100009813846_100000747405 [1,1,0,0,0,0|1,0,0]=3 10321 B14R0.337 CCC(=O)COCCCCCCCCCl 7a_100000033203_100000747405 [1,1,0,0,0,0|1,0,0]=3 10322 B14R0.337 CCC(=O)COCCCCCCCCO 34a_100000725409_100000033203 [1,1,0,0,0,0|1,0,0]=3 10323 B14R0.337 CCC(=O)COCCCOCCCOC 7a_200011215475_100000747405 [1,1,0,0,0,0|2,0,0]=4 10324 B14R0.337 CCC(=O)CSCCCCCCCCO 62a_100000033203_100000747405 [1,1,0,0,0,0|1,0,0]=3 10325 B14R0.337 CCC(=O)CSCCCCCCCCO 62a_100000747405_100000033203 [1,1,0,0,0,0|1,0,0]=3 10326 B14R0.337 CCC(=O)NCCCCCCCCCO 240690a_100000078944_100000210414 [1,1,0,0,0,0|1,0,0]=3 10327 B14R0.337 CCC(=O)NCCNCCCCCCF 34a_100132302217_100015922095 [1,1,0,0,0,0|2,0,0]=4 10328 B14R0.337 CCC(=O)NCCNCCCCCCO 34a_100132302217_100000766143 [1,1,0,0,0,0|2,0,0]=4 10329 B14R0.337 CCC(=O)NCCOCCCCCCF 34a_200000158885_100015922095 [1,1,0,0,0,0|2,0,0]=4 10330 B14R0.337 CCC(=O)NCCOCCCCCCF 7a_200000158885_100015922095 [1,1,0,0,0,0|2,0,0]=4 10331 B14R0.337 CCC(=O)NCCOCCCCCCO 34a_200000158885_100000766143 [1,1,0,0,0,0|2,0,0]=4 10332 B14R0.337 CCC(=O)NCCOCCCCCCO 7a_200000158885_100000766143 [1,1,0,0,0,0|2,0,0]=4 10333 B14R0.337 CCC(=O)OCCOCCCCCCF 7a_200000031056_100015922095 [1,1,0,0,0,0|2,0,0]=4 10334 B14R0.337 CCC(=O)OCCOCCCCCCO 7a_200000031056_100000766143 [1,1,0,0,0,0|2,0,0]=4 10335 B14R0.337 CCC/C=C/COCCCCC(=O)OC 34a_100016278788_100000204269 [1,1,0,0,0,0|0,0,2]=4 10336 B14R0.337 CCC/C=C/COCCCCC(=O)OC 7a_100016278788_100000204269 [1,1,0,0,0,0|0,0,2]=4 10337 B14R0.337 CCCC#CCCOCCCC(=O)OC 34a_100000042726_100000742333 [1,1,0,0,0,0|0,0,2]=4 10338 B14R0.337 CCCC#CCCOCCCC(=O)OC 7a_100000042726_100011218270 [1,1,0,0,0,0|0,0,2]=4 10339 B14R0.337 CCCC#CCOCCCCC(=O)OC 34a_100000034806_100000204269 [1,1,0,0,0,0|0,0,2]=4 10340 B14R0.337 CCCC#CCOCCCCC(=O)OC 7a_100000034806_100000204269 [1,1,0,0,0,0|0,0,2]=4 10341 B14R0.337 CCCC/C=C/COCCCC(=O)OC 34a_200016272032_100000742333 [1,1,0,0,0,0|0,0,2]=4 10342 B14R0.337 CCCC/C=C/COCCCC(=O)OC 7a_200016272032_100011218270 [1,1,0,0,0,0|0,0,2]=4 10343 B14R0.337 CCCC/C=C\CCOCCC(=O)OC 34a_200016286491_100000742370 [1,1,0,0,0,0|0,0,2]=4 10344 B14R0.337 CCCC/C=C\CCOCCC(=O)OC 7a_200016286491_100000204255 [1,1,0,0,0,0|0,0,2]=4 10345 B14R0.337 CCCCC#CCCCOCC(=O)CC 34a_100000725409_200000047210 [1,1,0,0,0,0|0,0,2]=4 10346 B14R0.337 CCCCC#CCCCSCC(=O)CC 62a_100000747405_200000047210 [1,1,0,0,0,0|0,0,2]=4 10347 B14R0.337 CCCCC#CCCCSCC(=O)CC 62a_200000047210_100000747405 [1,1,0,0,0,0|0,0,2]=4 10348 B14R0.337 CCCCC#CCCCSCC(=O)OC 62a_100000747449_200000047210 [1,1,0,0,0,0|0,0,2]=4 10349 B14R0.337 CCCCC#CCCCSCC(=O)OC 62a_200000047210_100000747449 [1,1,0,0,0,0|0,0,2]=4 10350 B14R0.337 CCCCC#CCCOCCC(=O)OC 34a_100000037610_100000742370 [1,1,0,0,0,0|0,0,2]=4 10351 B14R0.337 CCCCC#CCCOCCC(=O)OC 7a_100000037610_100000204255 [1,1,0,0,0,0|0,0,2]=4 10352 B14R0.337 CCCCC#CCOCCCC(=O)OC 34a_200000034558_100000742333 [1,1,0,0,0,0|0,0,2]=4 10353 B14R0.337 CCCCC#CCOCCCC(=O)OC 7a_200000034558_100011218270 [1,1,0,0,0,0|0,0,2]=4 10354 B14R0.337 CCCCC/C=C/COCCC(=O)OC 34a_100016258190_100000742370 [1,1,0,0,0,0|0,0,2]=4 10355 B14R0.337 CCCCC/C=C/COCCC(=O)OC 7a_100016258190_100000204255 [1,1,0,0,0,0|0,0,2]=4 10356 B14R0.337 CCCCC/C=C\CCOCC(=O)CC 7a_100016277358_100000747405 [1,1,0,0,0,0|0,0,2]=4 10357 B14R0.337 CCCCC/C=C\CCOCC(=O)OC 34a_100016277358_100000747449 [1,1,0,0,0,0|0,0,2]=4 10358 B14R0.337 CCCCC/C=C\CCOCC(=O)OC 7a_100016277358_100000747449 [1,1,0,0,0,0|0,0,2]=4 10359 B14R0.337 CCCCCC#CCCOCC(=O)CC 7a_200000042877_100000747405 [1,1,0,0,0,0|0,0,2]=4 10360 B14R0.337 CCCCCC#CCCOCC(=O)OC 34a_200000042877_100000747449 [1,1,0,0,0,0|0,0,2]=4 10361 B14R0.337 CCCCCC#CCCOCC(=O)OC 7a_200000042877_100000747449 [1,1,0,0,0,0|0,0,2]=4 10362 B14R0.337 CCCCCC#CCOCCC(=O)OC 34a_200000033628_100000742370 [1,1,0,0,0,0|0,0,2]=4 10363 B14R0.337 CCCCCC#CCOCCC(=O)OC 7a_200000033628_100000204255 [1,1,0,0,0,0|0,0,2]=4 10364 B14R0.337 CCCCCC#CCSCCC(=O)OC 62a_100000204255_100009816472 [1,1,0,0,0,0|0,0,2]=4 10365 B14R0.337 CCCCCC#CCSCCC(=O)OC 62a_100009816472_100000204255 [1,1,0,0,0,0|0,0,2]=4 10366 B14R0.337 CCCCCC/C=C/COCC(=O)CC 7a_200016276170_100000747405 [1,1,0,0,0,0|0,0,2]=4 10367 B14R0.337 CCCCCC/C=C/COCC(=O)OC 34a_200016276170_100000747449 [1,1,0,0,0,0|0,0,2]=4 10368 B14R0.337 CCCCCC/C=C/COCC(=O)OC 7a_200016276170_100000747449 [1,1,0,0,0,0|0,0,2]=4 10369 B14R0.337 CCCCCCC#CCOCC(=O)CC 7a_200000037284_100000747405 [1,1,0,0,0,0|0,0,2]=4 10370 B14R0.337 CCCCCCC#CCOCC(=O)OC 34a_200000037284_100000747449 [1,1,0,0,0,0|0,0,2]=4 10371 B14R0.337 CCCCCCC#CCOCC(=O)OC 7a_200000037284_100000747449 [1,1,0,0,0,0|0,0,2]=4 10372 B14R0.337 CCCCCCCCC=NNC(=O)CC 4a_100000183195_100011218696 [1,1,0,0,0,0|1,0,1]=4 10373 B14R0.337 CCCCCCCCCC=CC(=O)CC 1458a_200015352897_100000210202 [1,1,0,0,0,0|0,0,1]=3 10374 B14R0.337 CCCCCCCCCC=CC(=O)CF 1458a_200015352897_100015361967 [1,1,0,0,0,0|1,0,1]=4 10375 B14R0.337 CCCCCCCCCC=CC(=O)NC 11a_106832991635_200015352897 [1,1,0,0,0,0|1,0,1]=4 10376 B14R0.337 CCCCCCCCCC=CC(=O)NC 1626a_100102657272_200015352897 [1,1,0,0,0,0|1,0,1]=4 10377 B14R0.337 CCCCCCCCCC=CC(=O)NC 240690a_100102657272_200015352897 [1,1,0,0,0,0|1,0,1]=4 10378 B14R0.337 CCCCCCCCCCCC(=O)CC 1458a_100000210414_100011215454 [1,1,0,0,0,0|0,0,0]=2 10379 B14R0.337 CCCCCCCCCCCC(=O)CC 1458a_100000210736_100000210202 [1,1,0,0,0,0|0,0,0]=2 10380 B14R0.337 CCCCCCCCCCCC(=O)CF 1458a_100000210736_100015361967 [1,1,0,0,0,0|1,0,0]=3 10381 B14R0.337 CCCCCCCCCCCC(=O)CO 1458a_100000210174_100011215454 [1,1,0,0,0,0|1,0,0]=3 10382 B14R0.337 CCCCCCCCCCCC(=O)NC 11a_106832991635_100000210736 [1,1,0,0,0,0|1,0,0]=3 10383 B14R0.337 CCCCCCCCCCCC(=O)NC 1626a_100102657272_100000210736 [1,1,0,0,0,0|1,0,0]=3 10384 B14R0.337 CCCCCCCCCCCC(=O)NC 240690a_100102657272_100000210736 [1,1,0,0,0,0|1,0,0]=3 10385 B14R0.337 CCCCCCCCCCCC(C)OC 34a_100011217895_200000210301 [1,1,0,0,0,0|1,0,1]=4 10386 B14R0.337 CCCCCCCCCCCC(C)OC 7a_100011217895_200000210301 [1,1,0,0,0,0|1,0,1]=4 10387 B14R0.337 CCCCCCCCCCCC(C)O[13CH3] 34a_100011217895_200025704644 [1,1,0,0,0,0|1,0,1]=4 10388 B14R0.337 CCCCCCCCCCCC(C)O[13CH3] 7a_100011217895_200025704644 [1,1,0,0,0,0|1,0,1]=4 10389 B14R0.337 CCCCCCCCCCCN(C)CC 2230a_100000225621_100011215454 [1,1,0,0,0,0|2,0,0]=4 10390 B14R0.337 CCCCCCCCCCCN(C)CC 269982a_100000225621_100011215454 [1,1,0,0,0,0|2,0,0]=4 10391 B14R0.337 CCCCCCCCCCNC(=O)CC 11a_100000684558_100000210414 [1,1,0,0,0,0|0,0,0]=2 10392 B14R0.337 CCCCCCCCCCNC(=O)CC 1626a_100000684558_100000210414 [1,1,0,0,0,0|0,0,0]=2 10393 B14R0.337 CCCCCCCCCCNC(=O)CC 240690a_100000684558_100000210414 [1,1,0,0,0,0|0,0,0]=2 10394 B14R0.337 CCCCCCCCCCNC(=O)CC 527a_100000684558_100000210414 [1,1,0,0,0,0|0,0,0]=2 10395 B14R0.337 CCCCCCCCCCNC(=O)CO 240690a_100000684558_100000210174 [1,1,0,0,0,0|1,0,0]=3 10396 B14R0.337 CCCCCCCCCCNC(=O)CO 527a_100000684558_100000210174 [1,1,0,0,0,0|1,0,0]=3 10397 B14R0.337 CCCCCCCCCCNC(=O)NC 2708a_100000684558_106832991635 [1,1,0,0,0,0|1,0,0]=3 10398 B14R0.337 CCCCCCCCCCNC(=O)NC 2708a_100102657272_100000684558 [1,1,0,0,0,0|1,0,0]=3 10399 B14R0.337 CCCCCCCCCCNC(=O)NC 273464a_100000684558_100102657272 [1,1,0,0,0,0|1,0,0]=3 10400 B14R0.337 CCCCCCCCCCNC(=O)NC 273464a_100102657272_100000684558 [1,1,0,0,0,0|1,0,0]=3 10401 B14R0.337 CCCCCCCCCCNC(=O)NC 512a_100000684558_100102657272 [1,1,0,0,0,0|1,0,0]=3 10402 B14R0.337 CCCCCCCCCCNC(=O)NC 512a_106832991638_100000684558 [1,1,0,0,0,0|1,0,0]=3 10403 B14R0.337 CCCCCCCCCCNC(C)CC 2230a_100000209981_100000210320 [1,1,0,0,0,0|1,0,1]=4 10404 B14R0.337 CCCCCCCCCCNC(C)CC 2230a_100000684558_100000758301 [1,1,0,0,0,0|1,0,1]=4 10405 B14R0.337 CCCCCCCCCCNC(C)CC 34a_100000684558_100011215416 [1,1,0,0,0,0|1,0,1]=4 10406 B14R0.337 CCCCCCCCCCOC(C)CC 34a_100000210711_100011215416 [1,1,0,0,0,0|1,0,1]=4 10407 B14R0.337 CCCCCCCCCCOC(C)CC 7a_100000210228_100000210320 [1,1,0,0,0,0|1,0,1]=4 10408 B14R0.337 CCCCCCCCCCOC(C)CC 7a_100000210711_100000758301 [1,1,0,0,0,0|1,0,1]=4 10409 B14R0.337 CCCCCCCCCCSC(C)OC 62a_100009879195_100000210320 [1,1,0,0,0,0|1,0,1]=4 10410 B14R0.337 CCCCCCCCCNCC(=O)NC 2230a_100000212291_100000183359 [1,1,0,0,0,0|1,0,0]=3 10411 B14R0.337 CCCCCCCCCNCC(=O)NC 2230a_100000693194_100011214924 [1,1,0,0,0,0|1,0,0]=3 10412 B14R0.337 CCCCCCCCCNCC(=O)NC 34a_100000212291_100000183359 [1,1,0,0,0,0|1,0,0]=3 10413 B14R0.337 CCCCCCCCCNCC(=O)OC 2230a_100000212291_100000747449 [1,1,0,0,0,0|0,0,0]=2 10414 B14R0.337 CCCCCCCCCNCC(=O)OC 34a_100000212291_100000747449 [1,1,0,0,0,0|0,0,0]=2 10415 B14R0.337 CCCCCCCCCNCC(C)CC 2230a_100000212291_100000748023 [1,1,0,0,0,0|1,0,1]=4 10416 B14R0.337 CCCCCCCCCNCC(C)CC 2230a_100020588543_100011214924 [1,1,0,0,0,0|1,0,1]=4 10417 B14R0.337 CCCCCCCCCNCC(C)CC 270004a_100000212291_100000243153 [1,1,0,0,0,0|1,0,1]=4 10418 B14R0.337 CCCCCCCCCNCC(C)CC 34a_100000212291_100000748023 [1,1,0,0,0,0|1,0,1]=4 10419 B14R0.337 CCCCCCCCCNCC(O)CC 2230a_100000212291_100011218378 [1,1,0,0,0,0|0,0,2]=4 10420 B14R0.337 CCCCCCCCCNCC(O)CC 2230a_100011218483_100011214924 [1,1,0,0,0,0|0,0,2]=4 10421 B14R0.337 CCCCCCCCCNCC(O)CC 34a_100000212291_100011218378 [1,1,0,0,0,0|0,0,2]=4 10422 B14R0.337 CCCCCCCCCNC[C@@H](C)CC 2230a_100000212291_100009816398 [1,1,0,0,0,0|1,0,1]=4 10423 B14R0.337 CCCCCCCCCNC[C@@H](C)CC 34a_100000212291_100009816398 [1,1,0,0,0,0|1,0,1]=4 10424 B14R0.337 CCCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100011214924 [1,1,0,0,0,0|1,0,1]=4 10425 B14R0.337 CCCCCCCCCOCC(=O)CC 34a_100000725409_100011214924 [1,1,0,0,0,0|0,0,0]=2 10426 B14R0.337 CCCCCCCCCOCC(=O)CC 7a_100000210712_100000747405 [1,1,0,0,0,0|0,0,0]=2 10427 B14R0.337 CCCCCCCCCOCC(=O)NC 34a_100000210712_100000183359 [1,1,0,0,0,0|1,0,0]=3 10428 B14R0.337 CCCCCCCCCOCC(=O)NC 34a_100000750040_100011214924 [1,1,0,0,0,0|1,0,0]=3 10429 B14R0.337 CCCCCCCCCOCC(=O)NC 7a_100000210712_100000183359 [1,1,0,0,0,0|1,0,0]=3 10430 B14R0.337 CCCCCCCCCOCC(=O)OC 34a_100000210712_100000747449 [1,1,0,0,0,0|0,0,0]=2 10431 B14R0.337 CCCCCCCCCOCC(=O)OC 7a_100000210712_100000747449 [1,1,0,0,0,0|0,0,0]=2 10432 B14R0.337 CCCCCCCCCOCC(C)CC 34a_100000210712_100000748023 [1,1,0,0,0,0|1,0,1]=4 10433 B14R0.337 CCCCCCCCCOCC(C)CC 7a_100000210712_100000748023 [1,1,0,0,0,0|1,0,1]=4 10434 B14R0.337 CCCCCCCCCOCC(C)OC 34a_100000690652_100011214924 [1,1,0,0,0,0|1,0,1]=4 10435 B14R0.337 CCCCCCCCCOCC(O)CC 34a_100000210712_100011218378 [1,1,0,0,0,0|0,0,2]=4 10436 B14R0.337 CCCCCCCCCOCC(O)CC 7a_100000210712_100011218378 [1,1,0,0,0,0|0,0,2]=4 10437 B14R0.337 CCCCCCCCCOC[C@@H](C)CC 34a_100000210712_100009816398 [1,1,0,0,0,0|1,0,1]=4 10438 B14R0.337 CCCCCCCCCOC[C@@H](C)CC 7a_100000210712_100009816398 [1,1,0,0,0,0|1,0,1]=4 10439 B14R0.337 CCCCCCCCCOC[C@@H](C)CC 7a_100009816381_100000210328 [1,1,0,0,0,0|1,0,1]=4 10440 B14R0.337 CCCCCCCCCSCC(=O)CC 62a_100000747405_100000210670 [1,1,0,0,0,0|0,0,0]=2 10441 B14R0.337 CCCCCCCCCSCC(=O)NC 62a_100000183359_100000210670 [1,1,0,0,0,0|1,0,0]=3 10442 B14R0.337 CCCCCCCCCSCC(=O)OC 62a_100000747449_100000210670 [1,1,0,0,0,0|0,0,0]=2 10443 B14R0.337 CCCCCCCCCSCC(O)CC 62a_100011218378_100000210670 [1,1,0,0,0,0|0,0,2]=4 10444 B14R0.337 CCCCCCCCNCCC(=O)NC 2230a_100000229939_100000737683 [1,1,0,0,0,0|1,0,0]=3 10445 B14R0.337 CCCCCCCCNCCC(=O)NC 2230a_100000738227_100000210759 [1,1,0,0,0,0|1,0,0]=3 10446 B14R0.337 CCCCCCCCNCCC(=O)NC 34a_100000229939_100012179268 [1,1,0,0,0,0|1,0,0]=3 10447 B14R0.337 CCCCCCCCNCCC(=O)NC 34a_100000738227_100000210759 [1,1,0,0,0,0|1,0,0]=3 10448 B14R0.337 CCCCCCCCNCCC(=O)OC 2230a_100000229939_100000204255 [1,1,0,0,0,0|0,0,0]=2 10449 B14R0.337 CCCCCCCCNCCC(=O)OC 34a_100000229939_100000742370 [1,1,0,0,0,0|0,0,0]=2 10450 B14R0.337 CCCCCCCCNCCC(C)CC 2230a_100020591266_100000210759 [1,1,0,0,0,0|1,0,1]=4 10451 B14R0.337 CCCCCCCCOCCC(=O)NC 34a_100000210232_100012179268 [1,1,0,0,0,0|1,0,0]=3 10452 B14R0.337 CCCCCCCCOCCC(=O)NC 34a_100000754576_100000210759 [1,1,0,0,0,0|1,0,0]=3 10453 B14R0.337 CCCCCCCCOCCC(=O)NC 7a_100000210232_100000737683 [1,1,0,0,0,0|1,0,0]=3 10454 B14R0.337 CCCCCCCCOCCC(=O)OC 34a_100000210232_100000742370 [1,1,0,0,0,0|0,0,0]=2 10455 B14R0.337 CCCCCCCCOCCC(=O)OC 7a_100000210232_100000204255 [1,1,0,0,0,0|0,0,0]=2 10456 B14R0.337 CCCCCCCCOCCC(C)CC 7a_100011215188_100000210759 [1,1,0,0,0,0|1,0,1]=4 10457 B14R0.337 CCCCCCCCOCCC(C)OC 7a_100000764861_100000210759 [1,1,0,0,0,0|1,0,1]=4 10458 B14R0.337 CCCCCCCCSCCC(=O)NC 62a_100000210759_100000737683 [1,1,0,0,0,0|1,0,0]=3 10459 B14R0.337 CCCCCCCCSCCC(=O)NC 62a_100000737683_100000210317 [1,1,0,0,0,0|1,0,0]=3 10460 B14R0.337 CCCCCCCCSCCC(=O)OC 62a_100000204255_100000210317 [1,1,0,0,0,0|0,0,0]=2 10461 B14R0.337 CCCCCCCCSCCC(=O)OC 62a_100000210759_100000204255 [1,1,0,0,0,0|0,0,0]=2 10462 B14R0.337 CCCCCCCCSCOC(=O)OC 62a_100000210759_100000139417 [1,1,0,0,0,0|1,0,0]=3 10463 B14R0.337 CCCCCCCNC/C=C/C(=O)OC 2230a_100000229938_100000742655 [1,1,0,0,0,0|0,0,2]=4 10464 B14R0.337 CCCCCCCNCCCC(=O)NC 2230a_100000229938_100000741757 [1,1,0,0,0,0|1,0,0]=3 10465 B14R0.337 CCCCCCCNCCCC(=O)NC 2230a_100000740002_100000210681 [1,1,0,0,0,0|1,0,0]=3 10466 B14R0.337 CCCCCCCNCCCC(=O)NC 34a_100000740002_100000210614 [1,1,0,0,0,0|1,0,0]=3 10467 B14R0.337 CCCCCCCNCCCC(=O)OC 2230a_100000229938_100011218270 [1,1,0,0,0,0|0,0,0]=2 10468 B14R0.337 CCCCCCCNCCCN(C)CC 2230a_100000229938_100015186262 [1,1,0,0,0,0|2,0,0]=4 10469 B14R0.337 CCCCCCCNCCNC(=O)CC 34a_100132302217_100000210614 [1,1,0,0,0,0|1,0,0]=3 10470 B14R0.337 CCCCCCCNCCNC(=O)NC 34a_100015205895_100000210614 [1,1,0,0,0,0|2,0,0]=4 10471 B14R0.337 CCCCCCCOC/C=C/C(=O)OC 34a_100000210272_100000742655 [1,1,0,0,0,0|0,0,2]=4 10472 B14R0.337 CCCCCCCOC/C=C/C(=O)OC 7a_100000210272_100000742655 [1,1,0,0,0,0|0,0,2]=4 10473 B14R0.337 CCCCCCCOCCCC(=O)NC 34a_100000210272_100000741757 [1,1,0,0,0,0|1,0,0]=3 10474 B14R0.337 CCCCCCCOCCCC(=O)NC 7a_100000210272_100000741757 [1,1,0,0,0,0|1,0,0]=3 10475 B14R0.337 CCCCCCCOCCCC(=O)NN 34a_100000211488_100000210614 [1,1,0,0,0,0|2,0,0]=4 10476 B14R0.337 CCCCCCCOCCCC(=O)OC 34a_100000210272_100000742333 [1,1,0,0,0,0|0,0,0]=2 10477 B14R0.337 CCCCCCCOCCCC(=O)OC 7a_100000210272_100011218270 [1,1,0,0,0,0|0,0,0]=2 10478 B14R0.337 CCCCCCCOCCCC(C)CC 7a_100011216074_100000210614 [1,1,0,0,0,0|1,0,1]=4 10479 B14R0.337 CCCCCCCOCCCN(C)CC 7a_100000210272_100015186262 [1,1,0,0,0,0|2,0,0]=4 10480 B14R0.337 CCCCCCCOCCNC(=O)CC 34a_200000158885_100000210614 [1,1,0,0,0,0|1,0,0]=3 10481 B14R0.337 CCCCCCCOCCNC(=O)CC 7a_200000158885_100000210614 [1,1,0,0,0,0|1,0,0]=3 10482 B14R0.337 CCCCCCCOCCNC(=O)OC 34a_100000757965_100000210614 [1,1,0,0,0,0|1,0,0]=3 10483 B14R0.337 CCCCCCCOCCOC(=O)CC 7a_200000031056_100000210614 [1,1,0,0,0,0|1,0,0]=3 10484 B14R0.337 CCCCCCCOCCOC(=O)NC 34a_100000210272_200011997002 [1,1,0,0,0,0|2,0,0]=4 10485 B14R0.337 CCCCCCCOCCOC(=O)NC 7a_100000210272_200011997002 [1,1,0,0,0,0|2,0,0]=4 10486 B14R0.337 CCCCCCCOCCOC(=O)OC 34a_100010262106_100000210614 [1,1,0,0,0,0|1,0,0]=3 10487 B14R0.337 CCCCCCCSC/C=C/C(=O)OC 62a_100000210614_100000742655 [1,1,0,0,0,0|0,0,2]=4 10488 B14R0.337 CCCCCCCSC/C=C/C(=O)OC 62a_100000742655_100000210316 [1,1,0,0,0,0|0,0,2]=4 10489 B14R0.337 CCCCCCCSCCCC(=O)NC 62a_100000210614_100000741757 [1,1,0,0,0,0|1,0,0]=3 10490 B14R0.337 CCCCCCCSCCCC(=O)NC 62a_100000741757_100000210316 [1,1,0,0,0,0|1,0,0]=3 10491 B14R0.337 CCCCCCCSCCCC(=O)OC 62a_100000210614_100011218270 [1,1,0,0,0,0|0,0,0]=2 10492 B14R0.337 CCCCCCCSCCCC(=O)OC 62a_100011218270_100000210316 [1,1,0,0,0,0|0,0,0]=2 10493 B14R0.337 CCCCCCCSCCCN(C)CC 62a_100000210614_100015186262 [1,1,0,0,0,0|2,0,0]=4 10494 B14R0.337 CCCCCCCSCCOC(=O)NC 62a_100000210614_200011997002 [1,1,0,0,0,0|2,0,0]=4 10495 B14R0.337 CCCCCCCSCCOC(=O)NC 62a_200011997002_100000210316 [1,1,0,0,0,0|2,0,0]=4 10496 B14R0.337 CCCCCCNCCCCC(=O)OC 2230a_100000210581_100000204269 [1,1,0,0,0,0|0,0,0]=2 10497 B14R0.337 CCCCCCNCCOCC(=O)OC 2230a_100000210581_100000090808 [1,1,0,0,0,0|1,0,0]=3 10498 B14R0.337 CCCCCCOCCCCC(=O)OC 34a_100000059025_100000210314 [1,1,0,0,0,0|0,0,0]=2 10499 B14R0.337 CCCCCCOCCCCC(=O)OC 34a_100000210259_100000204269 [1,1,0,0,0,0|0,0,0]=2 10500 B14R0.337 CCCCCCOCCCCC(=O)OC 7a_100000059025_100000210314 [1,1,0,0,0,0|0,0,0]=2 10501 B14R0.337 CCCCCCOCCCCC(=O)OC 7a_100000210259_100000204269 [1,1,0,0,0,0|0,0,0]=2 10502 B14R0.337 CCCCCCOCCOCC(=O)CC 7a_100000691444_100000747405 [1,1,0,0,0,0|1,0,0]=3 10503 B14R0.337 CCCCCCOCCOCC(=O)NC 34a_100000691444_100000183359 [1,1,0,0,0,0|2,0,0]=4 10504 B14R0.337 CCCCCCOCCOCC(=O)NC 7a_100000691444_100000183359 [1,1,0,0,0,0|2,0,0]=4 10505 B14R0.337 CCCCCCOCCOCC(=O)OC 34a_100000210259_100000090808 [1,1,0,0,0,0|1,0,0]=3 10506 B14R0.337 CCCCCCOCCOCC(=O)OC 34a_100000691444_100000747449 [1,1,0,0,0,0|1,0,0]=3 10507 B14R0.337 CCCCCCOCCOCC(=O)OC 7a_100000210259_100000090808 [1,1,0,0,0,0|1,0,0]=3 10508 B14R0.337 CCCCCCOCCOCC(=O)OC 7a_100000691444_100000747449 [1,1,0,0,0,0|1,0,0]=3 10509 B14R0.337 CCCCCCSCCCCC(=O)OC 62a_100000204269_100000210757 [1,1,0,0,0,0|0,0,0]=2 10510 B14R0.337 CCCCCCSCCCCC(=O)OC 62a_100000210314_100000204269 [1,1,0,0,0,0|0,0,0]=2 10511 B14R0.337 CCCCCCSCCOCC(=O)OC 62a_100000090808_100000210757 [1,1,0,0,0,0|1,0,0]=3 10512 B14R0.337 CCCCCCSCCOCC(=O)OC 62a_100000210314_100000090808 [1,1,0,0,0,0|1,0,0]=3 10513 B14R0.337 CCCCCNCCCCCC(=O)OC 2230a_100000209983_100009816466 [1,1,0,0,0,0|0,0,0]=2 10514 B14R0.337 CCCCCNCCOCCC(=O)NC 34a_100000224656_100012179268 [1,1,0,0,0,0|2,0,0]=4 10515 B14R0.337 CCCCCNCCOCCC(=O)OC 34a_100000224656_100000742370 [1,1,0,0,0,0|1,0,0]=3 10516 B14R0.337 CCCCCNN=CCCCC(=O)OC 4a_100000694160_100000094087 [1,1,0,0,0,0|1,0,1]=4 10517 B14R0.337 CCCCCOCCCCCC(=O)OC 34a_100000074720_100000718602 [1,1,0,0,0,0|0,0,0]=2 10518 B14R0.337 CCCCCOCCCCCC(=O)OC 34a_100000210253_100009816466 [1,1,0,0,0,0|0,0,0]=2 10519 B14R0.337 CCCCCOCCCCCC(=O)OC 7a_100000074720_100000210326 [1,1,0,0,0,0|0,0,0]=2 10520 B14R0.337 CCCCCOCCCCCC(=O)OC 7a_100000210253_100009816466 [1,1,0,0,0,0|0,0,0]=2 10521 B14R0.337 CCCCCOCCCCCC(C)CC 7a_200000035636_100000210326 [1,1,0,0,0,0|1,0,1]=4 10522 B14R0.337 CCCCCOCCOCCC(=O)NC 34a_100011215259_100012179268 [1,1,0,0,0,0|2,0,0]=4 10523 B14R0.337 CCCCCOCCOCCC(=O)NC 7a_100011215259_100000737683 [1,1,0,0,0,0|2,0,0]=4 10524 B14R0.337 CCCCCOCCOCCC(=O)OC 34a_100011215259_100000742370 [1,1,0,0,0,0|1,0,0]=3 10525 B14R0.337 CCCCCOCCOCCC(=O)OC 7a_100011215259_100000204255 [1,1,0,0,0,0|1,0,0]=3 10526 B14R0.337 CCCCCSCCCCCC(=O)OC 62a_100000210326_100009816466 [1,1,0,0,0,0|0,0,0]=2 10527 B14R0.337 CCCCCSCCCCCC(=O)OC 62a_100009816466_100000210326 [1,1,0,0,0,0|0,0,0]=2 10528 B14R0.337 CCCCNCCCCCCC(=O)OC 2230a_100000102301_100009815986 [1,1,0,0,0,0|0,0,0]=2 10529 B14R0.337 CCCCNCCCCCCC(=O)OC 7a_106832991798_100009815986 [1,1,0,0,0,0|0,0,0]=2 10530 B14R0.337 CCCCNCCCCOCC(=O)NC 34a_200011216965_100000183359 [1,1,0,0,0,0|2,0,0]=4 10531 B14R0.337 CCCCNCCCCOCC(=O)OC 34a_200011216965_100000747449 [1,1,0,0,0,0|1,0,0]=3 10532 B14R0.337 CCCCNN=CCCCCC(=O)OC 4a_100025702795_100000052768 [1,1,0,0,0,0|1,0,1]=4 10533 B14R0.337 CCCCOCCCCCCC(=O)OC 34a_100000210227_100009815986 [1,1,0,0,0,0|0,0,0]=2 10534 B14R0.337 CCCCOCCCCCCC(=O)OC 34a_100009863599_100000210210 [1,1,0,0,0,0|0,0,0]=2 10535 B14R0.337 CCCCOCCCCCCC(=O)OC 7a_100000210227_100009815986 [1,1,0,0,0,0|0,0,0]=2 10536 B14R0.337 CCCCOCCCCCCC(=O)OC 7a_100009863599_100000210211 [1,1,0,0,0,0|0,0,0]=2 10537 B14R0.337 CCCCOCCCCOCC(=O)CC 7a_200000760531_100000747405 [1,1,0,0,0,0|1,0,0]=3 10538 B14R0.337 CCCCOCCCCOCC(=O)NC 34a_200000760531_100000183359 [1,1,0,0,0,0|2,0,0]=4 10539 B14R0.337 CCCCOCCCCOCC(=O)NC 7a_200000760531_100000183359 [1,1,0,0,0,0|2,0,0]=4 10540 B14R0.337 CCCCOCCCCOCC(=O)OC 34a_200000760531_100000747449 [1,1,0,0,0,0|1,0,0]=3 10541 B14R0.337 CCCCOCCCCOCC(=O)OC 7a_200000760531_100000747449 [1,1,0,0,0,0|1,0,0]=3 10542 B14R0.337 CCCCOCCCNCCC(=O)NC 2230a_200000211371_100000737683 [1,1,0,0,0,0|2,0,0]=4 10543 B14R0.337 CCCCOCCCNCCC(=O)NC 34a_200000211371_100012179268 [1,1,0,0,0,0|2,0,0]=4 10544 B14R0.337 CCCCOCCCNCCC(=O)OC 2230a_200000211371_100000204255 [1,1,0,0,0,0|1,0,0]=3 10545 B14R0.337 CCCCOCCCNCCC(=O)OC 34a_200000211371_100000742370 [1,1,0,0,0,0|1,0,0]=3 10546 B14R0.337 CCCCOCCCOCCC(=O)NC 34a_200011215613_100012179268 [1,1,0,0,0,0|2,0,0]=4 10547 B14R0.337 CCCCOCCCOCCC(=O)NC 7a_200011215613_100000737683 [1,1,0,0,0,0|2,0,0]=4 10548 B14R0.337 CCCCOCCCOCCC(=O)OC 34a_200011215613_100000742370 [1,1,0,0,0,0|1,0,0]=3 10549 B14R0.337 CCCCOCCCOCCC(=O)OC 7a_200011215613_100000204255 [1,1,0,0,0,0|1,0,0]=3 10550 B14R0.337 CCCCOCCNCCCC(=O)NC 2230a_100000740002_100000743108 [1,1,0,0,0,0|2,0,0]=4 10551 B14R0.337 CCCCOCCNCCCC(=O)NC 34a_100000740002_100000743108 [1,1,0,0,0,0|2,0,0]=4 10552 B14R0.337 CCCCOCCNCCNC(=O)CC 34a_100132302217_100000743108 [1,1,0,0,0,0|2,0,0]=4 10553 B14R0.337 CCCCOCCOCCCC(=O)NC 34a_100000210238_100000741757 [1,1,0,0,0,0|2,0,0]=4 10554 B14R0.337 CCCCOCCOCCCC(=O)NC 7a_100000210238_100000741757 [1,1,0,0,0,0|2,0,0]=4 10555 B14R0.337 CCCCOCCOCCCC(=O)OC 34a_100000210238_100000742333 [1,1,0,0,0,0|1,0,0]=3 10556 B14R0.337 CCCCOCCOCCCC(=O)OC 7a_100000210238_100011218270 [1,1,0,0,0,0|1,0,0]=3 10557 B14R0.337 CCCCOCCOCCNC(=O)CC 34a_200000158885_100000743108 [1,1,0,0,0,0|2,0,0]=4 10558 B14R0.337 CCCCOCCOCCNC(=O)CC 7a_200000158885_100000743108 [1,1,0,0,0,0|2,0,0]=4 10559 B14R0.337 CCCCOCCOCCNC(=O)OC 34a_100000757965_100000743108 [1,1,0,0,0,0|2,0,0]=4 10560 B14R0.337 CCCCOCCOCCOC(=O)CC 7a_200000031056_100000743108 [1,1,0,0,0,0|2,0,0]=4 10561 B14R0.337 CCCCOCCOCCOC(=O)OC 34a_100010262106_100000743108 [1,1,0,0,0,0|2,0,0]=4 10562 B14R0.337 CCCCOCCSCCCC(=O)NC 62a_100000741757_100000743108 [1,1,0,0,0,0|2,0,0]=4 10563 B14R0.337 CCCCOCCSCCCC(=O)NC 62a_100000743108_100000741757 [1,1,0,0,0,0|2,0,0]=4 10564 B14R0.337 CCCCOCCSCCCC(=O)OC 62a_100000743108_100011218270 [1,1,0,0,0,0|1,0,0]=3 10565 B14R0.337 CCCCOCCSCCCC(=O)OC 62a_100011218270_100000743108 [1,1,0,0,0,0|1,0,0]=3 10566 B14R0.337 CCCCOCOCCCCC(=O)OC 34a_100000059025_100011995733 [1,1,0,0,0,0|1,0,0]=3 10567 B14R0.337 CCCCOCSCCCCC(=O)OC 62a_100000204269_100011995733 [1,1,0,0,0,0|1,0,0]=3 10568 B14R0.337 CCCCOCSCCCCC(=O)OC 62a_100011995733_100000204269 [1,1,0,0,0,0|1,0,0]=3 10569 B14R0.337 CCCCOCSCCOCC(=O)OC 62a_100000090808_100011995733 [1,1,0,0,0,0|2,0,0]=4 10570 B14R0.337 CCCCOCSCCOCC(=O)OC 62a_100011995733_100000090808 [1,1,0,0,0,0|2,0,0]=4 10571 B14R0.337 CCCCSCCCCCCC(=O)OC 62a_100000210211_100009815986 [1,1,0,0,0,0|0,0,0]=2 10572 B14R0.337 CCCCSCCCCCCC(=O)OC 62a_100009815986_100000210210 [1,1,0,0,0,0|0,0,0]=2 10573 B14R0.337 CCCCSCCNCCCC(=O)NC 2230a_100025743550_100000741757 [1,1,0,0,0,0|2,0,0]=4 10574 B14R0.337 CCCCSCCNCCCC(=O)OC 2230a_100025743550_100011218270 [1,1,0,0,0,0|1,0,0]=3 10575 B14R0.337 CCCCSCCOCCCC(=O)NC 34a_200000230436_100000741757 [1,1,0,0,0,0|2,0,0]=4 10576 B14R0.337 CCCCSCCOCCCC(=O)NC 7a_200000230436_100000741757 [1,1,0,0,0,0|2,0,0]=4 10577 B14R0.337 CCCCSCCOCCCC(=O)OC 34a_200000230436_100000742333 [1,1,0,0,0,0|1,0,0]=3 10578 B14R0.337 CCCCSCCOCCCC(=O)OC 7a_200000230436_100011218270 [1,1,0,0,0,0|1,0,0]=3 10579 B14R0.337 CCCOCCCCCCCC(=O)OC 34a_100000210258_100010004213 [1,1,0,0,0,0|0,0,0]=2 10580 B14R0.337 CCCOCCCCCCCC(=O)OC 34a_100011022521_100000210303 [1,1,0,0,0,0|0,0,0]=2 10581 B14R0.337 CCCOCCCCCCCC(=O)OC 7a_100011022521_100000210303 [1,1,0,0,0,0|0,0,0]=2 10582 B14R0.337 CCCOCCCNCCCC(=O)NC 2230a_100011217757_100000741757 [1,1,0,0,0,0|2,0,0]=4 10583 B14R0.337 CCCOCCCNCCCC(=O)NC 34a_100011217757_100000741757 [1,1,0,0,0,0|2,0,0]=4 10584 B14R0.337 CCCOCCCNCCCC(=O)OC 2230a_100011217757_100011218270 [1,1,0,0,0,0|1,0,0]=3 10585 B14R0.337 CCCOCCCNCCCC(=O)OC 34a_100011217757_100000742333 [1,1,0,0,0,0|1,0,0]=3 10586 B14R0.337 CCCOCCNCCCCC(=O)OC 2230a_100161115042_100000204269 [1,1,0,0,0,0|1,0,0]=3 10587 B14R0.337 CCCOCCNCCCCC(=O)OC 34a_100161115042_100000204269 [1,1,0,0,0,0|1,0,0]=3 10588 B14R0.337 CCCOCCNCCOCC(=O)OC 2230a_100161115042_100000090808 [1,1,0,0,0,0|2,0,0]=4 10589 B14R0.337 CCCOCCNCCOCC(=O)OC 34a_100161115042_100000090808 [1,1,0,0,0,0|2,0,0]=4 10590 B14R0.337 CCCOCCOCCCCC(=O)OC 34a_100000059025_100011215938 [1,1,0,0,0,0|1,0,0]=3 10591 B14R0.337 CCCOCCOCCCCC(=O)OC 34a_100000752267_100000204269 [1,1,0,0,0,0|1,0,0]=3 10592 B14R0.337 CCCOCCOCCCCC(=O)OC 7a_100000059025_100011215938 [1,1,0,0,0,0|1,0,0]=3 10593 B14R0.337 CCCOCCOCCCCC(=O)OC 7a_100000752267_100000204269 [1,1,0,0,0,0|1,0,0]=3 10594 B14R0.337 CCCOCCOCCNCC(=O)OC 2230a_200011904461_100000747449 [1,1,0,0,0,0|2,0,0]=4 10595 B14R0.337 CCCOCCOCCNCC(=O)OC 34a_200011904461_100000747449 [1,1,0,0,0,0|2,0,0]=4 10596 B14R0.337 CCCOCCOCCOCC(=O)OC 34a_100000752267_100000090808 [1,1,0,0,0,0|2,0,0]=4 10597 B14R0.337 CCCOCCOCCOCC(=O)OC 34a_100011023656_100000210303 [1,1,0,0,0,0|2,0,0]=4 10598 B14R0.337 CCCOCCOCCOCC(=O)OC 7a_100000752267_100000090808 [1,1,0,0,0,0|2,0,0]=4 10599 B14R0.337 CCCOCCOCCOCC(=O)OC 7a_100011023656_100000210303 [1,1,0,0,0,0|2,0,0]=4 10600 B14R0.337 CCCOCCSCCCCC(=O)OC 62a_100000204269_100011215938 [1,1,0,0,0,0|1,0,0]=3 10601 B14R0.337 CCCOCCSCCCCC(=O)OC 62a_100011215938_100000204269 [1,1,0,0,0,0|1,0,0]=3 10602 B14R0.337 CCCOCCSCCOCC(=O)OC 62a_100000090808_100011215938 [1,1,0,0,0,0|2,0,0]=4 10603 B14R0.337 CCCOCCSCCOCC(=O)OC 62a_100011215938_100000090808 [1,1,0,0,0,0|2,0,0]=4 10604 B14R0.337 CCCSCCCCCCCC(=O)OC 62a_100000210303_100010004213 [1,1,0,0,0,0|0,0,0]=2 10605 B14R0.337 CCCSCCCCCCCC(=O)OC 62a_100010004213_100000210303 [1,1,0,0,0,0|0,0,0]=2 10606 B14R0.337 CCCSCCNCCCCC(=O)OC 2230a_100020603323_100000204269 [1,1,0,0,0,0|1,0,0]=3 10607 B14R0.337 CCCSCCNCCOCC(=O)OC 2230a_100020603323_100000090808 [1,1,0,0,0,0|2,0,0]=4 10608 B14R0.337 CCCSCCOCCCCC(=O)OC 34a_200000230433_100000204269 [1,1,0,0,0,0|1,0,0]=3 10609 B14R0.337 CCCSCCOCCCCC(=O)OC 7a_200000230433_100000204269 [1,1,0,0,0,0|1,0,0]=3 10610 B14R0.337 CCCSCCOCCOCC(=O)OC 34a_200000230433_100000090808 [1,1,0,0,0,0|2,0,0]=4 10611 B14R0.337 CCCSCCOCCOCC(=O)OC 7a_200000230433_100000090808 [1,1,0,0,0,0|2,0,0]=4 10612 B14R0.337 CCN(C)CCCCCCCCCCO 2230a_100000225621_100009813290 [1,1,0,0,0,0|2,0,0]=4 10613 B14R0.337 CCN(C)CCCCCCCCCCO 269982a_100000225621_100009813290 [1,1,0,0,0,0|2,0,0]=4 10614 B14R0.337 CCNCCCCCCCCC(=O)OC 2230a_100015525214_100010282707 [1,1,0,0,0,0|0,0,0]=2 10615 B14R0.337 CCOCCCCCCCCC(=O)OC 34a_100000035544_100000210202 [1,1,0,0,0,0|0,0,0]=2 10616 B14R0.337 CCOCCCCCCCCC(=O)OC 34a_100121572206_100010282707 [1,1,0,0,0,0|0,0,0]=2 10617 B14R0.337 CCOCCCCCCCCC(=O)OC 7a_100000035544_100000210202 [1,1,0,0,0,0|0,0,0]=2 10618 B14R0.337 CCOCCCNCCCCC(=O)OC 2230a_100000210961_100000204269 [1,1,0,0,0,0|1,0,0]=3 10619 B14R0.337 CCOCCCNCCCCC(=O)OC 34a_100000210961_100000204269 [1,1,0,0,0,0|1,0,0]=3 10620 B14R0.337 CCOCCCNCCOCC(=O)OC 2230a_100000210961_100000090808 [1,1,0,0,0,0|2,0,0]=4 10621 B14R0.337 CCOCCCNCCOCC(=O)OC 34a_100000210961_100000090808 [1,1,0,0,0,0|2,0,0]=4 10622 B14R0.337 CCOCCCOCCCCC(=O)OC 34a_100000059025_100012232248 [1,1,0,0,0,0|1,0,0]=3 10623 B14R0.337 CCOCCCOCCCCC(=O)OC 34a_100000757476_100000204269 [1,1,0,0,0,0|1,0,0]=3 10624 B14R0.337 CCOCCCOCCCCC(=O)OC 7a_100000059025_100012232248 [1,1,0,0,0,0|1,0,0]=3 10625 B14R0.337 CCOCCCOCCCCC(=O)OC 7a_100000757476_100000204269 [1,1,0,0,0,0|1,0,0]=3 10626 B14R0.337 CCOCCCOCCOCC(=O)OC 34a_100000757476_100000090808 [1,1,0,0,0,0|2,0,0]=4 10627 B14R0.337 CCOCCCOCCOCC(=O)OC 7a_100000757476_100000090808 [1,1,0,0,0,0|2,0,0]=4 10628 B14R0.337 CCOCCCSCCCCC(=O)OC 62a_100000204269_100012232248 [1,1,0,0,0,0|1,0,0]=3 10629 B14R0.337 CCOCCCSCCCCC(=O)OC 62a_100012232248_100000204269 [1,1,0,0,0,0|1,0,0]=3 10630 B14R0.337 CCOCCCSCCOCC(=O)OC 62a_100000090808_100012232248 [1,1,0,0,0,0|2,0,0]=4 10631 B14R0.337 CCOCCCSCCOCC(=O)OC 62a_100012232248_100000090808 [1,1,0,0,0,0|2,0,0]=4 10632 B14R0.337 CCOCCNCCCCCC(=O)OC 2230a_102516460346_100009816466 [1,1,0,0,0,0|1,0,0]=3 10633 B14R0.337 CCOCCNCCCCCC(=O)OC 34a_102516460346_100009816466 [1,1,0,0,0,0|1,0,0]=3 10634 B14R0.337 CCOCCOCCCCCC(=O)OC 34a_100000074720_100000210147 [1,1,0,0,0,0|1,0,0]=3 10635 B14R0.337 CCOCCOCCCCCC(=O)OC 34a_100000210136_100009816466 [1,1,0,0,0,0|1,0,0]=3 10636 B14R0.337 CCOCCOCCCCCC(=O)OC 7a_100000074720_100011215890 [1,1,0,0,0,0|1,0,0]=3 10637 B14R0.337 CCOCCOCCCCCC(=O)OC 7a_100000210136_100009816466 [1,1,0,0,0,0|1,0,0]=3 10638 B14R0.337 CCOCCOCCNCCC(=O)OC 2230a_100102712874_100000204255 [1,1,0,0,0,0|2,0,0]=4 10639 B14R0.337 CCOCCOCCNCCC(=O)OC 34a_100102712874_100000742370 [1,1,0,0,0,0|2,0,0]=4 10640 B14R0.337 CCOCCOCCOCCC(=O)OC 34a_100000210240_100000742370 [1,1,0,0,0,0|2,0,0]=4 10641 B14R0.337 CCOCCOCCOCCC(=O)OC 34a_100010982084_100000210202 [1,1,0,0,0,0|2,0,0]=4 10642 B14R0.337 CCOCCOCCOCCC(=O)OC 7a_100000210240_100000204255 [1,1,0,0,0,0|2,0,0]=4 10643 B14R0.337 CCOCCOCCOCCC(=O)OC 7a_100010982084_100000210202 [1,1,0,0,0,0|2,0,0]=4 10644 B14R0.337 CCOCCOCCSCCC(=O)OC 62a_100000204255_100011211534 [1,1,0,0,0,0|2,0,0]=4 10645 B14R0.337 CCOCCOCCSCCC(=O)OC 62a_100011211534_100000204255 [1,1,0,0,0,0|2,0,0]=4 10646 B14R0.337 CCOCCSCCCCCC(=O)OC 62a_100000210147_100009816466 [1,1,0,0,0,0|1,0,0]=3 10647 B14R0.337 CCOCCSCCCCCC(=O)OC 62a_100009816466_100011215890 [1,1,0,0,0,0|1,0,0]=3 10648 B14R0.337 CCOCSCCCCCCC(=O)OC 62a_100000739092_100009815986 [1,1,0,0,0,0|1,0,0]=3 10649 B14R0.337 CCOCSCCCCCCC(=O)OC 62a_100009815986_100000739092 [1,1,0,0,0,0|1,0,0]=3 10650 B14R0.337 CCSCCCCCCCCC(=O)OC 62a_100000210202_100010282707 [1,1,0,0,0,0|0,0,0]=2 10651 B14R0.337 CCSCCCCCCCCC(=O)OC 62a_100010282707_100000210202 [1,1,0,0,0,0|0,0,0]=2 10652 B14R0.337 CCSCCCOCCCCC(=O)OC 34a_100011216438_100000204269 [1,1,0,0,0,0|1,0,0]=3 10653 B14R0.337 CCSCCCOCCCCC(=O)OC 7a_100011216438_100000204269 [1,1,0,0,0,0|1,0,0]=3 10654 B14R0.337 CCSCCCOCCOCC(=O)OC 34a_100011216438_100000090808 [1,1,0,0,0,0|2,0,0]=4 10655 B14R0.337 CCSCCCOCCOCC(=O)OC 7a_100011216438_100000090808 [1,1,0,0,0,0|2,0,0]=4 10656 B14R0.337 CCSCCNCCCCCC(=O)OC 2230a_100000106463_100009816466 [1,1,0,0,0,0|1,0,0]=3 10657 B14R0.337 CCSCCOCCCCCC(=O)OC 34a_100000074720_100000757381 [1,1,0,0,0,0|1,0,0]=3 10658 B14R0.337 CCSCCOCCCCCC(=O)OC 34a_100000212035_100009816466 [1,1,0,0,0,0|1,0,0]=3 10659 B14R0.337 CCSCCOCCCCCC(=O)OC 7a_100000074720_100000757381 [1,1,0,0,0,0|1,0,0]=3 10660 B14R0.337 CCSCCOCCCCCC(=O)OC 7a_100000212035_100009816466 [1,1,0,0,0,0|1,0,0]=3 10661 B14R0.337 CCSCCSCCCCCC(=O)OC 62a_100000757381_100009816466 [1,1,0,0,0,0|1,0,0]=3 10662 B14R0.337 CCSCCSCCCCCC(=O)OC 62a_100009816466_100000757381 [1,1,0,0,0,0|1,0,0]=3 10663 B14R0.337 CNC(=O)CCCCCCCCCCO 240690a_100102657272_200000016029 [1,1,0,0,0,0|1,0,0]=3 10664 B14R0.337 CNC(=O)CCCNCCCCCCF 2230a_100000740002_100015922095 [1,1,0,0,0,0|2,0,0]=4 10665 B14R0.337 CNC(=O)CCCNCCCCCCF 34a_100000740002_100015922095 [1,1,0,0,0,0|2,0,0]=4 10666 B14R0.337 CNC(=O)CCCNCCCCCCO 2230a_100000686447_100000741757 [1,1,0,0,0,0|2,0,0]=4 10667 B14R0.337 CNC(=O)CCCNCCCCCCO 2230a_100000740002_100000766143 [1,1,0,0,0,0|2,0,0]=4 10668 B14R0.337 CNC(=O)CCCNCCCCCCO 34a_100000686447_100000741757 [1,1,0,0,0,0|2,0,0]=4 10669 B14R0.337 CNC(=O)CCCNCCCCCCO 34a_100000740002_100000766143 [1,1,0,0,0,0|2,0,0]=4 10670 B14R0.337 CNC(=O)CCCNCCCCCOC 2230a_100000747528_100000741757 [1,1,0,0,0,0|2,0,0]=4 10671 B14R0.337 CNC(=O)CCCNCCCCCOC 34a_100000747528_100000741757 [1,1,0,0,0,0|2,0,0]=4 10672 B14R0.337 CNC(=O)CCCOCCCCCCBr 34a_100011215345_100000741757 [1,1,0,0,0,0|2,0,0]=4 10673 B14R0.337 CNC(=O)CCCOCCCCCCBr 7a_100011215345_100000741757 [1,1,0,0,0,0|2,0,0]=4 10674 B14R0.337 CNC(=O)CCCOCCCCCCCl 34a_100000766143_100000741757 [1,1,0,0,0,0|2,0,0]=4 10675 B14R0.337 CNC(=O)CCCOCCCCCCCl 7a_100000766143_100000741757 [1,1,0,0,0,0|2,0,0]=4 10676 B14R0.337 CNC(=O)CCCOCCCCCCF 34a_100000732779_100000741757 [1,1,0,0,0,0|2,0,0]=4 10677 B14R0.337 CNC(=O)CCCOCCCCCCF 7a_100000732779_100000741757 [1,1,0,0,0,0|2,0,0]=4 10678 B14R0.337 CNC(=O)CCCOCCCCCCN 34a_100000686447_100000741757 [1,1,0,0,0,0|2,0,0]=4 10679 B14R0.337 CNC(=O)CCCSCCCCCCF 62a_100000741757_100015922095 [1,1,0,0,0,0|2,0,0]=4 10680 B14R0.337 CNC(=O)CCCSCCCCCCF 62a_100015922095_100000741757 [1,1,0,0,0,0|2,0,0]=4 10681 B14R0.337 CNC(=O)CCCSCCCCCCO 62a_100000741757_100000766143 [1,1,0,0,0,0|2,0,0]=4 10682 B14R0.337 CNC(=O)CCCSCCCCCCO 62a_100000766143_100000741757 [1,1,0,0,0,0|2,0,0]=4 10683 B14R0.337 CNC(=O)CCNCCCCCCCO 2230a_100000738227_100000760002 [1,1,0,0,0,0|2,0,0]=4 10684 B14R0.337 CNC(=O)CCNCCCCCCCO 2230a_100011996573_100000737683 [1,1,0,0,0,0|2,0,0]=4 10685 B14R0.337 CNC(=O)CCNCCCCCCCO 34a_100000738227_100000760002 [1,1,0,0,0,0|2,0,0]=4 10686 B14R0.337 CNC(=O)CCNCCCCCCCO 34a_100011996573_100012179268 [1,1,0,0,0,0|2,0,0]=4 10687 B14R0.337 CNC(=O)CCNCCCCCCOC 2230a_100000738227_100011998445 [1,1,0,0,0,0|2,0,0]=4 10688 B14R0.337 CNC(=O)CCNCCCCCCOC 34a_100000738227_100011998445 [1,1,0,0,0,0|2,0,0]=4 10689 B14R0.337 CNC(=O)CCOCCCCCCCBr 34a_100000760002_100012179268 [1,1,0,0,0,0|2,0,0]=4 10690 B14R0.337 CNC(=O)CCOCCCCCCCBr 7a_100000760002_100000737683 [1,1,0,0,0,0|2,0,0]=4 10691 B14R0.337 CNC(=O)CCOCCCCCCCN 34a_100011996573_100012179268 [1,1,0,0,0,0|2,0,0]=4 10692 B14R0.337 CNC(=O)CCOCCCCCCCO 34a_100000754576_100000760002 [1,1,0,0,0,0|2,0,0]=4 10693 B14R0.337 CNC(=O)CCOCCCCCCOC 34a_100000754576_100011998445 [1,1,0,0,0,0|2,0,0]=4 10694 B14R0.337 CNC(=O)CCOCCCCCCOC 34a_200012092642_100012179268 [1,1,0,0,0,0|2,0,0]=4 10695 B14R0.337 CNC(=O)CCOCCCCCCOC 7a_200012092642_100000737683 [1,1,0,0,0,0|2,0,0]=4 10696 B14R0.337 CNC(=O)CCSCCCCCCCO 62a_100000737683_100000760002 [1,1,0,0,0,0|2,0,0]=4 10697 B14R0.337 CNC(=O)CCSCCCCCCCO 62a_100000760002_100000737683 [1,1,0,0,0,0|2,0,0]=4 10698 B14R0.337 CNC(=O)CCSCCCCCCOC 62a_100000737683_100011998445 [1,1,0,0,0,0|2,0,0]=4 10699 B14R0.337 CNC(=O)CCSCCCCCCOC 62a_100011998445_100000737683 [1,1,0,0,0,0|2,0,0]=4 10700 B14R0.337 CNC(=O)CNCCCCCCCCO 2230a_100000693194_100000033203 [1,1,0,0,0,0|2,0,0]=4 10701 B14R0.337 CNC(=O)CNCCCCCCCCO 2230a_102515433106_100000183359 [1,1,0,0,0,0|2,0,0]=4 10702 B14R0.337 CNC(=O)CNCCCCCCCCO 34a_102515433106_100000183359 [1,1,0,0,0,0|2,0,0]=4 10703 B14R0.337 CNC(=O)COCCCCCCCCBr 34a_100009813846_100000183359 [1,1,0,0,0,0|2,0,0]=4 10704 B14R0.337 CNC(=O)COCCCCCCCCBr 7a_100009813846_100000183359 [1,1,0,0,0,0|2,0,0]=4 10705 B14R0.337 CNC(=O)COCCCCCCCCCl 34a_100000033203_100000183359 [1,1,0,0,0,0|2,0,0]=4 10706 B14R0.337 CNC(=O)COCCCCCCCCCl 7a_100000033203_100000183359 [1,1,0,0,0,0|2,0,0]=4 10707 B14R0.337 CNC(=O)COCCCCCCCCN 34a_102515433106_100000183359 [1,1,0,0,0,0|2,0,0]=4 10708 B14R0.337 CNC(=O)COCCCCCCCCO 34a_100000750040_100000033203 [1,1,0,0,0,0|2,0,0]=4 10709 B14R0.337 CNC(=O)CSCCCCCCCCO 62a_100000033203_100000183359 [1,1,0,0,0,0|2,0,0]=4 10710 B14R0.337 CNC(=O)CSCCCCCCCCO 62a_100000183359_100000033203 [1,1,0,0,0,0|2,0,0]=4 10711 B14R0.337 CNC(=O)NCCCCCCCCCO 2708a_100000078944_106832991635 [1,1,0,0,0,0|2,0,0]=4 10712 B14R0.337 CNC(=O)NCCCCCCCCCO 2708a_100102657272_100000078944 [1,1,0,0,0,0|2,0,0]=4 10713 B14R0.337 CNC(=O)NCCCCCCCCCO 273464a_100000078944_100102657272 [1,1,0,0,0,0|2,0,0]=4 10714 B14R0.337 CNC(=O)NCCCCCCCCCO 273464a_100102657272_100000078944 [1,1,0,0,0,0|2,0,0]=4 10715 B14R0.337 CNC(=O)NCCCCCCCCCO 512a_100000078944_100102657272 [1,1,0,0,0,0|2,0,0]=4 10716 B14R0.337 CNC(=O)NCCCCCCCCCO 512a_106832991638_100000078944 [1,1,0,0,0,0|2,0,0]=4 10717 B14R0.337 CNCCCCCCCCCC(=O)OC 2230a_106832991635_100009813843 [1,1,0,0,0,0|0,0,0]=2 10718 B14R0.337 CNCCCCCCCCCC(=O)OC 34a_100102657272_100009813843 [1,1,0,0,0,0|0,0,0]=2 10719 B14R0.337 CNCCCCCCCCCC(=O)OC 7a_106832991635_100009813843 [1,1,0,0,0,0|0,0,0]=2 10720 B14R0.337 CNCCCCCOCCCC(=O)NC 34a_100000722520_100000741757 [1,1,0,0,0,0|2,0,0]=4 10721 B14R0.337 CNCCCCCOCCCC(=O)OC 34a_100000722520_100000742333 [1,1,0,0,0,0|1,0,0]=3 10722 B14R0.337 CNCCCOCCCCCC(=O)OC 34a_100000213112_100009816466 [1,1,0,0,0,0|1,0,0]=3 10723 B14R0.337 CNCCOCCOCCCC(=O)OC 34a_100000228057_100000742333 [1,1,0,0,0,0|2,0,0]=4 10724 B14R0.337 COC(=O)CCCCCCCCCSC 62a_200000210301_100009813843 [1,1,0,0,0,0|0,0,0]=2 10725 B14R0.337 COC(=O)CCCCCCCCCS[13CH3] 62a_200025704644_100009813843 [1,1,0,0,0,0|0,0,0]=2 10726 B14R0.337 COC(=O)CCCCCCCCOCF 34a_100000035544_100015361967 [1,1,0,0,0,0|1,0,0]=3 10727 B14R0.337 COC(=O)CCCCCCCCOCF 7a_100000035544_100015361967 [1,1,0,0,0,0|1,0,0]=3 10728 B14R0.337 COC(=O)CCCCCCCCSCF 62a_100010282707_100015361967 [1,1,0,0,0,0|1,0,0]=3 10729 B14R0.337 COC(=O)CCCCCCCCSCF 62a_100015361967_100010282707 [1,1,0,0,0,0|1,0,0]=3 10730 B14R0.337 COC(=O)CCCCCCCNCCF 34a_100000724931_100010004213 [1,1,0,0,0,0|1,0,0]=3 10731 B14R0.337 COC(=O)CCCCCCCNCCO 2230a_100016997473_100010004213 [1,1,0,0,0,0|1,0,0]=3 10732 B14R0.337 COC(=O)CCCCCCCNCCO 34a_100016990907_100010004213 [1,1,0,0,0,0|1,0,0]=3 10733 B14R0.337 COC(=O)CCCCCCCOCC#N 7a_100011022521_100011215382 [1,1,0,0,0,0|1,0,1]=4 10734 B14R0.337 COC(=O)CCCCCCCOCC=O 34a_100011022521_200009817547 [1,1,0,0,0,0|1,0,1]=4 10735 B14R0.337 COC(=O)CCCCCCCOCC=O 7a_100011022521_200015260668 [1,1,0,0,0,0|1,0,1]=4 10736 B14R0.337 COC(=O)CCCCCCCOCCBr 34a_100000211926_100010004213 [1,1,0,0,0,0|1,0,0]=3 10737 B14R0.337 COC(=O)CCCCCCCOCCF 34a_100011022521_100011217306 [1,1,0,0,0,0|1,0,0]=3 10738 B14R0.337 COC(=O)CCCCCCCOCCF 7a_100011022521_100011217306 [1,1,0,0,0,0|1,0,0]=3 10739 B14R0.337 COC(=O)CCCCCCCOCCN 34a_100000210304_100010004213 [1,1,0,0,0,0|1,0,0]=3 10740 B14R0.337 COC(=O)CCCCCCCOCCO 34a_100011022521_100000211926 [1,1,0,0,0,0|1,0,0]=3 10741 B14R0.337 COC(=O)CCCCCCCOCCO 7a_100011022521_100000211926 [1,1,0,0,0,0|1,0,0]=3 10742 B14R0.337 COC(=O)CCCCCCCOCSC 34a_100011022521_100011218213 [1,1,0,0,0,0|1,0,0]=3 10743 B14R0.337 COC(=O)CCCCCCCSCC#N 62a_100010004213_100011215382 [1,1,0,0,0,0|1,0,1]=4 10744 B14R0.337 COC(=O)CCCCCCCSCC#N 62a_100011215382_100010004213 [1,1,0,0,0,0|1,0,1]=4 10745 B14R0.337 COC(=O)CCCCCCCSCC=O 62a_100010004213_200015260668 [1,1,0,0,0,0|1,0,1]=4 10746 B14R0.337 COC(=O)CCCCCCCSCC=O 62a_200015260668_100010004213 [1,1,0,0,0,0|1,0,1]=4 10747 B14R0.337 COC(=O)CCCCCCCSCCF 62a_100010004213_100011217306 [1,1,0,0,0,0|1,0,0]=3 10748 B14R0.337 COC(=O)CCCCCCCSCCF 62a_100011217306_100010004213 [1,1,0,0,0,0|1,0,0]=3 10749 B14R0.337 COC(=O)CCCCCCCSCCO 62a_100000211926_100010004213 [1,1,0,0,0,0|1,0,0]=3 10750 B14R0.337 COC(=O)CCCCCCCSCCO 62a_100010004213_100000211926 [1,1,0,0,0,0|1,0,0]=3 10751 B14R0.337 COC(=O)CCCCCCCSCSC 62a_100010004213_100011218213 [1,1,0,0,0,0|1,0,0]=3 10752 B14R0.337 COC(=O)CCCCCCCSCSC 62a_100011218213_100010004213 [1,1,0,0,0,0|1,0,0]=3 10753 B14R0.337 COC(=O)CCCCCCNCCCF 2230a_100015189416_100009815986 [1,1,0,0,0,0|1,0,0]=3 10754 B14R0.337 COC(=O)CCCCCCNCCCF 34a_100015189416_100009815986 [1,1,0,0,0,0|1,0,0]=3 10755 B14R0.337 COC(=O)CCCCCCNCCSC 2230a_100020590264_100009815986 [1,1,0,0,0,0|1,0,0]=3 10756 B14R0.337 COC(=O)CCCCCCOCCC#N 7a_100009863599_100000184422 [1,1,0,0,0,0|1,0,1]=4 10757 B14R0.337 COC(=O)CCCCCCOCCCBr 34a_100011217188_100009815986 [1,1,0,0,0,0|1,0,0]=3 10758 B14R0.337 COC(=O)CCCCCCOCCCCl 34a_100000230001_100009815986 [1,1,0,0,0,0|1,0,0]=3 10759 B14R0.337 COC(=O)CCCCCCOCCCF 34a_100000759539_100009815986 [1,1,0,0,0,0|1,0,0]=3 10760 B14R0.337 COC(=O)CCCCCCOCCCF 34a_100009863599_100011934791 [1,1,0,0,0,0|1,0,0]=3 10761 B14R0.337 COC(=O)CCCCCCOCCCF 7a_100009863599_100011934791 [1,1,0,0,0,0|1,0,0]=3 10762 B14R0.337 COC(=O)CCCCCCOCCCN 34a_100000182051_100009815986 [1,1,0,0,0,0|1,0,0]=3 10763 B14R0.337 COC(=O)CCCCCCOCCCO 34a_100009863599_100000230001 [1,1,0,0,0,0|1,0,0]=3 10764 B14R0.337 COC(=O)CCCCCCOCCCO 7a_100009863599_100011215043 [1,1,0,0,0,0|1,0,0]=3 10765 B14R0.337 COC(=O)CCCCCCOCCON 34a_100000700252_100009815986 [1,1,0,0,0,0|2,0,0]=4 10766 B14R0.337 COC(=O)CCCCCCOCCSC 34a_100000230434_100009815986 [1,1,0,0,0,0|1,0,0]=3 10767 B14R0.337 COC(=O)CCCCCCOCCSC 34a_100009863599_100000212216 [1,1,0,0,0,0|1,0,0]=3 10768 B14R0.337 COC(=O)CCCCCCOCCSC 7a_100000230434_100009815986 [1,1,0,0,0,0|1,0,0]=3 10769 B14R0.337 COC(=O)CCCCCCOCCSC 7a_100009863599_100000212216 [1,1,0,0,0,0|1,0,0]=3 10770 B14R0.337 COC(=O)CCCCCCSCCC#N 62a_100009815986_100011215226 [1,1,0,0,0,0|1,0,1]=4 10771 B14R0.337 COC(=O)CCCCCCSCCC#N 62a_100011215226_100009815986 [1,1,0,0,0,0|1,0,1]=4 10772 B14R0.337 COC(=O)CCCCCCSCCCF 62a_100009815986_100011934791 [1,1,0,0,0,0|1,0,0]=3 10773 B14R0.337 COC(=O)CCCCCCSCCCF 62a_100011934791_100009815986 [1,1,0,0,0,0|1,0,0]=3 10774 B14R0.337 COC(=O)CCCCCCSCCCO 62a_100009815986_100011215043 [1,1,0,0,0,0|1,0,0]=3 10775 B14R0.337 COC(=O)CCCCCCSCCCO 62a_100011215043_100009815986 [1,1,0,0,0,0|1,0,0]=3 10776 B14R0.337 COC(=O)CCCCCCSCCSC 62a_100000212216_100009815986 [1,1,0,0,0,0|1,0,0]=3 10777 B14R0.337 COC(=O)CCCCCCSCCSC 62a_100009815986_100000751147 [1,1,0,0,0,0|1,0,0]=3 10778 B14R0.337 COC(=O)CCCCCNCCCCO 2230a_100000750430_100009816466 [1,1,0,0,0,0|1,0,0]=3 10779 B14R0.337 COC(=O)CCCCCNCCCCO 34a_100000750430_100009816466 [1,1,0,0,0,0|1,0,0]=3 10780 B14R0.337 COC(=O)CCCCCNCCCSC 2230a_100000749238_100009816466 [1,1,0,0,0,0|1,0,0]=3 10781 B14R0.337 COC(=O)CCCCCOCCCC#N 7a_100000074720_100000687738 [1,1,0,0,0,0|1,0,1]=4 10782 B14R0.337 COC(=O)CCCCCOCCCC=O 7a_100000074720_200011292268 [1,1,0,0,0,0|1,0,1]=4 10783 B14R0.337 COC(=O)CCCCCOCCCCBr 34a_100011216708_100009816466 [1,1,0,0,0,0|1,0,0]=3 10784 B14R0.337 COC(=O)CCCCCOCCCCCl 34a_100000210776_100009816466 [1,1,0,0,0,0|1,0,0]=3 10785 B14R0.337 COC(=O)CCCCCOCCCCCl 7a_100000210776_100009816466 [1,1,0,0,0,0|1,0,0]=3 10786 B14R0.337 COC(=O)CCCCCOCCCCF 34a_100000074720_100000729493 [1,1,0,0,0,0|1,0,0]=3 10787 B14R0.337 COC(=O)CCCCCOCCCCF 34a_100011995726_100009816466 [1,1,0,0,0,0|1,0,0]=3 10788 B14R0.337 COC(=O)CCCCCOCCCCF 7a_100000074720_100000729493 [1,1,0,0,0,0|1,0,0]=3 10789 B14R0.337 COC(=O)CCCCCOCCCCF 7a_100011995726_100009816466 [1,1,0,0,0,0|1,0,0]=3 10790 B14R0.337 COC(=O)CCCCCOCCCCI 34a_200012148704_100009816466 [1,1,0,0,0,0|1,0,0]=3 10791 B14R0.337 COC(=O)CCCCCOCCCCN 34a_100000750430_100009816466 [1,1,0,0,0,0|1,0,0]=3 10792 B14R0.337 COC(=O)CCCCCOCCCCO 34a_100000074720_100011216708 [1,1,0,0,0,0|1,0,0]=3 10793 B14R0.337 COC(=O)CCCCCOCCCCO 7a_100000074720_100000210776 [1,1,0,0,0,0|1,0,0]=3 10794 B14R0.337 COC(=O)CCCCCOCCCSC 34a_100000690336_100009816466 [1,1,0,0,0,0|1,0,0]=3 10795 B14R0.337 COC(=O)CCCCCOCCCSC 7a_100000690336_100009816466 [1,1,0,0,0,0|1,0,0]=3 10796 B14R0.337 COC(=O)CCCCCSCCCC#N 62a_100000687738_100009816466 [1,1,0,0,0,0|1,0,1]=4 10797 B14R0.337 COC(=O)CCCCCSCCCC#N 62a_100009816466_100000687738 [1,1,0,0,0,0|1,0,1]=4 10798 B14R0.337 COC(=O)CCCCCSCCCC=O 62a_100009816466_200011292268 [1,1,0,0,0,0|1,0,1]=4 10799 B14R0.337 COC(=O)CCCCCSCCCC=O 62a_200011292268_100009816466 [1,1,0,0,0,0|1,0,1]=4 10800 B14R0.337 COC(=O)CCCCCSCCCCF 62a_100000729493_100009816466 [1,1,0,0,0,0|1,0,0]=3 10801 B14R0.337 COC(=O)CCCCCSCCCCF 62a_100009816466_100000729493 [1,1,0,0,0,0|1,0,0]=3 10802 B14R0.337 COC(=O)CCCCCSCCCCO 62a_100000210776_100009816466 [1,1,0,0,0,0|1,0,0]=3 10803 B14R0.337 COC(=O)CCCCCSCCCCO 62a_100009816466_100000210776 [1,1,0,0,0,0|1,0,0]=3 10804 B14R0.337 COC(=O)CCCCNCCCCCO 2230a_100000762737_100000204269 [1,1,0,0,0,0|1,0,0]=3 10805 B14R0.337 COC(=O)CCCCNCCCCCO 34a_100000762737_100000204269 [1,1,0,0,0,0|1,0,0]=3 10806 B14R0.337 COC(=O)CCCCNCCOCCO 2230a_100000211614_100000204269 [1,1,0,0,0,0|2,0,0]=4 10807 B14R0.337 COC(=O)CCCCNCCOCCO 34a_100000211614_100000204269 [1,1,0,0,0,0|2,0,0]=4 10808 B14R0.337 COC(=O)CCCCNCCSCCO 2230a_100011219999_100000204269 [1,1,0,0,0,0|2,0,0]=4 10809 B14R0.337 COC(=O)CCCCOCCCCC#N 7a_100000059025_100000211819 [1,1,0,0,0,0|1,0,1]=4 10810 B14R0.337 COC(=O)CCCCOCCCCC=O 7a_100000059025_100000139335 [1,1,0,0,0,0|1,0,1]=4 10811 B14R0.337 COC(=O)CCCCOCCCCCBr 34a_100000746331_100000204269 [1,1,0,0,0,0|1,0,0]=3 10812 B14R0.337 COC(=O)CCCCOCCCCCBr 7a_100000746331_100000204269 [1,1,0,0,0,0|1,0,0]=3 10813 B14R0.337 COC(=O)CCCCOCCCCCCl 34a_100000746330_100000204269 [1,1,0,0,0,0|1,0,0]=3 10814 B14R0.337 COC(=O)CCCCOCCCCCCl 7a_100000746330_100000204269 [1,1,0,0,0,0|1,0,0]=3 10815 B14R0.337 COC(=O)CCCCOCCCCCF 34a_100000059025_100000729378 [1,1,0,0,0,0|1,0,0]=3 10816 B14R0.337 COC(=O)CCCCOCCCCCF 7a_100000059025_100000729378 [1,1,0,0,0,0|1,0,0]=3 10817 B14R0.337 COC(=O)CCCCOCCCCCI 34a_200012148887_100000204269 [1,1,0,0,0,0|1,0,0]=3 10818 B14R0.337 COC(=O)CCCCOCCCCCI 7a_200012148887_100000204269 [1,1,0,0,0,0|1,0,0]=3 10819 B14R0.337 COC(=O)CCCCOCCCCCN 34a_100000762737_100000204269 [1,1,0,0,0,0|1,0,0]=3 10820 B14R0.337 COC(=O)CCCCOCCCCCO 34a_100000059025_100000746330 [1,1,0,0,0,0|1,0,0]=3 10821 B14R0.337 COC(=O)CCCCOCCCCCO 7a_100000059025_100000746330 [1,1,0,0,0,0|1,0,0]=3 10822 B14R0.337 COC(=O)CCCCOCCCCSC 34a_100011217163_100000204269 [1,1,0,0,0,0|1,0,0]=3 10823 B14R0.337 COC(=O)CCCCOCCCCSC 7a_100011217163_100000204269 [1,1,0,0,0,0|1,0,0]=3 10824 B14R0.337 COC(=O)CCCCOCCOCCBr 34a_100000692535_100000204269 [1,1,0,0,0,0|2,0,0]=4 10825 B14R0.337 COC(=O)CCCCOCCOCCBr 7a_100000692535_100000204269 [1,1,0,0,0,0|2,0,0]=4 10826 B14R0.337 COC(=O)CCCCOCCOCCCl 34a_100011215305_100000204269 [1,1,0,0,0,0|2,0,0]=4 10827 B14R0.337 COC(=O)CCCCOCCOCCCl 7a_100011215305_100000204269 [1,1,0,0,0,0|2,0,0]=4 10828 B14R0.337 COC(=O)CCCCOCCOCCF 34a_200015357709_100000204269 [1,1,0,0,0,0|2,0,0]=4 10829 B14R0.337 COC(=O)CCCCOCCOCCF 7a_200015357709_100000204269 [1,1,0,0,0,0|2,0,0]=4 10830 B14R0.337 COC(=O)CCCCOCCOCCI 34a_100012149058_100000204269 [1,1,0,0,0,0|2,0,0]=4 10831 B14R0.337 COC(=O)CCCCOCCOCCI 7a_100012149058_100000204269 [1,1,0,0,0,0|2,0,0]=4 10832 B14R0.337 COC(=O)CCCCOCCOCCN 34a_100000211614_100000204269 [1,1,0,0,0,0|2,0,0]=4 10833 B14R0.337 COC(=O)CCCCOCCOCCO 34a_100000059025_100000692535 [1,1,0,0,0,0|2,0,0]=4 10834 B14R0.337 COC(=O)CCCCOCCOCCO 7a_100000059025_100011215305 [1,1,0,0,0,0|2,0,0]=4 10835 B14R0.337 COC(=O)CCCCSCCCCC#N 62a_100000204269_100000211819 [1,1,0,0,0,0|1,0,1]=4 10836 B14R0.337 COC(=O)CCCCSCCCCC#N 62a_100011219923_100000204269 [1,1,0,0,0,0|1,0,1]=4 10837 B14R0.337 COC(=O)CCCCSCCCCC=O 62a_100000139335_100000204269 [1,1,0,0,0,0|1,0,1]=4 10838 B14R0.337 COC(=O)CCCCSCCCCC=O 62a_100000204269_100000139335 [1,1,0,0,0,0|1,0,1]=4 10839 B14R0.337 COC(=O)CCCCSCCCCCF 62a_100000204269_100000729378 [1,1,0,0,0,0|1,0,0]=3 10840 B14R0.337 COC(=O)CCCCSCCCCCF 62a_100000729378_100000204269 [1,1,0,0,0,0|1,0,0]=3 10841 B14R0.337 COC(=O)CCCCSCCCCCO 62a_100000204269_100000746330 [1,1,0,0,0,0|1,0,0]=3 10842 B14R0.337 COC(=O)CCCCSCCCCCO 62a_100000746330_100000204269 [1,1,0,0,0,0|1,0,0]=3 10843 B14R0.337 COC(=O)CCCCSCCOCCO 62a_100000204269_100011215305 [1,1,0,0,0,0|2,0,0]=4 10844 B14R0.337 COC(=O)CCCCSCCOCCO 62a_100011215305_100000204269 [1,1,0,0,0,0|2,0,0]=4 10845 B14R0.337 COC(=O)CCCNCCCCCCO 2230a_100000686447_100011218270 [1,1,0,0,0,0|1,0,0]=3 10846 B14R0.337 COC(=O)CCCNCCCCCCO 34a_100000686447_100000742333 [1,1,0,0,0,0|1,0,0]=3 10847 B14R0.337 COC(=O)CCCOCCCCCCBr 34a_100011215345_100000742333 [1,1,0,0,0,0|1,0,0]=3 10848 B14R0.337 COC(=O)CCCOCCCCCCBr 7a_100011215345_100011218270 [1,1,0,0,0,0|1,0,0]=3 10849 B14R0.337 COC(=O)CCCOCCCCCCCl 34a_100000766143_100000742333 [1,1,0,0,0,0|1,0,0]=3 10850 B14R0.337 COC(=O)CCCOCCCCCCCl 7a_100000766143_100011218270 [1,1,0,0,0,0|1,0,0]=3 10851 B14R0.337 COC(=O)CCCOCCCCCCF 34a_100000732779_100000742333 [1,1,0,0,0,0|1,0,0]=3 10852 B14R0.337 COC(=O)CCCOCCCCCCF 7a_100000732779_100011218270 [1,1,0,0,0,0|1,0,0]=3 10853 B14R0.337 COC(=O)CCCOCCCCCCN 34a_100000686447_100000742333 [1,1,0,0,0,0|1,0,0]=3 10854 B14R0.337 COC(=O)CCCSCCCCCC#N 62a_100009813376_100011218270 [1,1,0,0,0,0|1,0,1]=4 10855 B14R0.337 COC(=O)CCCSCCCCCC#N 62a_100011218270_100009813376 [1,1,0,0,0,0|1,0,1]=4 10856 B14R0.337 COC(=O)CCCSCCCCCC=O 62a_100000139337_100011218270 [1,1,0,0,0,0|1,0,1]=4 10857 B14R0.337 COC(=O)CCCSCCCCCC=O 62a_100011218270_100000139337 [1,1,0,0,0,0|1,0,1]=4 10858 B14R0.337 COC(=O)CCCSCCCCCCF 62a_100011218270_100015922095 [1,1,0,0,0,0|1,0,0]=3 10859 B14R0.337 COC(=O)CCCSCCCCCCF 62a_100015922095_100011218270 [1,1,0,0,0,0|1,0,0]=3 10860 B14R0.337 COC(=O)CCCSCCCCCCO 62a_100000766143_100011218270 [1,1,0,0,0,0|1,0,0]=3 10861 B14R0.337 COC(=O)CCCSCCCCCCO 62a_100011218270_100000766143 [1,1,0,0,0,0|1,0,0]=3 10862 B14R0.337 COC(=O)CCNCCCCCCCO 2230a_100011996573_100000204255 [1,1,0,0,0,0|1,0,0]=3 10863 B14R0.337 COC(=O)CCNCCCCCCCO 34a_100011996573_100000742370 [1,1,0,0,0,0|1,0,0]=3 10864 B14R0.337 COC(=O)CCNCCCOCCCO 2230a_100011310245_100000204255 [1,1,0,0,0,0|2,0,0]=4 10865 B14R0.337 COC(=O)CCNCCCOCCCO 34a_100011310245_100000742370 [1,1,0,0,0,0|2,0,0]=4 10866 B14R0.337 COC(=O)CCOCCCCCCCBr 34a_100000760002_100000742370 [1,1,0,0,0,0|1,0,0]=3 10867 B14R0.337 COC(=O)CCOCCCCCCCBr 7a_100000760002_100000204255 [1,1,0,0,0,0|1,0,0]=3 10868 B14R0.337 COC(=O)CCOCCCCCCCN 34a_100011996573_100000742370 [1,1,0,0,0,0|1,0,0]=3 10869 B14R0.337 COC(=O)CCOCCCOCCCN 34a_100011310245_100000742370 [1,1,0,0,0,0|2,0,0]=4 10870 B14R0.337 COC(=O)CCSCCCCCCC#N 62a_100000204255_100009813337 [1,1,0,0,0,0|1,0,1]=4 10871 B14R0.337 COC(=O)CCSCCCCCCC#N 62a_100009813337_100000204255 [1,1,0,0,0,0|1,0,1]=4 10872 B14R0.337 COC(=O)CCSCCCCCCCO 62a_100000204255_100000760002 [1,1,0,0,0,0|1,0,0]=3 10873 B14R0.337 COC(=O)CCSCCCCCCCO 62a_100000760002_100000204255 [1,1,0,0,0,0|1,0,0]=3 10874 B14R0.337 COC(=O)CNCCCCCCCCO 2230a_102515433106_100000747449 [1,1,0,0,0,0|1,0,0]=3 10875 B14R0.337 COC(=O)CNCCCCCCCCO 34a_102515433106_100000747449 [1,1,0,0,0,0|1,0,0]=3 10876 B14R0.337 COC(=O)COCCCCCCCCBr 34a_100009813846_100000747449 [1,1,0,0,0,0|1,0,0]=3 10877 B14R0.337 COC(=O)COCCCCCCCCBr 7a_100009813846_100000747449 [1,1,0,0,0,0|1,0,0]=3 10878 B14R0.337 COC(=O)COCCCCCCCCCl 34a_100000033203_100000747449 [1,1,0,0,0,0|1,0,0]=3 10879 B14R0.337 COC(=O)COCCCCCCCCCl 7a_100000033203_100000747449 [1,1,0,0,0,0|1,0,0]=3 10880 B14R0.337 COC(=O)COCCCCCCCCN 34a_102515433106_100000747449 [1,1,0,0,0,0|1,0,0]=3 10881 B14R0.337 COC(=O)COCCCCCNCCN 34a_103619048469_100000747449 [1,1,0,0,0,0|2,0,0]=4 10882 B14R0.337 COC(=O)COCCNCCCCCO 2230a_100000762737_100000090808 [1,1,0,0,0,0|2,0,0]=4 10883 B14R0.337 COC(=O)COCCNCCCCCO 34a_100000762737_100000090808 [1,1,0,0,0,0|2,0,0]=4 10884 B14R0.337 COC(=O)COCCOCCCCCBr 34a_100000746331_100000090808 [1,1,0,0,0,0|2,0,0]=4 10885 B14R0.337 COC(=O)COCCOCCCCCBr 7a_100000746331_100000090808 [1,1,0,0,0,0|2,0,0]=4 10886 B14R0.337 COC(=O)COCCOCCCCCCl 34a_100000746330_100000090808 [1,1,0,0,0,0|2,0,0]=4 10887 B14R0.337 COC(=O)COCCOCCCCCCl 7a_100000746330_100000090808 [1,1,0,0,0,0|2,0,0]=4 10888 B14R0.337 COC(=O)COCCOCCCCCI 34a_200012148887_100000090808 [1,1,0,0,0,0|2,0,0]=4 10889 B14R0.337 COC(=O)COCCOCCCCCI 7a_200012148887_100000090808 [1,1,0,0,0,0|2,0,0]=4 10890 B14R0.337 COC(=O)COCCOCCCCCN 34a_100000762737_100000090808 [1,1,0,0,0,0|2,0,0]=4 10891 B14R0.337 COC(=O)COCCOCCCCSC 34a_100011217163_100000090808 [1,1,0,0,0,0|2,0,0]=4 10892 B14R0.337 COC(=O)COCCOCCCCSC 7a_100011217163_100000090808 [1,1,0,0,0,0|2,0,0]=4 10893 B14R0.337 COC(=O)COCCSCCCCCF 62a_100000090808_100000729378 [1,1,0,0,0,0|2,0,0]=4 10894 B14R0.337 COC(=O)COCCSCCCCCF 62a_100000729378_100000090808 [1,1,0,0,0,0|2,0,0]=4 10895 B14R0.337 COC(=O)COCCSCCCCCO 62a_100000090808_100000746330 [1,1,0,0,0,0|2,0,0]=4 10896 B14R0.337 COC(=O)COCCSCCCCCO 62a_100000746330_100000090808 [1,1,0,0,0,0|2,0,0]=4 10897 B14R0.337 COC(=O)CSCCCCCCCCO 62a_100000033203_100000747449 [1,1,0,0,0,0|1,0,0]=3 10898 B14R0.337 COC(=O)CSCCCCCCCCO 62a_100000747449_100000033203 [1,1,0,0,0,0|1,0,0]=3 10899 B14R0.337 COC(=O)NCCOCCCCCCF 34a_100000757965_100015922095 [1,1,0,0,0,0|2,0,0]=4 10900 B14R0.337 COC(=O)NCCOCCCCCCO 34a_100000757965_100000766143 [1,1,0,0,0,0|2,0,0]=4 10901 B14R0.337 COC(=O)OCCOCCCCCCF 34a_100010262106_100015922095 [1,1,0,0,0,0|2,0,0]=4 10902 B14R0.337 COC(=O)OCCOCCCCCCO 34a_100010262106_100000766143 [1,1,0,0,0,0|2,0,0]=4 10903 B14R0.337 COC(=O)OCSCCCCCCCO 62a_100000760002_100000139417 [1,1,0,0,0,0|2,0,0]=4 10904 B14R0.337 COCCCCCCCCCC(=O)OC 34a_100138415774_100009813843 [1,1,0,0,0,0|0,0,0]=2 10905 B14R0.337 COCCCCCCOCCC(=O)OC 34a_200012092642_100000742370 [1,1,0,0,0,0|1,0,0]=3 10906 B14R0.337 COCCCCCCOCCC(=O)OC 7a_200012092642_100000204255 [1,1,0,0,0,0|1,0,0]=3 10907 B14R0.337 COCCCCCCSCCC(=O)OC 62a_100000204255_100011998445 [1,1,0,0,0,0|1,0,0]=3 10908 B14R0.337 COCCCCCCSCCC(=O)OC 62a_100011998445_100000204255 [1,1,0,0,0,0|1,0,0]=3 10909 B14R0.337 COCCCCCCSCOC(=O)OC 62a_100011998445_100000139417 [1,1,0,0,0,0|2,0,0]=4 10910 B14R0.337 COCCCCCNCCCC(=O)OC 2230a_100000747528_100011218270 [1,1,0,0,0,0|1,0,0]=3 10911 B14R0.337 COCCCCCNCCCC(=O)OC 34a_100000747528_100000742333 [1,1,0,0,0,0|1,0,0]=3 10912 B14R0.337 COCCCCOCCCCC(=O)OC 34a_100000059025_100000755781 [1,1,0,0,0,0|1,0,0]=3 10913 B14R0.337 COCCCCOCCCCC(=O)OC 34a_100000740925_100000204269 [1,1,0,0,0,0|1,0,0]=3 10914 B14R0.337 COCCCCOCCCCC(=O)OC 7a_100000059025_100000730899 [1,1,0,0,0,0|1,0,0]=3 10915 B14R0.337 COCCCCOCCOCC(=O)OC 34a_100000740925_100000090808 [1,1,0,0,0,0|2,0,0]=4 10916 B14R0.337 COCCCCSCCCCC(=O)OC 62a_100000204269_100000730899 [1,1,0,0,0,0|1,0,0]=3 10917 B14R0.337 COCCCCSCCCCC(=O)OC 62a_100000730899_100000204269 [1,1,0,0,0,0|1,0,0]=3 10918 B14R0.337 COCCCCSCCOCC(=O)OC 62a_100000090808_100000730899 [1,1,0,0,0,0|2,0,0]=4 10919 B14R0.337 COCCCCSCCOCC(=O)OC 62a_100000730899_100000090808 [1,1,0,0,0,0|2,0,0]=4 10920 B14R0.337 COCCCNCCCCCC(=O)OC 34a_100150723488_100009816466 [1,1,0,0,0,0|1,0,0]=3 10921 B14R0.337 COCCCOCCCCCC(=O)OC 34a_100000074720_100000740836 [1,1,0,0,0,0|1,0,0]=3 10922 B14R0.337 COCCCOCCCCCC(=O)OC 34a_100000740835_100009816466 [1,1,0,0,0,0|1,0,0]=3 10923 B14R0.337 COCCCOCCCCCC(=O)OC 7a_100000074720_100000740836 [1,1,0,0,0,0|1,0,0]=3 10924 B14R0.337 COCCCOCCCOCC(=O)OC 34a_200011215475_100000747449 [1,1,0,0,0,0|2,0,0]=4 10925 B14R0.337 COCCCOCCCOCC(=O)OC 7a_200011215475_100000747449 [1,1,0,0,0,0|2,0,0]=4 10926 B14R0.337 COCCCSCCCCCC(=O)OC 62a_100000709357_100009816466 [1,1,0,0,0,0|1,0,0]=3 10927 B14R0.337 COCCCSCCCCCC(=O)OC 62a_100009816466_100000709357 [1,1,0,0,0,0|1,0,0]=3 10928 B14R0.337 COCCNCCCCCCC(=O)OC 2230a_100000209980_100009815986 [1,1,0,0,0,0|1,0,0]=3 10929 B14R0.337 COCCOCCCCCCC(=O)OC 34a_100000210237_100009815986 [1,1,0,0,0,0|1,0,0]=3 10930 B14R0.337 COCCOCCCCCCC(=O)OC 34a_100009863599_100011201679 [1,1,0,0,0,0|1,0,0]=3 10931 B14R0.337 COCCOCCCCCCC(=O)OC 7a_100009863599_100000233755 [1,1,0,0,0,0|1,0,0]=3 10932 B14R0.337 COCCOCCCNCCC(=O)OC 2230a_100000206027_100000204255 [1,1,0,0,0,0|2,0,0]=4 10933 B14R0.337 COCCOCCCNCCC(=O)OC 34a_100000206027_100000742370 [1,1,0,0,0,0|2,0,0]=4 10934 B14R0.337 COCCOCCCSCCC(=O)OC 62a_100000204255_100011216529 [1,1,0,0,0,0|2,0,0]=4 10935 B14R0.337 COCCOCCCSCCC(=O)OC 62a_100011216529_100000204255 [1,1,0,0,0,0|2,0,0]=4 10936 B14R0.337 COCCOCCNCCCC(=O)OC 2230a_100000745349_100011218270 [1,1,0,0,0,0|2,0,0]=4 10937 B14R0.337 COCCOCCNCCCC(=O)OC 34a_100000745349_100000742333 [1,1,0,0,0,0|2,0,0]=4 10938 B14R0.337 COCCOCCOCCCC(=O)OC 34a_100011215163_100000742333 [1,1,0,0,0,0|2,0,0]=4 10939 B14R0.337 COCCOCCOCCCC(=O)OC 7a_100011215163_100011218270 [1,1,0,0,0,0|2,0,0]=4 10940 B14R0.337 COCCOCCSCCCC(=O)OC 62a_100000695917_100011218270 [1,1,0,0,0,0|2,0,0]=4 10941 B14R0.337 COCCOCCSCCCC(=O)OC 62a_100011218270_100000695917 [1,1,0,0,0,0|2,0,0]=4 10942 B14R0.337 COCCOCSCCCCC(=O)OC 62a_100000204269_100000231047 [1,1,0,0,0,0|2,0,0]=4 10943 B14R0.337 COCCOCSCCCCC(=O)OC 62a_100000231047_100000204269 [1,1,0,0,0,0|2,0,0]=4 10944 B14R0.337 COCCSCCCCCCC(=O)OC 62a_100000233755_100009815986 [1,1,0,0,0,0|1,0,0]=3 10945 B14R0.337 COCCSCCCCCCC(=O)OC 62a_100009815986_100000233755 [1,1,0,0,0,0|1,0,0]=3 10946 B14R0.337 COCSCCCCCCCC(=O)OC 62a_100000766300_100010004213 [1,1,0,0,0,0|1,0,0]=3 10947 B14R0.337 COCSCCCCCCCC(=O)OC 62a_100010004213_100000766300 [1,1,0,0,0,0|1,0,0]=3 10948 B14R0.337 O=C(CO)CCCCCCCCCCO 1458a_100000210174_100009813290 [1,1,0,0,0,0|1,0,0]=3 10949 B14R0.337 O=C(CO)NCCCCCCCCCO 240690a_100000078944_100000210174 [1,1,0,0,0,0|2,0,0]=4 10950 B14R0.340 C#CCCCCCCCCC(=O)C(C)C 1458a_100000029693_100000210206 [1,1,0,0,0,0|0,0,2]=4 10951 B14R0.340 C=C(C)C(=O)CCCCCCCCCC 1458a_100000185857_100000210319 [1,1,0,0,0,0|0,0,1]=3 10952 B14R0.340 C=C(C)C(=O)CCCCCCCCCO 1458a_100000185857_100009813782 [1,1,0,0,0,0|1,0,1]=4 10953 B14R0.340 C=C(C)C(=O)NCCCCCCCCC 11a_100000212291_100000185857 [1,1,0,0,0,0|1,0,1]=4 10954 B14R0.340 C=C(C)C(=O)NCCCCCCCCC 1626a_100000212291_100000185857 [1,1,0,0,0,0|1,0,1]=4 10955 B14R0.340 C=CCCCCCCCCC(=O)C(C)C 1458a_100000210198_100011933949 [1,1,0,0,0,0|0,0,2]=4 10956 B14R0.340 C=CCCCCCCCCC(=O)C(C)C 1458a_100000211349_100000210206 [1,1,0,0,0,0|0,0,2]=4 10957 B14R0.340 C=CCCCCCCCCC(=O)C(C)F 1458a_100000062450_100011933949 [1,1,0,0,0,0|0,0,2]=4 10958 B14R0.340 C=CCCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100011933949 [1,1,0,0,0,0|0,0,2]=4 10959 B14R0.340 C=CCCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100011933949 [1,1,0,0,0,0|0,0,2]=4 10960 B14R0.340 CC#CCCCCCCCC(=O)C(C)C 1458a_100000066323_100000210206 [1,1,0,0,0,0|0,0,2]=4 10961 B14R0.340 CC(C)C(=O)CCCCCCCCCF 1458a_200009909015_100000210206 [1,1,0,0,0,0|1,0,0]=3 10962 B14R0.340 CC(C)C(=O)CCCCCCCCCO 1458a_100000210198_100009813782 [1,1,0,0,0,0|1,0,0]=3 10963 B14R0.340 CC(C)C(=O)CNCCCCCCCO 2230a_100011996573_100000753385 [1,1,0,0,0,0|2,0,0]=4 10964 B14R0.340 CC(C)C(=O)CNCCCCCCCO 34a_100011996573_100000753385 [1,1,0,0,0,0|2,0,0]=4 10965 B14R0.340 CC(C)C(=O)COCCCCCCCBr 34a_100000760002_100000753385 [1,1,0,0,0,0|2,0,0]=4 10966 B14R0.340 CC(C)C(=O)COCCCCCCCBr 7a_100000760002_100000753385 [1,1,0,0,0,0|2,0,0]=4 10967 B14R0.340 CC(C)C(=O)COCCCCCCCN 34a_100011996573_100000753385 [1,1,0,0,0,0|2,0,0]=4 10968 B14R0.340 CC(C)C(=O)CSCCCCCCCO 62a_100000753385_100000760002 [1,1,0,0,0,0|2,0,0]=4 10969 B14R0.340 CC(C)C(=O)CSCCCCCCCO 62a_100000760002_100000753385 [1,1,0,0,0,0|2,0,0]=4 10970 B14R0.340 CC(C)C(=O)NCCCCCCCCO 240690a_102515433106_100000210198 [1,1,0,0,0,0|2,0,0]=4 10971 B14R0.340 CC(F)C(=O)CCCCCCCCCO 1458a_100000062450_100009813782 [1,1,0,0,0,0|1,0,0]=3 10972 B14R0.340 CC(F)C(=O)NCCCCCCCCO 240690a_102515433106_100000062450 [1,1,0,0,0,0|2,0,0]=4 10973 B14R0.340 CCC#CCCCCCCC(=O)C(C)C 1458a_100000210198_200000036426 [1,1,0,0,0,0|0,0,2]=4 10974 B14R0.340 CCC#CCCCCCCC(=O)C(C)F 1458a_100000062450_200000036426 [1,1,0,0,0,0|0,0,2]=4 10975 B14R0.340 CCC#CCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_200000036426 [1,1,0,0,0,0|0,0,2]=4 10976 B14R0.340 CCC#CCCCCCCC(=O)[C@H](C)O 1458a_217856618621_200000036426 [1,1,0,0,0,0|0,0,2]=4 10977 B14R0.340 CCCCCCCCC=CC(=O)C(C)C 1458a_100015345288_100000210206 [1,1,0,0,0,0|0,0,2]=4 10978 B14R0.340 CCCCCCCCCCC(=O)C(C)C 1458a_100000210198_100000210319 [1,1,0,0,0,0|0,0,0]=2 10979 B14R0.340 CCCCCCCCCCC(=O)C(C)C 1458a_100000210375_100000210206 [1,1,0,0,0,0|0,0,0]=2 10980 B14R0.340 CCCCCCCCCCC(=O)C(C)F 1458a_100000062450_100000210319 [1,1,0,0,0,0|0,0,0]=2 10981 B14R0.340 CCCCCCCCCCC(=O)C(O)O 1458a_100000233687_100000210319 [1,1,0,0,0,0|1,0,0]=3 10982 B14R0.340 CCCCCCCCCCC(=O)N(C)C 11a_100102631434_100000210375 [1,1,0,0,0,0|1,0,0]=3 10983 B14R0.340 CCCCCCCCCCC(=O)N(C)C 1626a_100102631434_100000210375 [1,1,0,0,0,0|1,0,0]=3 10984 B14R0.340 CCCCCCCCCCC(=O)N(C)C 240690a_100102631434_100000210375 [1,1,0,0,0,0|1,0,0]=3 10985 B14R0.340 CCCCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100000210319 [1,1,0,0,0,0|0,0,0]=2 10986 B14R0.340 CCCCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100000210319 [1,1,0,0,0,0|0,0,0]=2 10987 B14R0.340 CCCCCCCCCCN(C)C(C)C 2230a_100000207566_100000210206 [1,1,0,0,0,0|2,0,0]=4 10988 B14R0.340 CCCCCCCCCCN(C)C(C)C 269982a_100000207566_100000210206 [1,1,0,0,0,0|2,0,0]=4 10989 B14R0.340 CCCCCCCCCCN(C)C(C)C 269982a_200000211004_100000210320 [1,1,0,0,0,0|2,0,0]=4 10990 B14R0.340 CCCCCCCCCNC(=O)C(C)C 11a_100000212291_100000210198 [1,1,0,0,0,0|1,0,0]=3 10991 B14R0.340 CCCCCCCCCNC(=O)C(C)C 1626a_100000212291_100000210198 [1,1,0,0,0,0|1,0,0]=3 10992 B14R0.340 CCCCCCCCCNC(=O)C(C)C 240690a_100000212291_100000210198 [1,1,0,0,0,0|1,0,0]=3 10993 B14R0.340 CCCCCCCCCNC(=O)C(C)C 527a_100000212291_100000210198 [1,1,0,0,0,0|1,0,0]=3 10994 B14R0.340 CCCCCCCCCNC(=O)C(C)F 11a_100000212291_100000062450 [1,1,0,0,0,0|1,0,0]=3 10995 B14R0.340 CCCCCCCCCNC(=O)C(C)F 1626a_100000212291_100000062450 [1,1,0,0,0,0|1,0,0]=3 10996 B14R0.340 CCCCCCCCCNC(=O)C(C)F 240690a_100000212291_100000062450 [1,1,0,0,0,0|1,0,0]=3 10997 B14R0.340 CCCCCCCCCNC(=O)C(C)F 527a_100000212291_100000062450 [1,1,0,0,0,0|1,0,0]=3 10998 B14R0.340 CCCCCCCCCNC(=O)C(F)F 11a_100000212291_100000210393 [1,1,0,0,0,0|2,0,0]=4 10999 B14R0.340 CCCCCCCCCNC(=O)C(F)F 1626a_100000212291_100000210393 [1,1,0,0,0,0|2,0,0]=4 11000 B14R0.340 CCCCCCCCCNC(=O)C(F)F 240690a_100000212291_100000210393 [1,1,0,0,0,0|2,0,0]=4 11001 B14R0.340 CCCCCCCCCNC(=O)C(F)F 527a_100000212291_100000210393 [1,1,0,0,0,0|2,0,0]=4 11002 B14R0.340 CCCCCCCCCNC(=O)C(O)O 240690a_100000212291_100000233687 [1,1,0,0,0,0|2,0,0]=4 11003 B14R0.340 CCCCCCCCCNC(=O)N(C)C 2708a_100000212291_100102631434 [1,1,0,0,0,0|2,0,0]=4 11004 B14R0.340 CCCCCCCCCNC(=O)[C@@H](C)O 240690a_100000212291_100000717761 [1,1,0,0,0,0|1,0,0]=3 11005 B14R0.340 CCCCCCCCCNC(=O)[C@H](C)O 1626a_100000212291_217856618621 [1,1,0,0,0,0|1,0,0]=3 11006 B14R0.340 CCCCCCCCCNC(=O)[C@H](C)O 240690a_100000212291_217856618621 [1,1,0,0,0,0|1,0,0]=3 11007 B14R0.340 CCCCCCCCNCC(=O)C(=O)C 34a_100000229939_100011261029 [1,1,0,0,0,0|1,0,1]=4 11008 B14R0.340 CCCCCCCCNCC(=O)C(C)C 2230a_100000229939_100000753385 [1,1,0,0,0,0|1,0,0]=3 11009 B14R0.340 CCCCCCCCNCC(=O)C(C)C 34a_100000229939_100000753385 [1,1,0,0,0,0|1,0,0]=3 11010 B14R0.340 CCCCCCCCNCC(=O)N(C)C 2230a_100000229939_100000185267 [1,1,0,0,0,0|2,0,0]=4 11011 B14R0.340 CCCCCCCCNCC(=O)N(C)C 2230a_100015183351_100000210759 [1,1,0,0,0,0|2,0,0]=4 11012 B14R0.340 CCCCCCCCNCC(=O)N(C)C 34a_100000229939_100000692301 [1,1,0,0,0,0|2,0,0]=4 11013 B14R0.340 CCCCCCCCOCC(=O)C(=O)C 34a_100000210232_100011261029 [1,1,0,0,0,0|1,0,1]=4 11014 B14R0.340 CCCCCCCCOCC(=O)C(C)C 1458a_100000759886_100000210206 [1,1,0,0,0,0|1,0,0]=3 11015 B14R0.340 CCCCCCCCOCC(=O)C(C)C 34a_100000210232_100000753385 [1,1,0,0,0,0|1,0,0]=3 11016 B14R0.340 CCCCCCCCOCC(=O)C(C)C 7a_100000210232_100000753385 [1,1,0,0,0,0|1,0,0]=3 11017 B14R0.340 CCCCCCCCOCC(=O)N(C)C 11a_100102631434_100000759886 [1,1,0,0,0,0|2,0,0]=4 11018 B14R0.340 CCCCCCCCOCC(=O)N(C)C 1626a_100102631434_100000759886 [1,1,0,0,0,0|2,0,0]=4 11019 B14R0.340 CCCCCCCCOCC(=O)N(C)C 240690a_100102631434_100000759886 [1,1,0,0,0,0|2,0,0]=4 11020 B14R0.340 CCCCCCCCOCC(=O)N(C)C 34a_100000210232_100000692301 [1,1,0,0,0,0|2,0,0]=4 11021 B14R0.340 CCCCCCCCOCC(=O)N(C)C 527a_100102631434_100000759886 [1,1,0,0,0,0|2,0,0]=4 11022 B14R0.340 CCCCCCCCOCC(=O)N(C)C 7a_100000210232_100000692301 [1,1,0,0,0,0|2,0,0]=4 11023 B14R0.340 CCCCCCCCSCC(=O)C(=O)C 62a_100000210759_100011261029 [1,1,0,0,0,0|1,0,1]=4 11024 B14R0.340 CCCCCCCCSCC(=O)C(=O)C 62a_100011261029_100000210317 [1,1,0,0,0,0|1,0,1]=4 11025 B14R0.340 CCCCCCCCSCC(=O)C(C)C 62a_100000210759_100000753385 [1,1,0,0,0,0|1,0,0]=3 11026 B14R0.340 CCCCCCCCSCC(=O)C(C)C 62a_100000753385_100000210317 [1,1,0,0,0,0|1,0,0]=3 11027 B14R0.340 CCCCCCCCSCC(=O)N(C)C 62a_100000210759_100000692301 [1,1,0,0,0,0|2,0,0]=4 11028 B14R0.340 CCCCCCCCSCC(=O)N(C)C 62a_100000692301_100000210317 [1,1,0,0,0,0|2,0,0]=4 11029 B14R0.340 CCCCCCCNCCC(=O)N(C)C 2230a_100000229938_100000737620 [1,1,0,0,0,0|2,0,0]=4 11030 B14R0.340 CCCCCCCNCCC(=O)N(C)C 2230a_100000738053_100000210681 [1,1,0,0,0,0|2,0,0]=4 11031 B14R0.340 CCCCCCCOCCC(=O)N(C)C 34a_200000747469_100000210614 [1,1,0,0,0,0|2,0,0]=4 11032 B14R0.340 CCCCCCCOCCC(=O)N(C)C 7a_100000210272_100000737620 [1,1,0,0,0,0|2,0,0]=4 11033 B14R0.340 CCCCCCCSCCC(=O)N(C)C 62a_100000210614_100000737620 [1,1,0,0,0,0|2,0,0]=4 11034 B14R0.340 CCCCCCCSCCC(=O)N(C)C 62a_100000737620_100000210316 [1,1,0,0,0,0|2,0,0]=4 11035 B14R0.340 CCCCCCCSCOC(=O)C(C)C 62a_100000139345_100000210316 [1,1,0,0,0,0|2,0,0]=4 11036 B14R0.340 CCCCCCCSCOC(=O)C(C)C 62a_100000210614_100000139345 [1,1,0,0,0,0|2,0,0]=4 11037 B14R0.340 CCCCCCNCCCC(=O)N(C)C 2230a_100000210581_100000737642 [1,1,0,0,0,0|2,0,0]=4 11038 B14R0.340 CCCCCCNCCCC(=O)N(C)C 2230a_200000744827_100000210314 [1,1,0,0,0,0|2,0,0]=4 11039 B14R0.340 CCCCCCNCCNC(=O)C(C)C 2230a_100000752568_100000210314 [1,1,0,0,0,0|2,0,0]=4 11040 B14R0.340 CCCCCCNCCNC(=O)C(C)C 34a_100000752568_100000210314 [1,1,0,0,0,0|2,0,0]=4 11041 B14R0.340 CCCCCCOCCCC(=O)N(C)C 7a_100000210259_100000737642 [1,1,0,0,0,0|2,0,0]=4 11042 B14R0.340 CCCCCCSCCCC(=O)N(C)C 62a_100000210314_100000737642 [1,1,0,0,0,0|2,0,0]=4 11043 B14R0.340 CCCCCCSCCCC(=O)N(C)C 62a_100000737642_100000210757 [1,1,0,0,0,0|2,0,0]=4 11044 B14R0.340 CCCCCNCCOCC(=O)C(C)C 34a_100000224656_100000753385 [1,1,0,0,0,0|2,0,0]=4 11045 B14R0.340 CCCCCOCCCCC(=O)N(C)C 34a_100000210253_100000752486 [1,1,0,0,0,0|2,0,0]=4 11046 B14R0.340 CCCCCOCCCCC(=O)N(C)C 7a_100000210253_100000752486 [1,1,0,0,0,0|2,0,0]=4 11047 B14R0.340 CCCCCOCCOCC(=O)C(C)C 34a_100011215259_100000753385 [1,1,0,0,0,0|2,0,0]=4 11048 B14R0.340 CCCCCOCCOCC(=O)C(C)C 7a_100011215259_100000753385 [1,1,0,0,0,0|2,0,0]=4 11049 B14R0.340 CCCCCSCCCCC(=O)N(C)C 62a_100000210326_100000752486 [1,1,0,0,0,0|2,0,0]=4 11050 B14R0.340 CCCCCSCCCCC(=O)N(C)C 62a_100000752486_100000210326 [1,1,0,0,0,0|2,0,0]=4 11051 B14R0.340 CCCCOCCCNCC(=O)C(C)C 2230a_200000211371_100000753385 [1,1,0,0,0,0|2,0,0]=4 11052 B14R0.340 CCCCOCCCNCC(=O)C(C)C 34a_200000211371_100000753385 [1,1,0,0,0,0|2,0,0]=4 11053 B14R0.340 CCCCOCCCOCC(=O)C(C)C 34a_200011215613_100000753385 [1,1,0,0,0,0|2,0,0]=4 11054 B14R0.340 CCCCOCCCOCC(=O)C(C)C 7a_200011215613_100000753385 [1,1,0,0,0,0|2,0,0]=4 11055 B14R0.340 CN(C)C(=O)CCCCCCCCCF 11a_100102631434_200009909015 [1,1,0,0,0,0|2,0,0]=4 11056 B14R0.340 CN(C)C(=O)CCCCCCCCCF 240690a_100102631434_200009909015 [1,1,0,0,0,0|2,0,0]=4 11057 B14R0.340 CN(C)C(=O)CCCCCCCCCF 527a_100102631434_200009909015 [1,1,0,0,0,0|2,0,0]=4 11058 B14R0.340 CN(C)C(=O)CCCCCCCCCO 240690a_100102631434_100000032657 [1,1,0,0,0,0|2,0,0]=4 11059 B14R0.340 COCCCCCCOCC(=O)C(C)C 34a_200012092642_100000753385 [1,1,0,0,0,0|2,0,0]=4 11060 B14R0.340 COCCCCCCOCC(=O)C(C)C 7a_200012092642_100000753385 [1,1,0,0,0,0|2,0,0]=4 11061 B14R0.340 COCCCCCCSCC(=O)C(C)C 62a_100000753385_100011998445 [1,1,0,0,0,0|2,0,0]=4 11062 B14R0.340 COCCCCCCSCC(=O)C(C)C 62a_100011998445_100000753385 [1,1,0,0,0,0|2,0,0]=4 11063 B14R0.340 C[C@@H](O)C(=O)CCCCCCCCCO 1458a_100000717761_100009813782 [1,1,0,0,0,0|1,0,0]=3 11064 B14R0.340 C[C@@H](O)C(=O)NCCCCCCCCO 240690a_102515433106_100000717761 [1,1,0,0,0,0|2,0,0]=4 11065 B14R0.340 C[C@H](O)C(=O)CCCCCCCCCO 1458a_217856618621_100009813782 [1,1,0,0,0,0|1,0,0]=3 11066 B14R0.340 C[C@H](O)C(=O)NCCCCCCCCO 240690a_102515433106_217856618621 [1,1,0,0,0,0|2,0,0]=4 11067 B14R0.340 O=C(CCCCCCCCCO)C(O)O 1458a_100000233687_100009813782 [1,1,0,0,0,0|2,0,0]=4 11068 B14R0.2056 CCCCCCCCCCS(=O)(=O)NC 270084a_100102657272_200011217601 [1,1,0,0,0,0|2,0,0]=4 11069 B14R0.2056 CCCCCCCCCCS(=O)(=O)NC 274078a_100102657272_200011217601 [1,1,0,0,0,0|2,0,0]=4 11070 B14R0.2056 CCCCCCCCCNS(=O)(=O)CC 270084a_100000212291_100000211323 [1,1,0,0,0,0|2,0,0]=4 11071 B14R0.2056 CCCCCCCCCNS(=O)(=O)CC 274078a_100000212291_100000211323 [1,1,0,0,0,0|2,0,0]=4 11072 B14R0.2056 CCCCCCCCCNS(=O)(=O)CC 40a_100000212291_100000053943 [1,1,0,0,0,0|2,0,0]=4 11073 B14R0.2056 CCCCCCCNCCS(=O)(=O)CC 2230a_100000229938_100000756660 [1,1,0,0,0,0|2,0,0]=4 11074 B14R0.2056 CCCCCCCNCCS(=O)(=O)CC 2230a_100000751051_100000210681 [1,1,0,0,0,0|2,0,0]=4 11075 B14R0.2056 CCCCCCCNCCS(=O)(=O)CC 34a_100000751051_100000210614 [1,1,0,0,0,0|2,0,0]=4 11076 B14R0.2056 CCCCCCCOCCS(=O)(=O)CC 34a_100000210272_100000756660 [1,1,0,0,0,0|2,0,0]=4 11077 B14R0.2056 CCCCCCCOCCS(=O)(=O)CC 34a_200011216379_100000210614 [1,1,0,0,0,0|2,0,0]=4 11078 B14R0.2056 CCCCCCCOCCS(=O)(=O)CC 7a_100000210272_100000756660 [1,1,0,0,0,0|2,0,0]=4 11079 B14R0.2056 CCCCCCCOCCS(=O)(=O)CC 7a_200011216379_100000210614 [1,1,0,0,0,0|2,0,0]=4 11080 B14R0.2056 CCCCCCCSCCS(=O)(=O)CC 62a_100000210614_100000756660 [1,1,0,0,0,0|2,0,0]=4 11081 B14R0.2056 CCCCCCCSCCS(=O)(=O)CC 62a_100000756660_100000210316 [1,1,0,0,0,0|2,0,0]=4 11082 B14R0.2297 CCCCCCCCCCN(CC)CC 2230a_100000724800_100000210320 [1,1,0,0,0,0|2,0,0]=4 11083 B14R0.2297 CCCCCCCCCCN(CC)CC 269956a_100000042499_100000210320 [1,1,0,0,0,0|2,0,0]=4 11084 B14R0.2297 CCCCCCCCCCN(CC)CC 269982a_100000724800_100000210320 [1,1,0,0,0,0|2,0,0]=4 11085 B14R0.2297 CCCCCOCCCCN(CC)N=O 34a_200000035056_100000718602 [1,1,0,0,0,0|2,0,0]=4 11086 B14R0.145 CC/C=C\CCC(=O)CCCCCCC 1458a_100000211969_100015370543 [1,1,0,0,0,0|1,0,1]=4 11087 B14R0.145 CC/C=C\CCN(C)CCCCCCC 2230a_100000228206_100015370543 [1,1,0,0,0,0|2,0,0]=4 11088 B14R0.145 CC/C=C\CCN(C)CCCCCCC 269982a_100000228206_100015370543 [1,1,0,0,0,0|2,0,0]=4 11089 B14R0.145 CC/C=C\CCNC(C)CCCCCC 2230a_100000210919_100015370543 [1,1,0,0,0,0|2,0,0]=4 11090 B14R0.145 CC/C=C\CCNC(C)CCCCCC 34a_100000210919_100015370543 [1,1,0,0,0,0|2,0,0]=4 11091 B14R0.145 CC/C=C\CCOC(C)CCCCCC 34a_100000210265_100015370543 [1,1,0,0,0,0|2,0,0]=4 11092 B14R0.145 CC/C=C\CCOC(C)CCCCCC 34a_100016288707_100011215978 [1,1,0,0,0,0|2,0,0]=4 11093 B14R0.145 CC/C=C\CCOC(C)CCCCCC 7a_100000210265_100015370543 [1,1,0,0,0,0|2,0,0]=4 11094 B14R0.145 CC/C=C\CCOC(C)CCCCCC 7a_100016288707_100011215978 [1,1,0,0,0,0|2,0,0]=4 11095 B14R0.145 CC/C=C\COC(C)CCCCCCC 34a_100016268518_200011218727 [1,1,0,0,0,0|2,0,0]=4 11096 B14R0.145 CC/C=C\COC(C)CCCCCCC 34a_200011215852_100103147603 [1,1,0,0,0,0|2,0,0]=4 11097 B14R0.145 CC/C=C\COC(C)CCCCCCC 7a_200011215852_100103147603 [1,1,0,0,0,0|2,0,0]=4 11098 B14R0.145 CCCCCCC(C)NCCCOCC 2230a_100000210919_100012232248 [1,1,0,0,0,0|1,0,1]=4 11099 B14R0.145 CCCCCCC(C)NCCCOCC 2230a_100000210961_100011215978 [1,1,0,0,0,0|1,0,1]=4 11100 B14R0.145 CCCCCCC(C)NCCCOCC 270004a_100000210961_100000210826 [1,1,0,0,0,0|1,0,1]=4 11101 B14R0.145 CCCCCCC(C)NCCCOCC 34a_100000210919_100012232248 [1,1,0,0,0,0|1,0,1]=4 11102 B14R0.145 CCCCCCC(C)NCCCOCC 34a_100000210961_100011215978 [1,1,0,0,0,0|1,0,1]=4 11103 B14R0.145 CCCCCCC(C)OCCCOCC 34a_100000210265_100012232248 [1,1,0,0,0,0|1,0,1]=4 11104 B14R0.145 CCCCCCC(C)OCCCOCC 34a_100000757476_100011215978 [1,1,0,0,0,0|1,0,1]=4 11105 B14R0.145 CCCCCCC(C)OCCCOCC 7a_100000210265_100012232248 [1,1,0,0,0,0|1,0,1]=4 11106 B14R0.145 CCCCCCC(C)OCCCOCC 7a_100000757476_100011215978 [1,1,0,0,0,0|1,0,1]=4 11107 B14R0.145 CCCCCCC(C)SCCCOCC 62a_100011215978_100012232248 [1,1,0,0,0,0|1,0,1]=4 11108 B14R0.145 CCCCCCC(C)SCCCOCC 62a_100012232248_100011215978 [1,1,0,0,0,0|1,0,1]=4 11109 B14R0.145 CCCCCCCC(=O)CCCOCC 1458a_100000211969_100012232248 [1,1,0,0,0,0|0,0,2]=4 11110 B14R0.145 CCCCCCCC(C)NCCOCC 2230a_102516460346_200011218727 [1,1,0,0,0,0|1,0,1]=4 11111 B14R0.145 CCCCCCCC(C)NCCOCC 270004a_102516460346_100000210596 [1,1,0,0,0,0|1,0,1]=4 11112 B14R0.145 CCCCCCCC(C)NCCOCC 34a_102516460346_200011218727 [1,1,0,0,0,0|1,0,1]=4 11113 B14R0.145 CCCCCCCC(C)OCCOCC 34a_100000210136_200011218727 [1,1,0,0,0,0|1,0,1]=4 11114 B14R0.145 CCCCCCCC(C)OCCOCC 34a_200011215852_100000210147 [1,1,0,0,0,0|1,0,1]=4 11115 B14R0.145 CCCCCCCC(C)OCCOCC 7a_100000210136_200011218727 [1,1,0,0,0,0|1,0,1]=4 11116 B14R0.145 CCCCCCCC(C)OCCOCC 7a_200011215852_100011215890 [1,1,0,0,0,0|1,0,1]=4 11117 B14R0.145 CCCCCCCC(C)SCCOCC 62a_100000210147_200011218727 [1,1,0,0,0,0|1,0,1]=4 11118 B14R0.145 CCCCCCCC(C)SCCOCC 62a_200011218727_100011215890 [1,1,0,0,0,0|1,0,1]=4 11119 B14R0.145 CCCCCCCN(C)CCCOCC 2230a_100000228206_100012232248 [1,1,0,0,0,0|1,0,1]=4 11120 B14R0.145 CCCCCCCN(C)CCCOCC 269982a_100000228206_100012232248 [1,1,0,0,0,0|1,0,1]=4 11121 B14R0.179 CC/C=C/CC(=O)CCCCCCCC 1458a_100016274230_100000210759 [1,1,0,0,0,0|1,0,1]=4 11122 B14R0.179 CC/C=C/CCCOC(C)CCCCC 34a_100016287902_200011218191 [1,1,0,0,0,0|2,0,0]=4 11123 B14R0.179 CC/C=C/CCCOC(C)CCCCC 7a_100016287902_200011218191 [1,1,0,0,0,0|2,0,0]=4 11124 B14R0.179 CC/C=C\CC(=O)CCCCCCCC 1458a_100000210188_100103147603 [1,1,0,0,0,0|1,0,1]=4 11125 B14R0.179 CC/C=C\CN(C)CCCCCCCC 2230a_100000207567_100103147603 [1,1,0,0,0,0|2,0,0]=4 11126 B14R0.179 CC/C=C\CN(C)CCCCCCCC 269982a_100000207567_100103147603 [1,1,0,0,0,0|2,0,0]=4 11127 B14R0.179 CCCCCCCCC(=O)C=COCC 1458a_100016266692_100000210759 [1,1,0,0,0,0|0,0,2]=4 11128 B14R0.179 CCCCCCCCC(=O)CCOCC 1458a_100000210188_100011215890 [1,1,0,0,0,0|0,0,2]=4 11129 B14R0.179 CCCCCCCCC(=O)CCOCC 1458a_100000749530_100000210759 [1,1,0,0,0,0|0,0,2]=4 11130 B14R0.179 CCCCCCCCC(C)CNCCC 270004a_100020643023_100011995885 [1,1,0,0,0,0|2,0,0]=4 11131 B14R0.179 CCCCCCCCC(C)COCCC 34a_200012125181_100000210303 [1,1,0,0,0,0|2,0,0]=4 11132 B14R0.179 CCCCCCCCC(C)COCCC 7a_200012125181_100000210303 [1,1,0,0,0,0|2,0,0]=4 11133 B14R0.179 CCCCCCCCN(C)CCOCC 2230a_100000207567_100011215890 [1,1,0,0,0,0|1,0,1]=4 11134 B14R0.179 CCCCCCCCN(C)CCOCC 269982a_100000207567_100011215890 [1,1,0,0,0,0|1,0,1]=4 11135 B14R0.179 CCCCCCCNC(C)CCOCC 270004a_100000229938_200011216536 [1,1,0,0,0,0|1,0,1]=4 11136 B14R0.392 C#CCCCCCCCCCCOCC 34a_100000054667_100000210202 [1,1,0,0,0,0|0,0,2]=4 11137 B14R0.392 C#CCCCCCCCCCCOCC 7a_100000054667_100000210202 [1,1,0,0,0,0|0,0,2]=4 11138 B14R0.392 C#CCOCCCCCCCCCCC 34a_100000210247_100011215454 [1,1,0,0,0,0|0,0,2]=4 11139 B14R0.392 C#CCOCCCCCCCCCCC 34a_100000210809_100000184674 [1,1,0,0,0,0|0,0,2]=4 11140 B14R0.392 C#CCOCCCCCCCCCCC 7a_100000210809_100000038162 [1,1,0,0,0,0|0,0,2]=4 11141 B14R0.392 C=CCCCCCCCCCCOCC 34a_100121572206_100011093070 [1,1,0,0,0,0|0,0,2]=4 11142 B14R0.392 C=CCOCCCCCCCCCCC 34a_100000210809_100015514636 [1,1,0,0,0,0|0,0,2]=4 11143 B14R0.392 C=CCOCCCCCCCCCCC 34a_200000210373_100011215454 [1,1,0,0,0,0|0,0,2]=4 11144 B14R0.392 C=CCOCCCCCCCCCCC 7a_100000210809_100015514636 [1,1,0,0,0,0|0,0,2]=4 11145 B14R0.392 CC/C=C/CCCOCCCCCCC 34a_100016287902_100000210614 [1,1,0,0,0,0|1,0,0]=3 11146 B14R0.392 CC/C=C/CCCOCCCCCCC 7a_100016287902_100000210614 [1,1,0,0,0,0|1,0,0]=3 11147 B14R0.392 CC/C=C/CCCOCCCCCCF 34a_100016287902_100015922095 [1,1,0,0,0,0|2,0,0]=4 11148 B14R0.392 CC/C=C/CCCOCCCCCCF 7a_100016287902_100015922095 [1,1,0,0,0,0|2,0,0]=4 11149 B14R0.392 CC/C=C/CCCOCCCCCCO 34a_100016287902_100000766143 [1,1,0,0,0,0|2,0,0]=4 11150 B14R0.392 CC/C=C/CCCOCCCCCCO 7a_100016287902_100000766143 [1,1,0,0,0,0|2,0,0]=4 11151 B14R0.392 CC/C=C/CCCOCCOCCCC 34a_100016287902_100000743108 [1,1,0,0,0,0|2,0,0]=4 11152 B14R0.392 CC/C=C/CCCOCCOCCCC 7a_100016287902_100000743108 [1,1,0,0,0,0|2,0,0]=4 11153 B14R0.392 CC/C=C\CCCCCCCNCCC 269862a_100020643023_200025770492 [1,1,0,0,0,0|1,0,0]=3 11154 B14R0.392 CC/C=C\CCCCCCCNCCF 269862a_100000724931_200025770492 [1,1,0,0,0,0|2,0,0]=4 11155 B14R0.392 CC/C=C\CCCCCCCNCCO 269862a_100000210304_200025770492 [1,1,0,0,0,0|2,0,0]=4 11156 B14R0.392 CC/C=C\CCCCCNCCCCC 269862a_100000209983_100016288537 [1,1,0,0,0,0|1,0,0]=3 11157 B14R0.392 CC/C=C\CCCCCNCCCCO 269862a_100000750430_100016288537 [1,1,0,0,0,0|2,0,0]=4 11158 B14R0.392 CC/C=C\CCCCCNCCCOC 269862a_100150723488_100016288537 [1,1,0,0,0,0|2,0,0]=4 11159 B14R0.392 CC/C=C\CCCCCNCCCSC 269862a_100000749238_100016288537 [1,1,0,0,0,0|2,0,0]=4 11160 B14R0.392 CC/C=C\CCCCCNCCOCC 269862a_100011200944_100016288537 [1,1,0,0,0,0|2,0,0]=4 11161 B14R0.392 CC/C=C\CCCCCNCCSCC 269862a_100000106463_100016288537 [1,1,0,0,0,0|2,0,0]=4 11162 B14R0.392 CC/C=C\CCCCCOCCCCC 34a_100016268722_100000718602 [1,1,0,0,0,0|1,0,0]=3 11163 B14R0.392 CC/C=C\CCCCCOCCCCC 7a_100016268722_100000210326 [1,1,0,0,0,0|1,0,0]=3 11164 B14R0.392 CC/C=C\CCCCCOCCCCF 34a_100016268722_100000729493 [1,1,0,0,0,0|2,0,0]=4 11165 B14R0.392 CC/C=C\CCCCCOCCCCF 7a_100016268722_100000729493 [1,1,0,0,0,0|2,0,0]=4 11166 B14R0.392 CC/C=C\CCCCCOCCCCO 34a_100016268722_100011216708 [1,1,0,0,0,0|2,0,0]=4 11167 B14R0.392 CC/C=C\CCCCCOCCCCO 7a_100016268722_100000210776 [1,1,0,0,0,0|2,0,0]=4 11168 B14R0.392 CC/C=C\CCCCCOCCCOC 34a_100016268722_100000740836 [1,1,0,0,0,0|2,0,0]=4 11169 B14R0.392 CC/C=C\CCCCCOCCCOC 7a_100016268722_100000740836 [1,1,0,0,0,0|2,0,0]=4 11170 B14R0.392 CC/C=C\CCCCCOCCOCC 34a_100016268722_100000210147 [1,1,0,0,0,0|2,0,0]=4 11171 B14R0.392 CC/C=C\CCCCCOCCOCC 7a_100016268722_100011215890 [1,1,0,0,0,0|2,0,0]=4 11172 B14R0.392 CC/C=C\CCCCCOCCSCC 34a_100016268722_100000757381 [1,1,0,0,0,0|2,0,0]=4 11173 B14R0.392 CC/C=C\CCCCCOCCSCC 7a_100016268722_100000757381 [1,1,0,0,0,0|2,0,0]=4 11174 B14R0.392 CC/C=C\CCCCOCCCCCC 34a_100016287862_100000210314 [1,1,0,0,0,0|1,0,0]=3 11175 B14R0.392 CC/C=C\CCCCOCCCCCC 7a_100016287862_100000210314 [1,1,0,0,0,0|1,0,0]=3 11176 B14R0.392 CC/C=C\CCCCOCCCCCF 34a_100016287862_100000729378 [1,1,0,0,0,0|2,0,0]=4 11177 B14R0.392 CC/C=C\CCCCOCCCCCF 7a_100016287862_100000729378 [1,1,0,0,0,0|2,0,0]=4 11178 B14R0.392 CC/C=C\CCCCOCCCCCO 34a_100016287862_100000746330 [1,1,0,0,0,0|2,0,0]=4 11179 B14R0.392 CC/C=C\CCCCOCCCCCO 7a_100016287862_100000746330 [1,1,0,0,0,0|2,0,0]=4 11180 B14R0.392 CC/C=C\CCCCOCCCCOC 34a_100016287862_100000755781 [1,1,0,0,0,0|2,0,0]=4 11181 B14R0.392 CC/C=C\CCCCOCCCCOC 7a_100016287862_100000730899 [1,1,0,0,0,0|2,0,0]=4 11182 B14R0.392 CC/C=C\CCCCOCCCOCC 34a_100016287862_100012232248 [1,1,0,0,0,0|2,0,0]=4 11183 B14R0.392 CC/C=C\CCCCOCCCOCC 7a_100016287862_100012232248 [1,1,0,0,0,0|2,0,0]=4 11184 B14R0.392 CC/C=C\CCCCOCCOCCC 34a_100016287862_100011215938 [1,1,0,0,0,0|2,0,0]=4 11185 B14R0.392 CC/C=C\CCCCOCCOCCC 7a_100016287862_100011215938 [1,1,0,0,0,0|2,0,0]=4 11186 B14R0.392 CC/C=C\CCCCOCOCCCC 34a_100016287862_100011995733 [1,1,0,0,0,0|2,0,0]=4 11187 B14R0.392 CC/C=C\CCNCCCCCCCC 2230a_100000229939_100015370543 [1,1,0,0,0,0|1,0,0]=3 11188 B14R0.392 CC/C=C\CCNCCCCCCCC 34a_100000229939_100015370543 [1,1,0,0,0,0|1,0,0]=3 11189 B14R0.392 CC/C=C\CCNCCCCCCCO 2230a_100011996573_100015370543 [1,1,0,0,0,0|2,0,0]=4 11190 B14R0.392 CC/C=C\CCNCCCCCCCO 34a_100011996573_100015370543 [1,1,0,0,0,0|2,0,0]=4 11191 B14R0.392 CC/C=C\CCNCCCOCCCC 2230a_200000211371_100015370543 [1,1,0,0,0,0|2,0,0]=4 11192 B14R0.392 CC/C=C\CCNCCCOCCCC 34a_200000211371_100015370543 [1,1,0,0,0,0|2,0,0]=4 11193 B14R0.392 CC/C=C\CCOCCCCCCCBr 34a_100000760002_100015370543 [1,1,0,0,0,0|2,0,0]=4 11194 B14R0.392 CC/C=C\CCOCCCCCCCBr 7a_100000760002_100015370543 [1,1,0,0,0,0|2,0,0]=4 11195 B14R0.392 CC/C=C\CCOCCCCCCCC 34a_100000210232_100015370543 [1,1,0,0,0,0|1,0,0]=3 11196 B14R0.392 CC/C=C\CCOCCCCCCCC 34a_100016288707_100000210759 [1,1,0,0,0,0|1,0,0]=3 11197 B14R0.392 CC/C=C\CCOCCCCCCCC 7a_100000210232_100015370543 [1,1,0,0,0,0|1,0,0]=3 11198 B14R0.392 CC/C=C\CCOCCCCCCCC 7a_100016288707_100000210759 [1,1,0,0,0,0|1,0,0]=3 11199 B14R0.392 CC/C=C\CCOCCCCCCCN 34a_100011996573_100015370543 [1,1,0,0,0,0|2,0,0]=4 11200 B14R0.392 CC/C=C\CCOCCCCCCCO 34a_100016288707_100000760002 [1,1,0,0,0,0|2,0,0]=4 11201 B14R0.392 CC/C=C\CCOCCCCCCCO 7a_100016288707_100000760002 [1,1,0,0,0,0|2,0,0]=4 11202 B14R0.392 CC/C=C\CCOCCCCCCOC 34a_100016288707_100011998445 [1,1,0,0,0,0|2,0,0]=4 11203 B14R0.392 CC/C=C\CCOCCCCCCOC 34a_200012092642_100015370543 [1,1,0,0,0,0|2,0,0]=4 11204 B14R0.392 CC/C=C\CCOCCCCCCOC 7a_100016288707_100011998445 [1,1,0,0,0,0|2,0,0]=4 11205 B14R0.392 CC/C=C\CCOCCCCCCOC 7a_200012092642_100015370543 [1,1,0,0,0,0|2,0,0]=4 11206 B14R0.392 CC/C=C\CCOCCCOCCCC 34a_200011215613_100015370543 [1,1,0,0,0,0|2,0,0]=4 11207 B14R0.392 CC/C=C\CCOCCCOCCCC 7a_200011215613_100015370543 [1,1,0,0,0,0|2,0,0]=4 11208 B14R0.392 CC/C=C\CCOCCNCCCCC 34a_100000224656_100015370543 [1,1,0,0,0,0|2,0,0]=4 11209 B14R0.392 CC/C=C\CCOCCOCCCCC 34a_100011215259_100015370543 [1,1,0,0,0,0|2,0,0]=4 11210 B14R0.392 CC/C=C\CCOCCOCCCCC 7a_100011215259_100015370543 [1,1,0,0,0,0|2,0,0]=4 11211 B14R0.392 CC/C=C\CCSCCCCCCCO 62a_100000760002_100015370543 [1,1,0,0,0,0|2,0,0]=4 11212 B14R0.392 CC/C=C\CCSCCCCCCCO 62a_100015370543_100000760002 [1,1,0,0,0,0|2,0,0]=4 11213 B14R0.392 CC/C=C\CCSCCCCCCOC 62a_100011998445_100015370543 [1,1,0,0,0,0|2,0,0]=4 11214 B14R0.392 CC/C=C\CCSCCCCCCOC 62a_100015370543_100011998445 [1,1,0,0,0,0|2,0,0]=4 11215 B14R0.392 CC/C=C\CNCCCCCCCCC 2230a_100000212291_100103147603 [1,1,0,0,0,0|1,0,0]=3 11216 B14R0.392 CC/C=C\CNCCCCCCCCC 34a_100000212291_100103147603 [1,1,0,0,0,0|1,0,0]=3 11217 B14R0.392 CC/C=C\CNCCCCCCCCO 2230a_102515433106_100103147603 [1,1,0,0,0,0|2,0,0]=4 11218 B14R0.392 CC/C=C\CNCCCCCCCCO 34a_102515433106_100103147603 [1,1,0,0,0,0|2,0,0]=4 11219 B14R0.392 CC/C=C\COCCCCCCCCBr 34a_100009813846_100103147603 [1,1,0,0,0,0|2,0,0]=4 11220 B14R0.392 CC/C=C\COCCCCCCCCBr 7a_100009813846_100103147603 [1,1,0,0,0,0|2,0,0]=4 11221 B14R0.392 CC/C=C\COCCCCCCCCC 34a_100000210712_100103147603 [1,1,0,0,0,0|1,0,0]=3 11222 B14R0.392 CC/C=C\COCCCCCCCCC 34a_100016268518_100011214924 [1,1,0,0,0,0|1,0,0]=3 11223 B14R0.392 CC/C=C\COCCCCCCCCC 7a_100000210712_100103147603 [1,1,0,0,0,0|1,0,0]=3 11224 B14R0.392 CC/C=C\COCCCCCCCCCl 34a_100000033203_100103147603 [1,1,0,0,0,0|2,0,0]=4 11225 B14R0.392 CC/C=C\COCCCCCCCCCl 7a_100000033203_100103147603 [1,1,0,0,0,0|2,0,0]=4 11226 B14R0.392 CC/C=C\COCCCCCCCCN 34a_102515433106_100103147603 [1,1,0,0,0,0|2,0,0]=4 11227 B14R0.392 CC/C=C\COCCCCCCCCO 34a_100016268518_100000033203 [1,1,0,0,0,0|2,0,0]=4 11228 B14R0.392 CC/C=C\COCCCCNCCCC 34a_200011216965_100103147603 [1,1,0,0,0,0|2,0,0]=4 11229 B14R0.392 CC/C=C\COCCCCOCCCC 34a_200000760531_100103147603 [1,1,0,0,0,0|2,0,0]=4 11230 B14R0.392 CC/C=C\COCCCCOCCCC 7a_200000760531_100103147603 [1,1,0,0,0,0|2,0,0]=4 11231 B14R0.392 CC/C=C\COCCOCCCCCC 34a_100000691444_100103147603 [1,1,0,0,0,0|2,0,0]=4 11232 B14R0.392 CC/C=C\COCCOCCCCCC 7a_100000691444_100103147603 [1,1,0,0,0,0|2,0,0]=4 11233 B14R0.392 CC/C=C\CSCCCCCCCCO 62a_100000033203_100103147603 [1,1,0,0,0,0|2,0,0]=4 11234 B14R0.392 CC/C=C\CSCCCCCCCCO 62a_100103147603_100000033203 [1,1,0,0,0,0|2,0,0]=4 11235 B14R0.392 CC=C=CCCOCCCCCCCC 34a_100011020354_100000210759 [1,1,0,0,0,0|1,0,1]=4 11236 B14R0.392 CCC#CCCCCCCCCOCC 34a_200000031908_100000210202 [1,1,0,0,0,0|0,0,2]=4 11237 B14R0.392 CCC#CCCCCCCCCOCC 7a_200000031908_100000210202 [1,1,0,0,0,0|0,0,2]=4 11238 B14R0.392 CCC#CCCCCCCNCCCC 2230a_100000102301_200000036426 [1,1,0,0,0,0|1,0,1]=4 11239 B14R0.392 CCC#CCCCCCCNCCCC 7a_106832991798_200000036426 [1,1,0,0,0,0|1,0,1]=4 11240 B14R0.392 CCC#CCCCCCCOCCCC 34a_100000210227_200000036426 [1,1,0,0,0,0|1,0,1]=4 11241 B14R0.392 CCC#CCCCCCCOCCCC 7a_100000210227_200000036426 [1,1,0,0,0,0|1,0,1]=4 11242 B14R0.392 CCC#CCCCCCCSCCCC 62a_100000210211_200000036426 [1,1,0,0,0,0|1,0,1]=4 11243 B14R0.392 CCC#CCCCCCCSCCCC 62a_200000036426_100000210210 [1,1,0,0,0,0|1,0,1]=4 11244 B14R0.392 CCC#CCCOCCCCCCCC 34a_100000036655_100000210759 [1,1,0,0,0,0|1,0,1]=4 11245 B14R0.392 CCC#CCCOCCCCCCCC 7a_100000036655_100000210759 [1,1,0,0,0,0|1,0,1]=4 11246 B14R0.392 CCC#CCNCCCCCCCCC 2230a_100000212291_100009813939 [1,1,0,0,0,0|1,0,1]=4 11247 B14R0.392 CCC#CCNCCCCCCCCC 34a_100000212291_100009813939 [1,1,0,0,0,0|1,0,1]=4 11248 B14R0.392 CCC#CCOCCCCCCCCC 34a_100000032950_100011214924 [1,1,0,0,0,0|1,0,1]=4 11249 B14R0.392 CCC#CCOCCCCCCCCC 34a_100000210712_100009813939 [1,1,0,0,0,0|1,0,1]=4 11250 B14R0.392 CCC#CCOCCCCCCCCC 7a_100000210712_100009813939 [1,1,0,0,0,0|1,0,1]=4 11251 B14R0.392 CCC#CCSCCCCCCCCC 62a_100009813939_100000210670 [1,1,0,0,0,0|1,0,1]=4 11252 B14R0.392 CCC/C=C/COCCCCCCCC 34a_100016278788_100000210759 [1,1,0,0,0,0|1,0,1]=4 11253 B14R0.392 CCC/C=C/COCCCCCCCC 7a_100016278788_100000210759 [1,1,0,0,0,0|1,0,1]=4 11254 B14R0.392 CCCCC#CCCCCCCOCC 34a_100121572206_200000043322 [1,1,0,0,0,0|0,0,2]=4 11255 B14R0.392 CCCCCCCCC/C=C/COCC 34a_100015232335_100000210202 [1,1,0,0,0,0|0,0,1]=3 11256 B14R0.392 CCCCCCCCC/C=C/COCC 7a_100015232335_100000210202 [1,1,0,0,0,0|0,0,1]=3 11257 B14R0.392 CCCCCCCCC/C=C/COCF 34a_100015232335_100015361967 [1,1,0,0,0,0|1,0,1]=4 11258 B14R0.392 CCCCCCCCC/C=C/COCF 7a_100015232335_100015361967 [1,1,0,0,0,0|1,0,1]=4 11259 B14R0.392 CCCCCCCCCC/C=C/COC 34a_200025761149_200000210301 [1,1,0,0,0,0|1,0,0]=3 11260 B14R0.392 CCCCCCCCCC/C=C/COC 7a_200025761149_200000210301 [1,1,0,0,0,0|1,0,0]=3 11261 B14R0.392 CCCCCCCCCC/C=C/CO[13CH3] 34a_200025761149_200025704644 [1,1,0,0,0,0|1,0,0]=3 11262 B14R0.392 CCCCCCCCCC/C=C/CO[13CH3] 7a_200025761149_200025704644 [1,1,0,0,0,0|1,0,0]=3 11263 B14R0.392 CCCCCCCCCCC=NNCC 4a_100000756455_100011218819 [1,1,0,0,0,0|1,0,0]=3 11264 B14R0.392 CCCCCCCCCCCCCNC 2230a_100011215765_200000210301 [1,1,0,0,0,0|1,0,1]=4 11265 B14R0.392 CCCCCCCCCCCCCNC 2230a_106832991635_100000210684 [1,1,0,0,0,0|1,0,1]=4 11266 B14R0.392 CCCCCCCCCCCCCNC 270004a_106832991635_200011215488 [1,1,0,0,0,0|1,0,1]=4 11267 B14R0.392 CCCCCCCCCCCCCNC 34a_100011215765_200000210301 [1,1,0,0,0,0|1,0,1]=4 11268 B14R0.392 CCCCCCCCCCCCCNC 34a_100102657272_100000210684 [1,1,0,0,0,0|1,0,1]=4 11269 B14R0.392 CCCCCCCCCCCCCNC 7a_106832991635_100000210684 [1,1,0,0,0,0|1,0,1]=4 11270 B14R0.392 CCCCCCCCCCCCCN[13CH3] 2230a_100011215765_200025704644 [1,1,0,0,0,0|1,0,1]=4 11271 B14R0.392 CCCCCCCCCCCCCN[13CH3] 34a_100011215765_200025704644 [1,1,0,0,0,0|1,0,1]=4 11272 B14R0.392 CCCCCCCCCCCCCOC 34a_100000185773_200000210301 [1,1,0,0,0,0|1,0,1]=4 11273 B14R0.392 CCCCCCCCCCCCCOC 34a_100138415774_100000210684 [1,1,0,0,0,0|1,0,1]=4 11274 B14R0.392 CCCCCCCCCCCCCOC 7a_100000185773_200000210301 [1,1,0,0,0,0|1,0,1]=4 11275 B14R0.392 CCCCCCCCCCCCCO[13CH3] 34a_100000185773_200025704644 [1,1,0,0,0,0|1,0,1]=4 11276 B14R0.392 CCCCCCCCCCCCCO[13CH3] 7a_100000185773_200025704644 [1,1,0,0,0,0|1,0,1]=4 11277 B14R0.392 CCCCCCCCCCCCNCC 2230a_100000210451_100000210202 [1,1,0,0,0,0|1,0,1]=4 11278 B14R0.392 CCCCCCCCCCCCNCC 2230a_100015525214_100011215052 [1,1,0,0,0,0|1,0,1]=4 11279 B14R0.392 CCCCCCCCCCCCNCC 270004a_100015525214_100011218549 [1,1,0,0,0,0|1,0,1]=4 11280 B14R0.392 CCCCCCCCCCCCNCC 34a_100000210451_100000210202 [1,1,0,0,0,0|1,0,1]=4 11281 B14R0.392 CCCCCCCCCCCCOCC 34a_100000210810_100000210202 [1,1,0,0,0,0|0,0,1]=3 11282 B14R0.392 CCCCCCCCCCCCOCC 34a_100121572206_100000759014 [1,1,0,0,0,0|0,0,1]=3 11283 B14R0.392 CCCCCCCCCCCCOCC 7a_100000210810_100000210202 [1,1,0,0,0,0|0,0,1]=3 11284 B14R0.392 CCCCCCCCCCCCOCF 34a_100000210810_100015361967 [1,1,0,0,0,0|1,0,1]=4 11285 B14R0.392 CCCCCCCCCCCCOCF 7a_100000210810_100015361967 [1,1,0,0,0,0|1,0,1]=4 11286 B14R0.392 CCCCCCCCCCCNCCC 2230a_200011215754_100000210303 [1,1,0,0,0,0|1,0,1]=4 11287 B14R0.392 CCCCCCCCCCCNCCC 34a_200011215754_100000210303 [1,1,0,0,0,0|1,0,1]=4 11288 B14R0.392 CCCCCCCCCCCNCCF 2230a_200011215754_100011217306 [1,1,0,0,0,0|1,0,1]=4 11289 B14R0.392 CCCCCCCCCCCNCCF 34a_100000724931_100011215454 [1,1,0,0,0,0|1,0,1]=4 11290 B14R0.392 CCCCCCCCCCCNCCF 34a_200011215754_100011217306 [1,1,0,0,0,0|1,0,1]=4 11291 B14R0.392 CCCCCCCCCCCNCCO 2230a_100016997473_100011215454 [1,1,0,0,0,0|1,0,1]=4 11292 B14R0.392 CCCCCCCCCCCNCCO 2230a_200011215754_100000211926 [1,1,0,0,0,0|1,0,1]=4 11293 B14R0.392 CCCCCCCCCCCNCCO 34a_100016990907_100011215454 [1,1,0,0,0,0|1,0,1]=4 11294 B14R0.392 CCCCCCCCCCCNCCO 34a_200011215754_100000211926 [1,1,0,0,0,0|1,0,1]=4 11295 B14R0.392 CCCCCCCCCCCNCOC 2230a_200011215754_100000766300 [1,1,0,0,0,0|1,0,1]=4 11296 B14R0.392 CCCCCCCCCCCNCSC 2230a_200011215754_100011218213 [1,1,0,0,0,0|1,0,1]=4 11297 B14R0.392 CCCCCCCCCCCNCSC 34a_200011215754_100011218213 [1,1,0,0,0,0|1,0,1]=4 11298 B14R0.392 CCCCCCCCCCCOCC#N 7a_100000210809_100011215382 [1,1,0,0,0,0|0,0,2]=4 11299 B14R0.392 CCCCCCCCCCCOCC=O 34a_100000210809_200009817547 [1,1,0,0,0,0|0,0,2]=4 11300 B14R0.392 CCCCCCCCCCCOCC=O 7a_100000210809_200015260668 [1,1,0,0,0,0|0,0,2]=4 11301 B14R0.392 CCCCCCCCCCCOCCBr 34a_100000211926_100011215454 [1,1,0,0,0,0|0,0,1]=3 11302 B14R0.392 CCCCCCCCCCCOCCC 34a_100000210258_100011215454 [1,1,0,0,0,0|0,0,1]=3 11303 B14R0.392 CCCCCCCCCCCOCCC 34a_100000210809_100000210303 [1,1,0,0,0,0|0,0,1]=3 11304 B14R0.392 CCCCCCCCCCCOCCC 7a_100000210809_100000210303 [1,1,0,0,0,0|0,0,1]=3 11305 B14R0.392 CCCCCCCCCCCOCCF 34a_100000210809_100011217306 [1,1,0,0,0,0|0,0,1]=3 11306 B14R0.392 CCCCCCCCCCCOCCF 7a_100000210809_100011217306 [1,1,0,0,0,0|0,0,1]=3 11307 B14R0.392 CCCCCCCCCCCOCCN 34a_100000210304_100011215454 [1,1,0,0,0,0|0,0,1]=3 11308 B14R0.392 CCCCCCCCCCCOCCO 34a_100000210809_100000211926 [1,1,0,0,0,0|0,0,1]=3 11309 B14R0.392 CCCCCCCCCCCOCCO 7a_100000210809_100000211926 [1,1,0,0,0,0|0,0,1]=3 11310 B14R0.392 CCCCCCCCCCCOCSC 34a_100000210809_100011218213 [1,1,0,0,0,0|0,0,1]=3 11311 B14R0.392 CCCCCCCCCCCSCCO 62a_100000211926_100011215454 [1,1,0,0,0,0|0,1,1]=4 11312 B14R0.392 CCCCCCCCCCCSCOC 62a_100000766300_100011215454 [1,1,0,0,0,0|0,1,1]=4 11313 B14R0.392 CCCCCCCCCCNCCCC 2230a_100000102301_100000210320 [1,1,0,0,0,0|1,0,1]=4 11314 B14R0.392 CCCCCCCCCCNCCCC 2230a_100000684558_100000210211 [1,1,0,0,0,0|1,0,1]=4 11315 B14R0.392 CCCCCCCCCCNCCCC 34a_100000684558_100000210210 [1,1,0,0,0,0|1,0,1]=4 11316 B14R0.392 CCCCCCCCCCNCCCC 7a_106832991798_100000210320 [1,1,0,0,0,0|1,0,1]=4 11317 B14R0.392 CCCCCCCCCCNCCCF 2230a_100000684558_100011934791 [1,1,0,0,0,0|2,0,0]=4 11318 B14R0.392 CCCCCCCCCCNCCCF 2230a_100015189416_100000210320 [1,1,0,0,0,0|2,0,0]=4 11319 B14R0.392 CCCCCCCCCCNCCCF 34a_100000684558_100011934791 [1,1,0,0,0,0|2,0,0]=4 11320 B14R0.392 CCCCCCCCCCNCCCF 34a_100015189416_100000210320 [1,1,0,0,0,0|2,0,0]=4 11321 B14R0.392 CCCCCCCCCCNCCCO 2230a_100000684558_100000230001 [1,1,0,0,0,0|2,0,0]=4 11322 B14R0.392 CCCCCCCCCCNCCCO 34a_100000684558_100000230001 [1,1,0,0,0,0|2,0,0]=4 11323 B14R0.392 CCCCCCCCCCNCCOC 2230a_100000209980_100000210320 [1,1,0,0,0,0|2,0,0]=4 11324 B14R0.392 CCCCCCCCCCNCCOC 2230a_100000684558_100011201679 [1,1,0,0,0,0|2,0,0]=4 11325 B14R0.392 CCCCCCCCCCNCCOC 34a_100000684558_100011201679 [1,1,0,0,0,0|2,0,0]=4 11326 B14R0.392 CCCCCCCCCCNCCSC 2230a_100000684558_100000751147 [1,1,0,0,0,0|2,0,0]=4 11327 B14R0.392 CCCCCCCCCCNCCSC 2230a_100020590264_100000210320 [1,1,0,0,0,0|2,0,0]=4 11328 B14R0.392 CCCCCCCCCCNCCSC 34a_100000684558_100000212216 [1,1,0,0,0,0|2,0,0]=4 11329 B14R0.392 CCCCCCCCCCOCCCBr 34a_100011217188_100000210320 [1,1,0,0,0,0|2,0,0]=4 11330 B14R0.392 CCCCCCCCCCOCCCC 34a_100000210227_100000210320 [1,1,0,0,0,0|1,0,1]=4 11331 B14R0.392 CCCCCCCCCCOCCCC 34a_100000210711_100000210210 [1,1,0,0,0,0|1,0,1]=4 11332 B14R0.392 CCCCCCCCCCOCCCC 7a_100000210227_100000210320 [1,1,0,0,0,0|1,0,1]=4 11333 B14R0.392 CCCCCCCCCCOCCCC 7a_100000210711_100000210211 [1,1,0,0,0,0|1,0,1]=4 11334 B14R0.392 CCCCCCCCCCOCCCCl 34a_100000230001_100000210320 [1,1,0,0,0,0|2,0,0]=4 11335 B14R0.392 CCCCCCCCCCOCCCF 34a_100000210711_100011934791 [1,1,0,0,0,0|2,0,0]=4 11336 B14R0.392 CCCCCCCCCCOCCCF 34a_100000759539_100000210320 [1,1,0,0,0,0|2,0,0]=4 11337 B14R0.392 CCCCCCCCCCOCCCF 7a_100000210711_100011934791 [1,1,0,0,0,0|2,0,0]=4 11338 B14R0.392 CCCCCCCCCCOCCCN 34a_100000182051_100000210320 [1,1,0,0,0,0|2,0,0]=4 11339 B14R0.392 CCCCCCCCCCOCCCO 34a_100000210711_100000230001 [1,1,0,0,0,0|2,0,0]=4 11340 B14R0.392 CCCCCCCCCCOCCCO 7a_100000210711_100011215043 [1,1,0,0,0,0|2,0,0]=4 11341 B14R0.392 CCCCCCCCCCOCCOC 34a_100000210237_100000210320 [1,1,0,0,0,0|2,0,0]=4 11342 B14R0.392 CCCCCCCCCCOCCOC 34a_100000210711_100011201679 [1,1,0,0,0,0|2,0,0]=4 11343 B14R0.392 CCCCCCCCCCOCCOC 7a_100000210711_100000233755 [1,1,0,0,0,0|2,0,0]=4 11344 B14R0.392 CCCCCCCCCCOCCSC 34a_100000210711_100000212216 [1,1,0,0,0,0|2,0,0]=4 11345 B14R0.392 CCCCCCCCCCOCCSC 34a_100000230434_100000210320 [1,1,0,0,0,0|2,0,0]=4 11346 B14R0.392 CCCCCCCCCCOCCSC 7a_100000210711_100000212216 [1,1,0,0,0,0|2,0,0]=4 11347 B14R0.392 CCCCCCCCCCOCCSC 7a_100000230434_100000210320 [1,1,0,0,0,0|2,0,0]=4 11348 B14R0.392 CCCCCCCCCCSCCCO 62a_100011215043_100000210320 [1,1,0,0,0,0|2,0,0]=4 11349 B14R0.392 CCCCCCCCCCSCCOC 34a_100011628728_200000210301 [1,1,0,0,0,0|2,0,0]=4 11350 B14R0.392 CCCCCCCCCCSCCOC 62a_100000233755_100000210320 [1,1,0,0,0,0|2,0,0]=4 11351 B14R0.392 CCCCCCCCCCSCCOC 7a_100011628728_200000210301 [1,1,0,0,0,0|2,0,0]=4 11352 B14R0.392 CCCCCCCCCCSCCO[13CH3] 34a_100011628728_200025704644 [1,1,0,0,0,0|2,0,0]=4 11353 B14R0.392 CCCCCCCCCCSCCO[13CH3] 7a_100011628728_200025704644 [1,1,0,0,0,0|2,0,0]=4 11354 B14R0.392 CCCCCCCCCCSCOCC 62a_100000739092_100000210320 [1,1,0,0,0,0|0,0,1]=3 11355 B14R0.392 CCCCCCCCCNCCCCC 2230a_100000209983_100011214924 [1,1,0,0,0,0|1,0,1]=4 11356 B14R0.392 CCCCCCCCCNCCCCC 2230a_100000212291_100000210326 [1,1,0,0,0,0|1,0,1]=4 11357 B14R0.392 CCCCCCCCCNCCCCC 34a_100000212291_100000718602 [1,1,0,0,0,0|1,0,1]=4 11358 B14R0.392 CCCCCCCCCNCCOCC 2230a_100000212291_100011215890 [1,1,0,0,0,0|0,0,1]=3 11359 B14R0.392 CCCCCCCCCNCCOCC 2230a_102516460346_100011214924 [1,1,0,0,0,0|0,0,1]=3 11360 B14R0.392 CCCCCCCCCNCCOCC 34a_100000212291_100000210147 [1,1,0,0,0,0|0,0,1]=3 11361 B14R0.392 CCCCCCCCCNCCOCC 34a_102516460346_100011214924 [1,1,0,0,0,0|0,0,1]=3 11362 B14R0.392 CCCCCCCCCNCCSCC 2230a_100000106463_100011214924 [1,1,0,0,0,0|0,1,1]=4 11363 B14R0.392 CCCCCCCCCNCCSCC 2230a_100000212291_100000757381 [1,1,0,0,0,0|0,1,1]=4 11364 B14R0.392 CCCCCCCCCNCCSCC 34a_100000212291_100000757381 [1,1,0,0,0,0|0,1,1]=4 11365 B14R0.392 CCCCCCCCCOCCCCC 34a_100000210253_100011214924 [1,1,0,0,0,0|1,0,1]=4 11366 B14R0.392 CCCCCCCCCOCCCCC 34a_100000210712_100000718602 [1,1,0,0,0,0|1,0,1]=4 11367 B14R0.392 CCCCCCCCCOCCCCC 7a_100000210253_100000210328 [1,1,0,0,0,0|1,0,1]=4 11368 B14R0.392 CCCCCCCCCOCCCCC 7a_100000210712_100000210326 [1,1,0,0,0,0|1,0,1]=4 11369 B14R0.392 CCCCCCCCCOCCOCC 34a_100000210136_100011214924 [1,1,0,0,0,0|0,0,1]=3 11370 B14R0.392 CCCCCCCCCOCCOCC 34a_100000210712_100000210147 [1,1,0,0,0,0|0,0,1]=3 11371 B14R0.392 CCCCCCCCCOCCOCC 7a_100000210136_100000210328 [1,1,0,0,0,0|0,0,1]=3 11372 B14R0.392 CCCCCCCCCOCCOCC 7a_100000210712_100011215890 [1,1,0,0,0,0|0,0,1]=3 11373 B14R0.392 CCCCCCCCCOCCSCC 34a_100000210712_100000757381 [1,1,0,0,0,0|0,1,1]=4 11374 B14R0.392 CCCCCCCCCOCCSCC 34a_100000212035_100011214924 [1,1,0,0,0,0|0,1,1]=4 11375 B14R0.392 CCCCCCCCCOCCSCC 7a_100000210712_100000757381 [1,1,0,0,0,0|0,1,1]=4 11376 B14R0.392 CCCCCCCCCOCCSCC 7a_100000212035_100000210328 [1,1,0,0,0,0|0,1,1]=4 11377 B14R0.392 CCCCCCCCCSCCOCC 62a_100000210147_100000210670 [1,1,0,0,0,0|0,0,1]=3 11378 B14R0.392 CCCCCCCCNCCCCCC 2230a_100000210581_100000210759 [1,1,0,0,0,0|1,0,1]=4 11379 B14R0.392 CCCCCCCCNCCCCCC 2230a_100000229939_100000210314 [1,1,0,0,0,0|1,0,1]=4 11380 B14R0.392 CCCCCCCCNCCCCCC 34a_100000229939_100000210314 [1,1,0,0,0,0|1,0,1]=4 11381 B14R0.392 CCCCCCCCNCCCOCC 2230a_100000210961_100000210759 [1,1,0,0,0,0|0,0,1]=3 11382 B14R0.392 CCCCCCCCNCCCOCC 2230a_100000229939_100012232248 [1,1,0,0,0,0|0,0,1]=3 11383 B14R0.392 CCCCCCCCNCCCOCC 34a_100000210961_100000210759 [1,1,0,0,0,0|0,0,1]=3 11384 B14R0.392 CCCCCCCCNCCCOCC 34a_100000229939_100012232248 [1,1,0,0,0,0|0,0,1]=3 11385 B14R0.392 CCCCCCCCNCCOCCC 2230a_100000229939_100011215938 [1,1,0,0,0,0|1,0,1]=4 11386 B14R0.392 CCCCCCCCNCCOCCC 2230a_100161115042_100000210759 [1,1,0,0,0,0|1,0,1]=4 11387 B14R0.392 CCCCCCCCNCCOCCC 34a_100000229939_100011215938 [1,1,0,0,0,0|1,0,1]=4 11388 B14R0.392 CCCCCCCCNCCOCCC 34a_100161115042_100000210759 [1,1,0,0,0,0|1,0,1]=4 11389 B14R0.392 CCCCCCCCNCCOCCO 2230a_100000211614_100000210759 [1,1,0,0,0,0|1,0,1]=4 11390 B14R0.392 CCCCCCCCNCCOCCO 2230a_100000229939_100011215305 [1,1,0,0,0,0|1,0,1]=4 11391 B14R0.392 CCCCCCCCNCCOCCO 34a_100000211614_100000210759 [1,1,0,0,0,0|1,0,1]=4 11392 B14R0.392 CCCCCCCCNCCOCCO 34a_100000229939_100000692535 [1,1,0,0,0,0|1,0,1]=4 11393 B14R0.392 CCCCCCCCNCCSCCC 2230a_100020603323_100000210759 [1,1,0,0,0,0|2,0,0]=4 11394 B14R0.392 CCCCCCCCOCCCCCC 34a_100000210232_100000210314 [1,1,0,0,0,0|1,0,1]=4 11395 B14R0.392 CCCCCCCCOCCCCCC 34a_100000210259_100000210759 [1,1,0,0,0,0|1,0,1]=4 11396 B14R0.392 CCCCCCCCOCCCCCC 7a_100000210232_100000210314 [1,1,0,0,0,0|1,0,1]=4 11397 B14R0.392 CCCCCCCCOCCCCCC 7a_100000210259_100000210759 [1,1,0,0,0,0|1,0,1]=4 11398 B14R0.392 CCCCCCCCOCCCOCC 34a_100000210232_100012232248 [1,1,0,0,0,0|0,0,1]=3 11399 B14R0.392 CCCCCCCCOCCCOCC 34a_100000757476_100000210759 [1,1,0,0,0,0|0,0,1]=3 11400 B14R0.392 CCCCCCCCOCCCOCC 7a_100000210232_100012232248 [1,1,0,0,0,0|0,0,1]=3 11401 B14R0.392 CCCCCCCCOCCCOCC 7a_100000757476_100000210759 [1,1,0,0,0,0|0,0,1]=3 11402 B14R0.392 CCCCCCCCOCCCSCC 34a_100011216438_100000210759 [1,1,0,0,0,0|0,1,1]=4 11403 B14R0.392 CCCCCCCCOCCCSCC 7a_100011216438_100000210759 [1,1,0,0,0,0|0,1,1]=4 11404 B14R0.392 CCCCCCCCOCCOCCBr 34a_100000692535_100000210759 [1,1,0,0,0,0|1,0,1]=4 11405 B14R0.392 CCCCCCCCOCCOCCBr 7a_100000692535_100000210759 [1,1,0,0,0,0|1,0,1]=4 11406 B14R0.392 CCCCCCCCOCCOCCC 34a_100000210232_100011215938 [1,1,0,0,0,0|1,0,1]=4 11407 B14R0.392 CCCCCCCCOCCOCCC 34a_100000752267_100000210759 [1,1,0,0,0,0|1,0,1]=4 11408 B14R0.392 CCCCCCCCOCCOCCC 7a_100000210232_100011215938 [1,1,0,0,0,0|1,0,1]=4 11409 B14R0.392 CCCCCCCCOCCOCCC 7a_100000752267_100000210759 [1,1,0,0,0,0|1,0,1]=4 11410 B14R0.392 CCCCCCCCOCCOCCCl 34a_100011215305_100000210759 [1,1,0,0,0,0|1,0,1]=4 11411 B14R0.392 CCCCCCCCOCCOCCCl 7a_100011215305_100000210759 [1,1,0,0,0,0|1,0,1]=4 11412 B14R0.392 CCCCCCCCOCCOCCF 34a_200015357709_100000210759 [1,1,0,0,0,0|1,0,1]=4 11413 B14R0.392 CCCCCCCCOCCOCCF 7a_200015357709_100000210759 [1,1,0,0,0,0|1,0,1]=4 11414 B14R0.392 CCCCCCCCOCCOCCI 34a_100012149058_100000210759 [1,1,0,0,0,0|1,0,1]=4 11415 B14R0.392 CCCCCCCCOCCOCCI 7a_100012149058_100000210759 [1,1,0,0,0,0|1,0,1]=4 11416 B14R0.392 CCCCCCCCOCCOCCN 34a_100000211614_100000210759 [1,1,0,0,0,0|1,0,1]=4 11417 B14R0.392 CCCCCCCCOCCOCCO 34a_100000210232_100000692535 [1,1,0,0,0,0|1,0,1]=4 11418 B14R0.392 CCCCCCCCOCCOCCO 7a_100000210232_100011215305 [1,1,0,0,0,0|1,0,1]=4 11419 B14R0.392 CCCCCCCCOCCSCCC 34a_200000230433_100000210759 [1,1,0,0,0,0|2,0,0]=4 11420 B14R0.392 CCCCCCCCOCCSCCC 7a_200000230433_100000210759 [1,1,0,0,0,0|2,0,0]=4 11421 B14R0.392 CCCCCCCCSCCCOCC 62a_100000210759_100012232248 [1,1,0,0,0,0|0,0,1]=3 11422 B14R0.392 CCCCCCCCSCCCOCC 62a_100012232248_100000210317 [1,1,0,0,0,0|0,0,1]=3 11423 B14R0.392 CCCCCCCCSCCOCCC 62a_100000210759_100011215938 [1,1,0,0,0,0|1,0,1]=4 11424 B14R0.392 CCCCCCCCSCCOCCC 62a_100011215938_100000210317 [1,1,0,0,0,0|1,0,1]=4 11425 B14R0.392 CCCCCCCCSCCOCCO 62a_100000210759_100011215305 [1,1,0,0,0,0|1,0,1]=4 11426 B14R0.392 CCCCCCCCSCCOCCO 62a_100011215305_100000210317 [1,1,0,0,0,0|1,0,1]=4 11427 B14R0.392 CCCCCCCNCCCCCCC 2230a_100000229938_100000210681 [1,1,0,0,0,0|1,0,1]=4 11428 B14R0.392 CCCCCCCNCCCOCCC 2230a_100011217757_100000210681 [1,1,0,0,0,0|1,0,1]=4 11429 B14R0.392 CCCCCCCNCCCOCCC 34a_100011217757_100000210614 [1,1,0,0,0,0|1,0,1]=4 11430 B14R0.392 CCCCCCCOCCCCCCC 34a_100000210272_100000210614 [1,1,0,0,0,0|1,0,1]=4 11431 B14R0.392 CCCCCCCOCCCCCCC 7a_100000210272_100000210614 [1,1,0,0,0,0|1,0,1]=4 11432 B14R0.392 CCCCCCNCCOCCOCC 2230a_100000210581_100011211534 [1,1,0,0,0,0|1,0,1]=4 11433 B14R0.392 CCCCCCNCCOCCOCC 2230a_100102712874_100000210314 [1,1,0,0,0,0|1,0,1]=4 11434 B14R0.392 CCCCCCNCCOCCOCC 34a_100102712874_100000210314 [1,1,0,0,0,0|1,0,1]=4 11435 B14R0.392 CCCCCCOCCOCCOCC 34a_100000032842_100000210202 [1,1,0,0,0,0|1,0,1]=4 11436 B14R0.392 CCCCCCOCCOCCOCC 34a_100000210240_100000210314 [1,1,0,0,0,0|1,0,1]=4 11437 B14R0.392 CCCCCCOCCOCCOCC 34a_100000210259_100011211534 [1,1,0,0,0,0|1,0,1]=4 11438 B14R0.392 CCCCCCOCCOCCOCC 34a_100000691444_100000210147 [1,1,0,0,0,0|1,0,1]=4 11439 B14R0.392 CCCCCCOCCOCCOCC 7a_100000032842_100000210202 [1,1,0,0,0,0|1,0,1]=4 11440 B14R0.392 CCCCCCOCCOCCOCC 7a_100000210240_100000210314 [1,1,0,0,0,0|1,0,1]=4 11441 B14R0.392 CCCCCCOCCOCCOCC 7a_100000210259_100011211534 [1,1,0,0,0,0|1,0,1]=4 11442 B14R0.392 CCCCCCOCCOCCOCC 7a_100000691444_100011215890 [1,1,0,0,0,0|1,0,1]=4 11443 B14R0.392 CCCCCCSCCOCCOCC 62a_100000210314_100011211534 [1,1,0,0,0,0|1,0,1]=4 11444 B14R0.392 CCCCCCSCCOCCOCC 62a_100011211534_100000210757 [1,1,0,0,0,0|1,0,1]=4 11445 B14R0.392 CCCCCNCCOCCCOCC 34a_100000224656_100012232248 [1,1,0,0,0,0|1,0,1]=4 11446 B14R0.392 CCCCCOCCOCCCOCC 34a_100011215259_100012232248 [1,1,0,0,0,0|1,0,1]=4 11447 B14R0.392 CCCCCOCCOCCCOCC 7a_100011215259_100012232248 [1,1,0,0,0,0|1,0,1]=4 11448 B14R0.392 CCCCNCCCCOCCOCC 34a_200011216965_100000210147 [1,1,0,0,0,0|1,0,1]=4 11449 B14R0.392 CCCCOCCCCOCCOCC 34a_200000760531_100000210147 [1,1,0,0,0,0|1,0,1]=4 11450 B14R0.392 CCCCOCCCCOCCOCC 7a_200000760531_100011215890 [1,1,0,0,0,0|1,0,1]=4 11451 B14R0.392 CCCCOCCCNCCCOCC 2230a_200000211371_100012232248 [1,1,0,0,0,0|1,0,1]=4 11452 B14R0.392 CCCCOCCCNCCCOCC 34a_200000211371_100012232248 [1,1,0,0,0,0|1,0,1]=4 11453 B14R0.392 CCCCOCCCOCCCOCC 34a_200011215613_100012232248 [1,1,0,0,0,0|1,0,1]=4 11454 B14R0.392 CCCCOCCCOCCCOCC 7a_200011215613_100012232248 [1,1,0,0,0,0|1,0,1]=4 11455 B14R0.392 CCCNCCCCCCCCCCO 2230a_100000066964_100000210303 [1,1,0,0,0,0|2,0,0]=4 11456 B14R0.392 CCCNCCCCCCCCCCO 34a_100000066964_100000210303 [1,1,0,0,0,0|2,0,0]=4 11457 B14R0.392 CCCOCCCCCCCCCCBr 34a_100009813290_100000210303 [1,1,0,0,0,0|1,0,1]=4 11458 B14R0.392 CCCOCCCCCCCCCCBr 7a_100009813290_100000210303 [1,1,0,0,0,0|1,0,1]=4 11459 B14R0.392 CCCOCCCCCCCCCCCl 34a_200000033068_100000210303 [1,1,0,0,0,0|1,0,1]=4 11460 B14R0.392 CCCOCCCCCCCCCCCl 7a_200000033068_100000210303 [1,1,0,0,0,0|1,0,1]=4 11461 B14R0.392 CCCOCCCCCCCCCCN 34a_100000066964_100000210303 [1,1,0,0,0,0|1,0,1]=4 11462 B14R0.392 CCCOCCCCCCCCCCO 34a_100000210258_100009813290 [1,1,0,0,0,0|1,0,1]=4 11463 B14R0.392 CCCSCCCCCCCCCCO 62a_100000210303_200000033068 [1,1,0,0,0,0|2,0,0]=4 11464 B14R0.392 CCCSCCCCCCCCCCO 62a_100009813290_100000210303 [1,1,0,0,0,0|2,0,0]=4 11465 B14R0.392 CCNCCCCCCCCCCCO 2230a_100015525214_100009812471 [1,1,0,0,0,0|1,0,1]=4 11466 B14R0.392 CCOCCCCCCCCCCCBr 34a_100009812471_100000210202 [1,1,0,0,0,0|0,0,1]=3 11467 B14R0.392 CCOCCCCCCCCCCCBr 7a_100009812471_100000210202 [1,1,0,0,0,0|0,0,1]=3 11468 B14R0.392 CCOCCCCCCCCCCCO 34a_100121572206_100009812471 [1,1,0,0,0,0|0,0,1]=3 11469 B14R0.392 CCOCCCCCCCCCOCC 34a_100009875440_100000210202 [1,1,0,0,0,0|0,0,1]=3 11470 B14R0.392 CCOCCCCCCCCCOCC 7a_100009875440_100000210202 [1,1,0,0,0,0|0,0,1]=3 11471 B14R0.392 CCOCCCCCCCCCOCF 34a_100009875440_100015361967 [1,1,0,0,0,0|1,0,1]=4 11472 B14R0.392 CCOCCCCCCCCCOCF 7a_100009875440_100015361967 [1,1,0,0,0,0|1,0,1]=4 11473 B14R0.392 CCOCCCNCCCCCCCO 2230a_100000210961_100000760002 [1,1,0,0,0,0|1,0,1]=4 11474 B14R0.392 CCOCCCNCCCCCCCO 2230a_100011996573_100012232248 [1,1,0,0,0,0|1,0,1]=4 11475 B14R0.392 CCOCCCNCCCCCCCO 34a_100000210961_100000760002 [1,1,0,0,0,0|1,0,1]=4 11476 B14R0.392 CCOCCCNCCCCCCCO 34a_100011996573_100012232248 [1,1,0,0,0,0|1,0,1]=4 11477 B14R0.392 CCOCCCNCCCCCCOC 2230a_100000210961_100011998445 [1,1,0,0,0,0|1,0,1]=4 11478 B14R0.392 CCOCCCNCCCCCCOC 34a_100000210961_100011998445 [1,1,0,0,0,0|1,0,1]=4 11479 B14R0.392 CCOCCCOCCCCCCCBr 34a_100000760002_100012232248 [1,1,0,0,0,0|1,0,1]=4 11480 B14R0.392 CCOCCCOCCCCCCCBr 7a_100000760002_100012232248 [1,1,0,0,0,0|1,0,1]=4 11481 B14R0.392 CCOCCCOCCCCCCCN 34a_100011996573_100012232248 [1,1,0,0,0,0|1,0,1]=4 11482 B14R0.392 CCOCCCOCCCCCCCO 34a_100000757476_100000760002 [1,1,0,0,0,0|1,0,1]=4 11483 B14R0.392 CCOCCCOCCCCCCCO 7a_100000757476_100000760002 [1,1,0,0,0,0|1,0,1]=4 11484 B14R0.392 CCOCCCOCCCCCCOC 34a_100000757476_100011998445 [1,1,0,0,0,0|1,0,1]=4 11485 B14R0.392 CCOCCCOCCCCCCOC 34a_200012092642_100012232248 [1,1,0,0,0,0|1,0,1]=4 11486 B14R0.392 CCOCCCOCCCCCCOC 7a_100000757476_100011998445 [1,1,0,0,0,0|1,0,1]=4 11487 B14R0.392 CCOCCCOCCCCCCOC 7a_200012092642_100012232248 [1,1,0,0,0,0|1,0,1]=4 11488 B14R0.392 CCOCCCSCCCCCCCO 62a_100000760002_100012232248 [1,1,0,0,0,0|1,0,1]=4 11489 B14R0.392 CCOCCCSCCCCCCCO 62a_100012232248_100000760002 [1,1,0,0,0,0|1,0,1]=4 11490 B14R0.392 CCOCCCSCCCCCCOC 62a_100011998445_100012232248 [1,1,0,0,0,0|1,0,1]=4 11491 B14R0.392 CCOCCCSCCCCCCOC 62a_100012232248_100011998445 [1,1,0,0,0,0|1,0,1]=4 11492 B14R0.392 CCOCCNCCCCCCCCO 2230a_102515433106_100011215890 [1,1,0,0,0,0|1,0,1]=4 11493 B14R0.392 CCOCCNCCCCCCCCO 2230a_102516460346_100000033203 [1,1,0,0,0,0|1,0,1]=4 11494 B14R0.392 CCOCCNCCCCCCCCO 34a_102515433106_100000210147 [1,1,0,0,0,0|1,0,1]=4 11495 B14R0.392 CCOCCNCCCCCCCCO 34a_102516460346_100000033203 [1,1,0,0,0,0|1,0,1]=4 11496 B14R0.392 CCOCCOCCCCCCCCBr 34a_100009813846_100000210147 [1,1,0,0,0,0|1,0,1]=4 11497 B14R0.392 CCOCCOCCCCCCCCBr 7a_100009813846_100011215890 [1,1,0,0,0,0|1,0,1]=4 11498 B14R0.392 CCOCCOCCCCCCCCCl 34a_100000033203_100000210147 [1,1,0,0,0,0|1,0,1]=4 11499 B14R0.392 CCOCCOCCCCCCCCCl 7a_100000033203_100011215890 [1,1,0,0,0,0|1,0,1]=4 11500 B14R0.392 CCOCCOCCCCCCCCN 34a_102515433106_100000210147 [1,1,0,0,0,0|1,0,1]=4 11501 B14R0.392 CCOCCOCCCCCCCCO 34a_100000210136_100000033203 [1,1,0,0,0,0|1,0,1]=4 11502 B14R0.392 CCOCCOCCCCCCCCO 7a_100000210136_100000033203 [1,1,0,0,0,0|1,0,1]=4 11503 B14R0.392 CCOCCSCCCCCCCCO 62a_100000033203_100011215890 [1,1,0,0,0,0|1,0,1]=4 11504 B14R0.392 CCOCCSCCCCCCCCO 62a_100000210147_100000033203 [1,1,0,0,0,0|1,0,1]=4 11505 B14R0.392 CCOCSCCCCCCCCCO 62a_100000739092_100009813782 [1,1,0,0,0,0|1,0,1]=4 11506 B14R0.392 CCOCSCCCCCCCCCO 62a_100009813782_100000739092 [1,1,0,0,0,0|1,0,1]=4 11507 B14R0.392 CCSCCCCCCCCCCCO 62a_100009812471_100000210202 [1,1,0,0,0,0|0,1,1]=4 11508 B14R0.392 CSCOCCCCCCCCCCBr 34a_100009813290_100011218213 [1,1,0,0,0,0|1,0,1]=4 11509 B14R0.392 CSCOCCCCCCCCCCCl 34a_200000033068_100011218213 [1,1,0,0,0,0|1,0,1]=4 11510 B14R0.392 CSCOCCCCCCCCCCN 34a_100000066964_100011218213 [1,1,0,0,0,0|1,0,1]=4 11511 B14R0.392 FCCOCCCCCCCCCCBr 34a_100009813290_100011217306 [1,1,0,0,0,0|1,0,1]=4 11512 B14R0.392 FCCOCCCCCCCCCCBr 7a_100009813290_100011217306 [1,1,0,0,0,0|1,0,1]=4 11513 B14R0.392 FCCOCCCCCCCCCCCl 34a_200000033068_100011217306 [1,1,0,0,0,0|1,0,1]=4 11514 B14R0.392 FCCOCCCCCCCCCCCl 7a_200000033068_100011217306 [1,1,0,0,0,0|1,0,1]=4 11515 B14R0.392 FCOCCCCCCCCCCCBr 34a_100009812471_100015361967 [1,1,0,0,0,0|1,0,1]=4 11516 B14R0.392 FCOCCCCCCCCCCCBr 7a_100009812471_100015361967 [1,1,0,0,0,0|1,0,1]=4 11517 B14R0.392 NCCCCCCCCCCOCCF 34a_100000066964_100011217306 [1,1,0,0,0,0|1,0,1]=4 11518 B14R0.392 NCCCCCCCCCCOCCO 34a_100000066964_100000211926 [1,1,0,0,0,0|1,0,1]=4 11519 B14R0.392 NCCOCCCCCCCCCCO 34a_100000210304_100009813290 [1,1,0,0,0,0|1,0,1]=4 11520 B14R0.392 OCCCCCCCCCCOCCBr 34a_100000211926_100009813290 [1,1,0,0,0,0|1,0,1]=4 11521 B14R0.392 OCCOCCCCCCCCCCBr 34a_100009813290_100000211926 [1,1,0,0,0,0|1,0,1]=4 11522 B14R0.392 OCCOCCCCCCCCCCBr 7a_100009813290_100000211926 [1,1,0,0,0,0|1,0,1]=4 11523 B14R0.392 OCCOCCCCCCCCCCCl 34a_200000033068_100000211926 [1,1,0,0,0,0|1,0,1]=4 11524 B14R0.392 OCCOCCCCCCCCCCCl 7a_200000033068_100000211926 [1,1,0,0,0,0|1,0,1]=4 11525 B14R0.394 CC(C)OCCCCCCCCCCBr 34a_100009813290_100000210206 [1,1,0,0,0,0|1,0,1]=4 11526 B14R0.394 CC(C)OCCCCCCCCCCBr 7a_100009813290_100000210206 [1,1,0,0,0,0|1,0,1]=4 11527 B14R0.394 CC(C)OCCCCCCCCCCCl 34a_200000033068_100000210206 [1,1,0,0,0,0|1,0,1]=4 11528 B14R0.394 CC(C)OCCCCCCCCCCCl 7a_200000033068_100000210206 [1,1,0,0,0,0|1,0,1]=4 11529 B14R0.394 CC(C)OCCCCCCCCCCN 34a_100000066964_100000210206 [1,1,0,0,0,0|1,0,1]=4 11530 B14R0.394 CC(C)OCCCCCCCCCCO 34a_100000212225_100009813290 [1,1,0,0,0,0|1,0,1]=4 11531 B14R0.394 CC/C=C/CCCOCCCCC(C)C 34a_100016287902_100011216152 [1,1,0,0,0,0|2,0,0]=4 11532 B14R0.394 CC/C=C/CCCOCCCCC(C)C 7a_100016287902_100011216152 [1,1,0,0,0,0|2,0,0]=4 11533 B14R0.394 CC/C=C\CCCCCNCCC(C)C 269862a_100000210545_100016288537 [1,1,0,0,0,0|2,0,0]=4 11534 B14R0.394 CC/C=C\CCCCCNCCC(C)O 269862a_200000755665_100016288537 [1,1,0,0,0,0|2,0,0]=4 11535 B14R0.394 CC/C=C\CCCCCOCCC(C)C 34a_100016268722_100000210312 [1,1,0,0,0,0|2,0,0]=4 11536 B14R0.394 CC/C=C\CCCCCOCCC(C)C 7a_100016268722_100000210626 [1,1,0,0,0,0|2,0,0]=4 11537 B14R0.394 CC/C=C\CCCCCOCCC(C)O 34a_100016268722_100012276601 [1,1,0,0,0,0|2,0,0]=4 11538 B14R0.394 CC/C=C\CCCCCOCCC(C)O 7a_100016268722_100012276601 [1,1,0,0,0,0|2,0,0]=4 11539 B14R0.394 CC/C=C\CCCCOCCCC(C)C 34a_100016287862_100011214892 [1,1,0,0,0,0|2,0,0]=4 11540 B14R0.394 CC/C=C\CCCCOCCCC(C)C 7a_100016287862_100011214892 [1,1,0,0,0,0|2,0,0]=4 11541 B14R0.394 CC/C=C\CCCCOCCCC(C)O 34a_100016287862_200000718107 [1,1,0,0,0,0|2,0,0]=4 11542 B14R0.394 CC/C=C\CCCCOCCCC(C)O 7a_100016287862_200000718107 [1,1,0,0,0,0|2,0,0]=4 11543 B14R0.394 CC/C=C\CCNCCCCCC(C)C 2230a_100011290863_100015370543 [1,1,0,0,0,0|2,0,0]=4 11544 B14R0.394 CC/C=C\CCNCCCCCC(C)C 34a_100011290863_100015370543 [1,1,0,0,0,0|2,0,0]=4 11545 B14R0.394 CC/C=C\CCOCCCCCC(C)C 34a_100011995859_100015370543 [1,1,0,0,0,0|2,0,0]=4 11546 B14R0.394 CC/C=C\CCOCCCCCC(C)C 34a_100016288707_100000210682 [1,1,0,0,0,0|2,0,0]=4 11547 B14R0.394 CC/C=C\CCOCCCCCC(C)C 7a_100011995859_100015370543 [1,1,0,0,0,0|2,0,0]=4 11548 B14R0.394 CC/C=C\CCOCCCCCC(C)C 7a_100016288707_100000210682 [1,1,0,0,0,0|2,0,0]=4 11549 B14R0.394 CC/C=C\CNCCCCCCC(C)C 2230a_100000211014_100103147603 [1,1,0,0,0,0|2,0,0]=4 11550 B14R0.394 CC/C=C\CNCCCCCCC(C)C 34a_100000211014_100103147603 [1,1,0,0,0,0|2,0,0]=4 11551 B14R0.394 CCCCCCCCCCCNC(C)C 2230a_100138425928_100011215454 [1,1,0,0,0,0|1,0,1]=4 11552 B14R0.394 CCCCCCCCCCCNC(C)C 2230a_200011215754_100000210206 [1,1,0,0,0,0|1,0,1]=4 11553 B14R0.394 CCCCCCCCCCCNC(C)C 34a_100138425928_100011215454 [1,1,0,0,0,0|1,0,1]=4 11554 B14R0.394 CCCCCCCCCCCNC(C)C 34a_200011215754_100000210206 [1,1,0,0,0,0|1,0,1]=4 11555 B14R0.394 CCCCCCCCCCCOC(C)C 34a_100000210809_100000210206 [1,1,0,0,0,0|0,0,1]=3 11556 B14R0.394 CCCCCCCCCCCOC(C)C 34a_100000212225_100011215454 [1,1,0,0,0,0|0,0,1]=3 11557 B14R0.394 CCCCCCCCCCCOC(C)C 7a_100000210809_100000210206 [1,1,0,0,0,0|0,0,1]=3 11558 B14R0.394 CCCCCCCCCCNCC(C)C 2230a_100000210953_100000210320 [1,1,0,0,0,0|2,0,0]=4 11559 B14R0.394 CCCCCCCCCCNCC(C)C 2230a_100000684558_100000210760 [1,1,0,0,0,0|2,0,0]=4 11560 B14R0.394 CCCCCCCCCCNCC(C)C 270004a_100000684558_100000210432 [1,1,0,0,0,0|2,0,0]=4 11561 B14R0.394 CCCCCCCCCCNCC(C)C 34a_100000210953_100000210320 [1,1,0,0,0,0|2,0,0]=4 11562 B14R0.394 CCCCCCCCCCNCC(C)C 34a_100000684558_100000210624 [1,1,0,0,0,0|2,0,0]=4 11563 B14R0.394 CCCCCCCCCCNCC(C)O 2230a_100000210904_100000210320 [1,1,0,0,0,0|2,0,0]=4 11564 B14R0.394 CCCCCCCCCCNCC(C)O 2230a_100000684558_100011218427 [1,1,0,0,0,0|2,0,0]=4 11565 B14R0.394 CCCCCCCCCCNCC(C)O 34a_100000210904_100000210320 [1,1,0,0,0,0|2,0,0]=4 11566 B14R0.394 CCCCCCCCCCNCC(C)O 34a_100000684558_100011218427 [1,1,0,0,0,0|2,0,0]=4 11567 B14R0.394 CCCCCCCCCCNC[C@@H](C)O 2230a_100000684558_100009817552 [1,1,0,0,0,0|2,0,0]=4 11568 B14R0.394 CCCCCCCCCCNC[C@@H](C)O 34a_100000684558_100009817552 [1,1,0,0,0,0|2,0,0]=4 11569 B14R0.394 CCCCCCCCCCOCC(C)Br 34a_100012180447_100000210320 [1,1,0,0,0,0|2,0,0]=4 11570 B14R0.394 CCCCCCCCCCOCC(C)C 34a_100000210257_100000210320 [1,1,0,0,0,0|2,0,0]=4 11571 B14R0.394 CCCCCCCCCCOCC(C)C 34a_100000210711_100000210624 [1,1,0,0,0,0|2,0,0]=4 11572 B14R0.394 CCCCCCCCCCOCC(C)C 7a_100000210711_100000210760 [1,1,0,0,0,0|2,0,0]=4 11573 B14R0.394 CCCCCCCCCCOCC(C)F 34a_100015925927_100000210320 [1,1,0,0,0,0|2,0,0]=4 11574 B14R0.394 CCCCCCCCCCOCC(C)O 34a_100000210711_100011218427 [1,1,0,0,0,0|2,0,0]=4 11575 B14R0.394 CCCCCCCCCCOCC(C)O 7a_100000210711_100011218427 [1,1,0,0,0,0|2,0,0]=4 11576 B14R0.394 CCCCCCCCCCOC[C@@H](C)Cl 34a_100016084084_100000210320 [1,1,0,0,0,0|2,0,0]=4 11577 B14R0.394 CCCCCCCCCCOC[C@@H](C)N 34a_100000737577_100000210320 [1,1,0,0,0,0|2,0,0]=4 11578 B14R0.394 CCCCCCCCCCOC[C@@H](C)O 34a_100000210711_100009817552 [1,1,0,0,0,0|2,0,0]=4 11579 B14R0.394 CCCCCCCCCCOC[C@@H](C)O 7a_100000210711_100009817552 [1,1,0,0,0,0|2,0,0]=4 11580 B14R0.394 CCCCCCCCCCSCC(C)O 62a_100011218427_100000210320 [1,1,0,0,0,0|2,0,0]=4 11581 B14R0.394 CCCCCCCCCCSC[C@@H](C)O 62a_100009817552_100000210320 [1,1,0,0,0,0|2,0,0]=4 11582 B14R0.394 CCCCCCCCCNCOC(C)C 2230a_100000212291_100000709892 [1,1,0,0,0,0|1,0,1]=4 11583 B14R0.394 CCCCCCCCCNCOC(C)C 34a_100000212291_100000709892 [1,1,0,0,0,0|1,0,1]=4 11584 B14R0.394 CCCCCCCCCOCOC(C)C 34a_100000210712_100000709892 [1,1,0,0,0,0|1,0,1]=4 11585 B14R0.394 CCCCCCCCCSCOC(C)C 62a_100000709892_100000210670 [1,1,0,0,0,0|1,0,1]=4 11586 B14R0.394 CCCCCCCCNCCOC(C)C 2230a_100000229939_100000211751 [1,1,0,0,0,0|1,0,1]=4 11587 B14R0.394 CCCCCCCCNCCOC(C)C 2230a_100000701111_100000210759 [1,1,0,0,0,0|1,0,1]=4 11588 B14R0.394 CCCCCCCCNCCOC(C)C 34a_100000229939_100000211751 [1,1,0,0,0,0|1,0,1]=4 11589 B14R0.394 CCCCCCCCNCCOC(C)C 34a_100000701111_100000210759 [1,1,0,0,0,0|1,0,1]=4 11590 B14R0.394 CCCCCCCCOCCOC(C)C 34a_100000210232_100000211751 [1,1,0,0,0,0|1,0,1]=4 11591 B14R0.394 CCCCCCCCOCCOC(C)C 34a_100000211219_100000210759 [1,1,0,0,0,0|1,0,1]=4 11592 B14R0.394 CCCCCCCCOCCOC(C)C 7a_100000210232_100000211751 [1,1,0,0,0,0|1,0,1]=4 11593 B14R0.394 CCCCCCCCOCCOC(C)C 7a_100000211219_100000210759 [1,1,0,0,0,0|1,0,1]=4 11594 B14R0.394 CCCCCCCCSCCOC(C)C 62a_100000210759_100000211751 [1,1,0,0,0,0|1,0,1]=4 11595 B14R0.394 CCCCCCCCSCCOC(C)C 62a_100000211751_100000210317 [1,1,0,0,0,0|1,0,1]=4 11596 B14R0.394 CCCCCCCNCCCOC(C)C 2230a_100000737246_100000210681 [1,1,0,0,0,0|1,0,1]=4 11597 B14R0.394 CCCCCCCNCCCOC(C)C 34a_100000737246_100000210614 [1,1,0,0,0,0|1,0,1]=4 11598 B14R0.394 CCOCCCNCCCCCC(C)C 2230a_100000210961_100000210682 [1,1,0,0,0,0|1,0,1]=4 11599 B14R0.394 CCOCCCNCCCCCC(C)C 2230a_100011290863_100012232248 [1,1,0,0,0,0|1,0,1]=4 11600 B14R0.394 CCOCCCNCCCCCC(C)C 34a_100000210961_100000210682 [1,1,0,0,0,0|1,0,1]=4 11601 B14R0.394 CCOCCCNCCCCCC(C)C 34a_100011290863_100012232248 [1,1,0,0,0,0|1,0,1]=4 11602 B14R0.394 CCOCCCOCCCCCC(C)C 34a_100000757476_100000210682 [1,1,0,0,0,0|1,0,1]=4 11603 B14R0.394 CCOCCCOCCCCCC(C)C 34a_100011995859_100012232248 [1,1,0,0,0,0|1,0,1]=4 11604 B14R0.394 CCOCCCOCCCCCC(C)C 7a_100000757476_100000210682 [1,1,0,0,0,0|1,0,1]=4 11605 B14R0.394 CCOCCCOCCCCCC(C)C 7a_100011995859_100012232248 [1,1,0,0,0,0|1,0,1]=4 11606 B14R0.394 CCOCCCSCCCCCC(C)C 62a_100000210682_100012232248 [1,1,0,0,0,0|1,0,1]=4 11607 B14R0.394 CCOCCCSCCCCCC(C)C 62a_100012232248_100000210682 [1,1,0,0,0,0|1,0,1]=4 11608 B14R0.394 CCOCCNCCCCCCC(C)C 2230a_100000211014_100011215890 [1,1,0,0,0,0|1,0,1]=4 11609 B14R0.394 CCOCCNCCCCCCC(C)C 34a_100000211014_100000210147 [1,1,0,0,0,0|1,0,1]=4 11610 B16R0.8 CCCCC(=O)NCC[C@@H](O)CC(=O)OCC 188690a_200020634500_100000210183 [0,2,0,0,0,0|1,0,1]=4 11611 B16R0.8 CCCCC(C)COC[C@@H](O)CC(=O)OCC 34a_100011995851_100000688340 [0,2,0,0,0,0|1,0,0]=3 11612 B16R0.8 CCCCC(C)COC[C@@H](O)CC(=O)OCC 7a_100011995851_100000688340 [0,2,0,0,0,0|1,0,0]=3 11613 B16R0.8 CCCC[C@H](N)COC[C@@H](O)CC(=O)OCC 34a_100011934283_100000688340 [0,2,0,0,0,0|1,0,0]=3 11614 B16R0.8 CCCOC(C)CNC[C@@H](O)CC(=O)OCC 34a_100015185124_100000688340 [0,2,0,0,0,0|2,0,0]=4 11615 B16R0.8 CCOC(=O)C[C@H](O)CNC[C@H](C)CCCO 34a_100160569302_100000688340 [0,2,0,0,0,0|2,0,0]=4 11616 B16R0.8 CCOC(=O)C[C@H](O)COC[C@@H](N)CCSC 34a_100011827619_100000688340 [0,2,0,0,0,0|2,0,0]=4 11617 B16R0.8 CCOCC(O)CNC[C@@H](O)CC(=O)OCC 34a_102515437182_100000688340 [0,2,0,0,0,0|2,0,0]=4 11618 B16R0.45 CCCCC(C)C(=O)CCCCC(=O)OCC 1458a_100000725509_100000750268 [0,2,0,0,0,0|0,0,1]=3 11619 B16R0.45 CCCCC(C)C(=O)CCCCC(=O)OCC 1458a_100011217402_200011215066 [0,2,0,0,0,0|0,0,1]=3 11620 B16R0.45 CCCCC(C)C(=O)CCOCC(=O)OCC 1458a_100000725509_100000088970 [0,2,0,0,0,0|1,0,1]=4 11621 B16R0.45 CCCCC(C)C(=O)NCCCC(=O)OCC 188690a_100000211256_100000725509 [0,2,0,0,0,0|1,0,1]=4 11622 B16R0.45 CCCCC(O)C(=O)CCCCC(=O)OCC 1458a_100000720857_100000750268 [0,2,0,0,0,0|0,0,1]=3 11623 B16R0.45 CCCCC(O)C(=O)CCOCC(=O)OCC 1458a_100000720857_100000088970 [0,2,0,0,0,0|1,0,1]=4 11624 B16R0.45 CCCCC(O)C(=O)NCCCC(=O)OCC 188690a_100000211256_100000720857 [0,2,0,0,0,0|1,0,1]=4 11625 B16R0.45 CCCCN(C)C(=O)CCCCC(=O)OCC 11a_100000207549_100011217402 [0,2,0,0,0,0|1,0,1]=4 11626 B16R0.45 CCCCN(C)C(=O)CCCCC(=O)OCC 1626a_100000207549_100011217402 [0,2,0,0,0,0|1,0,1]=4 11627 B16R0.45 CCCCN(C)C(=O)CCCCC(=O)OCC 240690a_100000207549_100011217402 [0,2,0,0,0,0|1,0,1]=4 11628 B16R0.45 CCCCN(C)C(=O)CCCCC(=O)OCC 527a_100000207549_100011217402 [0,2,0,0,0,0|1,0,1]=4 11629 B16R0.45 CCOC(=O)CCCCC(=O)C(O)CCSC 1458a_100000685904_100000750268 [0,2,0,0,0,0|1,0,1]=4 11630 B16R0.135 CC(C)OC(=O)CCCCCN(C)CCCO 2230a_100000213112_200010986244 [0,2,0,0,0,0|2,0,0]=4 11631 B16R0.135 CC(C)OC(=O)CCCCCN(C)CCCO 269982a_100000213112_200010986244 [0,2,0,0,0,0|2,0,0]=4 11632 B16R0.135 CCCCC(=O)CCCCCC(=O)OC(C)C 1458a_100000210183_200010986244 [0,2,0,0,0,0|0,0,1]=3 11633 B16R0.135 CCCCN(C)CCCCCC(=O)OC(C)C 2230a_100000207549_200010986244 [0,2,0,0,0,0|1,0,0]=3 11634 B16R0.135 CCCCN(C)CCCCCC(=O)OC(C)C 269982a_100000207549_200010986244 [0,2,0,0,0,0|1,0,0]=3 11635 B16R0.135 CCOCC(=O)CCCCCC(=O)OC(C)C 1458a_100000211967_200010986244 [0,2,0,0,0,0|1,0,1]=4 11636 B16R0.135 CCSCC(=O)CCCCCC(=O)OC(C)C 1458a_100000230394_200010986244 [0,2,0,0,0,0|1,0,1]=4 11637 B16R0.135 COCCC(=O)CCCCCC(=O)OC(C)C 1458a_100000749529_200010986244 [0,2,0,0,0,0|1,0,1]=4 11638 B16R0.135 COCCN(C)CCCCCC(=O)OC(C)C 2230a_100000743101_200010986244 [0,2,0,0,0,0|2,0,0]=4 11639 B16R0.135 COCCN(C)CCCCCC(=O)OC(C)C 269982a_100000743101_200010986244 [0,2,0,0,0,0|2,0,0]=4 11640 B16R0.135 CSCCC(=O)CCCCCC(=O)OC(C)C 1458a_100000174002_200010986244 [0,2,0,0,0,0|1,0,1]=4 11641 B16R0.135 CSCCN(C)CCCCCC(=O)OC(C)C 2230a_100000686725_200010986244 [0,2,0,0,0,0|2,0,0]=4 11642 B16R0.135 CSCCN(C)CCCCCC(=O)OC(C)C 269982a_100000686725_200010986244 [0,2,0,0,0,0|2,0,0]=4 11643 B16R0.281 C#CC(CCCC)OCCCCC(=O)OCC 34a_200011217967_100000750268 [0,2,0,0,0,0|1,0,0]=3 11644 B16R0.281 C#CC(CCCC)OCCCCC(=O)OCC 7a_200011217967_100000750268 [0,2,0,0,0,0|1,0,0]=3 11645 B16R0.281 C#CC(CCCC)OCCOCC(=O)OCC 34a_200011217967_100000088970 [0,2,0,0,0,0|2,0,0]=4 11646 B16R0.281 C#CC(CCCC)OCCOCC(=O)OCC 7a_200011217967_100000088970 [0,2,0,0,0,0|2,0,0]=4 11647 B16R0.281 C=CC(CCCC)OCCCCC(=O)OCC 34a_200011215037_100000750268 [0,2,0,0,0,0|1,0,0]=3 11648 B16R0.281 C=CC(CCCC)OCCCCC(=O)OCC 7a_200011215037_100000750268 [0,2,0,0,0,0|1,0,0]=3 11649 B16R0.281 C=CC(CCCC)OCCOCC(=O)OCC 34a_200011215037_100000088970 [0,2,0,0,0,0|2,0,0]=4 11650 B16R0.281 C=CC(CCCC)OCCOCC(=O)OCC 7a_200011215037_100000088970 [0,2,0,0,0,0|2,0,0]=4 11651 B16R0.281 CCCCC(CC)CNCCCC(=O)OCC 2230a_100000209976_100009991533 [0,2,0,0,0,0|1,0,0]=3 11652 B16R0.281 CCCCC(CC)COCCCC(=O)OCC 34a_100000210273_100009991533 [0,2,0,0,0,0|1,0,0]=3 11653 B16R0.281 CCCCC(CC)COCCCC(=O)OCC 7a_100000210273_100011215271 [0,2,0,0,0,0|1,0,0]=3 11654 B16R0.281 CCCCC(CC)COCCCC(=O)OCC 7a_100012001163_100000211942 [0,2,0,0,0,0|1,0,0]=3 11655 B16R0.281 CCCCC(CC)COCCNC(=O)OCC 34a_100000158857_100000211942 [0,2,0,0,0,0|2,0,0]=4 11656 B16R0.281 CCCCC(CC)COCCNC(=O)OCC 7a_100000210273_200011445536 [0,2,0,0,0,0|2,0,0]=4 11657 B16R0.281 CCCCC(CC)CSCCCC(=O)OCC 62a_100000211942_100009991533 [0,2,0,0,0,0|1,0,0]=3 11658 B16R0.281 CCCCC(CC)CSCCCC(=O)OCC 62a_100009991533_100000211942 [0,2,0,0,0,0|1,0,0]=3 11659 B16R0.281 CCCCC(CC)CSCCNC(=O)OCC 62a_100000211942_200011445536 [0,2,0,0,0,0|2,0,0]=4 11660 B16R0.281 CCCCC(CC)OCCCCC(=O)OCC 34a_100011215227_100000750268 [0,2,0,0,0,0|1,0,0]=3 11661 B16R0.281 CCCCC(CC)OCCCCC(=O)OCC 7a_100011215227_100000750268 [0,2,0,0,0,0|1,0,0]=3 11662 B16R0.281 CCCCC(CC)OCCOCC(=O)OCC 34a_100011215227_100000088970 [0,2,0,0,0,0|2,0,0]=4 11663 B16R0.281 CCCCC(CC)OCCOCC(=O)OCC 7a_100011215227_100000088970 [0,2,0,0,0,0|2,0,0]=4 11664 B16R0.281 CCCCC(CC)OCCSCC(=O)OCC 7a_200000230590_200011216223 [0,2,0,0,0,0|2,0,0]=4 11665 B16R0.281 CCCCC(CC)SCCCCC(=O)OCC 62a_100000750268_200011216223 [0,2,0,0,0,0|1,0,0]=3 11666 B16R0.281 CCCCC(CC)SCCCCC(=O)OCC 62a_200011216223_100000750268 [0,2,0,0,0,0|1,0,0]=3 11667 B16R0.281 CCCCC(CC)SCCOCC(=O)OCC 62a_100000088970_200011216223 [0,2,0,0,0,0|2,0,0]=4 11668 B16R0.281 CCCCC(CC)SCCOCC(=O)OCC 62a_200011216223_100000088970 [0,2,0,0,0,0|2,0,0]=4 11669 B16R0.281 CCCCN(CC)CCCCCC(=O)OCC 2230a_100000207695_100000755133 [0,2,0,0,0,0|1,0,0]=3 11670 B16R0.281 CCCCN(CC)CCCCCC(=O)OCC 269982a_100000207695_100000755133 [0,2,0,0,0,0|1,0,0]=3 11671 B16R0.281 CCCCN(CC)CCCOCC(=O)OCC 2230a_100000207695_100009893628 [0,2,0,0,0,0|2,0,0]=4 11672 B16R0.281 CCCCN(CC)CCCOCC(=O)OCC 269982a_100000207695_100009893628 [0,2,0,0,0,0|2,0,0]=4 11673 B16R0.281 CCCCN(CC)CCNCCC(=O)OCC 2230a_200011208488_100011206558 [0,2,0,0,0,0|2,0,0]=4 11674 B16R0.281 CCCC[C@@H](CO)NCCCCC(=O)OCC 2230a_100011934283_100000750268 [0,2,0,0,0,0|1,0,0]=3 11675 B16R0.281 CCCC[C@@H](CO)NCCCCC(=O)OCC 34a_100011934283_100000750268 [0,2,0,0,0,0|1,0,0]=3 11676 B16R0.281 CCCC[C@@H](CO)NCCOCC(=O)OCC 2230a_100011934283_100000088970 [0,2,0,0,0,0|2,0,0]=4 11677 B16R0.281 CCCC[C@@H](CO)NCCOCC(=O)OCC 34a_100011934283_100000088970 [0,2,0,0,0,0|2,0,0]=4 11678 B16R0.281 CCOC(=O)CCCCCN(CC)CCOC 2230a_100000731262_100000755133 [0,2,0,0,0,0|2,0,0]=4 11679 B16R0.281 CCOC(=O)CCCCCN(CC)CCOC 269982a_100000731262_100000755133 [0,2,0,0,0,0|2,0,0]=4 11680 B16R0.281 CCOC(=O)CCCCN[C@H](CO)CCSC 2230a_100011827619_100000750268 [0,2,0,0,0,0|2,0,0]=4 11681 B16R0.281 CCOCC(CN)OCCCCC(=O)OCC 34a_102515437182_100000750268 [0,2,0,0,0,0|2,0,0]=4 11682 B16R0.299 C#CCCCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100000731252 [0,2,0,0,0,0|0,0,2]=4 11683 B16R0.299 C#CCCCC(=O)CCCCCC(=O)OCC 1458a_100000690238_100000755133 [0,2,0,0,0,0|0,0,2]=4 11684 B16R0.299 C=CCCCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100000757094 [0,2,0,0,0,0|0,0,2]=4 11685 B16R0.299 C=CCCCC(=O)CCCCCC(=O)OCC 1458a_100000766728_100000755133 [0,2,0,0,0,0|0,0,2]=4 11686 B16R0.299 CC/C=C/CC(=O)CCCCCC(=O)OCC 1458a_100016274230_100000755133 [0,2,0,0,0,0|0,0,2]=4 11687 B16R0.299 CC/C=C\CC(=O)CCCCCC(=O)OCC 1458a_100000037472_100103147603 [0,2,0,0,0,0|0,0,2]=4 11688 B16R0.299 CCC#CCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100009813939 [0,2,0,0,0,0|0,0,2]=4 11689 B16R0.299 CCC#CCC(C)OCCCCC(=O)OCC 34a_200000035118_100000750268 [0,2,0,0,0,0|0,0,2]=4 11690 B16R0.299 CCC#CCC(C)OCCCCC(=O)OCC 7a_200000035118_100000750268 [0,2,0,0,0,0|0,0,2]=4 11691 B16R0.299 CCCC#CC(=O)CCCCCC(=O)OCC 1458a_200011218047_100000755133 [0,2,0,0,0,0|0,0,2]=4 11692 B16R0.299 CCCC=CC(=O)CCCCCC(=O)OCC 1458a_100000212230_100000755133 [0,2,0,0,0,0|0,0,2]=4 11693 B16R0.299 CCCCCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100000210326 [0,2,0,0,0,0|0,0,0]=2 11694 B16R0.299 CCCCCC(=O)CCCCCC(=O)OCC 1458a_100000212188_100000755133 [0,2,0,0,0,0|0,0,0]=2 11695 B16R0.299 CCCCCC(=O)CCCOCC(=O)OCC 1458a_100000212188_100009893628 [0,2,0,0,0,0|0,0,1]=3 11696 B16R0.299 CCCCCC(=O)COCCCC(=O)OCC 7a_100012001163_200012276598 [0,2,0,0,0,0|0,0,1]=3 11697 B16R0.299 CCCCCC(=O)COCCNC(=O)OCC 34a_100000158857_200012276598 [0,2,0,0,0,0|1,0,1]=4 11698 B16R0.299 CCCCCC(=O)CSCCCC(=O)OCC 62a_100009991533_200012276598 [0,2,0,0,0,0|0,0,1]=3 11699 B16R0.299 CCCCCC(=O)CSCCCC(=O)OCC 62a_200012276598_100009991533 [0,2,0,0,0,0|0,0,1]=3 11700 B16R0.299 CCCCCC(=O)CSCCNC(=O)OCC 62a_200012276598_200011445536 [0,2,0,0,0,0|1,0,1]=4 11701 B16R0.299 CCCCCC(=O)NCCCCC(=O)OCC 188690a_100000718961_100000212188 [0,2,0,0,0,0|0,0,1]=3 11702 B16R0.299 CCCCCC(C)NCCCCC(=O)OCC 2230a_100000211957_100000750268 [0,2,0,0,0,0|0,0,0]=2 11703 B16R0.299 CCCCCC(C)NCCOCC(=O)OCC 2230a_100000211957_100000088970 [0,2,0,0,0,0|1,0,0]=3 11704 B16R0.299 CCCCCC(C)OCCCCC(=O)OCC 34a_100011215632_100000750268 [0,2,0,0,0,0|0,0,0]=2 11705 B16R0.299 CCCCCC(C)OCCCCC(=O)OCC 7a_100011215632_100000750268 [0,2,0,0,0,0|0,0,0]=2 11706 B16R0.299 CCCCCC(C)OCCOCC(=O)OCC 34a_100011215632_100000088970 [0,2,0,0,0,0|1,0,0]=3 11707 B16R0.299 CCCCCC(C)OCCOCC(=O)OCC 7a_100011215632_100000088970 [0,2,0,0,0,0|1,0,0]=3 11708 B16R0.299 CCCCCC(C)OCCSCC(=O)OCC 7a_200000230590_200011218191 [0,2,0,0,0,0|1,0,0]=3 11709 B16R0.299 CCCCCC(C)SCCCCC(=O)OCC 62a_100000750268_200011218191 [0,2,0,0,0,0|0,0,0]=2 11710 B16R0.299 CCCCCC(C)SCCCCC(=O)OCC 62a_200011218191_100000750268 [0,2,0,0,0,0|0,0,0]=2 11711 B16R0.299 CCCCCC(C)SCCOCC(=O)OCC 62a_100000088970_200011218191 [0,2,0,0,0,0|1,0,0]=3 11712 B16R0.299 CCCCCC(C)SCCOCC(=O)OCC 62a_200011218191_100000088970 [0,2,0,0,0,0|1,0,0]=3 11713 B16R0.299 CCCCCN(C)CCCCCC(=O)OCC 2230a_100000223495_100000755133 [0,2,0,0,0,0|0,0,0]=2 11714 B16R0.299 CCCCCN(C)CCCCCC(=O)OCC 269982a_100000223495_100000755133 [0,2,0,0,0,0|0,0,0]=2 11715 B16R0.299 CCCCCN(C)CCCOCC(=O)OCC 2230a_100000223495_100009893628 [0,2,0,0,0,0|1,0,0]=3 11716 B16R0.299 CCCCCN(C)CCCOCC(=O)OCC 269982a_100000223495_100009893628 [0,2,0,0,0,0|1,0,0]=3 11717 B16R0.299 CCCCNC(=O)CCCCCC(=O)OCC 11a_100000102301_100000037472 [0,2,0,0,0,0|0,0,1]=3 11718 B16R0.299 CCCCNC(=O)CCCCCC(=O)OCC 1626a_100000102301_100000037472 [0,2,0,0,0,0|0,0,1]=3 11719 B16R0.299 CCCCNC(=O)CCCCCC(=O)OCC 240690a_100000102301_100000037472 [0,2,0,0,0,0|0,0,1]=3 11720 B16R0.299 CCCCNC(=O)CCCCCC(=O)OCC 527a_100000102301_100000037472 [0,2,0,0,0,0|0,0,1]=3 11721 B16R0.299 CCCCNC(=O)COCCCC(=O)OCC 7a_100012001163_100000182744 [0,2,0,0,0,0|1,0,1]=4 11722 B16R0.299 CCCCNC(=O)CSCCCC(=O)OCC 62a_100000182744_100009991533 [0,2,0,0,0,0|1,0,1]=4 11723 B16R0.299 CCCCNC(=O)CSCCCC(=O)OCC 62a_100009991533_100000182744 [0,2,0,0,0,0|1,0,1]=4 11724 B16R0.299 CCCCOC(=O)COCCCC(=O)OCC 7a_100012001163_100000211628 [0,2,0,0,0,0|1,0,1]=4 11725 B16R0.299 CCCCOC(=O)CSCCCC(=O)OCC 62a_100000211628_100009991533 [0,2,0,0,0,0|1,0,1]=4 11726 B16R0.299 CCCCOC(=O)CSCCCC(=O)OCC 62a_100009991533_100000211628 [0,2,0,0,0,0|1,0,1]=4 11727 B16R0.299 CCCNNC(=O)CCCCCC(=O)OCC 22a_100000740057_100000037472 [0,2,0,0,0,0|1,0,1]=4 11728 B16R0.299 CCCOCC(=O)CCCCCC(=O)OCC 1458a_100000745993_100000755133 [0,2,0,0,0,0|0,0,1]=3 11729 B16R0.299 CCCOCC(=O)CCCOCC(=O)OCC 1458a_100000745993_100009893628 [0,2,0,0,0,0|1,0,1]=4 11730 B16R0.299 CCCOCC(=O)NCCCCC(=O)OCC 188690a_100000718961_100000745993 [0,2,0,0,0,0|1,0,1]=4 11731 B16R0.299 CCCSCC(=O)CCCCCC(=O)OCC 1458a_100000217233_100000755133 [0,2,0,0,0,0|0,0,1]=3 11732 B16R0.299 CCCSCC(=O)CCCOCC(=O)OCC 1458a_100000217233_100009893628 [0,2,0,0,0,0|1,0,1]=4 11733 B16R0.299 CCCSCC(=O)NCCCCC(=O)OCC 188690a_100000718961_100000217233 [0,2,0,0,0,0|1,0,1]=4 11734 B16R0.299 CCOC(=O)CCCCCC(=O)CCCC#N 1458a_100000037472_100000211468 [0,2,0,0,0,0|0,0,2]=4 11735 B16R0.299 CCOC(=O)CCCCCC(=O)CCCC#N 1458a_100000075515_100000755133 [0,2,0,0,0,0|0,0,2]=4 11736 B16R0.299 CCOC(=O)CCCCCC(=O)CCCCF 1458a_100000037472_100000729493 [0,2,0,0,0,0|0,0,1]=3 11737 B16R0.299 CCOC(=O)CCCCCC(=O)CCCCO 1458a_100000037472_100000210776 [0,2,0,0,0,0|0,0,1]=3 11738 B16R0.299 CCOC(=O)CCCCCC(=O)CCCCO 1458a_100000695505_100000755133 [0,2,0,0,0,0|0,0,1]=3 11739 B16R0.299 CCOC(=O)CCCCCC(=O)CCCOC 1458a_100000037472_100000740836 [0,2,0,0,0,0|0,0,1]=3 11740 B16R0.299 CCOC(=O)CCCCCC(=O)CCCOC 1458a_100000741012_100000755133 [0,2,0,0,0,0|0,0,1]=3 11741 B16R0.299 CCOC(=O)CCCCCC(=O)CCCSC 1458a_100000173376_100000755133 [0,2,0,0,0,0|0,0,1]=3 11742 B16R0.299 CCOC(=O)CCCCCC(=O)CCSCC 1458a_100000037472_100000757381 [0,2,0,0,0,0|0,0,1]=3 11743 B16R0.299 CCOC(=O)CCCCCC(=O)CCSCC 1458a_100000230768_100000755133 [0,2,0,0,0,0|0,0,1]=3 11744 B16R0.299 CCOC(=O)CCCCCC(=O)COCCO 1458a_100000708028_100000755133 [0,2,0,0,0,0|1,0,1]=4 11745 B16R0.299 CCOC(=O)CCCCCC(=O)NCCCF 11a_100015189416_100000037472 [0,2,0,0,0,0|1,0,1]=4 11746 B16R0.299 CCOC(=O)CCCCCC(=O)NCCCF 1626a_100015189416_100000037472 [0,2,0,0,0,0|1,0,1]=4 11747 B16R0.299 CCOC(=O)CCCCCC(=O)NCCCF 240690a_100015189416_100000037472 [0,2,0,0,0,0|1,0,1]=4 11748 B16R0.299 CCOC(=O)CCCCCC(=O)NCCCF 527a_100015189416_100000037472 [0,2,0,0,0,0|1,0,1]=4 11749 B16R0.299 CCOC(=O)CCCCCC(=O)NCCCO 240690a_100000182051_100000037472 [0,2,0,0,0,0|1,0,1]=4 11750 B16R0.299 CCOC(=O)CCCCCC(=O)NCCCO 527a_100000182051_100000037472 [0,2,0,0,0,0|1,0,1]=4 11751 B16R0.299 CCOC(=O)CCCCCC(=O)NCCOC 1626a_100000209980_100000037472 [0,2,0,0,0,0|1,0,1]=4 11752 B16R0.299 CCOC(=O)CCCCCC(=O)NCCOC 240690a_100000209980_100000037472 [0,2,0,0,0,0|1,0,1]=4 11753 B16R0.299 CCOC(=O)CCCCCC(=O)NCCOC 527a_100000209980_100000037472 [0,2,0,0,0,0|1,0,1]=4 11754 B16R0.299 CCOC(=O)CCCCCC(=O)NCCSC 11a_100020590264_100000037472 [0,2,0,0,0,0|1,0,1]=4 11755 B16R0.299 CCOC(=O)CCCCCC(=O)NCCSC 1626a_100020590264_100000037472 [0,2,0,0,0,0|1,0,1]=4 11756 B16R0.299 CCOC(=O)CCCCCC(=O)NCCSC 240690a_100020590264_100000037472 [0,2,0,0,0,0|1,0,1]=4 11757 B16R0.299 CCOC(=O)CCCCCC(=O)NCCSC 527a_100020590264_100000037472 [0,2,0,0,0,0|1,0,1]=4 11758 B16R0.299 CCOC(=O)CCCCCN(C)CCCCO 2230a_100000717598_100000755133 [0,2,0,0,0,0|1,0,0]=3 11759 B16R0.299 CCOC(=O)CCCCCN(C)CCCCO 269982a_100000717598_100000755133 [0,2,0,0,0,0|1,0,0]=3 11760 B16R0.299 CCOC(=O)CCCCCN(C)CCCOC 2230a_100000224831_100000755133 [0,2,0,0,0,0|1,0,0]=3 11761 B16R0.299 CCOC(=O)CCCCCN(C)CCCOC 269982a_100000224831_100000755133 [0,2,0,0,0,0|1,0,0]=3 11762 B16R0.299 CCOC(=O)CCCCNC(=O)CCCCO 188690a_100000718961_100000695505 [0,2,0,0,0,0|1,0,1]=4 11763 B16R0.299 CCOC(=O)CCCCNC(=O)CCCOC 188690a_100000718961_100000741012 [0,2,0,0,0,0|1,0,1]=4 11764 B16R0.299 CCOC(=O)CCCCNC(=O)CCCSC 188690a_100000718961_100000173376 [0,2,0,0,0,0|1,0,1]=4 11765 B16R0.299 CCOC(=O)CCCCNC(=O)CCSCC 188690a_100000718961_100000230768 [0,2,0,0,0,0|1,0,1]=4 11766 B16R0.299 CCOC(=O)CCCCOC(C)CCCOC 34a_200011539412_100000750268 [0,2,0,0,0,0|1,0,0]=3 11767 B16R0.299 CCOC(=O)CCCCOC(C)CCCOC 7a_200011539412_100000750268 [0,2,0,0,0,0|1,0,0]=3 11768 B16R0.299 CCOC(=O)CCCOC[C@@H](N)CCCCN 34a_100016993712_100009991533 [0,2,0,0,0,0|1,0,0]=3 11769 B16R0.299 CCOC(=O)COCCCC(=O)CCCCO 1458a_100000695505_100009893628 [0,2,0,0,0,0|1,0,1]=4 11770 B16R0.299 CCOC(=O)COCCCC(=O)CCCOC 1458a_100000741012_100009893628 [0,2,0,0,0,0|1,0,1]=4 11771 B16R0.299 CCOC(=O)COCCCC(=O)CCCSC 1458a_100000173376_100009893628 [0,2,0,0,0,0|1,0,1]=4 11772 B16R0.299 CCOC(=O)COCCCC(=O)CCSCC 1458a_100000230768_100009893628 [0,2,0,0,0,0|1,0,1]=4 11773 B16R0.299 CCOC(=O)COCCCN(C)CCCCO 2230a_100000717598_100009893628 [0,2,0,0,0,0|2,0,0]=4 11774 B16R0.299 CCOC(=O)COCCCN(C)CCCCO 269982a_100000717598_100009893628 [0,2,0,0,0,0|2,0,0]=4 11775 B16R0.299 CCOC(=O)COCCCN(C)CCCOC 2230a_100000224831_100009893628 [0,2,0,0,0,0|2,0,0]=4 11776 B16R0.299 CCOC(=O)COCCCN(C)CCCOC 269982a_100000224831_100009893628 [0,2,0,0,0,0|2,0,0]=4 11777 B16R0.299 CCOC(=O)COCCOC(C)CCCOC 34a_200011539412_100000088970 [0,2,0,0,0,0|2,0,0]=4 11778 B16R0.299 CCOC(=O)COCCOC(C)CCCOC 7a_200011539412_100000088970 [0,2,0,0,0,0|2,0,0]=4 11779 B16R0.299 CCOCCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100011215890 [0,2,0,0,0,0|0,0,1]=3 11780 B16R0.299 CCOCCC(=O)CCCCCC(=O)OCC 1458a_100000749530_100000755133 [0,2,0,0,0,0|0,0,1]=3 11781 B16R0.299 CCOCCC(=O)CCCOCC(=O)OCC 1458a_100000749530_100009893628 [0,2,0,0,0,0|1,0,1]=4 11782 B16R0.299 CCOCCC(=O)NCCCCC(=O)OCC 188690a_100000718961_100000749530 [0,2,0,0,0,0|1,0,1]=4 11783 B16R0.812 C=C(C)CCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100000730704 [0,2,0,0,0,0|0,0,2]=4 11784 B16R0.812 C=C(C)CCC(=O)CCCCCC(=O)OCC 1458a_200000688413_100000755133 [0,2,0,0,0,0|0,0,2]=4 11785 B16R0.812 CCOC(=O)CCCCCC(=O)CCC(C)C 1458a_100000037472_100000210312 [0,2,0,0,0,0|0,0,1]=3 11786 B16R0.812 CCOC(=O)CCCCCC(=O)CCC(C)C 1458a_100000181311_100000755133 [0,2,0,0,0,0|0,0,1]=3 11787 B16R0.812 CCOC(=O)CCCCCC(=O)CCC(C)O 1458a_100000037472_100012276601 [0,2,0,0,0,0|0,0,1]=3 11788 B16R0.812 CCOC(=O)CCCCCC(=O)CC[S+](C)C 1458a_100009452791_100000755133 [0,2,0,0,0,0|1,0,1]=4 11789 B16R0.812 CCOC(=O)CCCCCC(=O)COC(C)C 1458a_100000745533_100000755133 [0,2,0,0,0,0|1,0,1]=4 11790 B16R0.812 CCOC(=O)CCCCCC(=O)CSC(C)C 1458a_100000241585_100000755133 [0,2,0,0,0,0|1,0,1]=4 11791 B16R0.812 CCOC(=O)CCCCCC(=O)NCC(C)C 11a_100000210953_100000037472 [0,2,0,0,0,0|1,0,1]=4 11792 B16R0.812 CCOC(=O)CCCCCC(=O)NCC(C)C 1626a_100000210953_100000037472 [0,2,0,0,0,0|1,0,1]=4 11793 B16R0.812 CCOC(=O)CCCCCC(=O)NCC(C)C 240690a_100000210953_100000037472 [0,2,0,0,0,0|1,0,1]=4 11794 B16R0.812 CCOC(=O)CCCCCC(=O)NCC(C)C 527a_100000210953_100000037472 [0,2,0,0,0,0|1,0,1]=4 11795 B16R0.812 CCOC(=O)CCCCCC(=O)NCC(C)O 11a_100000210904_100000037472 [0,2,0,0,0,0|1,0,1]=4 11796 B16R0.812 CCOC(=O)CCCCCC(=O)NCC(C)O 240690a_100000210904_100000037472 [0,2,0,0,0,0|1,0,1]=4 11797 B16R0.812 CCOC(=O)CCCCCC(=O)NCC(C)O 527a_100000210904_100000037472 [0,2,0,0,0,0|1,0,1]=4 11798 B16R0.812 CCOC(=O)CCCCCN(C)CCC(C)C 2230a_100000742789_100000755133 [0,2,0,0,0,0|1,0,0]=3 11799 B16R0.812 CCOC(=O)CCCCCN(C)CCC(C)C 269982a_100000742789_100000755133 [0,2,0,0,0,0|1,0,0]=3 11800 B16R0.812 CCOC(=O)CCCCCN(C)CCN(C)C 269982a_100000225618_100000755133 [0,2,0,0,0,0|2,0,0]=4 11801 B16R0.812 CCOC(=O)CCCCNC(=O)CCC(C)C 188690a_100000718961_100000181311 [0,2,0,0,0,0|1,0,1]=4 11802 B16R0.812 CCOC(=O)CCCCNC(=O)CCC(C)O 188690a_100000718961_100000718519 [0,2,0,0,0,0|1,0,1]=4 11803 B16R0.812 CCOC(=O)CCCCNC(C)CCC(C)C 2230a_100138410893_100000750268 [0,2,0,0,0,0|1,0,0]=3 11804 B16R0.812 CCOC(=O)CCCCOC(C)CCC(C)C 34a_100011215350_100000750268 [0,2,0,0,0,0|1,0,0]=3 11805 B16R0.812 CCOC(=O)CCCCOC(C)CCC(C)C 7a_100011215350_100000750268 [0,2,0,0,0,0|1,0,0]=3 11806 B16R0.812 CCOC(=O)CCCCSC(C)CCC(C)C 62a_100000750268_100011261404 [0,2,0,0,0,0|1,0,0]=3 11807 B16R0.812 CCOC(=O)CCCCSC(C)CCC(C)C 62a_100011261404_100000750268 [0,2,0,0,0,0|1,0,0]=3 11808 B16R0.812 CCOC(=O)COCCCC(=O)CCC(C)C 1458a_100000181311_100009893628 [0,2,0,0,0,0|1,0,1]=4 11809 B16R0.812 CCOC(=O)COCCCN(C)CCC(C)C 2230a_100000742789_100009893628 [0,2,0,0,0,0|2,0,0]=4 11810 B16R0.812 CCOC(=O)COCCCN(C)CCC(C)C 269982a_100000742789_100009893628 [0,2,0,0,0,0|2,0,0]=4 11811 B16R0.812 CCOC(=O)COCCNC(C)CCC(C)C 2230a_100138410893_100000088970 [0,2,0,0,0,0|2,0,0]=4 11812 B16R0.812 CCOC(=O)COCCOC(C)CCC(C)C 34a_100011215350_100000088970 [0,2,0,0,0,0|2,0,0]=4 11813 B16R0.812 CCOC(=O)COCCOC(C)CCC(C)C 7a_100011215350_100000088970 [0,2,0,0,0,0|2,0,0]=4 11814 B16R0.812 CCOC(=O)COCCSC(C)CCC(C)C 62a_100000088970_100011261404 [0,2,0,0,0,0|2,0,0]=4 11815 B16R0.812 CCOC(=O)COCCSC(C)CCC(C)C 62a_100011261404_100000088970 [0,2,0,0,0,0|2,0,0]=4 11816 B16R0.1035 CCCCC(C)CCC(=O)NCC(=O)OCC 188690a_100000741813_100000033779 [0,2,0,0,0,0|1,0,1]=4 11817 B16R0.1035 CCCCC(C)COC(C)CCC(=O)OCC 34a_100011995851_100000748298 [0,2,0,0,0,0|1,0,0]=3 11818 B16R0.1035 CCCCC(C)COC(C)CCC(=O)OCC 7a_100011995851_100000748298 [0,2,0,0,0,0|1,0,0]=3 11819 B16R0.1035 CCCC[C@H](N)COC(C)CCC(=O)OCC 34a_100011934283_100000748298 [0,2,0,0,0,0|1,0,0]=3 11820 B16R0.1035 CCCOC(C)CNC(C)CCC(=O)OCC 2230a_100015185124_100000748298 [0,2,0,0,0,0|2,0,0]=4 11821 B16R0.1035 CCCOC(C)CNC(C)CCC(=O)OCC 34a_100015185124_100000748298 [0,2,0,0,0,0|2,0,0]=4 11822 B16R0.1035 CCOC(=O)CCC(C)NC[C@H](C)CCCO 2230a_100160569302_100000748298 [0,2,0,0,0,0|2,0,0]=4 11823 B16R0.1035 CCOC(=O)CCC(C)NC[C@H](C)CCCO 34a_100160569302_100000748298 [0,2,0,0,0,0|2,0,0]=4 11824 B16R0.1035 CCOC(=O)CCC(C)OC[C@@H](N)CCSC 34a_100011827619_100000748298 [0,2,0,0,0,0|2,0,0]=4 11825 B16R0.1035 CCOCC(O)CNC(C)CCC(=O)OCC 2230a_102515437182_100000748298 [0,2,0,0,0,0|2,0,0]=4 11826 B16R0.1035 CCOCC(O)CNC(C)CCC(=O)OCC 34a_102515437182_100000748298 [0,2,0,0,0,0|2,0,0]=4 11827 B16R0.1241 CCCCC(C)COCCCC(=O)NCCC 7a_100011995851_100011194427 [0,2,0,0,0,0|2,0,0]=4 11828 B16R0.3227 CCOC(=O)CCCCCC(=O)CC(=O)CC 1458a_100000037472_100000747405 [0,2,0,0,0,0|0,0,2]=4 11829 B16R0.3227 CCOC(=O)CCCCCC(=O)CC(C)CC 1458a_100000037472_100000748023 [0,2,0,0,0,0|0,0,1]=3 11830 B16R0.3227 CCOC(=O)CCCCCC(=O)CC(C)CC 1458a_100000708755_100000755133 [0,2,0,0,0,0|0,0,1]=3 11831 B16R0.3227 CCOC(=O)CCCCCC(=O)CC(O)CC 1458a_100000037472_100011218378 [0,2,0,0,0,0|0,0,1]=3 11832 B16R0.3227 CCOC(=O)CCCCCC(=O)CC(O)CC 1458a_100011667805_100000755133 [0,2,0,0,0,0|0,0,1]=3 11833 B16R0.3227 CCOC(=O)CCCCCC(=O)CN(C)CC 1458a_100116209913_100000755133 [0,2,0,0,0,0|1,0,1]=4 11834 B16R0.3227 CCOC(=O)CCCCCC(=O)C[C@@H](C)CC 1458a_100000037472_100009816398 [0,2,0,0,0,0|0,0,1]=3 11835 B16R0.3227 CCOC(=O)CCCCCC(=O)C[C@@H](C)CO 1458a_100000037472_100000059175 [0,2,0,0,0,0|1,0,1]=4 11836 B16R0.3227 CCOC(=O)CCCCCC(=O)NC(C)CC 11a_100000209981_100000037472 [0,2,0,0,0,0|1,0,1]=4 11837 B16R0.3227 CCOC(=O)CCCCCC(=O)NC(C)CC 1626a_100000209981_100000037472 [0,2,0,0,0,0|1,0,1]=4 11838 B16R0.3227 CCOC(=O)CCCCCC(=O)NC(C)CC 240690a_100000209981_100000037472 [0,2,0,0,0,0|1,0,1]=4 11839 B16R0.3227 CCOC(=O)CCCCCC(=O)NC(C)CC 527a_100000209981_100000037472 [0,2,0,0,0,0|1,0,1]=4 11840 B16R0.3227 CCOC(=O)CCCCCN(C)CC(C)CC 2230a_100000753921_100000755133 [0,2,0,0,0,0|1,0,0]=3 11841 B16R0.3227 CCOC(=O)CCCCCN(C)CC(C)CC 269982a_100000753921_100000755133 [0,2,0,0,0,0|1,0,0]=3 11842 B16R0.3227 CCOC(=O)CCCCCN(C)CC(O)CO 2230a_100011216503_100000755133 [0,2,0,0,0,0|2,0,0]=4 11843 B16R0.3227 CCOC(=O)CCCCCN(C)CC(O)CO 269982a_100011216503_100000755133 [0,2,0,0,0,0|2,0,0]=4 11844 B16R0.3227 CCOC(=O)CCCCNC(=O)CC(C)CC 188690a_100000718961_100000708755 [0,2,0,0,0,0|1,0,1]=4 11845 B16R0.3227 CCOC(=O)CCCCNC(=O)CC(O)CC 188690a_100000718961_100011667805 [0,2,0,0,0,0|1,0,1]=4 11846 B16R0.3227 CCOC(=O)CCCCNC(C)CC(C)CC 2230a_100000763565_100000750268 [0,2,0,0,0,0|1,0,0]=3 11847 B16R0.3227 CCOC(=O)COCCCC(=O)CC(C)CC 1458a_100000708755_100009893628 [0,2,0,0,0,0|1,0,1]=4 11848 B16R0.3227 CCOC(=O)COCCCC(=O)CC(O)CC 1458a_100011667805_100009893628 [0,2,0,0,0,0|1,0,1]=4 11849 B16R0.3227 CCOC(=O)COCCCN(C)CC(C)CC 2230a_100000753921_100009893628 [0,2,0,0,0,0|2,0,0]=4 11850 B16R0.3227 CCOC(=O)COCCCN(C)CC(C)CC 269982a_100000753921_100009893628 [0,2,0,0,0,0|2,0,0]=4 11851 B16R0.3227 CCOC(=O)COCCNC(C)CC(C)CC 2230a_100000763565_100000088970 [0,2,0,0,0,0|2,0,0]=4 11852 B16R0.3228 C=C(COCCCC(C)CCC)C(=O)OCC 34a_100011713154_100000755967 [0,2,0,0,0,0|1,0,1]=4 11853 B16R0.3228 C=C(COCCCC(C)CCC)C(=O)OCC 7a_100011713154_100000755967 [0,2,0,0,0,0|1,0,1]=4 11854 B16R0.3228 CCCC(=O)CCCCCC(=O)C(=O)OCC 1458a_100000211992_100000068741 [0,2,0,0,0,0|0,0,2]=4 11855 B16R0.3228 CCCC(C)C(=O)CCCCCC(=O)OCC 1458a_100000037472_100000766640 [0,2,0,0,0,0|0,0,1]=3 11856 B16R0.3228 CCCC(C)C(=O)CCCCCC(=O)OCC 1458a_100000210906_100000755133 [0,2,0,0,0,0|0,0,1]=3 11857 B16R0.3228 CCCC(C)C(=O)CCCOCC(=O)OCC 1458a_100000210906_100009893628 [0,2,0,0,0,0|1,0,1]=4 11858 B16R0.3228 CCCC(C)C(=O)NCCCCC(=O)OCC 188690a_100000718961_100000210906 [0,2,0,0,0,0|1,0,1]=4 11859 B16R0.3228 CCCC(C)C(C)OCCCCC(=O)OCC 34a_100000708338_100000750268 [0,2,0,0,0,0|1,0,0]=3 11860 B16R0.3228 CCCC(C)C(C)OCCCCC(=O)OCC 7a_100000708338_100000750268 [0,2,0,0,0,0|1,0,0]=3 11861 B16R0.3228 CCCC(C)C(C)OCCOCC(=O)OCC 34a_100000708338_100000088970 [0,2,0,0,0,0|2,0,0]=4 11862 B16R0.3228 CCCC(C)C(C)OCCOCC(=O)OCC 7a_100000708338_100000088970 [0,2,0,0,0,0|2,0,0]=4 11863 B16R0.3228 CCCN(C)C(=O)CCCCCC(=O)OCC 11a_100000747261_100000037472 [0,2,0,0,0,0|1,0,1]=4 11864 B16R0.3228 CCCN(C)C(=O)CCCCCC(=O)OCC 1626a_100000747261_100000037472 [0,2,0,0,0,0|1,0,1]=4 11865 B16R0.3228 CCCN(C)C(=O)CCCCCC(=O)OCC 240690a_100000747261_100000037472 [0,2,0,0,0,0|1,0,1]=4 11866 B16R0.3228 CCCN(C)C(=O)CCCCCC(=O)OCC 527a_100000747261_100000037472 [0,2,0,0,0,0|1,0,1]=4 11867 B16R0.3228 CCCN(C)CCCCCC(=O)C(=O)OCC 2230a_100000747261_100000068741 [0,2,0,0,0,0|1,0,1]=4 11868 B16R0.3228 CCCN(C)CCCCCC(=O)C(=O)OCC 269982a_100000747261_100000068741 [0,2,0,0,0,0|1,0,1]=4 11869 B16R0.3228 CCC[C@H](O)C(=O)CCCCCC(=O)OCC 1458a_100009822183_100000755133 [0,2,0,0,0,0|0,0,1]=3 11870 B16R0.3228 CCC[C@H](O)C(=O)CCCOCC(=O)OCC 1458a_100009822183_100009893628 [0,2,0,0,0,0|1,0,1]=4 11871 B16R0.3228 CCC[C@H](O)C(=O)NCCCCC(=O)OCC 188690a_100000718961_100009822183 [0,2,0,0,0,0|1,0,1]=4 11872 B16R0.3228 CCOC(=O)CCCCCC(=O)C(C)CCO 1458a_100000037472_100009893172 [0,2,0,0,0,0|1,0,1]=4 11873 B16R0.3228 CCOC(=O)CCCCCC(=O)C(C)COC 1458a_100000037472_100000765312 [0,2,0,0,0,0|1,0,1]=4 11874 B16R0.3228 CCOC(=O)CCCCCC(=O)C(C)COC 1458a_100000751857_100000755133 [0,2,0,0,0,0|1,0,1]=4 11875 B16R0.3228 CCOC(=O)CCCCCC(=O)C(C)CSC 1458a_100000753918_100000755133 [0,2,0,0,0,0|1,0,1]=4 11876 B16R0.3228 CCOC(=O)CCCCCC(=O)C(C)OCC 1458a_100000739345_100000755133 [0,2,0,0,0,0|1,0,1]=4 11877 B16R0.3228 CCOC(=O)CCCCCC(=O)C(C)SCC 1458a_100000230601_100000755133 [0,2,0,0,0,0|1,0,1]=4 11878 B16R0.3228 CCOC(=O)CCCCCN(C)C(C)CCO 2230a_100000731037_100000755133 [0,2,0,0,0,0|2,0,0]=4 11879 B16R0.3228 CCOC(=O)CCCCCN(C)C(C)CCO 269982a_100000731037_100000755133 [0,2,0,0,0,0|2,0,0]=4 11880 B16R0.3324 CCCCC(C)(C)COCCCC(=O)OCC 7a_200011995781_100011215271 [0,2,0,0,0,0|1,0,0]=3 11881 B16R0.3324 CCCCC(C)(C)COCCNC(=O)OCC 7a_200011995781_200011445536 [0,2,0,0,0,0|2,0,0]=4 11882 B16R0.3324 CCCCC(C)(C)OCCCCC(=O)OCC 7a_100011219641_100000750268 [0,2,0,0,0,0|1,0,0]=3 11883 B16R0.3324 CCCCC(C)(C)OCCOCC(=O)OCC 7a_100011219641_100000088970 [0,2,0,0,0,0|2,0,0]=4 11884 B16R0.3324 CCCC[Si](C)(C)COCCCC(=O)OCC 7a_100012001163_200000073895 [0,2,0,0,0,0|1,1,0]=4 11885 B16R0.3324 CCCC[Si](C)(C)CSCCCC(=O)OCC 62a_100009991533_200000073895 [0,2,0,0,0,0|1,1,0]=4 11886 B16R0.3324 CCCC[Si](C)(C)CSCCCC(=O)OCC 62a_200000073895_100009991533 [0,2,0,0,0,0|1,1,0]=4 11887 B16R0.3324 CCOC(=O)CCCCOC(C)(C)CCCBr 7a_100009888830_100000750268 [0,2,0,0,0,0|2,0,0]=4 11888 B16R0.6103 CCCCC(C)NC(=O)CCCC(=O)OCC 11a_100000126638_100000210991 [0,2,0,0,0,0|1,0,1]=4 11889 B16R0.6103 CCCCC(C)NC(=O)CCCC(=O)OCC 1626a_100000126638_100000210991 [0,2,0,0,0,0|1,0,1]=4 11890 B16R0.6103 CCCCC(C)NC(=O)CCCC(=O)OCC 240690a_100000126638_100000210991 [0,2,0,0,0,0|1,0,1]=4 11891 B16R0.6103 CCCCC(C)NC(=O)CCCC(=O)OCC 527a_100000126638_100000210991 [0,2,0,0,0,0|1,0,1]=4 11892 B16R0.156 CCCCCCC(C)NCCC(=O)NC(C)C 2230a_100000210919_100000737564 [0,2,0,0,0,0|2,0,0]=4 11893 B16R0.156 CCCCCCC(C)NCCC(=O)OC(C)C 2230a_100000210919_100000760027 [0,2,0,0,0,0|1,0,0]=3 11894 B16R0.156 CCCCCCC(C)OCCC(=O)NC(C)C 7a_100000210265_100000737564 [0,2,0,0,0,0|2,0,0]=4 11895 B16R0.156 CCCCCCC(C)OCCC(=O)OC(C)C 7a_100000210265_100000760027 [0,2,0,0,0,0|1,0,0]=3 11896 B16R0.156 CCCCCCC(C)SCCC(=O)NC(C)C 62a_100000737564_100011215978 [0,2,0,0,0,0|2,0,0]=4 11897 B16R0.156 CCCCCCC(C)SCCC(=O)NC(C)C 62a_100011215978_100000737564 [0,2,0,0,0,0|2,0,0]=4 11898 B16R0.156 CCCCCCC(C)SCCC(=O)OC(C)C 62a_100000760027_100011215978 [0,2,0,0,0,0|1,0,0]=3 11899 B16R0.156 CCCCCCC(C)SCCC(=O)OC(C)C 62a_100011215978_100000760027 [0,2,0,0,0,0|1,0,0]=3 11900 B16R0.156 CCCCCCC(C)SCOC(=O)OC(C)C 62a_100000003507_100011215978 [0,2,0,0,0,0|2,0,0]=4 11901 B16R0.156 CCCCCCC(C)SCOC(=O)OC(C)C 62a_100011215978_100000003507 [0,2,0,0,0,0|2,0,0]=4 11902 B16R0.156 CCCCOCC(C)OCCC(=O)OC(C)C 7a_100011217071_100000760027 [0,2,0,0,0,0|2,0,0]=4 11903 B16R0.185 CCCCCCC(=O)CCCC(=O)NCCC 1458a_100000199544_100000210757 [0,2,0,0,0,0|1,0,1]=4 11904 B16R0.185 CCCCCCC(=O)CCCC(=O)NCCC 1458a_100102632555_100011194427 [0,2,0,0,0,0|1,0,1]=4 11905 B16R0.185 CCCCCCC(C)NCOC(=O)OCCC 34a_100000210919_200000139673 [0,2,0,0,0,0|2,0,0]=4 11906 B16R0.185 CCCCCCC(C)OCOC(=O)OCCC 34a_100000210265_200000139673 [0,2,0,0,0,0|2,0,0]=4 11907 B16R0.185 CCCCCCC(C)OCOC(=O)OCCC 7a_100000210265_200000139673 [0,2,0,0,0,0|2,0,0]=4 11908 B16R0.185 CCCCCCC(C)SCOC(=O)OCCC 62a_100011215978_200000139673 [0,2,0,0,0,0|2,0,0]=4 11909 B16R0.185 CCCCCCN(C)CCCC(=O)NCCC 2230a_106256046315_100011194427 [0,2,0,0,0,0|2,0,0]=4 11910 B16R0.185 CCCCCCN(C)CCCC(=O)NCCC 269982a_106256046315_100011194427 [0,2,0,0,0,0|2,0,0]=4 11911 B16R0.914 CCCCCCC(=O)C(C)CCC(=O)OCC 1458a_100102632555_100000748298 [0,2,0,0,0,0|0,0,1]=3 11912 B16R0.914 CCCCCCC(=O)N(C)CCC(=O)OCC 11a_100000745921_100102632555 [0,2,0,0,0,0|1,0,1]=4 11913 B16R0.914 CCCCCCC(=O)N(C)CCC(=O)OCC 1626a_100000745921_100102632555 [0,2,0,0,0,0|1,0,1]=4 11914 B16R0.914 CCCCCCC(=O)N(C)CCC(=O)OCC 240690a_100000745921_100102632555 [0,2,0,0,0,0|1,0,1]=4 11915 B16R0.914 CCCCCCC(=O)N(C)CCC(=O)OCC 527a_100000745921_100102632555 [0,2,0,0,0,0|1,0,1]=4 11916 B16R0.914 CCCCCCC(C)C(=O)CCC(=O)NCC 1458a_100000199579_100011215978 [0,2,0,0,0,0|1,0,1]=4 11917 B16R0.914 CCCCCCC(C)C(=O)CCC(=O)OCC 1458a_100000183558_100011215978 [0,2,0,0,0,0|0,0,1]=3 11918 B16R0.914 CCCCCCC(C)C(=O)CNC(=O)OCC 1458a_100000190774_100011215978 [0,2,0,0,0,0|1,0,1]=4 11919 B16R0.914 CCCCCCC(C)N(C)CCC(=O)OCC 2230a_100000745921_100011215978 [0,2,0,0,0,0|1,0,0]=3 11920 B16R0.914 CCCCCCC(C)N(C)CCC(=O)OCC 269982a_100000745921_100011215978 [0,2,0,0,0,0|1,0,0]=3 11921 B16R0.914 CCCCCCC(O)C(=O)NCC(=O)OCC 188690a_100000741813_100011215828 [0,2,0,0,0,0|1,0,1]=4 11922 B16R0.914 CCCCCCN(C)C(=O)CCC(=O)OCC 11a_106256046315_100000183558 [0,2,0,0,0,0|1,0,1]=4 11923 B16R0.914 CCCCCCN(C)C(=O)CCC(=O)OCC 1626a_106256046315_100000183558 [0,2,0,0,0,0|1,0,1]=4 11924 B16R0.914 CCCCCCN(C)C(=O)CCC(=O)OCC 240690a_106256046315_100000183558 [0,2,0,0,0,0|1,0,1]=4 11925 B16R0.914 CCCCCCN(C)C(C)CCC(=O)OCC 2230a_106256046315_100000748298 [0,2,0,0,0,0|1,0,0]=3 11926 B16R0.914 CCCCCCN(C)C(C)CCC(=O)OCC 269982a_106256046315_100000748298 [0,2,0,0,0,0|1,0,0]=3 11927 B16R0.914 CCCCOCC(=O)C(C)CCC(=O)OCC 1458a_100000757543_100000748298 [0,2,0,0,0,0|1,0,1]=4 11928 B16R0.914 CCCCSCC(=O)C(C)CCC(=O)OCC 1458a_100000191162_100000748298 [0,2,0,0,0,0|1,0,1]=4 11929 B16R0.914 CCOC(=O)CCC(C)C(=O)CCCCCO 1458a_100102619762_100000748298 [0,2,0,0,0,0|1,0,1]=4 11930 B16R0.914 CCOC(=O)CCC(C)N(C)CCCCCO 2230a_100000722520_100000748298 [0,2,0,0,0,0|2,0,0]=4 11931 B16R0.914 CCOC(=O)CCC(C)N(C)CCCCCO 269982a_100000722520_100000748298 [0,2,0,0,0,0|2,0,0]=4 11932 B16R0.1263 C=C(CNC(C)CCCCCC)C(=O)OCC 34a_100000210919_100000755967 [0,2,0,0,0,0|1,0,1]=4 11933 B16R0.1263 C=C(COC(C)CCCCCC)C(=O)OCC 34a_100000210265_100000755967 [0,2,0,0,0,0|1,0,1]=4 11934 B16R0.1263 C=C(COC(C)CCCCCC)C(=O)OCC 7a_100000210265_100000755967 [0,2,0,0,0,0|1,0,1]=4 11935 B16R0.1263 C=C(CSC(C)CCCCCC)C(=O)OCC 62a_100000755967_100011215978 [0,2,0,0,0,0|1,0,1]=4 11936 B16R0.1263 C=C(CSC(C)CCCCCC)C(=O)OCC 62a_100011215978_100000755967 [0,2,0,0,0,0|1,0,1]=4 11937 B16R0.1263 CCCCCCC(C)SCC(=O)C(=O)OCC 62a_100000211299_100011215978 [0,2,0,0,0,0|1,0,1]=4 11938 B16R0.1263 CCCCCCC(C)SCC(=O)C(=O)OCC 62a_100011215978_100000211299 [0,2,0,0,0,0|1,0,1]=4 11939 B16R0.2840 CCOC(=O)CCCC(=O)CCCN(C)CC 1458a_100000210991_100015186262 [0,2,0,0,0,0|1,0,1]=4 11940 B16R0.2840 CCOC(=O)CCCC(=O)NCCC(C)CC 11a_100020591266_100000210991 [0,2,0,0,0,0|1,0,1]=4 11941 B16R0.2840 CCOC(=O)CCCC(=O)NCCC(C)CC 1626a_100020591266_100000210991 [0,2,0,0,0,0|1,0,1]=4 11942 B16R0.2840 CCOC(=O)CCCC(=O)NCCC(C)CC 240690a_100020591266_100000210991 [0,2,0,0,0,0|1,0,1]=4 11943 B16R0.2840 CCOC(=O)CCCC(=O)NCCC(C)CC 527a_100020591266_100000210991 [0,2,0,0,0,0|1,0,1]=4 11944 B16R0.2842 CCNC(=O)CCCC(=O)CCCCC(C)C 1458a_100000199580_100011216152 [0,2,0,0,0,0|1,0,1]=4 11945 B16R0.2842 CCOC(=O)CCCC(=O)CCCCC(=O)C 1458a_100000210991_100000735457 [0,2,0,0,0,0|0,0,2]=4 11946 B16R0.2842 CCOC(=O)CCCC(=O)CCCCC(C)C 1458a_100000210991_100011216152 [0,2,0,0,0,0|0,0,1]=3 11947 B16R0.2842 CCOC(=O)CCCC(=O)CCCCC(C)C 1458a_100011933920_100011215271 [0,2,0,0,0,0|0,0,1]=3 11948 B16R0.2842 CCOC(=O)CCCC(=O)NCCCC(C)C 11a_200000737386_100000210991 [0,2,0,0,0,0|1,0,1]=4 11949 B16R0.2842 CCOC(=O)CCCC(=O)NCCCC(C)C 1626a_200000737386_100000210991 [0,2,0,0,0,0|1,0,1]=4 11950 B16R0.2842 CCOC(=O)CCCC(=O)NCCCC(C)C 240690a_200000737386_100000210991 [0,2,0,0,0,0|1,0,1]=4 11951 B16R0.2842 CCOC(=O)CCCC(=O)NCCCC(C)C 527a_200000737386_100000210991 [0,2,0,0,0,0|1,0,1]=4 11952 B16R0.2842 CCOC(=O)CCNC(=O)CCCCC(C)C 188690a_100000746078_100011933920 [0,2,0,0,0,0|1,0,1]=4 11953 B16R0.2842 CCOC(=O)NCCC(=O)CCCCC(C)C 1458a_100011933920_200011445536 [0,2,0,0,0,0|1,0,1]=4 11954 B16R0.3139 CCCC(C)CCC(C)NCCC(=O)NCC 270004a_100025743525_200011216527 [0,2,0,0,0,0|2,0,0]=4 11955 B16R0.3139 CCCC(C)CCOC(C)CCC(=O)OCC 34a_100011217855_100000748298 [0,2,0,0,0,0|1,0,0]=3 11956 B16R0.3139 CCCC(C)CCOC(C)CCC(=O)OCC 7a_100011217855_100000748298 [0,2,0,0,0,0|1,0,0]=3 11957 B16R0.3139 CCC[C@H](N)CCOC(C)CCC(=O)OCC 34a_100015193777_100000748298 [0,2,0,0,0,0|1,0,0]=3 11958 B16R0.3162 CCCCCC(C)C(=O)CCCC(=O)NCC 1458a_100000199580_200011218191 [0,2,0,0,0,0|1,0,1]=4 11959 B16R0.3162 CCCCCC(C)C(=O)CCCC(=O)OCC 1458a_100000210991_200011218191 [0,2,0,0,0,0|0,0,1]=3 11960 B16R0.3162 CCCCCC(C)C(=O)CCCC(=O)OCC 1458a_100011215998_100011215271 [0,2,0,0,0,0|0,0,1]=3 11961 B16R0.3162 CCCCCC(C)C(=O)CCNC(=O)OCC 1458a_100011215998_200011445536 [0,2,0,0,0,0|1,0,1]=4 11962 B16R0.3162 CCCCCC(C)C(=O)NCCC(=O)OCC 188690a_100000746078_100011215998 [0,2,0,0,0,0|1,0,1]=4 11963 B16R0.3162 CCCCCN(C)C(=O)CCCC(=O)OCC 11a_100000223495_100000210991 [0,2,0,0,0,0|1,0,1]=4 11964 B16R0.3162 CCCCCN(C)C(=O)CCCC(=O)OCC 1626a_100000223495_100000210991 [0,2,0,0,0,0|1,0,1]=4 11965 B16R0.3162 CCCCCN(C)C(=O)CCCC(=O)OCC 240690a_100000223495_100000210991 [0,2,0,0,0,0|1,0,1]=4 11966 B16R0.3162 CCCCCN(C)C(=O)CCCC(=O)OCC 527a_100000223495_100000210991 [0,2,0,0,0,0|1,0,1]=4 11967 B16R0.3162 CCCCSC(C)C(=O)CCCC(=O)OCC 1458a_100000191163_100011215271 [0,2,0,0,0,0|1,0,1]=4 11968 B16R0.3278 CCCCCCC(=O)NC(C)CC(=O)OCC 188690a_100000686176_100102632555 [0,2,0,0,0,0|1,0,1]=4 11969 B16R0.3278 CCCCCCC(C)NC(=O)CC(=O)OCC 240690a_100000210919_100000243816 [0,2,0,0,0,0|1,0,1]=4 11970 B16R0.3278 CCCCCCC(C)NC(C)CC(=O)OCC 2230a_100000210919_100009817359 [0,2,0,0,0,0|1,0,0]=3 11971 B16R0.3278 CCCCCCC(C)OC(C)CC(=O)OCC 7a_100000210265_100009817359 [0,2,0,0,0,0|1,0,0]=3 11972 B16R0.3278 CCCCCCC(C)O[C@H](C)CC(=O)OCC 7a_100009816390_100011215978 [0,2,0,0,0,0|1,0,0]=3 11973 B16R0.3278 CCCCCCC(C)SC(C)CC(=O)OCC 62a_100009817359_100011215978 [0,2,0,0,0,0|1,0,0]=3 11974 B16R0.3278 CCCCCCC(C)SC(C)CC(=O)OCC 62a_100011215978_100009817359 [0,2,0,0,0,0|1,0,0]=3 11975 B16R0.3278 CCCCCCC(C)SC(C)OC(=O)OCC 62a_100000036008_100011215978 [0,2,0,0,0,0|2,0,0]=4 11976 B16R0.3278 CCCCCCC(C)SC(C)OC(=O)OCC 62a_100011215978_100000036008 [0,2,0,0,0,0|2,0,0]=4 11977 B16R0.3278 CCCCCCN(C)CC(=O)CC(=O)OCC 269982a_106256046315_100000210311 [0,2,0,0,0,0|1,0,1]=4 11978 B16R0.3278 CCCCCCN(C)C[C@@H](O)CC(=O)OCC 269982a_106256046315_100000688340 [0,2,0,0,0,0|1,0,0]=3 11979 B16R0.3278 CCCCOCC(C)OC(C)CC(=O)OCC 7a_100011217071_100009817359 [0,2,0,0,0,0|2,0,0]=4 11980 B16R0.3278 CCOC(=O)C[C@H](O)CN(C)CCCCCO 269982a_100000722520_100000688340 [0,2,0,0,0,0|2,0,0]=4 11981 B16R0.4716 C#CC(CCCCCBr)OCCC(=O)OCC 34a_200010408556_100000765890 [0,2,0,0,0,0|2,0,0]=4 11982 B16R0.4716 C#CC(CCCCCBr)OCCC(=O)OCC 7a_200010408556_100011206558 [0,2,0,0,0,0|2,0,0]=4 11983 B16R0.4716 C=CC(CCCCCC)OCCC(=O)NCC 7a_200011215977_100000737597 [0,2,0,0,0,0|2,0,0]=4 11984 B16R0.4716 C=CC(CCCCCC)OCCC(=O)OCC 34a_200011215977_100000765890 [0,2,0,0,0,0|1,0,0]=3 11985 B16R0.4716 C=CC(CCCCCC)OCCC(=O)OCC 7a_200011215977_100011206558 [0,2,0,0,0,0|1,0,0]=3 11986 B16R0.4716 CCCCCCC(CC)NCCC(=O)NCC 270004a_100025743525_100011219640 [0,2,0,0,0,0|2,0,0]=4 11987 B16R0.4716 CCCCCCC(CC)OCCC(=O)NCC 7a_100011215785_100000737597 [0,2,0,0,0,0|2,0,0]=4 11988 B16R0.4716 CCCCCCC(CC)OCCC(=O)OCC 34a_100011215785_100000765890 [0,2,0,0,0,0|1,0,0]=3 11989 B16R0.4716 CCCCCCC(CC)OCCC(=O)OCC 7a_100011215785_100011206558 [0,2,0,0,0,0|1,0,0]=3 11990 B16R0.5205 C#CCCCCCC(=O)CCCC(=O)OCC 1458a_100000210991_100012094781 [0,2,0,0,0,0|0,0,2]=4 11991 B16R0.5205 C#CCCCCCC(=O)CCCC(=O)OCC 1458a_100000694772_100011215271 [0,2,0,0,0,0|0,0,2]=4 11992 B16R0.5205 C=CCCCCCC(=O)CCCC(=O)OCC 1458a_100000210991_100000700193 [0,2,0,0,0,0|0,0,2]=4 11993 B16R0.5205 C=CCCCCCC(=O)CCCC(=O)OCC 1458a_100011934241_100011215271 [0,2,0,0,0,0|0,0,2]=4 11994 B16R0.5205 CCCC/C=C/CC(=O)CCCC(=O)OCC 1458a_200016282684_100011215271 [0,2,0,0,0,0|0,0,2]=4 11995 B16R0.5205 CCCCCC#CC(=O)CCCC(=O)OCC 1458a_100011215388_100011215271 [0,2,0,0,0,0|0,0,2]=4 11996 B16R0.5205 CCCCCC=CC(=O)CCCC(=O)OCC 1458a_100016263427_100011215271 [0,2,0,0,0,0|0,0,2]=4 11997 B16R0.5205 CCCCCCCC(=O)CCCC(=O)NCC 1458a_100000199580_100000210614 [0,2,0,0,0,0|1,0,0]=3 11998 B16R0.5205 CCCCCCCC(=O)CCCC(=O)OCC 1458a_100000210991_100000210614 [0,2,0,0,0,0|0,0,0]=2 11999 B16R0.5205 CCCCCCCC(=O)CCCC(=O)OCC 1458a_100000211969_100011215271 [0,2,0,0,0,0|0,0,0]=2 12000 B16R0.5205 CCCCCCCC(=O)CCNC(=O)OCC 1458a_100000211969_200011445536 [0,2,0,0,0,0|0,0,1]=3 12001 B16R0.5205 CCCCCCCC(=O)NCCC(=O)NCC 11a_100025743525_100000211969 [0,2,0,0,0,0|1,0,1]=4 12002 B16R0.5205 CCCCCCCC(=O)NCCC(=O)NCC 1626a_100025743525_100000211969 [0,2,0,0,0,0|1,0,1]=4 12003 B16R0.5205 CCCCCCCC(=O)NCCC(=O)NCC 240690a_100025743525_100000211969 [0,2,0,0,0,0|1,0,1]=4 12004 B16R0.5205 CCCCCCCC(=O)NCCC(=O)NCC 527a_100025743525_100000211969 [0,2,0,0,0,0|1,0,1]=4 12005 B16R0.5205 CCCCCCCC(=O)NCCC(=O)OCC 188690a_100000746078_100000211969 [0,2,0,0,0,0|0,0,1]=3 12006 B16R0.5205 CCCCCCCC(C)NCCC(=O)NCC 270004a_100025743525_100000210596 [0,2,0,0,0,0|1,0,0]=3 12007 B16R0.5205 CCCCCCCC(C)NCCC(=O)NCC 34a_100025743525_200011218727 [0,2,0,0,0,0|1,0,0]=3 12008 B16R0.5205 CCCCCCCC(C)OCCC(=O)NCC 7a_200011215852_100000737597 [0,2,0,0,0,0|1,0,0]=3 12009 B16R0.5205 CCCCCCCC(C)OCCC(=O)OCC 34a_200011215852_100000765890 [0,2,0,0,0,0|0,0,0]=2 12010 B16R0.5205 CCCCCCCC(C)OCCC(=O)OCC 7a_200011215852_100011206558 [0,2,0,0,0,0|0,0,0]=2 12011 B16R0.5205 CCCCCCCC(C)OCOC(=O)CCC 34a_200011215852_100000034017 [0,2,0,0,0,0|2,0,0]=4 12012 B16R0.5205 CCCCCCCC(C)SCCC(=O)NCC 62a_100000737597_200011218727 [0,2,0,0,0,0|1,0,0]=3 12013 B16R0.5205 CCCCCCCC(C)SCCC(=O)NCC 62a_200011218727_100000737597 [0,2,0,0,0,0|1,0,0]=3 12014 B16R0.5205 CCCCCCCC(C)SCCC(=O)OCC 62a_100000765890_200011218727 [0,2,0,0,0,0|0,0,0]=2 12015 B16R0.5205 CCCCCCCC(C)SCCC(=O)OCC 62a_200011218727_100000765890 [0,2,0,0,0,0|0,0,0]=2 12016 B16R0.5205 CCCCCCCC(C)SCOC(=O)CCC 62a_200011218727_100000034017 [0,2,0,0,0,0|2,0,0]=4 12017 B16R0.5205 CCCCCCCC(C)SCOC(=O)OCC 62a_200011218727_100000075025 [0,2,0,0,0,0|1,0,0]=3 12018 B16R0.5205 CCCCCCCN(C)C/C=C/C(=O)OCC 2230a_100000228206_100016267167 [0,2,0,0,0,0|0,0,2]=4 12019 B16R0.5205 CCCCCCCN(C)C/C=C/C(=O)OCC 269982a_100000228206_100016267167 [0,2,0,0,0,0|0,0,2]=4 12020 B16R0.5205 CCCCCCCN(C)CCCC(=O)OCC 2230a_100000228206_100009991533 [0,2,0,0,0,0|0,0,0]=2 12021 B16R0.5205 CCCCCCCN(C)CCCC(=O)OCC 269982a_100000228206_100009991533 [0,2,0,0,0,0|0,0,0]=2 12022 B16R0.5205 CCCCCCCN(C)CCNC(=O)OCC 269982a_100000228206_200011445536 [0,2,0,0,0,0|1,0,0]=3 12023 B16R0.5205 CCCCCCNC(=O)CCCC(=O)NCC 11a_100000210581_100000199580 [0,2,0,0,0,0|1,0,1]=4 12024 B16R0.5205 CCCCCCNC(=O)CCCC(=O)NCC 1626a_100000210581_100000199580 [0,2,0,0,0,0|1,0,1]=4 12025 B16R0.5205 CCCCCCNC(=O)CCCC(=O)NCC 240690a_100000210581_100000199580 [0,2,0,0,0,0|1,0,1]=4 12026 B16R0.5205 CCCCCCNC(=O)CCCC(=O)NCC 527a_100000210581_100000199580 [0,2,0,0,0,0|1,0,1]=4 12027 B16R0.5205 CCCCCCNC(=O)CCCC(=O)OCC 11a_100000210581_100000210991 [0,2,0,0,0,0|0,0,1]=3 12028 B16R0.5205 CCCCCCNC(=O)CCCC(=O)OCC 1626a_100000210581_100000210991 [0,2,0,0,0,0|0,0,1]=3 12029 B16R0.5205 CCCCCCNC(=O)CCCC(=O)OCC 240690a_100000210581_100000210991 [0,2,0,0,0,0|0,0,1]=3 12030 B16R0.5205 CCCCCCNC(=O)CCCC(=O)OCC 527a_100000210581_100000210991 [0,2,0,0,0,0|0,0,1]=3 12031 B16R0.5205 CCCCCCNC(=O)CSCC(=O)OCC 62a_100000230325_100000188475 [0,2,0,0,0,0|1,0,1]=4 12032 B16R0.5205 CCCCCNN=C(C)CCCC(=O)OCC 4a_100000694160_100000032325 [0,2,0,0,0,0|1,0,1]=4 12033 B16R0.5205 CCCCCNNC(=O)CCCC(=O)OCC 22a_100000694160_100000210991 [0,2,0,0,0,0|1,0,1]=4 12034 B16R0.5205 CCCCOCCC(=O)CCCC(=O)NCC 1458a_100000199580_100000743108 [0,2,0,0,0,0|1,0,1]=4 12035 B16R0.5205 CCCCOCCC(=O)CCCC(=O)OCC 1458a_100000210991_100000743108 [0,2,0,0,0,0|0,0,1]=3 12036 B16R0.5205 CCCOCCNC(=O)CCCC(=O)OCC 1626a_100161115042_100000210991 [0,2,0,0,0,0|1,0,1]=4 12037 B16R0.5205 CCCOCCNC(=O)CCCC(=O)OCC 240690a_100161115042_100000210991 [0,2,0,0,0,0|1,0,1]=4 12038 B16R0.5205 CCCOCCNC(=O)CCCC(=O)OCC 527a_100161115042_100000210991 [0,2,0,0,0,0|1,0,1]=4 12039 B16R0.5205 CCCSCCNC(=O)CCCC(=O)OCC 11a_100020603323_100000210991 [0,2,0,0,0,0|1,0,1]=4 12040 B16R0.5205 CCCSCCNC(=O)CCCC(=O)OCC 240690a_100020603323_100000210991 [0,2,0,0,0,0|1,0,1]=4 12041 B16R0.5205 CCCSCCNC(=O)CCCC(=O)OCC 527a_100020603323_100000210991 [0,2,0,0,0,0|1,0,1]=4 12042 B16R0.5205 CCNC(=O)CCCC(=O)CCCCCCF 1458a_100000199580_100015922095 [0,2,0,0,0,0|1,0,1]=4 12043 B16R0.5205 CCNC(=O)CCCC(=O)CCCCCCO 1458a_100000199580_100000766143 [0,2,0,0,0,0|1,0,1]=4 12044 B16R0.5205 CCOC(=O)CCCC(=O)CCCCCC#N 1458a_100000210991_100009813376 [0,2,0,0,0,0|0,0,2]=4 12045 B16R0.5205 CCOC(=O)CCCC(=O)CCCCCCF 1458a_100000210991_100015922095 [0,2,0,0,0,0|0,0,1]=3 12046 B16R0.5205 CCOC(=O)CCCC(=O)CCCCCCO 1458a_100000210991_100000766143 [0,2,0,0,0,0|0,0,1]=3 12047 B16R0.5205 CCOC(=O)CCCC(=O)CCCCCCO 1458a_100011996774_100011215271 [0,2,0,0,0,0|0,0,1]=3 12048 B16R0.5205 CCOC(=O)CCCC(=O)CCCCCOC 1458a_100011935119_100011215271 [0,2,0,0,0,0|0,0,1]=3 12049 B16R0.5205 CCOC(=O)CCCC(=O)CCOCCOC 1458a_100000210991_100000695917 [0,2,0,0,0,0|1,0,1]=4 12050 B16R0.5205 CCOC(=O)CCCC(=O)CCOCCOC 1458a_100000745395_100011215271 [0,2,0,0,0,0|1,0,1]=4 12051 B16R0.5205 CCOC(=O)CCCC(=O)NCCCCCO 240690a_100000762737_100000210991 [0,2,0,0,0,0|1,0,1]=4 12052 B16R0.5205 CCOC(=O)CCNC(=O)CCCCCCO 188690a_100000746078_100011996774 [0,2,0,0,0,0|1,0,1]=4 12053 B16R0.5205 CCOC(=O)CCNC(=O)CCCCCOC 188690a_100000746078_100011935119 [0,2,0,0,0,0|1,0,1]=4 12054 B16R0.5205 CCOC(=O)NCCC(=O)CCCCCCO 1458a_100011996774_200011445536 [0,2,0,0,0,0|1,0,1]=4 12055 B16R0.5205 CCOC(=O)NCCC(=O)CCCCCOC 1458a_100011935119_200011445536 [0,2,0,0,0,0|1,0,1]=4 12056 B16R0.5205 CCOCCCNC(=O)CCCC(=O)OCC 11a_100000210961_100000210991 [0,2,0,0,0,0|1,0,1]=4 12057 B16R0.5205 CCOCCCNC(=O)CCCC(=O)OCC 1626a_100000210961_100000210991 [0,2,0,0,0,0|1,0,1]=4 12058 B16R0.5205 CCOCCCNC(=O)CCCC(=O)OCC 240690a_100000210961_100000210991 [0,2,0,0,0,0|1,0,1]=4 12059 B16R0.5205 CCOCCCNC(=O)CCCC(=O)OCC 527a_100000210961_100000210991 [0,2,0,0,0,0|1,0,1]=4 12060 B16R0.8609 CCCCCCC(C)(C)OCCC(=O)NCC 7a_200011995690_100000737597 [0,2,0,0,0,0|2,0,0]=4 12061 B16R0.8609 CCCCCCC(C)(C)OCCC(=O)OCC 7a_200011995690_100011206558 [0,2,0,0,0,0|1,0,0]=3 12062 B16R0.8609 CCOC(=O)CCOC(C)(C)CCCCCBr 7a_100010402123_100011206558 [0,2,0,0,0,0|2,0,0]=4 12063 B16R0.60 C=C(C)CCOCCCCCC(=O)OC(C)C 34a_100000764851_200010986244 [0,2,0,0,0,0|1,0,1]=4 12064 B16R0.60 C=C(C)CCSCCCCCC(=O)OC(C)C 62a_100000730704_200010986244 [0,2,0,0,0,0|1,0,1]=4 12065 B16R0.60 C=C(C)CCSCCCCCC(=O)OC(C)C 62a_200010986244_100000730704 [0,2,0,0,0,0|1,0,1]=4 12066 B16R0.60 CC(=O)CCOCCCCCC(=O)OC(C)C 34a_100000759926_200010986244 [0,2,0,0,0,0|1,0,1]=4 12067 B16R0.60 CC(=O)CCOCCCCCC(=O)OC(C)C 7a_100000759926_200010986244 [0,2,0,0,0,0|1,0,1]=4 12068 B16R0.60 CC(=O)CCSCCCCCC(=O)OC(C)C 62a_100000053229_200010986244 [0,2,0,0,0,0|1,0,1]=4 12069 B16R0.60 CC(=O)CCSCCCCCC(=O)OC(C)C 62a_200010986244_100000053229 [0,2,0,0,0,0|1,0,1]=4 12070 B16R0.60 CC(Br)CCOCCCCCC(=O)OC(C)C 34a_100009893172_200010986244 [0,2,0,0,0,0|1,0,0]=3 12071 B16R0.60 CC(C)CCCCCCNCC(=O)NC(C)C 2230a_100000211014_100000183996 [0,2,0,0,0,0|2,0,0]=4 12072 B16R0.60 CC(C)CCCCCCNCC(=O)NC(C)C 34a_100000211014_100000183996 [0,2,0,0,0,0|2,0,0]=4 12073 B16R0.60 CC(C)CCCCCCNCC(=O)OC(C)C 2230a_100000211014_100011215430 [0,2,0,0,0,0|1,0,0]=3 12074 B16R0.60 CC(C)CCCCCCNCC(=O)OC(C)C 34a_100000211014_100011215430 [0,2,0,0,0,0|1,0,0]=3 12075 B16R0.60 CC(C)CCCCCNCCC(=O)NC(C)C 2230a_100011290863_100000737564 [0,2,0,0,0,0|2,0,0]=4 12076 B16R0.60 CC(C)CCCCCNCCC(=O)OC(C)C 2230a_100011290863_100000760027 [0,2,0,0,0,0|1,0,0]=3 12077 B16R0.60 CC(C)CCCCCOCCC(=O)NC(C)C 7a_100011995859_100000737564 [0,2,0,0,0,0|2,0,0]=4 12078 B16R0.60 CC(C)CCCCCOCCC(=O)OC(C)C 7a_100011995859_100000760027 [0,2,0,0,0,0|1,0,0]=3 12079 B16R0.60 CC(C)CCCCCSCCC(=O)NC(C)C 62a_100000210682_100000737564 [0,2,0,0,0,0|2,0,0]=4 12080 B16R0.60 CC(C)CCCCCSCCC(=O)NC(C)C 62a_100000737564_100000210682 [0,2,0,0,0,0|2,0,0]=4 12081 B16R0.60 CC(C)CCCCCSCCC(=O)OC(C)C 62a_100000210682_100000760027 [0,2,0,0,0,0|1,0,0]=3 12082 B16R0.60 CC(C)CCCCCSCCC(=O)OC(C)C 62a_100000760027_100000210682 [0,2,0,0,0,0|1,0,0]=3 12083 B16R0.60 CC(C)CCCCCSCOC(=O)OC(C)C 62a_100000003507_100000210682 [0,2,0,0,0,0|2,0,0]=4 12084 B16R0.60 CC(C)CCCCCSCOC(=O)OC(C)C 62a_100000210682_100000003507 [0,2,0,0,0,0|2,0,0]=4 12085 B16R0.60 CC(C)CCOCCCCCC(=O)OC(C)C 34a_100000210254_200010986244 [0,2,0,0,0,0|1,0,0]=3 12086 B16R0.60 CC(C)CCOCCCCCC(=O)OC(C)C 7a_100000210254_200010986244 [0,2,0,0,0,0|1,0,0]=3 12087 B16R0.60 CC(C)CCSCCCCCC(=O)OC(C)C 62a_100000210312_200010986244 [0,2,0,0,0,0|1,0,0]=3 12088 B16R0.60 CC(C)CCSCCCCCC(=O)OC(C)C 62a_200010986244_100000210312 [0,2,0,0,0,0|1,0,0]=3 12089 B16R0.60 CC(C)COCCCNCCC(=O)OC(C)C 2230a_100000205972_100000760027 [0,2,0,0,0,0|2,0,0]=4 12090 B16R0.60 CC(C)NCCCCCOCC(=O)OC(C)C 34a_100011629493_100011215430 [0,2,0,0,0,0|2,0,0]=4 12091 B16R0.60 CC(C)OC(=O)CCCCCOCCC(F)F 34a_100103093639_200010986244 [0,2,0,0,0,0|2,0,0]=4 12092 B16R0.60 CC(C)OC(=O)CCCCCOCC[C@@H](C)N 34a_100000706166_200010986244 [0,2,0,0,0,0|1,0,0]=3 12093 B16R0.60 CC(C)OC(=O)CCCCCSCCN(C)C 62a_200010986244_100000755713 [0,2,0,0,0,0|2,0,0]=4 12094 B16R0.60 CC(C)OCSCCCCCC(=O)OC(C)C 62a_100000709892_200010986244 [0,2,0,0,0,0|2,0,0]=4 12095 B16R0.60 CC(C)OCSCCCCCC(=O)OC(C)C 62a_200010986244_100000709892 [0,2,0,0,0,0|2,0,0]=4 12096 B16R0.60 CC(O)CCNCCCCCC(=O)OC(C)C 2230a_200000755665_200010986244 [0,2,0,0,0,0|1,0,0]=3 12097 B16R0.60 CC(O)CCSCCCCCC(=O)OC(C)C 62a_100012276601_200010986244 [0,2,0,0,0,0|1,0,0]=3 12098 B16R0.60 CC(O)CCSCCCCCC(=O)OC(C)C 62a_200010986244_100012276601 [0,2,0,0,0,0|1,0,0]=3 12099 B16R0.67 CC(C)C(C)C(=O)CCCCCCCCCO 1458a_100000755409_100009813782 [0,2,0,0,0,0|2,0,0]=4 12100 B16R0.67 CC(C)N(C)C(=O)CCCCCCCCCF 11a_200000211004_200009909015 [0,2,0,0,0,0|2,0,0]=4 12101 B16R0.67 CC(C)N(C)C(=O)CCCCCCCCCF 240690a_200000211004_200009909015 [0,2,0,0,0,0|2,0,0]=4 12102 B16R0.67 CC(C)N(C)C(=O)CCCCCCCCCF 527a_200000211004_200009909015 [0,2,0,0,0,0|2,0,0]=4 12103 B16R0.67 CC(C)N(C)C(=O)CCCCCCCCCO 240690a_200000211004_100000032657 [0,2,0,0,0,0|2,0,0]=4 12104 B16R0.67 CC(C)[C@@H](O)C(=O)CCCCCCCCCO 1458a_100000691806_100009813782 [0,2,0,0,0,0|2,0,0]=4 12105 B16R0.67 CCCCCCCCCCC(=O)C(=O)N(C)C 1458a_100011218876_100000210319 [0,2,0,0,0,0|2,0,0]=4 12106 B16R0.67 CCCCCCCCCCC(=O)C(C)C(=O)C 1458a_100000210375_100000179758 [0,2,0,0,0,0|1,0,1]=4 12107 B16R0.67 CCCCCCCCCCC(=O)N(C)C(C)C 11a_200000211004_100000210375 [0,2,0,0,0,0|1,0,0]=3 12108 B16R0.67 CCCCCCCCCCC(=O)N(C)C(C)C 1626a_200000211004_100000210375 [0,2,0,0,0,0|1,0,0]=3 12109 B16R0.67 CCCCCCCCCCC(=O)N(C)C(C)C 240690a_200000211004_100000210375 [0,2,0,0,0,0|1,0,0]=3 12110 B16R0.67 CCCCCCCCCCC(=O)[C@H](C)N(C)C 1458a_100009822176_100000210319 [0,2,0,0,0,0|2,0,0]=4 12111 B16R0.67 CCCCCCCCCCC(=O)[C@H](O)C(C)C 1458a_100000691806_100000210319 [0,2,0,0,0,0|1,0,0]=3 12112 B16R0.67 CCCCCCCCCNC(=O)C(C)C(C)C 11a_100000212291_100000755409 [0,2,0,0,0,0|2,0,0]=4 12113 B16R0.67 CCCCCCCCCNC(=O)C(C)C(C)C 1626a_100000212291_100000755409 [0,2,0,0,0,0|2,0,0]=4 12114 B16R0.67 CCCCCCCCCNC(=O)C(C)C(C)C 240690a_100000212291_100000755409 [0,2,0,0,0,0|2,0,0]=4 12115 B16R0.67 CCCCCCCCCNC(=O)C(C)C(C)C 527a_100000212291_100000755409 [0,2,0,0,0,0|2,0,0]=4 12116 B16R0.67 CCCCCCCCCNC(=O)N(C)C(C)C 2708a_100000212291_200000211004 [0,2,0,0,0,0|2,0,0]=4 12117 B16R0.67 CCCCCCCCCNC(=O)N(C)C(C)C 273464a_100000212291_200000211004 [0,2,0,0,0,0|2,0,0]=4 12118 B16R0.67 CCCCCCCCCNC(=O)[C@H](O)C(C)C 240690a_100000212291_100000691806 [0,2,0,0,0,0|2,0,0]=4 12119 B16R0.67 CCCCCCCCNCC(=O)N(C)C(C)C 2230a_100000229939_100000230190 [0,2,0,0,0,0|2,0,0]=4 12120 B16R0.67 CCCCCCCCNCC(=O)N(C)C(C)C 34a_100000229939_100000230190 [0,2,0,0,0,0|2,0,0]=4 12121 B16R0.67 CCCCCCCCOCC(=O)N(C)C(C)C 11a_200000211004_100000759886 [0,2,0,0,0,0|2,0,0]=4 12122 B16R0.67 CCCCCCCCOCC(=O)N(C)C(C)C 1626a_200000211004_100000759886 [0,2,0,0,0,0|2,0,0]=4 12123 B16R0.67 CCCCCCCCOCC(=O)N(C)C(C)C 240690a_200000211004_100000759886 [0,2,0,0,0,0|2,0,0]=4 12124 B16R0.67 CCCCCCCCOCC(=O)N(C)C(C)C 34a_100000210232_100000230190 [0,2,0,0,0,0|2,0,0]=4 12125 B16R0.67 CCCCCCCCOCC(=O)N(C)C(C)C 527a_200000211004_100000759886 [0,2,0,0,0,0|2,0,0]=4 12126 B16R0.67 CCCCCCCCOCC(=O)N(C)C(C)C 7a_100000210232_100000230190 [0,2,0,0,0,0|2,0,0]=4 12127 B16R0.67 CCCCCCCCSCC(=O)N(C)C(C)C 62a_100000210759_100000230190 [0,2,0,0,0,0|2,0,0]=4 12128 B16R0.67 CCCCCCCCSCC(=O)N(C)C(C)C 62a_100000230190_100000210317 [0,2,0,0,0,0|2,0,0]=4 12129 B16R0.110 CC(C)OC(=O)CCC(=O)CCCCCCO 1458a_100011996774_100000760027 [0,2,0,0,0,0|1,0,1]=4 12130 B16R0.110 CCCCCCCC(=O)CCC(=O)NC(C)C 1458a_100000211969_100000737564 [0,2,0,0,0,0|1,0,1]=4 12131 B16R0.110 CCCCCCCC(=O)CCC(=O)OC(C)C 1458a_100000211969_100000760027 [0,2,0,0,0,0|0,0,1]=3 12132 B16R0.110 CCCCCCCC(=O)COC(=O)OC(C)C 1458a_100000211969_100000003507 [0,2,0,0,0,0|1,0,1]=4 12133 B16R0.110 CCCCCCCC(C)NCC(=O)NC(C)C 2230a_100000168517_200011218727 [0,2,0,0,0,0|2,0,0]=4 12134 B16R0.110 CCCCCCCC(C)NCC(=O)NC(C)C 270004a_100000168517_100000210596 [0,2,0,0,0,0|2,0,0]=4 12135 B16R0.110 CCCCCCCC(C)OCC(=O)NC(C)C 34a_200011215852_100000183996 [0,2,0,0,0,0|2,0,0]=4 12136 B16R0.110 CCCCCCCC(C)OCC(=O)NC(C)C 7a_200011215852_100000183996 [0,2,0,0,0,0|2,0,0]=4 12137 B16R0.110 CCCCCCCC(C)OCC(=O)OC(C)C 34a_200011215852_100011215430 [0,2,0,0,0,0|1,0,0]=3 12138 B16R0.110 CCCCCCCC(C)OCC(=O)OC(C)C 7a_200011215852_100011215430 [0,2,0,0,0,0|1,0,0]=3 12139 B16R0.110 CCCCCCCC(C)SCC(=O)NC(C)C 62a_100000183996_200011218727 [0,2,0,0,0,0|2,0,0]=4 12140 B16R0.110 CCCCCCCC(C)SCC(=O)NC(C)C 62a_200011218727_100000183996 [0,2,0,0,0,0|2,0,0]=4 12141 B16R0.110 CCCCCCCC(C)SCC(=O)OC(C)C 62a_100011215430_200011218727 [0,2,0,0,0,0|1,0,0]=3 12142 B16R0.110 CCCCCCCC(C)SCC(=O)OC(C)C 62a_200011218727_100011215430 [0,2,0,0,0,0|1,0,0]=3 12143 B16R0.110 CCCCCCCN(C)CCC(=O)NC(C)C 2230a_100000228206_100000737564 [0,2,0,0,0,0|2,0,0]=4 12144 B16R0.110 CCCCCCCN(C)CCC(=O)NC(C)C 269982a_100000228206_100000737564 [0,2,0,0,0,0|2,0,0]=4 12145 B16R0.110 CCCCCCCN(C)CCC(=O)OC(C)C 2230a_100000228206_100000760027 [0,2,0,0,0,0|1,0,0]=3 12146 B16R0.110 CCCCCCCN(C)CCC(=O)OC(C)C 269982a_100000228206_100000760027 [0,2,0,0,0,0|1,0,0]=3 12147 B16R0.110 CCCCCCCN(C)COC(=O)OC(C)C 269982a_100000228206_100010125566 [0,2,0,0,0,0|2,0,0]=4 12148 B16R0.110 COCCCCCC(=O)CCC(=O)OC(C)C 1458a_100011935119_100000760027 [0,2,0,0,0,0|1,0,1]=4 12149 B16R0.263 CC(C)OC(=O)CCCCCNC[C@@H](F)CO 34a_100015665980_200010986244 [0,2,0,0,0,0|2,0,0]=4 12150 B16R0.263 CC(C)OC(=O)CCCCCNC[C@H](O)CO 2230a_100020644852_200010986244 [0,2,0,0,0,0|2,0,0]=4 12151 B16R0.263 CC(C)OC(=O)CCCCCOCC(Cl)CCl 34a_100000033668_200010986244 [0,2,0,0,0,0|2,0,0]=4 12152 B16R0.263 CC(C)OC(=O)CCCCCOC[C@H](F)CN 34a_100015665980_200010986244 [0,2,0,0,0,0|2,0,0]=4 12153 B16R0.263 CC(C)OC(=O)CCCCCSCC(O)CO 62a_100011219619_200010986244 [0,2,0,0,0,0|2,0,0]=4 12154 B16R0.263 CC(C)OC(=O)CCCCCSCC(O)CO 62a_200010986244_100011219619 [0,2,0,0,0,0|2,0,0]=4 12155 B16R0.263 CC(C)OC(=O)CCCCCSC[C@@H](C)CO 62a_100000059175_200010986244 [0,2,0,0,0,0|2,0,0]=4 12156 B16R0.263 CC(C)OC(=O)CCCCCSC[C@@H](C)CO 62a_200010986244_100000059175 [0,2,0,0,0,0|2,0,0]=4 12157 B16R0.263 CC(C)OC(=O)CCCCCSC[C@@H](O)CF 62a_100015614560_200010986244 [0,2,0,0,0,0|2,0,0]=4 12158 B16R0.263 CC(C)OC(=O)CCCCCSC[C@@H](O)CF 62a_200010986244_100015614560 [0,2,0,0,0,0|2,0,0]=4 12159 B16R0.263 CC(C)OC(=O)CCCCCSC[C@@H](O)CO 62a_100009815848_200010986244 [0,2,0,0,0,0|2,0,0]=4 12160 B16R0.263 CC(C)OC(=O)CCCCCSC[C@@H](O)CO 62a_200010986244_100009815848 [0,2,0,0,0,0|2,0,0]=4 12161 B16R0.263 CC(CN)COCCCCCC(=O)OC(C)C 34a_100000744482_200010986244 [0,2,0,0,0,0|2,0,0]=4 12162 B16R0.263 CC(CO)CNCCCCCC(=O)OC(C)C 34a_100000744482_200010986244 [0,2,0,0,0,0|2,0,0]=4 12163 B16R0.263 CCC(=O)COCCCCCC(=O)OC(C)C 34a_100000725409_200010986244 [0,2,0,0,0,0|1,0,1]=4 12164 B16R0.263 CCC(=O)CSCCCCCC(=O)OC(C)C 62a_100000747405_200010986244 [0,2,0,0,0,0|1,0,1]=4 12165 B16R0.263 CCC(=O)CSCCCCCC(=O)OC(C)C 62a_200010986244_100000747405 [0,2,0,0,0,0|1,0,1]=4 12166 B16R0.263 CCC(C)CCCCCOCC(=O)NC(C)C 7a_200000035636_100000183996 [0,2,0,0,0,0|2,0,0]=4 12167 B16R0.263 CCC(C)CCCCCOCC(=O)OC(C)C 7a_200000035636_100011215430 [0,2,0,0,0,0|1,0,0]=3 12168 B16R0.263 CCC(C)CNCCCCCC(=O)OC(C)C 2230a_100020588543_200010986244 [0,2,0,0,0,0|1,0,0]=3 12169 B16R0.263 CCC(C)CSCCCCCC(=O)OC(C)C 62a_100000748023_200010986244 [0,2,0,0,0,0|1,0,0]=3 12170 B16R0.263 CCC(C)CSCCCCCC(=O)OC(C)C 62a_200010986244_100000748023 [0,2,0,0,0,0|1,0,0]=3 12171 B16R0.263 CCC(O)CNCCCCCC(=O)OC(C)C 2230a_100011218483_200010986244 [0,2,0,0,0,0|1,0,0]=3 12172 B16R0.263 CCC(O)CSCCCCCC(=O)OC(C)C 62a_100011218378_200010986244 [0,2,0,0,0,0|1,0,0]=3 12173 B16R0.263 CCC(O)CSCCCCCC(=O)OC(C)C 62a_200010986244_100011218378 [0,2,0,0,0,0|1,0,0]=3 12174 B16R0.263 CC[C@H](C)COCCCCCC(=O)OC(C)C 7a_100009816381_200010986244 [0,2,0,0,0,0|1,0,0]=3 12175 B16R0.263 CC[C@H](C)CSCCCCCC(=O)OC(C)C 62a_100009816398_200010986244 [0,2,0,0,0,0|1,0,0]=3 12176 B16R0.263 CC[C@H](C)CSCCCCCC(=O)OC(C)C 62a_200010986244_100009816398 [0,2,0,0,0,0|1,0,0]=3 12177 B16R0.263 COC(C)COCCCCCC(=O)OC(C)C 34a_100000690652_200010986244 [0,2,0,0,0,0|2,0,0]=4 12178 B16R0.263 CO[C@H](C)CNCCCCCC(=O)OC(C)C 2230a_100020591295_200010986244 [0,2,0,0,0,0|2,0,0]=4 12179 B16R0.300 CC(C)OC(=O)CC(=O)CCCCCCCO 1458a_100011219782_100011215430 [0,2,0,0,0,0|1,0,1]=4 12180 B16R0.300 CCCCCCCCC(=O)CC(=O)NC(C)C 1458a_100000210188_100000183996 [0,2,0,0,0,0|1,0,1]=4 12181 B16R0.300 CCCCCCCCC(=O)CC(=O)OC(C)C 1458a_100000210188_100011215430 [0,2,0,0,0,0|0,0,1]=3 12182 B16R0.300 CCCCCCCCN(C)CC(=O)NC(C)C 2230a_100000168146_100000210759 [0,2,0,0,0,0|2,0,0]=4 12183 B16R0.300 CCCCCCCCN(C)CC(=O)NC(C)C 2230a_100000207567_100000183996 [0,2,0,0,0,0|2,0,0]=4 12184 B16R0.300 CCCCCCCCN(C)CC(=O)NC(C)C 269982a_100000168146_100000210759 [0,2,0,0,0,0|2,0,0]=4 12185 B16R0.300 CCCCCCCCN(C)CC(=O)NC(C)C 269982a_100000207567_100000183996 [0,2,0,0,0,0|2,0,0]=4 12186 B16R0.300 CCCCCCCCN(C)CC(=O)OC(C)C 2230a_100000207567_100011215430 [0,2,0,0,0,0|1,0,0]=3 12187 B16R0.300 CCCCCCCCN(C)CC(=O)OC(C)C 269982a_100000207567_100011215430 [0,2,0,0,0,0|1,0,0]=3 12188 B16R0.300 CCCCCCCOC(C)OC(=O)OC(C)C 7a_100000210272_100000067433 [0,2,0,0,0,0|2,0,0]=4 12189 B16R0.300 CCCCCCCSC(C)OC(=O)OC(C)C 62a_100000067433_100000210316 [0,2,0,0,0,0|2,0,0]=4 12190 B16R0.300 CCCCCCCSC(C)OC(=O)OC(C)C 62a_100000210614_100000067433 [0,2,0,0,0,0|2,0,0]=4 12191 B16R0.302 C#CCCCCCCCOCC(=O)OC(C)C 34a_100000054614_100011215430 [0,2,0,0,0,0|0,0,2]=4 12192 B16R0.302 C#CCCCCCCCOCC(=O)OC(C)C 7a_100000054614_100011215430 [0,2,0,0,0,0|0,0,2]=4 12193 B16R0.302 C#CCCCCCCCSCC(=O)OC(C)C 62a_100011215430_100153394163 [0,2,0,0,0,0|0,0,2]=4 12194 B16R0.302 C#CCCCCCCCSCC(=O)OC(C)C 62a_100153394163_100011215430 [0,2,0,0,0,0|0,0,2]=4 12195 B16R0.302 C#CCCCCCCOCCC(=O)OC(C)C 7a_100011217361_100000760027 [0,2,0,0,0,0|0,0,2]=4 12196 B16R0.302 C#CCCCCCCSCCC(=O)OC(C)C 62a_100000760027_100012276617 [0,2,0,0,0,0|0,0,2]=4 12197 B16R0.302 C#CCCCCCCSCCC(=O)OC(C)C 62a_100012276617_100000760027 [0,2,0,0,0,0|0,0,2]=4 12198 B16R0.302 C#CCCCNCCCCCC(=O)OC(C)C 34a_100000718082_200010986244 [0,2,0,0,0,0|0,0,2]=4 12199 B16R0.302 C#CCCCOCCCCCC(=O)OC(C)C 34a_100000215630_200010986244 [0,2,0,0,0,0|0,0,2]=4 12200 B16R0.302 C#CCCCOCCCCCC(=O)OC(C)C 7a_100000215630_200010986244 [0,2,0,0,0,0|0,0,2]=4 12201 B16R0.302 C#CCCCSCCCCCC(=O)OC(C)C 62a_100011215417_200010986244 [0,2,0,0,0,0|0,0,2]=4 12202 B16R0.302 C#CCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100011215417 [0,2,0,0,0,0|0,0,2]=4 12203 B16R0.302 C/C=C/CCOCCCCCC(=O)OC(C)C 34a_100016278192_200010986244 [0,2,0,0,0,0|0,0,2]=4 12204 B16R0.302 C=CCCCCCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100009814027 [0,2,0,0,0,0|1,0,1]=4 12205 B16R0.302 C=CCCCCCCCOCC(=O)OC(C)C 34a_100000730831_100011215430 [0,2,0,0,0,0|0,0,2]=4 12206 B16R0.302 C=CCCCCCCCOCC(=O)OC(C)C 7a_100000730831_100011215430 [0,2,0,0,0,0|0,0,2]=4 12207 B16R0.302 C=CCCCCCCCSCC(=O)OC(C)C 62a_100011215430_100012355270 [0,2,0,0,0,0|0,0,2]=4 12208 B16R0.302 C=CCCCCCCCSCC(=O)OC(C)C 62a_100012355270_100011215430 [0,2,0,0,0,0|0,0,2]=4 12209 B16R0.302 C=CCCCCCCOCCC(=O)OC(C)C 7a_200011216477_100000760027 [0,2,0,0,0,0|0,0,2]=4 12210 B16R0.302 C=CCCCCCCSCCC(=O)OC(C)C 62a_100000760027_100011215473 [0,2,0,0,0,0|0,0,2]=4 12211 B16R0.302 C=CCCCCCCSCCC(=O)OC(C)C 62a_100011215473_100000760027 [0,2,0,0,0,0|0,0,2]=4 12212 B16R0.302 C=CCCCNCCCCCC(=O)OC(C)C 2230a_100000700776_200010986244 [0,2,0,0,0,0|0,0,2]=4 12213 B16R0.302 C=CCCCNCCCCCC(=O)OC(C)C 34a_100000700776_200010986244 [0,2,0,0,0,0|0,0,2]=4 12214 B16R0.302 C=CCCCOCCCCCC(=O)OC(C)C 34a_100000758997_200010986244 [0,2,0,0,0,0|0,0,2]=4 12215 B16R0.302 C=CCCCOCCCCCC(=O)OC(C)C 7a_100000758997_200010986244 [0,2,0,0,0,0|0,0,2]=4 12216 B16R0.302 C=CCCCSCCCCCC(=O)OC(C)C 62a_100011713584_200010986244 [0,2,0,0,0,0|0,0,2]=4 12217 B16R0.302 C=CCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000757094 [0,2,0,0,0,0|0,0,2]=4 12218 B16R0.302 CC#CCCOCCCCCC(=O)OC(C)C 34a_100000750427_200010986244 [0,2,0,0,0,0|0,0,2]=4 12219 B16R0.302 CC(=CC(=O)CCCCCCCCCCO)C 1458a_100000211388_100009813290 [0,2,0,0,0,0|1,0,1]=4 12220 B16R0.302 CC(=CC(=O)CCCCCCCCCCO)Cl 1458a_200042562850_100009813290 [0,2,0,0,0,0|1,0,1]=4 12221 B16R0.302 CC(=CC(=O)CCCCCCCCCCO)I 1458a_100025716642_100009813290 [0,2,0,0,0,0|1,0,1]=4 12222 B16R0.302 CC(C)CC(=O)CCCCCCCCCCO 1458a_100000210554_100009813290 [0,2,0,0,0,0|1,0,0]=3 12223 B16R0.302 CC(C)CC(=O)NCCCCCCCCCO 240690a_100000078944_100000210554 [0,2,0,0,0,0|2,0,0]=4 12224 B16R0.302 CC(C)NC(=O)CCCCCCCCCCO 240690a_100138425928_200000016029 [0,2,0,0,0,0|1,0,0]=3 12225 B16R0.302 CC(C)NC(=O)CCNCCCCCCCO 2230a_100011996573_100000737564 [0,2,0,0,0,0|2,0,0]=4 12226 B16R0.302 CC(C)NC(=O)CCOCCCCCCCBr 7a_100000760002_100000737564 [0,2,0,0,0,0|2,0,0]=4 12227 B16R0.302 CC(C)NC(=O)CCSCCCCCCCO 62a_100000737564_100000760002 [0,2,0,0,0,0|2,0,0]=4 12228 B16R0.302 CC(C)NC(=O)CCSCCCCCCCO 62a_100000760002_100000737564 [0,2,0,0,0,0|2,0,0]=4 12229 B16R0.302 CC(C)NC(=O)CNCCCCCCCCO 2230a_100000168517_100000033203 [0,2,0,0,0,0|2,0,0]=4 12230 B16R0.302 CC(C)NC(=O)CNCCCCCCCCO 2230a_102515433106_100000183996 [0,2,0,0,0,0|2,0,0]=4 12231 B16R0.302 CC(C)NC(=O)CNCCCCCCCCO 34a_102515433106_100000183996 [0,2,0,0,0,0|2,0,0]=4 12232 B16R0.302 CC(C)NC(=O)COCCCCCCCCBr 34a_100009813846_100000183996 [0,2,0,0,0,0|2,0,0]=4 12233 B16R0.302 CC(C)NC(=O)COCCCCCCCCBr 7a_100009813846_100000183996 [0,2,0,0,0,0|2,0,0]=4 12234 B16R0.302 CC(C)NC(=O)COCCCCCCCCCl 34a_100000033203_100000183996 [0,2,0,0,0,0|2,0,0]=4 12235 B16R0.302 CC(C)NC(=O)COCCCCCCCCCl 7a_100000033203_100000183996 [0,2,0,0,0,0|2,0,0]=4 12236 B16R0.302 CC(C)NC(=O)COCCCCCCCCN 34a_102515433106_100000183996 [0,2,0,0,0,0|2,0,0]=4 12237 B16R0.302 CC(C)NC(=O)CSCCCCCCCCO 62a_100000033203_100000183996 [0,2,0,0,0,0|2,0,0]=4 12238 B16R0.302 CC(C)NC(=O)CSCCCCCCCCO 62a_100000183996_100000033203 [0,2,0,0,0,0|2,0,0]=4 12239 B16R0.302 CC(C)NC(=O)NCCCCCCCCCO 2708a_100000078944_100138425928 [0,2,0,0,0,0|2,0,0]=4 12240 B16R0.302 CC(C)NC(=O)NCCCCCCCCCO 2708a_100138425928_100000078944 [0,2,0,0,0,0|2,0,0]=4 12241 B16R0.302 CC(C)NC(=O)NCCCCCCCCCO 273464a_100138425928_100000078944 [0,2,0,0,0,0|2,0,0]=4 12242 B16R0.302 CC(C)NC(=O)NCCCCCCCCCO 512a_100000078944_100138425928 [0,2,0,0,0,0|2,0,0]=4 12243 B16R0.302 CC(C)NC(=O)NCCCCCCCCCO 512a_100138425928_100000078944 [0,2,0,0,0,0|2,0,0]=4 12244 B16R0.302 CC(C)OC(=O)CCCCCNCCCCO 2230a_100000750430_200010986244 [0,2,0,0,0,0|1,0,0]=3 12245 B16R0.302 CC(C)OC(=O)CCCCCNCCCCO 34a_100000750430_200010986244 [0,2,0,0,0,0|1,0,0]=3 12246 B16R0.302 CC(C)OC(=O)CCCCCOCCCCBr 34a_100011216708_200010986244 [0,2,0,0,0,0|1,0,0]=3 12247 B16R0.302 CC(C)OC(=O)CCCCCOCCCCCl 34a_100000210776_200010986244 [0,2,0,0,0,0|1,0,0]=3 12248 B16R0.302 CC(C)OC(=O)CCCCCOCCCCCl 7a_100000210776_200010986244 [0,2,0,0,0,0|1,0,0]=3 12249 B16R0.302 CC(C)OC(=O)CCCCCOCCCCF 34a_100011995726_200010986244 [0,2,0,0,0,0|1,0,0]=3 12250 B16R0.302 CC(C)OC(=O)CCCCCOCCCCF 7a_100011995726_200010986244 [0,2,0,0,0,0|1,0,0]=3 12251 B16R0.302 CC(C)OC(=O)CCCCCOCCCCI 34a_200012148704_200010986244 [0,2,0,0,0,0|1,0,0]=3 12252 B16R0.302 CC(C)OC(=O)CCCCCOCCCCN 34a_100000750430_200010986244 [0,2,0,0,0,0|1,0,0]=3 12253 B16R0.302 CC(C)OC(=O)CCCCCSCCCC#N 62a_100000687738_200010986244 [0,2,0,0,0,0|1,0,1]=4 12254 B16R0.302 CC(C)OC(=O)CCCCCSCCCC#N 62a_200010986244_100000687738 [0,2,0,0,0,0|1,0,1]=4 12255 B16R0.302 CC(C)OC(=O)CCCCCSCCCC=O 62a_200010986244_200011292268 [0,2,0,0,0,0|1,0,1]=4 12256 B16R0.302 CC(C)OC(=O)CCCCCSCCCC=O 62a_200011292268_200010986244 [0,2,0,0,0,0|1,0,1]=4 12257 B16R0.302 CC(C)OC(=O)CCCCCSCCCCF 62a_100000729493_200010986244 [0,2,0,0,0,0|1,0,0]=3 12258 B16R0.302 CC(C)OC(=O)CCCCCSCCCCF 62a_200010986244_100000729493 [0,2,0,0,0,0|1,0,0]=3 12259 B16R0.302 CC(C)OC(=O)CCCCCSCCCCO 62a_100000210776_200010986244 [0,2,0,0,0,0|1,0,0]=3 12260 B16R0.302 CC(C)OC(=O)CCCCCSCCCCO 62a_200010986244_100000210776 [0,2,0,0,0,0|1,0,0]=3 12261 B16R0.302 CC(C)OC(=O)CCNCCCCCCCO 2230a_100011996573_100000760027 [0,2,0,0,0,0|1,0,0]=3 12262 B16R0.302 CC(C)OC(=O)CCNCCCOCCCO 2230a_100011310245_100000760027 [0,2,0,0,0,0|2,0,0]=4 12263 B16R0.302 CC(C)OC(=O)CCOCCCCCCCBr 7a_100000760002_100000760027 [0,2,0,0,0,0|1,0,0]=3 12264 B16R0.302 CC(C)OC(=O)CCSCCCCCCC#N 62a_100000760027_100009813337 [0,2,0,0,0,0|1,0,1]=4 12265 B16R0.302 CC(C)OC(=O)CCSCCCCCCC#N 62a_100009813337_100000760027 [0,2,0,0,0,0|1,0,1]=4 12266 B16R0.302 CC(C)OC(=O)CCSCCCCCCCO 62a_100000760002_100000760027 [0,2,0,0,0,0|1,0,0]=3 12267 B16R0.302 CC(C)OC(=O)CCSCCCCCCCO 62a_100000760027_100000760002 [0,2,0,0,0,0|1,0,0]=3 12268 B16R0.302 CC(C)OC(=O)CNCCCCCCCCO 2230a_102515433106_100011215430 [0,2,0,0,0,0|1,0,0]=3 12269 B16R0.302 CC(C)OC(=O)CNCCCCCCCCO 34a_102515433106_100011215430 [0,2,0,0,0,0|1,0,0]=3 12270 B16R0.302 CC(C)OC(=O)COCCCCCCCCBr 34a_100009813846_100011215430 [0,2,0,0,0,0|1,0,0]=3 12271 B16R0.302 CC(C)OC(=O)COCCCCCCCCBr 7a_100009813846_100011215430 [0,2,0,0,0,0|1,0,0]=3 12272 B16R0.302 CC(C)OC(=O)COCCCCCCCCCl 34a_100000033203_100011215430 [0,2,0,0,0,0|1,0,0]=3 12273 B16R0.302 CC(C)OC(=O)COCCCCCCCCCl 7a_100000033203_100011215430 [0,2,0,0,0,0|1,0,0]=3 12274 B16R0.302 CC(C)OC(=O)COCCCCCCCCN 34a_102515433106_100011215430 [0,2,0,0,0,0|1,0,0]=3 12275 B16R0.302 CC(C)OC(=O)COCCCCCNCCN 34a_103619048469_100011215430 [0,2,0,0,0,0|2,0,0]=4 12276 B16R0.302 CC(C)OC(=O)CSCCCCCCCCO 62a_100000033203_100011215430 [0,2,0,0,0,0|1,0,0]=3 12277 B16R0.302 CC(C)OC(=O)CSCCCCCCCCO 62a_100011215430_100000033203 [0,2,0,0,0,0|1,0,0]=3 12278 B16R0.302 CC(C)OC(=O)OCSCCCCCCCO 62a_100000003507_100000760002 [0,2,0,0,0,0|2,0,0]=4 12279 B16R0.302 CC(C)OC(=O)OCSCCCCCCCO 62a_100000760002_100000003507 [0,2,0,0,0,0|2,0,0]=4 12280 B16R0.302 CC/C=C\CCCCCOCC(=O)OC(C)C 34a_100016268722_100011215430 [0,2,0,0,0,0|0,0,2]=4 12281 B16R0.302 CC/C=C\CCCCCOCC(=O)OC(C)C 7a_100016268722_100011215430 [0,2,0,0,0,0|0,0,2]=4 12282 B16R0.302 CC/C=C\CCCCOCCC(=O)OC(C)C 7a_100016287862_100000760027 [0,2,0,0,0,0|0,0,2]=4 12283 B16R0.302 CC/C=C\COCCCCCC(=O)OC(C)C 34a_100016268518_200010986244 [0,2,0,0,0,0|0,0,2]=4 12284 B16R0.302 CC/C=C\CSCCCCCC(=O)OC(C)C 62a_100103147603_200010986244 [0,2,0,0,0,0|0,0,2]=4 12285 B16R0.302 CC/C=C\CSCCCCCC(=O)OC(C)C 62a_200010986244_100103147603 [0,2,0,0,0,0|0,0,2]=4 12286 B16R0.302 CCC#CCOCCCCCC(=O)OC(C)C 34a_100000032950_200010986244 [0,2,0,0,0,0|0,0,2]=4 12287 B16R0.302 CCC#CCSCCCCCC(=O)OC(C)C 62a_100009813939_200010986244 [0,2,0,0,0,0|0,0,2]=4 12288 B16R0.302 CCC#CCSCCCCCC(=O)OC(C)C 62a_200010986244_100009813939 [0,2,0,0,0,0|0,0,2]=4 12289 B16R0.302 CCCC/C=C\CCOCCC(=O)OC(C)C 7a_200016286491_100000760027 [0,2,0,0,0,0|0,0,2]=4 12290 B16R0.302 CCCCC#CCCCSCC(=O)OC(C)C 62a_100011215430_200000047210 [0,2,0,0,0,0|0,0,2]=4 12291 B16R0.302 CCCCC#CCCCSCC(=O)OC(C)C 62a_200000047210_100011215430 [0,2,0,0,0,0|0,0,2]=4 12292 B16R0.302 CCCCC#CCCOCCC(=O)OC(C)C 7a_100000037610_100000760027 [0,2,0,0,0,0|0,0,2]=4 12293 B16R0.302 CCCCC/C=C/COCCC(=O)OC(C)C 7a_100016258190_100000760027 [0,2,0,0,0,0|0,0,2]=4 12294 B16R0.302 CCCCC/C=C\CCOCC(=O)OC(C)C 34a_100016277358_100011215430 [0,2,0,0,0,0|0,0,2]=4 12295 B16R0.302 CCCCC/C=C\CCOCC(=O)OC(C)C 7a_100016277358_100011215430 [0,2,0,0,0,0|0,0,2]=4 12296 B16R0.302 CCCCCC#CCCOCC(=O)OC(C)C 34a_200000042877_100011215430 [0,2,0,0,0,0|0,0,2]=4 12297 B16R0.302 CCCCCC#CCCOCC(=O)OC(C)C 7a_200000042877_100011215430 [0,2,0,0,0,0|0,0,2]=4 12298 B16R0.302 CCCCCC#CCOCCC(=O)OC(C)C 7a_200000033628_100000760027 [0,2,0,0,0,0|0,0,2]=4 12299 B16R0.302 CCCCCC#CCSCCC(=O)OC(C)C 62a_100000760027_100009816472 [0,2,0,0,0,0|0,0,2]=4 12300 B16R0.302 CCCCCC#CCSCCC(=O)OC(C)C 62a_100009816472_100000760027 [0,2,0,0,0,0|0,0,2]=4 12301 B16R0.302 CCCCCC/C=C/COCC(=O)OC(C)C 34a_200016276170_100011215430 [0,2,0,0,0,0|0,0,2]=4 12302 B16R0.302 CCCCCC/C=C/COCC(=O)OC(C)C 7a_200016276170_100011215430 [0,2,0,0,0,0|0,0,2]=4 12303 B16R0.302 CCCCCCC#CCOCC(=O)OC(C)C 34a_200000037284_100011215430 [0,2,0,0,0,0|0,0,2]=4 12304 B16R0.302 CCCCCCC#CCOCC(=O)OC(C)C 7a_200000037284_100011215430 [0,2,0,0,0,0|0,0,2]=4 12305 B16R0.302 CCCCCCCCCC=CC(=O)CC(C)O 1458a_200015352897_100011218427 [0,2,0,0,0,0|1,0,1]=4 12306 B16R0.302 CCCCCCCCCC=CC(=O)NC(C)C 11a_100138425928_200015352897 [0,2,0,0,0,0|1,0,1]=4 12307 B16R0.302 CCCCCCCCCC=CC(=O)NC(C)C 1626a_100138425928_200015352897 [0,2,0,0,0,0|1,0,1]=4 12308 B16R0.302 CCCCCCCCCC=CC(=O)NC(C)C 240690a_100138425928_200015352897 [0,2,0,0,0,0|1,0,1]=4 12309 B16R0.302 CCCCCCCCCCCC(=O)CC(C)O 1458a_100000210736_100011218427 [0,2,0,0,0,0|1,0,0]=3 12310 B16R0.302 CCCCCCCCCCCC(=O)CN(C)C 1458a_100000750896_100011215454 [0,2,0,0,0,0|2,0,0]=4 12311 B16R0.302 CCCCCCCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100011215454 [0,2,0,0,0,0|1,0,0]=3 12312 B16R0.302 CCCCCCCCCCCC(=O)C[S+](C)C 1458a_200159257847_100011215454 [0,2,0,0,0,0|2,0,0]=4 12313 B16R0.302 CCCCCCCCCCCC(=O)NC(C)C 11a_100138425928_100000210736 [0,2,0,0,0,0|1,0,0]=3 12314 B16R0.302 CCCCCCCCCCCC(=O)NC(C)C 1626a_100138425928_100000210736 [0,2,0,0,0,0|1,0,0]=3 12315 B16R0.302 CCCCCCCCCCCC(=O)NC(C)C 240690a_100138425928_100000210736 [0,2,0,0,0,0|1,0,0]=3 12316 B16R0.302 CCCCCCCCCCNC(=O)C=C(C)C 11a_100000684558_100000211388 [0,2,0,0,0,0|1,0,1]=4 12317 B16R0.302 CCCCCCCCCCNC(=O)C=C(C)C 1626a_100000684558_100000211388 [0,2,0,0,0,0|1,0,1]=4 12318 B16R0.302 CCCCCCCCCCNC(=O)C=C(C)C 240690a_100000684558_100000211388 [0,2,0,0,0,0|1,0,1]=4 12319 B16R0.302 CCCCCCCCCCNC(=O)C=C(C)Cl 11a_100000684558_200042562850 [0,2,0,0,0,0|1,0,1]=4 12320 B16R0.302 CCCCCCCCCCNC(=O)C=C(C)Cl 1626a_100000684558_200042562850 [0,2,0,0,0,0|1,0,1]=4 12321 B16R0.302 CCCCCCCCCCNC(=O)C=C(C)Cl 240690a_100000684558_200042562850 [0,2,0,0,0,0|1,0,1]=4 12322 B16R0.302 CCCCCCCCCCNC(=O)C=C(C)I 11a_100000684558_100025716642 [0,2,0,0,0,0|1,0,1]=4 12323 B16R0.302 CCCCCCCCCCNC(=O)C=C(C)I 1626a_100000684558_100025716642 [0,2,0,0,0,0|1,0,1]=4 12324 B16R0.302 CCCCCCCCCCNC(=O)CC(C)C 11a_100000684558_100000210554 [0,2,0,0,0,0|1,0,0]=3 12325 B16R0.302 CCCCCCCCCCNC(=O)CC(C)C 1626a_100000684558_100000210554 [0,2,0,0,0,0|1,0,0]=3 12326 B16R0.302 CCCCCCCCCCNC(=O)CC(C)C 240690a_100000684558_100000210554 [0,2,0,0,0,0|1,0,0]=3 12327 B16R0.302 CCCCCCCCCCNC(=O)CC(C)C 527a_100000684558_100000210554 [0,2,0,0,0,0|1,0,0]=3 12328 B16R0.302 CCCCCCCCCCNC(=O)CN(C)C 11a_100000684558_100000750896 [0,2,0,0,0,0|2,0,0]=4 12329 B16R0.302 CCCCCCCCCCNC(=O)CN(C)C 240690a_100000684558_100000750896 [0,2,0,0,0,0|2,0,0]=4 12330 B16R0.302 CCCCCCCCCCNC(=O)CN(C)C 527a_100000684558_100000750896 [0,2,0,0,0,0|2,0,0]=4 12331 B16R0.302 CCCCCCCCCCNC(=O)C[C@@H](C)O 240690a_100000684558_100011933948 [0,2,0,0,0,0|1,0,0]=3 12332 B16R0.302 CCCCCCCCCCNC(=O)C[S+](C)C 11a_100000684558_200159257847 [0,2,0,0,0,0|2,0,0]=4 12333 B16R0.302 CCCCCCCCCCNC(=O)C[S+](C)C 1626a_100000684558_200159257847 [0,2,0,0,0,0|2,0,0]=4 12334 B16R0.302 CCCCCCCCCCNC(=O)C[S+](C)C 240690a_100000684558_200159257847 [0,2,0,0,0,0|2,0,0]=4 12335 B16R0.302 CCCCCCCCCCNC(=O)C[S+](C)C 527a_100000684558_200159257847 [0,2,0,0,0,0|2,0,0]=4 12336 B16R0.302 CCCCCCCCCCNC(=O)NC(C)C 2708a_100000684558_100138425928 [0,2,0,0,0,0|1,0,0]=3 12337 B16R0.302 CCCCCCCCCCNC(=O)NC(C)C 2708a_100138425928_100000684558 [0,2,0,0,0,0|1,0,0]=3 12338 B16R0.302 CCCCCCCCCCNC(=O)NC(C)C 273464a_100138425928_100000684558 [0,2,0,0,0,0|1,0,0]=3 12339 B16R0.302 CCCCCCCCCCNC(=O)NC(C)C 512a_100000684558_100138425928 [0,2,0,0,0,0|1,0,0]=3 12340 B16R0.302 CCCCCCCCCCNC(=O)NC(C)C 512a_100138425928_100000684558 [0,2,0,0,0,0|1,0,0]=3 12341 B16R0.302 CCCCCCCCCCOC(=O)CC(=O)C 1458a_100000070787_100000210668 [0,2,0,0,0,0|1,0,1]=4 12342 B16R0.302 CCCCCCCCCCOC(=O)CN(C)C 2230a_100102631434_100000210668 [0,2,0,0,0,0|2,0,0]=4 12343 B16R0.302 CCCCCCCCCCOC(=O)CN(C)C 269982a_100102631434_100000210668 [0,2,0,0,0,0|2,0,0]=4 12344 B16R0.302 CCCCCCCCCNCC(=O)NC(C)C 2230a_100000168517_100011214924 [0,2,0,0,0,0|1,0,0]=3 12345 B16R0.302 CCCCCCCCCNCC(=O)NC(C)C 2230a_100000212291_100000183996 [0,2,0,0,0,0|1,0,0]=3 12346 B16R0.302 CCCCCCCCCNCC(=O)NC(C)C 34a_100000212291_100000183996 [0,2,0,0,0,0|1,0,0]=3 12347 B16R0.302 CCCCCCCCCNCC(=O)OC(C)C 2230a_100000212291_100011215430 [0,2,0,0,0,0|0,0,0]=2 12348 B16R0.302 CCCCCCCCCNCC(=O)OC(C)C 34a_100000212291_100011215430 [0,2,0,0,0,0|0,0,0]=2 12349 B16R0.302 CCCCCCCCCOCC(=O)NC(=O)C 7a_100000210712_100000183797 [0,2,0,0,0,0|1,0,1]=4 12350 B16R0.302 CCCCCCCCCOCC(=O)NC(C)C 34a_100000210712_100000183996 [0,2,0,0,0,0|1,0,0]=3 12351 B16R0.302 CCCCCCCCCOCC(=O)NC(C)C 7a_100000210712_100000183996 [0,2,0,0,0,0|1,0,0]=3 12352 B16R0.302 CCCCCCCCCOCC(=O)OC(C)C 34a_100000210712_100011215430 [0,2,0,0,0,0|0,0,0]=2 12353 B16R0.302 CCCCCCCCCOCC(=O)OC(C)C 7a_100000210712_100011215430 [0,2,0,0,0,0|0,0,0]=2 12354 B16R0.302 CCCCCCCCCSCC(=O)NC(C)C 62a_100000183996_100000210670 [0,2,0,0,0,0|1,0,0]=3 12355 B16R0.302 CCCCCCCCCSCC(=O)OC(C)C 62a_100011215430_100000210670 [0,2,0,0,0,0|0,0,0]=2 12356 B16R0.302 CCCCCCCCNCCC(=O)NC(C)C 2230a_100000229939_100000737564 [0,2,0,0,0,0|1,0,0]=3 12357 B16R0.302 CCCCCCCCNCCC(=O)OC(C)C 2230a_100000229939_100000760027 [0,2,0,0,0,0|0,0,0]=2 12358 B16R0.302 CCCCCCCCOCCC(=O)NC(C)C 7a_100000210232_100000737564 [0,2,0,0,0,0|1,0,0]=3 12359 B16R0.302 CCCCCCCCOCCC(=O)OC(C)C 7a_100000210232_100000760027 [0,2,0,0,0,0|0,0,0]=2 12360 B16R0.302 CCCCCCCCSCCC(=O)NC(C)C 62a_100000210759_100000737564 [0,2,0,0,0,0|1,0,0]=3 12361 B16R0.302 CCCCCCCCSCCC(=O)NC(C)C 62a_100000737564_100000210317 [0,2,0,0,0,0|1,0,0]=3 12362 B16R0.302 CCCCCCCCSCCC(=O)OC(C)C 62a_100000210759_100000760027 [0,2,0,0,0,0|0,0,0]=2 12363 B16R0.302 CCCCCCCCSCCC(=O)OC(C)C 62a_100000760027_100000210317 [0,2,0,0,0,0|0,0,0]=2 12364 B16R0.302 CCCCCCCCSCOC(=O)OC(C)C 62a_100000003507_100000210317 [0,2,0,0,0,0|1,0,0]=3 12365 B16R0.302 CCCCCCCCSCOC(=O)OC(C)C 62a_100000210759_100000003507 [0,2,0,0,0,0|1,0,0]=3 12366 B16R0.302 CCCCCCOCCOCC(=O)NC(C)C 34a_100000691444_100000183996 [0,2,0,0,0,0|2,0,0]=4 12367 B16R0.302 CCCCCCOCCOCC(=O)NC(C)C 7a_100000691444_100000183996 [0,2,0,0,0,0|2,0,0]=4 12368 B16R0.302 CCCCCCOCCOCC(=O)OC(C)C 34a_100000691444_100011215430 [0,2,0,0,0,0|1,0,0]=3 12369 B16R0.302 CCCCCCOCCOCC(=O)OC(C)C 7a_100000691444_100011215430 [0,2,0,0,0,0|1,0,0]=3 12370 B16R0.302 CCCCCNCCCCCC(=O)OC(C)C 2230a_100000209983_200010986244 [0,2,0,0,0,0|0,0,0]=2 12371 B16R0.302 CCCCCOCCCCCC(=O)OC(C)C 34a_100000210253_200010986244 [0,2,0,0,0,0|0,0,0]=2 12372 B16R0.302 CCCCCOCCCCCC(=O)OC(C)C 7a_100000210253_200010986244 [0,2,0,0,0,0|0,0,0]=2 12373 B16R0.302 CCCCCOCCOCCC(=O)NC(C)C 7a_100011215259_100000737564 [0,2,0,0,0,0|2,0,0]=4 12374 B16R0.302 CCCCCOCCOCCC(=O)OC(C)C 7a_100011215259_100000760027 [0,2,0,0,0,0|1,0,0]=3 12375 B16R0.302 CCCCCSCCCCCC(=O)OC(C)C 62a_100000210326_200010986244 [0,2,0,0,0,0|0,0,0]=2 12376 B16R0.302 CCCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000210326 [0,2,0,0,0,0|0,0,0]=2 12377 B16R0.302 CCCCNCCCCOCC(=O)NC(C)C 34a_200011216965_100000183996 [0,2,0,0,0,0|2,0,0]=4 12378 B16R0.302 CCCCNCCCCOCC(=O)OC(C)C 34a_200011216965_100011215430 [0,2,0,0,0,0|1,0,0]=3 12379 B16R0.302 CCCCOCCCCOCC(=O)NC(C)C 34a_200000760531_100000183996 [0,2,0,0,0,0|2,0,0]=4 12380 B16R0.302 CCCCOCCCCOCC(=O)NC(C)C 7a_200000760531_100000183996 [0,2,0,0,0,0|2,0,0]=4 12381 B16R0.302 CCCCOCCCCOCC(=O)OC(C)C 34a_200000760531_100011215430 [0,2,0,0,0,0|1,0,0]=3 12382 B16R0.302 CCCCOCCCCOCC(=O)OC(C)C 7a_200000760531_100011215430 [0,2,0,0,0,0|1,0,0]=3 12383 B16R0.302 CCCCOCCCNCCC(=O)NC(C)C 2230a_200000211371_100000737564 [0,2,0,0,0,0|2,0,0]=4 12384 B16R0.302 CCCCOCCCNCCC(=O)OC(C)C 2230a_200000211371_100000760027 [0,2,0,0,0,0|1,0,0]=3 12385 B16R0.302 CCCCOCCCOCCC(=O)NC(C)C 7a_200011215613_100000737564 [0,2,0,0,0,0|2,0,0]=4 12386 B16R0.302 CCCCOCCCOCCC(=O)OC(C)C 7a_200011215613_100000760027 [0,2,0,0,0,0|1,0,0]=3 12387 B16R0.302 CCCOCCOCCNCC(=O)OC(C)C 2230a_200011904461_100011215430 [0,2,0,0,0,0|2,0,0]=4 12388 B16R0.302 CCCOCCOCCNCC(=O)OC(C)C 34a_200011904461_100011215430 [0,2,0,0,0,0|2,0,0]=4 12389 B16R0.302 CCOCCNCCCCCC(=O)OC(C)C 2230a_102516460346_200010986244 [0,2,0,0,0,0|1,0,0]=3 12390 B16R0.302 CCOCCNCCCCCC(=O)OC(C)C 34a_102516460346_200010986244 [0,2,0,0,0,0|1,0,0]=3 12391 B16R0.302 CCOCCOCCCCCC(=O)OC(C)C 34a_100000210136_200010986244 [0,2,0,0,0,0|1,0,0]=3 12392 B16R0.302 CCOCCOCCCCCC(=O)OC(C)C 7a_100000210136_200010986244 [0,2,0,0,0,0|1,0,0]=3 12393 B16R0.302 CCOCCOCCNCCC(=O)OC(C)C 2230a_100102712874_100000760027 [0,2,0,0,0,0|2,0,0]=4 12394 B16R0.302 CCOCCOCCOCCC(=O)OC(C)C 7a_100000210240_100000760027 [0,2,0,0,0,0|2,0,0]=4 12395 B16R0.302 CCOCCOCCSCCC(=O)OC(C)C 62a_100000760027_100011211534 [0,2,0,0,0,0|2,0,0]=4 12396 B16R0.302 CCOCCOCCSCCC(=O)OC(C)C 62a_100011211534_100000760027 [0,2,0,0,0,0|2,0,0]=4 12397 B16R0.302 CCOCCSCCCCCC(=O)OC(C)C 62a_100000210147_200010986244 [0,2,0,0,0,0|1,0,0]=3 12398 B16R0.302 CCOCCSCCCCCC(=O)OC(C)C 62a_200010986244_100011215890 [0,2,0,0,0,0|1,0,0]=3 12399 B16R0.302 CCSCCNCCCCCC(=O)OC(C)C 2230a_100000106463_200010986244 [0,2,0,0,0,0|1,0,0]=3 12400 B16R0.302 CCSCCOCCCCCC(=O)OC(C)C 34a_100000212035_200010986244 [0,2,0,0,0,0|1,0,0]=3 12401 B16R0.302 CCSCCOCCCCCC(=O)OC(C)C 7a_100000212035_200010986244 [0,2,0,0,0,0|1,0,0]=3 12402 B16R0.302 CCSCCSCCCCCC(=O)OC(C)C 62a_100000757381_200010986244 [0,2,0,0,0,0|1,0,0]=3 12403 B16R0.302 CCSCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000757381 [0,2,0,0,0,0|1,0,0]=3 12404 B16R0.302 CN(C)CC(=O)CCCCCCCCCCO 1458a_100000750896_100009813290 [0,2,0,0,0,0|2,0,0]=4 12405 B16R0.302 CNCCCOCCCCCC(=O)OC(C)C 34a_100000213112_200010986244 [0,2,0,0,0,0|1,0,0]=3 12406 B16R0.302 COCCCCCCOCCC(=O)NC(C)C 7a_200012092642_100000737564 [0,2,0,0,0,0|2,0,0]=4 12407 B16R0.302 COCCCCCCOCCC(=O)OC(C)C 7a_200012092642_100000760027 [0,2,0,0,0,0|1,0,0]=3 12408 B16R0.302 COCCCCCCSCCC(=O)NC(C)C 62a_100000737564_100011998445 [0,2,0,0,0,0|2,0,0]=4 12409 B16R0.302 COCCCCCCSCCC(=O)NC(C)C 62a_100011998445_100000737564 [0,2,0,0,0,0|2,0,0]=4 12410 B16R0.302 COCCCCCCSCCC(=O)OC(C)C 62a_100000760027_100011998445 [0,2,0,0,0,0|1,0,0]=3 12411 B16R0.302 COCCCCCCSCCC(=O)OC(C)C 62a_100011998445_100000760027 [0,2,0,0,0,0|1,0,0]=3 12412 B16R0.302 COCCCCCCSCOC(=O)OC(C)C 62a_100000003507_100011998445 [0,2,0,0,0,0|2,0,0]=4 12413 B16R0.302 COCCCCCCSCOC(=O)OC(C)C 62a_100011998445_100000003507 [0,2,0,0,0,0|2,0,0]=4 12414 B16R0.302 COCCCNCCCCCC(=O)OC(C)C 34a_100150723488_200010986244 [0,2,0,0,0,0|1,0,0]=3 12415 B16R0.302 COCCCOCCCCCC(=O)OC(C)C 34a_100000740835_200010986244 [0,2,0,0,0,0|1,0,0]=3 12416 B16R0.302 COCCCOCCCOCC(=O)OC(C)C 34a_200011215475_100011215430 [0,2,0,0,0,0|2,0,0]=4 12417 B16R0.302 COCCCOCCCOCC(=O)OC(C)C 7a_200011215475_100011215430 [0,2,0,0,0,0|2,0,0]=4 12418 B16R0.302 COCCCSCCCCCC(=O)OC(C)C 62a_100000709357_200010986244 [0,2,0,0,0,0|1,0,0]=3 12419 B16R0.302 COCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000709357 [0,2,0,0,0,0|1,0,0]=3 12420 B16R0.302 COCCOCCCNCCC(=O)OC(C)C 2230a_100000206027_100000760027 [0,2,0,0,0,0|2,0,0]=4 12421 B16R0.302 COCCOCCCSCCC(=O)OC(C)C 62a_100000760027_100011216529 [0,2,0,0,0,0|2,0,0]=4 12422 B16R0.302 COCCOCCCSCCC(=O)OC(C)C 62a_100011216529_100000760027 [0,2,0,0,0,0|2,0,0]=4 12423 B16R0.302 CSCCCNCCCCCC(=O)OC(C)C 2230a_100000749238_200010986244 [0,2,0,0,0,0|1,0,0]=3 12424 B16R0.302 CSCCCOCCCCCC(=O)OC(C)C 34a_100000690336_200010986244 [0,2,0,0,0,0|1,0,0]=3 12425 B16R0.302 CSCCCOCCCCCC(=O)OC(C)C 7a_100000690336_200010986244 [0,2,0,0,0,0|1,0,0]=3 12426 B16R0.302 C[C@@H](O)CC(=O)CCCCCCCCCCO 1458a_100011933948_100009813290 [0,2,0,0,0,0|1,0,0]=3 12427 B16R0.302 C[C@@H](O)CC(=O)NCCCCCCCCCO 240690a_100000078944_100011933948 [0,2,0,0,0,0|2,0,0]=4 12428 B16R0.302 C[S+](C)CC(=O)CCCCCCCCCCO 1458a_200159257847_100009813290 [0,2,0,0,0,0|2,0,0]=4 12429 B16R0.337 C=C(C)CC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100000748629 [0,2,0,0,0,0|0,0,2]=4 12430 B16R0.337 C=C(C)CN(C)CCCCCCC(=O)OCC 2230a_100000225649_100009814379 [0,2,0,0,0,0|1,0,1]=4 12431 B16R0.337 C=C(C)CN(C)CCCCCCC(=O)OCC 269982a_100000225649_100009814379 [0,2,0,0,0,0|1,0,1]=4 12432 B16R0.337 CC(C)OC(=O)CCCCCN[C@H](C)CCO 2230a_100000706166_200010986244 [0,2,0,0,0,0|2,0,0]=4 12433 B16R0.337 CC(C)OC(=O)CCCCCN[C@H](C)CCO 34a_100000706166_200010986244 [0,2,0,0,0,0|2,0,0]=4 12434 B16R0.337 CC(C)OC(=O)CCCCCOC(C)CCBr 34a_100012276601_200010986244 [0,2,0,0,0,0|2,0,0]=4 12435 B16R0.337 CC(C)OC(=O)CCCCCSC(C)CCO 62a_100009893172_200010986244 [0,2,0,0,0,0|2,0,0]=4 12436 B16R0.337 CC(C)OC(=O)CCCCCSC(C)CCO 62a_200010986244_100009893172 [0,2,0,0,0,0|2,0,0]=4 12437 B16R0.337 CCCC(C)CCCOCCC(=O)NC(C)C 7a_100011713154_100000737564 [0,2,0,0,0,0|2,0,0]=4 12438 B16R0.337 CCCC(C)CCCOCCC(=O)OC(C)C 7a_100011713154_100000760027 [0,2,0,0,0,0|1,0,0]=3 12439 B16R0.337 CCCC(C)NCCCCCC(=O)OC(C)C 2230a_100000741246_200010986244 [0,2,0,0,0,0|1,0,0]=3 12440 B16R0.337 CCCC(C)OCCCCCC(=O)OC(C)C 34a_100000764384_200010986244 [0,2,0,0,0,0|1,0,0]=3 12441 B16R0.337 CCCC(C)OCCCCCC(=O)OC(C)C 7a_100000764384_200010986244 [0,2,0,0,0,0|1,0,0]=3 12442 B16R0.337 CCCC(C)SCCCCCC(=O)OC(C)C 62a_100000766640_200010986244 [0,2,0,0,0,0|1,0,0]=3 12443 B16R0.337 CCCC(C)SCCCCCC(=O)OC(C)C 62a_200010986244_100000766640 [0,2,0,0,0,0|1,0,0]=3 12444 B16R0.337 CCOC(=O)CCCCCCC(=O)CC(C)C 1458a_100000031895_100000210624 [0,2,0,0,0,0|0,0,1]=3 12445 B16R0.337 CCOC(=O)CCCCCCC(=O)CC(C)C 1458a_100000210554_100009814379 [0,2,0,0,0,0|0,0,1]=3 12446 B16R0.337 CCOC(=O)CCCCCCC(=O)CC(C)O 1458a_100000031895_100011218427 [0,2,0,0,0,0|0,0,1]=3 12447 B16R0.337 CCOC(=O)CCCCCCC(=O)CC(F)F 1458a_100000031895_100011934356 [0,2,0,0,0,0|1,0,1]=4 12448 B16R0.337 CCOC(=O)CCCCCCC(=O)CN(C)C 1458a_100000750896_100009814379 [0,2,0,0,0,0|1,0,1]=4 12449 B16R0.337 CCOC(=O)CCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100009814379 [0,2,0,0,0,0|0,0,1]=3 12450 B16R0.337 CCOC(=O)CCCCCCC(=O)C[S+](C)C 1458a_200159257847_100009814379 [0,2,0,0,0,0|1,0,1]=4 12451 B16R0.337 CCOC(=O)CCCCCCC(=O)NC(C)C 11a_100138425928_100000031895 [0,2,0,0,0,0|1,0,1]=4 12452 B16R0.337 CCOC(=O)CCCCCCC(=O)NC(C)C 1626a_100138425928_100000031895 [0,2,0,0,0,0|1,0,1]=4 12453 B16R0.337 CCOC(=O)CCCCCCC(=O)NC(C)C 240690a_100138425928_100000031895 [0,2,0,0,0,0|1,0,1]=4 12454 B16R0.337 CCOC(=O)CCCCCCC(=O)NC(C)C 527a_100138425928_100000031895 [0,2,0,0,0,0|1,0,1]=4 12455 B16R0.337 CCOC(=O)CCCCCCN(C)CC(C)C 2230a_100000747067_100009814379 [0,2,0,0,0,0|1,0,0]=3 12456 B16R0.337 CCOC(=O)CCCCCCN(C)CC(C)C 269982a_100000747067_100009814379 [0,2,0,0,0,0|1,0,0]=3 12457 B16R0.337 CCOC(=O)CCCCCCN(C)CC(C)O 2230a_100000227577_100009814379 [0,2,0,0,0,0|1,0,0]=3 12458 B16R0.337 CCOC(=O)CCCCCCN(C)CC(C)O 269982a_100000227577_100009814379 [0,2,0,0,0,0|1,0,0]=3 12459 B16R0.337 CCOC(=O)CCCCCNC(=O)CC(C)C 188690a_100000062434_100000210554 [0,2,0,0,0,0|1,0,1]=4 12460 B16R0.337 CCOC(=O)CCCCCNC(=O)C[C@@H](C)O 188690a_100000062434_100011933948 [0,2,0,0,0,0|1,0,1]=4 12461 B16R0.337 CCOC(=O)CCCCCNC(C)CC(C)C 2230a_100000692259_100000755133 [0,2,0,0,0,0|1,0,0]=3 12462 B16R0.337 CCOC(=O)CCCCCOC(C)CC(C)C 34a_100000211805_100000755133 [0,2,0,0,0,0|1,0,0]=3 12463 B16R0.337 CCOC(=O)CCCCCOC(C)CC(C)C 7a_100000211805_100000755133 [0,2,0,0,0,0|1,0,0]=3 12464 B16R0.337 CCOC(=O)CCCCCOC(C)CC(C)C 7a_100011214988_100000731052 [0,2,0,0,0,0|1,0,0]=3 12465 B16R0.337 CCOC(=O)CCCCCSC(C)CC(C)C 62a_100000731052_100000755133 [0,2,0,0,0,0|1,0,0]=3 12466 B16R0.337 CCOC(=O)CCCCCSC(C)CC(C)C 62a_100000755133_100000731052 [0,2,0,0,0,0|1,0,0]=3 12467 B16R0.337 CCOC(=O)CCCCCSC(C)CN(C)C 62a_100000755133_100020606517 [0,2,0,0,0,0|2,0,0]=4 12468 B16R0.337 CCOC(=O)CCCCCSC(C)CN(C)C 62a_100020606517_100000755133 [0,2,0,0,0,0|2,0,0]=4 12469 B16R0.337 CCOC(=O)CCCCOC[C@@H](N)CC(C)C 34a_100011830311_100000750268 [0,2,0,0,0,0|1,0,0]=3 12470 B16R0.337 CCOC(=O)CCCCSCC(C)CN(C)C 62a_100000750268_100015348159 [0,2,0,0,0,0|2,0,0]=4 12471 B16R0.337 CCOC(=O)CCCCSCC(C)CN(C)C 62a_100015348159_100000750268 [0,2,0,0,0,0|2,0,0]=4 12472 B16R0.337 CCOC(=O)CCCOCC[C@@H](N)CC(C)C 34a_100161151251_100009991533 [0,2,0,0,0,0|1,0,0]=3 12473 B16R0.337 CCOC(=O)COCCCNC(C)CC(C)C 2230a_100000692259_100009893628 [0,2,0,0,0,0|2,0,0]=4 12474 B16R0.337 CCOC(=O)COCCCOC(C)CC(C)C 34a_100000211805_100009893628 [0,2,0,0,0,0|2,0,0]=4 12475 B16R0.337 CCOC(=O)COCCCOC(C)CC(C)C 7a_100000211805_100009893628 [0,2,0,0,0,0|2,0,0]=4 12476 B16R0.337 CCOC(=O)COCCCSC(C)CC(C)C 62a_100000731052_100009893628 [0,2,0,0,0,0|2,0,0]=4 12477 B16R0.337 CCOC(=O)COCCCSC(C)CC(C)C 62a_100009893628_100000731052 [0,2,0,0,0,0|2,0,0]=4 12478 B16R0.337 CCOC(=O)COCCOC[C@@H](N)CC(C)C 34a_100011830311_100000088970 [0,2,0,0,0,0|2,0,0]=4 12479 B16R0.337 COCC(C)SCCCCCC(=O)OC(C)C 62a_100000765312_200010986244 [0,2,0,0,0,0|2,0,0]=4 12480 B16R0.337 COCC(C)SCCCCCC(=O)OC(C)C 62a_200010986244_100000765312 [0,2,0,0,0,0|2,0,0]=4 12481 B16R0.337 COC[C@@H](C)NCCCCCC(=O)OC(C)C 2230a_100000764878_200010986244 [0,2,0,0,0,0|2,0,0]=4 12482 B16R0.337 COC[C@@H](C)OCCCCCC(=O)OC(C)C 34a_100011934205_200010986244 [0,2,0,0,0,0|2,0,0]=4 12483 B16R0.1182 C#CC(C)NC(=O)CCCCCCCCCC 11a_100000707721_100000210375 [0,2,0,0,0,0|1,0,0]=3 12484 B16R0.1182 C#CC(C)NC(=O)CCCCCCCCCC 1626a_100000707721_100000210375 [0,2,0,0,0,0|1,0,0]=3 12485 B16R0.1182 C#CC(C)NC(=O)CCCCCCCCCC 240690a_100000707721_100000210375 [0,2,0,0,0,0|1,0,0]=3 12486 B16R0.1182 C#CC(C)NC(=O)CCCCCCCCCF 11a_100000707721_200009909015 [0,2,0,0,0,0|2,0,0]=4 12487 B16R0.1182 C#CC(C)NC(=O)CCCCCCCCCF 240690a_100000707721_200009909015 [0,2,0,0,0,0|2,0,0]=4 12488 B16R0.1182 C#CC(C)NC(=O)CCCCCCCCCF 527a_100000707721_200009909015 [0,2,0,0,0,0|2,0,0]=4 12489 B16R0.1182 C#CC(C)NC(=O)CCCCCCCCCO 240690a_100000707721_100000032657 [0,2,0,0,0,0|2,0,0]=4 12490 B16R0.1182 C#CC(C)NC(=O)COCCCCCCCC 11a_100000707721_100000759886 [0,2,0,0,0,0|2,0,0]=4 12491 B16R0.1182 C#CC(C)NC(=O)COCCCCCCCC 1626a_100000707721_100000759886 [0,2,0,0,0,0|2,0,0]=4 12492 B16R0.1182 C#CC(C)NC(=O)COCCCCCCCC 240690a_100000707721_100000759886 [0,2,0,0,0,0|2,0,0]=4 12493 B16R0.1182 C#CC(C)NC(=O)COCCCCCCCC 527a_100000707721_100000759886 [0,2,0,0,0,0|2,0,0]=4 12494 B16R0.1182 C#CC(C)NC(=O)NCCCCCCCCC 2708a_100000212291_100000707721 [0,2,0,0,0,0|2,0,0]=4 12495 B16R0.1182 C#CC(C)NC(=O)NCCCCCCCCC 2708a_100000707721_100000212291 [0,2,0,0,0,0|2,0,0]=4 12496 B16R0.1182 C#CC(C)NC(=O)NCCCCCCCCC 273464a_100000212291_100000707721 [0,2,0,0,0,0|2,0,0]=4 12497 B16R0.1182 C#CC(C)NC(=O)NCCCCCCCCC 273464a_100000707721_100000212291 [0,2,0,0,0,0|2,0,0]=4 12498 B16R0.1182 C#CC(C)NC(=O)NCCCCCCCCC 512a_100000212291_100000707721 [0,2,0,0,0,0|2,0,0]=4 12499 B16R0.1182 C#CC(C)NC(=O)NCCCCCCCCC 512a_100000707721_100000212291 [0,2,0,0,0,0|2,0,0]=4 12500 B16R0.1182 C#CC(C)OC(C)CCCCCCCCCC 34a_100011215000_200000035995 [0,2,0,0,0,0|1,0,1]=4 12501 B16R0.1182 C=CC(C)CC(=O)CCCCCCCCCO 1458a_100011934298_100009813782 [0,2,0,0,0,0|2,0,0]=4 12502 B16R0.1182 C=CC(C)CC(=O)NCCCCCCCCC 11a_100000212291_100011934298 [0,2,0,0,0,0|2,0,0]=4 12503 B16R0.1182 C=CC(C)CC(=O)NCCCCCCCCC 1626a_100000212291_100011934298 [0,2,0,0,0,0|2,0,0]=4 12504 B16R0.1182 C=CC(C)CC(=O)NCCCCCCCCC 240690a_100000212291_100011934298 [0,2,0,0,0,0|2,0,0]=4 12505 B16R0.1182 C=CC(C)CC(=O)NCCCCCCCCC 527a_100000212291_100011934298 [0,2,0,0,0,0|2,0,0]=4 12506 B16R0.1182 CC(C#N)NC(=O)CCCCCCCCCF 11a_100000737613_200009909015 [0,2,0,0,0,0|2,0,0]=4 12507 B16R0.1182 CC(C#N)NC(=O)CCCCCCCCCF 527a_100000737613_200009909015 [0,2,0,0,0,0|2,0,0]=4 12508 B16R0.1182 CCC(=CC(=O)CCCCCCCCCO)C 1458a_100020758463_100009813782 [0,2,0,0,0,0|2,0,0]=4 12509 B16R0.1182 CCC(=O)CC(=O)CCCCCCCCCF 1458a_200009909015_100000747405 [0,2,0,0,0,0|2,0,0]=4 12510 B16R0.1182 CCC(C)CC(=O)CCCCCCCCCO 1458a_100000708755_100009813782 [0,2,0,0,0,0|2,0,0]=4 12511 B16R0.1182 CCC(C)NC(=O)CCCCCCCCCF 11a_100000209981_200009909015 [0,2,0,0,0,0|2,0,0]=4 12512 B16R0.1182 CCC(C)NC(=O)CCCCCCCCCF 240690a_100000209981_200009909015 [0,2,0,0,0,0|2,0,0]=4 12513 B16R0.1182 CCC(C)NC(=O)CCCCCCCCCF 527a_100000209981_200009909015 [0,2,0,0,0,0|2,0,0]=4 12514 B16R0.1182 CCC(C)NC(=O)CCCCCCCCCO 240690a_100000209981_100000032657 [0,2,0,0,0,0|2,0,0]=4 12515 B16R0.1182 CCC(O)CC(=O)CCCCCCCCCF 1458a_200009909015_100011218378 [0,2,0,0,0,0|2,0,0]=4 12516 B16R0.1182 CCC(O)CC(=O)CCCCCCCCCO 1458a_100011667805_100009813782 [0,2,0,0,0,0|2,0,0]=4 12517 B16R0.1182 CCCCCCCCCCC(=O)CC(=O)CC 1458a_100000210375_100000747405 [0,2,0,0,0,0|1,0,0]=3 12518 B16R0.1182 CCCCCCCCCCC(=O)CC(=O)NC 1458a_100000210375_100000183359 [0,2,0,0,0,0|1,0,1]=4 12519 B16R0.1182 CCCCCCCCCCC(=O)CC(=O)OC 1458a_100000210375_100000747449 [0,2,0,0,0,0|1,0,1]=4 12520 B16R0.1182 CCCCCCCCCCC(=O)CC(=O)OC 1458a_100000211351_100000210319 [0,2,0,0,0,0|1,0,1]=4 12521 B16R0.1182 CCCCCCCCCCC(=O)CC(O)CC 1458a_100000210375_100011218378 [0,2,0,0,0,0|1,0,0]=3 12522 B16R0.1182 CCCCCCCCCCC(=O)CC(O)CC 1458a_100011667805_100000210319 [0,2,0,0,0,0|1,0,0]=3 12523 B16R0.1182 CCCCCCCCCCC(=O)CN(C)CC 1458a_100116209913_100000210319 [0,2,0,0,0,0|1,0,0]=3 12524 B16R0.1182 CCCCCCCCCCC(=O)C[C@@H](C)CO 1458a_100000210375_100000059175 [0,2,0,0,0,0|1,0,0]=3 12525 B16R0.1182 CCCCCCCCCCC(=O)NC(C)C#N 11a_100000737613_100000210375 [0,2,0,0,0,0|1,0,0]=3 12526 B16R0.1182 CCCCCCCCCCC(=O)NC(C)C#N 1626a_100000737613_100000210375 [0,2,0,0,0,0|1,0,0]=3 12527 B16R0.1182 CCCCCCCCCCC(=O)NC(C)CC 11a_100000209981_100000210375 [0,2,0,0,0,0|1,0,0]=3 12528 B16R0.1182 CCCCCCCCCCC(=O)NC(C)CC 1626a_100000209981_100000210375 [0,2,0,0,0,0|1,0,0]=3 12529 B16R0.1182 CCCCCCCCCCC(=O)NC(C)CC 240690a_100000209981_100000210375 [0,2,0,0,0,0|1,0,0]=3 12530 B16R0.1182 CCCCCCCCCCC(=O)N[C@H](C)CF 11a_100102880703_100000210375 [0,2,0,0,0,0|1,0,0]=3 12531 B16R0.1182 CCCCCCCCCCC(=O)N[C@H](C)CF 1626a_100102880703_100000210375 [0,2,0,0,0,0|1,0,0]=3 12532 B16R0.1182 CCCCCCCCCCC(=O)N[C@H](C)CF 240690a_100102880703_100000210375 [0,2,0,0,0,0|1,0,0]=3 12533 B16R0.1182 CCCCCCCCCCC(=O)N[C@H](C)CO 240690a_100000737577_100000210375 [0,2,0,0,0,0|1,0,0]=3 12534 B16R0.1182 CCCCCCCCCCC(C)OC(C)C#N 7a_100011215000_100000703298 [0,2,0,0,0,0|1,0,1]=4 12535 B16R0.1182 CCCCCCCCCCC(C)OC(C)CO 34a_100011215000_100012180447 [0,2,0,0,0,0|1,0,1]=4 12536 B16R0.1182 CCCCCCCCCCC(C)OC(C)CO 7a_100011215000_100012180447 [0,2,0,0,0,0|1,0,1]=4 12537 B16R0.1182 CCCCCCCCCNC(=O)C=C(C)CC 11a_100000212291_100020758463 [0,2,0,0,0,0|2,0,0]=4 12538 B16R0.1182 CCCCCCCCCNC(=O)C=C(C)CC 1626a_100000212291_100020758463 [0,2,0,0,0,0|2,0,0]=4 12539 B16R0.1182 CCCCCCCCCNC(=O)C=C(C)CC 240690a_100000212291_100020758463 [0,2,0,0,0,0|2,0,0]=4 12540 B16R0.1182 CCCCCCCCCNC(=O)CC(C)CC 11a_100000212291_100000708755 [0,2,0,0,0,0|2,0,0]=4 12541 B16R0.1182 CCCCCCCCCNC(=O)CC(C)CC 1626a_100000212291_100000708755 [0,2,0,0,0,0|2,0,0]=4 12542 B16R0.1182 CCCCCCCCCNC(=O)CC(C)CC 240690a_100000212291_100000708755 [0,2,0,0,0,0|2,0,0]=4 12543 B16R0.1182 CCCCCCCCCNC(=O)CC(C)CC 527a_100000212291_100000708755 [0,2,0,0,0,0|2,0,0]=4 12544 B16R0.1182 CCCCCCCCCNC(=O)CC(O)CC 1626a_100000212291_100011667805 [0,2,0,0,0,0|2,0,0]=4 12545 B16R0.1182 CCCCCCCCCNC(=O)CC(O)CC 240690a_100000212291_100011667805 [0,2,0,0,0,0|2,0,0]=4 12546 B16R0.1182 CCCCCCCCCNC(=O)CN(C)CC 240690a_100000212291_100116209913 [0,2,0,0,0,0|2,0,0]=4 12547 B16R0.1182 CCCCCCCCCNC(=O)CN(C)CC 527a_100000212291_100116209913 [0,2,0,0,0,0|2,0,0]=4 12548 B16R0.1182 CCCCCCCCCNC(=O)NC(C)C#N 2708a_100000212291_100000737613 [0,2,0,0,0,0|2,0,0]=4 12549 B16R0.1182 CCCCCCCCCNC(=O)NC(C)C#N 2708a_100000737613_100000212291 [0,2,0,0,0,0|2,0,0]=4 12550 B16R0.1182 CCCCCCCCCNC(=O)NC(C)C#N 273464a_100000212291_100000737613 [0,2,0,0,0,0|2,0,0]=4 12551 B16R0.1182 CCCCCCCCCNC(=O)NC(C)C#N 273464a_100000737613_100000212291 [0,2,0,0,0,0|2,0,0]=4 12552 B16R0.1182 CCCCCCCCCNC(=O)NC(C)C#N 512a_100000212291_100000737613 [0,2,0,0,0,0|2,0,0]=4 12553 B16R0.1182 CCCCCCCCCNC(=O)NC(C)C#N 512a_100000737613_100000212291 [0,2,0,0,0,0|2,0,0]=4 12554 B16R0.1182 CCCCCCCCCNC(=O)NC(C)CC 2708a_100000209981_100000212291 [0,2,0,0,0,0|2,0,0]=4 12555 B16R0.1182 CCCCCCCCCNC(=O)NC(C)CC 2708a_100000212291_100000209981 [0,2,0,0,0,0|2,0,0]=4 12556 B16R0.1182 CCCCCCCCCNC(=O)NC(C)CC 273464a_100000209981_100000212291 [0,2,0,0,0,0|2,0,0]=4 12557 B16R0.1182 CCCCCCCCCNC(=O)NC(C)CC 273464a_100000212291_100000209981 [0,2,0,0,0,0|2,0,0]=4 12558 B16R0.1182 CCCCCCCCCNC(=O)NC(C)CC 512a_100000209981_100000212291 [0,2,0,0,0,0|2,0,0]=4 12559 B16R0.1182 CCCCCCCCCNC(=O)NC(C)CC 512a_100000212291_100000209981 [0,2,0,0,0,0|2,0,0]=4 12560 B16R0.1182 CCCCCCCCCNC(=O)N[C@H](C)CF 2708a_100000212291_100102880703 [0,2,0,0,0,0|2,0,0]=4 12561 B16R0.1182 CCCCCCCCCNC(=O)N[C@H](C)CF 273464a_100000212291_100102880703 [0,2,0,0,0,0|2,0,0]=4 12562 B16R0.1182 CCCCCCCCCNC(=O)N[C@H](C)CF 273464a_100102880703_100000212291 [0,2,0,0,0,0|2,0,0]=4 12563 B16R0.1182 CCCCCCCCCNC(=O)N[C@H](C)CF 512a_100000212291_100102880703 [0,2,0,0,0,0|2,0,0]=4 12564 B16R0.1182 CCCCCCCCCNC(=O)N[C@H](C)CF 512a_100102880703_100000212291 [0,2,0,0,0,0|2,0,0]=4 12565 B16R0.1182 CCCCCCCCCNC(=O)N[C@H](C)CO 2708a_100000212291_100000737577 [0,2,0,0,0,0|2,0,0]=4 12566 B16R0.1182 CCCCCCCCCNC(=O)N[C@H](C)CO 273464a_100000737577_100000212291 [0,2,0,0,0,0|2,0,0]=4 12567 B16R0.1182 CCCCCCCCCNC(=O)N[C@H](C)CO 512a_100000212291_100000737577 [0,2,0,0,0,0|2,0,0]=4 12568 B16R0.1182 CCCCCCCCCNC(=O)N[C@H](C)CO 512a_100000737577_100000212291 [0,2,0,0,0,0|2,0,0]=4 12569 B16R0.1182 CCCCCCCCNCC(=O)NC(C)CC 2230a_100000229939_100000182745 [0,2,0,0,0,0|2,0,0]=4 12570 B16R0.1182 CCCCCCCCNCC(=O)NC(C)CC 34a_100000229939_100000182745 [0,2,0,0,0,0|2,0,0]=4 12571 B16R0.1182 CCCCCCCCOCC(=O)CC(=O)CC 1458a_100000759886_100000747405 [0,2,0,0,0,0|2,0,0]=4 12572 B16R0.1182 CCCCCCCCOCC(=O)CC(C)CC 1458a_100000759886_100000748023 [0,2,0,0,0,0|2,0,0]=4 12573 B16R0.1182 CCCCCCCCOCC(=O)CC(O)CC 1458a_100000759886_100011218378 [0,2,0,0,0,0|2,0,0]=4 12574 B16R0.1182 CCCCCCCCOCC(=O)C[C@@H](C)CC 1458a_100000759886_100009816398 [0,2,0,0,0,0|2,0,0]=4 12575 B16R0.1182 CCCCCCCCOCC(=O)C[C@@H](C)CO 1458a_100000759886_100000059175 [0,2,0,0,0,0|2,0,0]=4 12576 B16R0.1182 CCCCCCCCOCC(=O)NC(C)C#N 11a_100000737613_100000759886 [0,2,0,0,0,0|2,0,0]=4 12577 B16R0.1182 CCCCCCCCOCC(=O)NC(C)C#N 1626a_100000737613_100000759886 [0,2,0,0,0,0|2,0,0]=4 12578 B16R0.1182 CCCCCCCCOCC(=O)NC(C)C#N 527a_100000737613_100000759886 [0,2,0,0,0,0|2,0,0]=4 12579 B16R0.1182 CCCCCCCCOCC(=O)NC(C)CC 11a_100000209981_100000759886 [0,2,0,0,0,0|2,0,0]=4 12580 B16R0.1182 CCCCCCCCOCC(=O)NC(C)CC 1626a_100000209981_100000759886 [0,2,0,0,0,0|2,0,0]=4 12581 B16R0.1182 CCCCCCCCOCC(=O)NC(C)CC 240690a_100000209981_100000759886 [0,2,0,0,0,0|2,0,0]=4 12582 B16R0.1182 CCCCCCCCOCC(=O)NC(C)CC 34a_100000210232_100000182745 [0,2,0,0,0,0|2,0,0]=4 12583 B16R0.1182 CCCCCCCCOCC(=O)NC(C)CC 527a_100000209981_100000759886 [0,2,0,0,0,0|2,0,0]=4 12584 B16R0.1182 CCCCCCCCOCC(=O)NC(C)CC 7a_100000210232_100000182745 [0,2,0,0,0,0|2,0,0]=4 12585 B16R0.1182 CCCCCCCCOCC(=O)N[C@H](C)CF 11a_100102880703_100000759886 [0,2,0,0,0,0|2,0,0]=4 12586 B16R0.1182 CCCCCCCCOCC(=O)N[C@H](C)CF 1626a_100102880703_100000759886 [0,2,0,0,0,0|2,0,0]=4 12587 B16R0.1182 CCCCCCCCOCC(=O)N[C@H](C)CF 240690a_100102880703_100000759886 [0,2,0,0,0,0|2,0,0]=4 12588 B16R0.1182 CCCCCCCCOCC(=O)N[C@H](C)CF 527a_100102880703_100000759886 [0,2,0,0,0,0|2,0,0]=4 12589 B16R0.1182 CCCCCCCCOCC(=O)N[C@H](C)CO 240690a_100000737577_100000759886 [0,2,0,0,0,0|2,0,0]=4 12590 B16R0.1182 CCCCCCCCOCC(=O)N[C@H](C)CO 527a_100000737577_100000759886 [0,2,0,0,0,0|2,0,0]=4 12591 B16R0.1182 CCCCCCCCSCC(=O)NC(C)CC 62a_100000182745_100000210317 [0,2,0,0,0,0|2,0,0]=4 12592 B16R0.1182 CCCCCCCCSCC(=O)NC(C)CC 62a_100000210759_100000182745 [0,2,0,0,0,0|2,0,0]=4 12593 B16R0.1182 CCN(C)CC(=O)CCCCCCCCCO 1458a_100116209913_100009813782 [0,2,0,0,0,0|2,0,0]=4 12594 B16R0.1182 C[C@@H](CO)CC(=O)CCCCCCCCCF 1458a_200009909015_100000059175 [0,2,0,0,0,0|2,0,0]=4 12595 B16R0.1182 C[C@H](CF)NC(=O)CCCCCCCCCF 11a_100102880703_200009909015 [0,2,0,0,0,0|2,0,0]=4 12596 B16R0.1182 C[C@H](CF)NC(=O)CCCCCCCCCF 240690a_100102880703_200009909015 [0,2,0,0,0,0|2,0,0]=4 12597 B16R0.1182 C[C@H](CF)NC(=O)CCCCCCCCCF 527a_100102880703_200009909015 [0,2,0,0,0,0|2,0,0]=4 12598 B16R0.1182 C[C@H](CF)NC(=O)CCCCCCCCCO 240690a_100102880703_100000032657 [0,2,0,0,0,0|2,0,0]=4 12599 B16R0.1182 C[C@H](CO)NC(=O)CCCCCCCCCF 240690a_100000737577_200009909015 [0,2,0,0,0,0|2,0,0]=4 12600 B16R0.1182 C[C@H](CO)NC(=O)CCCCCCCCCF 527a_100000737577_200009909015 [0,2,0,0,0,0|2,0,0]=4 12601 B16R0.1182 C[C@H](CO)NC(=O)CCCCCCCCCO 240690a_100000737577_100000032657 [0,2,0,0,0,0|2,0,0]=4 12602 B16R0.1193 CC(C)(C)CC(=O)CCCCCCCCCO 1458a_100000211214_100009813782 [0,2,0,0,0,0|2,0,0]=4 12603 B16R0.1193 CC(C)(C)NC(=O)CCCCCCCCCF 11a_100000715429_200009909015 [0,2,0,0,0,0|2,0,0]=4 12604 B16R0.1193 CC(C)(C)NC(=O)CCCCCCCCCF 240690a_100000715429_200009909015 [0,2,0,0,0,0|2,0,0]=4 12605 B16R0.1193 CC(C)(C)NC(=O)CCCCCCCCCF 527a_100000715429_200009909015 [0,2,0,0,0,0|2,0,0]=4 12606 B16R0.1193 CC(C)(C)NC(=O)CCCCCCCCCO 240690a_100000715429_100000032657 [0,2,0,0,0,0|2,0,0]=4 12607 B16R0.1193 CC(C)(C)OC(=O)CCCCCCCCS[13CH3] 62a_100134616357_200025704644 [0,2,0,0,0,0|1,0,0]=3 12608 B16R0.1193 CC(C)(C)OC(=O)CCCCCCCCS[13CH3] 62a_200025704644_100134616357 [0,2,0,0,0,0|1,0,0]=3 12609 B16R0.1193 CC(C)(C)OC(=O)CCCCCCCOCF 34a_100032214103_100015361967 [0,2,0,0,0,0|2,0,0]=4 12610 B16R0.1193 CC(C)(C)OC(=O)CCCCCCCOCF 7a_100032214103_100015361967 [0,2,0,0,0,0|2,0,0]=4 12611 B16R0.1193 CC(C)(C)OC(=O)CCCCCCCSCF 62a_100010978495_100015361967 [0,2,0,0,0,0|2,0,0]=4 12612 B16R0.1193 CC(C)(C)OC(=O)CCCCCCCSCF 62a_100015361967_100010978495 [0,2,0,0,0,0|2,0,0]=4 12613 B16R0.1193 CC(C)(C)OC(=O)CCCCCCNCCF 34a_100000724931_100010989376 [0,2,0,0,0,0|2,0,0]=4 12614 B16R0.1193 CC(C)(C)OC(=O)CCCCCCNCCO 2230a_100016997473_100010989376 [0,2,0,0,0,0|2,0,0]=4 12615 B16R0.1193 CC(C)(C)OC(=O)CCCCCCNCCO 34a_100016990907_100010989376 [0,2,0,0,0,0|2,0,0]=4 12616 B16R0.1193 CC(C)(C)OC(=O)CCCCCCOCCBr 34a_100000211926_100010989376 [0,2,0,0,0,0|2,0,0]=4 12617 B16R0.1193 CC(C)(C)OC(=O)CCCCCCOCCF 34a_100048648013_100011217306 [0,2,0,0,0,0|2,0,0]=4 12618 B16R0.1193 CC(C)(C)OC(=O)CCCCCCOCCF 7a_100048648013_100011217306 [0,2,0,0,0,0|2,0,0]=4 12619 B16R0.1193 CC(C)(C)OC(=O)CCCCCCOCCN 34a_100000210304_100010989376 [0,2,0,0,0,0|2,0,0]=4 12620 B16R0.1193 CC(C)(C)OC(=O)CCCCCCOCCO 34a_100048648013_100000211926 [0,2,0,0,0,0|2,0,0]=4 12621 B16R0.1193 CC(C)(C)OC(=O)CCCCCCOCCO 7a_100048648013_100000211926 [0,2,0,0,0,0|2,0,0]=4 12622 B16R0.1193 CC(C)(C)OC(=O)CCCCCCSCCF 62a_100010989376_100011217306 [0,2,0,0,0,0|2,0,0]=4 12623 B16R0.1193 CC(C)(C)OC(=O)CCCCCCSCCF 62a_100011217306_100010989376 [0,2,0,0,0,0|2,0,0]=4 12624 B16R0.1193 CC(C)(C)OC(=O)CCCCCCSCCO 62a_100000211926_100010989376 [0,2,0,0,0,0|2,0,0]=4 12625 B16R0.1193 CC(C)(C)OC(=O)CCCCCCSCCO 62a_100010989376_100000211926 [0,2,0,0,0,0|2,0,0]=4 12626 B16R0.1193 CC(C)(C)OC(=O)CCCCCNCCCF 2230a_100015189416_100010886488 [0,2,0,0,0,0|2,0,0]=4 12627 B16R0.1193 CC(C)(C)OC(=O)CCCCCNCCCF 34a_100015189416_100010886488 [0,2,0,0,0,0|2,0,0]=4 12628 B16R0.1193 CC(C)(C)OC(=O)CCCCCOCCCBr 34a_100011217188_100010886488 [0,2,0,0,0,0|2,0,0]=4 12629 B16R0.1193 CC(C)(C)OC(=O)CCCCCOCCCCl 34a_100000230001_100010886488 [0,2,0,0,0,0|2,0,0]=4 12630 B16R0.1193 CC(C)(C)OC(=O)CCCCCOCCCF 34a_100000097220_100011934791 [0,2,0,0,0,0|2,0,0]=4 12631 B16R0.1193 CC(C)(C)OC(=O)CCCCCOCCCF 34a_100000759539_100010886488 [0,2,0,0,0,0|2,0,0]=4 12632 B16R0.1193 CC(C)(C)OC(=O)CCCCCOCCCF 7a_100000097220_100011934791 [0,2,0,0,0,0|2,0,0]=4 12633 B16R0.1193 CC(C)(C)OC(=O)CCCCCOCCCN 34a_100000182051_100010886488 [0,2,0,0,0,0|2,0,0]=4 12634 B16R0.1193 CC(C)(C)OC(=O)CCCCCOCCCO 34a_100000097220_100000230001 [0,2,0,0,0,0|2,0,0]=4 12635 B16R0.1193 CC(C)(C)OC(=O)CCCCCOCCCO 7a_100000097220_100011215043 [0,2,0,0,0,0|2,0,0]=4 12636 B16R0.1193 CC(C)(C)OC(=O)CCCCCSCCCF 62a_100010886488_100011934791 [0,2,0,0,0,0|2,0,0]=4 12637 B16R0.1193 CC(C)(C)OC(=O)CCCCCSCCCF 62a_100011934791_100010886488 [0,2,0,0,0,0|2,0,0]=4 12638 B16R0.1193 CC(C)(C)OC(=O)CCCCCSCCCO 62a_100010886488_100011215043 [0,2,0,0,0,0|2,0,0]=4 12639 B16R0.1193 CC(C)(C)OC(=O)CCCCCSCCCO 62a_100011215043_100010886488 [0,2,0,0,0,0|2,0,0]=4 12640 B16R0.1193 CC(C)(C)OC(=O)CCCCNCCCCO 2230a_100000750430_100010889705 [0,2,0,0,0,0|2,0,0]=4 12641 B16R0.1193 CC(C)(C)OC(=O)CCCCNCCCCO 34a_100000750430_100010889705 [0,2,0,0,0,0|2,0,0]=4 12642 B16R0.1193 CC(C)(C)OC(=O)CCCCOCCCCBr 34a_100011216708_100010889705 [0,2,0,0,0,0|2,0,0]=4 12643 B16R0.1193 CC(C)(C)OC(=O)CCCCOCCCCCl 34a_100000210776_100010889705 [0,2,0,0,0,0|2,0,0]=4 12644 B16R0.1193 CC(C)(C)OC(=O)CCCCOCCCCCl 7a_100000210776_100010889705 [0,2,0,0,0,0|2,0,0]=4 12645 B16R0.1193 CC(C)(C)OC(=O)CCCCOCCCCF 34a_100011995726_100010889705 [0,2,0,0,0,0|2,0,0]=4 12646 B16R0.1193 CC(C)(C)OC(=O)CCCCOCCCCF 7a_100011995726_100010889705 [0,2,0,0,0,0|2,0,0]=4 12647 B16R0.1193 CC(C)(C)OC(=O)CCCCOCCCCI 34a_200012148704_100010889705 [0,2,0,0,0,0|2,0,0]=4 12648 B16R0.1193 CC(C)(C)OC(=O)CCCCOCCCCN 34a_100000750430_100010889705 [0,2,0,0,0,0|2,0,0]=4 12649 B16R0.1193 CC(C)(C)OC(=O)CCCCSCCCCF 62a_100000729493_100010889705 [0,2,0,0,0,0|2,0,0]=4 12650 B16R0.1193 CC(C)(C)OC(=O)CCCCSCCCCF 62a_100010889705_100000729493 [0,2,0,0,0,0|2,0,0]=4 12651 B16R0.1193 CC(C)(C)OC(=O)CCCCSCCCCO 62a_100000210776_100010889705 [0,2,0,0,0,0|2,0,0]=4 12652 B16R0.1193 CC(C)(C)OC(=O)CCCCSCCCCO 62a_100010889705_100000210776 [0,2,0,0,0,0|2,0,0]=4 12653 B16R0.1193 CC(C)(C)OC(=O)CCCNCCCCCO 2230a_100000762737_100000708543 [0,2,0,0,0,0|2,0,0]=4 12654 B16R0.1193 CC(C)(C)OC(=O)CCCNCCCCCO 34a_100000762737_100000708543 [0,2,0,0,0,0|2,0,0]=4 12655 B16R0.1193 CC(C)(C)OC(=O)CCCOCCCCCBr 34a_100000746331_100000708543 [0,2,0,0,0,0|2,0,0]=4 12656 B16R0.1193 CC(C)(C)OC(=O)CCCOCCCCCBr 7a_100000746331_100000708543 [0,2,0,0,0,0|2,0,0]=4 12657 B16R0.1193 CC(C)(C)OC(=O)CCCOCCCCCCl 34a_100000746330_100000708543 [0,2,0,0,0,0|2,0,0]=4 12658 B16R0.1193 CC(C)(C)OC(=O)CCCOCCCCCCl 7a_100000746330_100000708543 [0,2,0,0,0,0|2,0,0]=4 12659 B16R0.1193 CC(C)(C)OC(=O)CCCOCCCCCF 34a_100000067108_100000729378 [0,2,0,0,0,0|2,0,0]=4 12660 B16R0.1193 CC(C)(C)OC(=O)CCCOCCCCCF 7a_100000067108_100000729378 [0,2,0,0,0,0|2,0,0]=4 12661 B16R0.1193 CC(C)(C)OC(=O)CCCOCCCCCI 34a_200012148887_100000708543 [0,2,0,0,0,0|2,0,0]=4 12662 B16R0.1193 CC(C)(C)OC(=O)CCCOCCCCCI 7a_200012148887_100000708543 [0,2,0,0,0,0|2,0,0]=4 12663 B16R0.1193 CC(C)(C)OC(=O)CCCOCCCCCN 34a_100000762737_100000708543 [0,2,0,0,0,0|2,0,0]=4 12664 B16R0.1193 CC(C)(C)OC(=O)CCCOCCCCCO 34a_100000067108_100000746330 [0,2,0,0,0,0|2,0,0]=4 12665 B16R0.1193 CC(C)(C)OC(=O)CCCOCCCCCO 7a_100000067108_100000746330 [0,2,0,0,0,0|2,0,0]=4 12666 B16R0.1193 CC(C)(C)OC(=O)CCCSCCCCCF 62a_100000708543_100000729378 [0,2,0,0,0,0|2,0,0]=4 12667 B16R0.1193 CC(C)(C)OC(=O)CCCSCCCCCF 62a_100000729378_100000708543 [0,2,0,0,0,0|2,0,0]=4 12668 B16R0.1193 CC(C)(C)OC(=O)CCCSCCCCCO 62a_100000708543_100000746330 [0,2,0,0,0,0|2,0,0]=4 12669 B16R0.1193 CC(C)(C)OC(=O)CCCSCCCCCO 62a_100000746330_100000708543 [0,2,0,0,0,0|2,0,0]=4 12670 B16R0.1193 CC(C)(C)OC(=O)CCNCCCCCCO 2230a_100000686447_100009816755 [0,2,0,0,0,0|2,0,0]=4 12671 B16R0.1193 CC(C)(C)OC(=O)CCNCCCCCCO 34a_100000686447_100009816755 [0,2,0,0,0,0|2,0,0]=4 12672 B16R0.1193 CC(C)(C)OC(=O)CCOCCCCCCBr 34a_100011215345_100009816755 [0,2,0,0,0,0|2,0,0]=4 12673 B16R0.1193 CC(C)(C)OC(=O)CCOCCCCCCBr 7a_100011215345_100009816755 [0,2,0,0,0,0|2,0,0]=4 12674 B16R0.1193 CC(C)(C)OC(=O)CCOCCCCCCCl 34a_100000766143_100009816755 [0,2,0,0,0,0|2,0,0]=4 12675 B16R0.1193 CC(C)(C)OC(=O)CCOCCCCCCCl 7a_100000766143_100009816755 [0,2,0,0,0,0|2,0,0]=4 12676 B16R0.1193 CC(C)(C)OC(=O)CCOCCCCCCF 34a_100000732779_100009816755 [0,2,0,0,0,0|2,0,0]=4 12677 B16R0.1193 CC(C)(C)OC(=O)CCOCCCCCCF 34a_100011934494_100015922095 [0,2,0,0,0,0|2,0,0]=4 12678 B16R0.1193 CC(C)(C)OC(=O)CCOCCCCCCF 7a_100000732779_100009816755 [0,2,0,0,0,0|2,0,0]=4 12679 B16R0.1193 CC(C)(C)OC(=O)CCOCCCCCCF 7a_100011934494_100015922095 [0,2,0,0,0,0|2,0,0]=4 12680 B16R0.1193 CC(C)(C)OC(=O)CCOCCCCCCN 34a_100000686447_100009816755 [0,2,0,0,0,0|2,0,0]=4 12681 B16R0.1193 CC(C)(C)OC(=O)CCOCCCCCCO 34a_100011934494_100000766143 [0,2,0,0,0,0|2,0,0]=4 12682 B16R0.1193 CC(C)(C)OC(=O)CCOCCCCCCO 7a_100011934494_100000766143 [0,2,0,0,0,0|2,0,0]=4 12683 B16R0.1193 CC(C)(C)OC(=O)CCSCCCCCCF 62a_100009816755_100015922095 [0,2,0,0,0,0|2,0,0]=4 12684 B16R0.1193 CC(C)(C)OC(=O)CCSCCCCCCF 62a_100015922095_100009816755 [0,2,0,0,0,0|2,0,0]=4 12685 B16R0.1193 CC(C)(C)OC(=O)CCSCCCCCCO 62a_100000766143_100009816755 [0,2,0,0,0,0|2,0,0]=4 12686 B16R0.1193 CC(C)(C)OC(=O)CCSCCCCCCO 62a_100009816755_100000766143 [0,2,0,0,0,0|2,0,0]=4 12687 B16R0.1193 CC(C)(C)OC(=O)CNCCCCCCCO 2230a_100011996573_100000183872 [0,2,0,0,0,0|2,0,0]=4 12688 B16R0.1193 CC(C)(C)OC(=O)CNCCCCCCCO 34a_100011996573_100000183872 [0,2,0,0,0,0|2,0,0]=4 12689 B16R0.1193 CC(C)(C)OC(=O)COCCCCCCCBr 34a_100000760002_100000183872 [0,2,0,0,0,0|2,0,0]=4 12690 B16R0.1193 CC(C)(C)OC(=O)COCCCCCCCBr 7a_100000760002_100000183872 [0,2,0,0,0,0|2,0,0]=4 12691 B16R0.1193 CC(C)(C)OC(=O)COCCCCCCCN 34a_100011996573_100000183872 [0,2,0,0,0,0|2,0,0]=4 12692 B16R0.1193 CC(C)(C)OC(=O)COCCCCCCCO 34a_100000752683_100000760002 [0,2,0,0,0,0|2,0,0]=4 12693 B16R0.1193 CC(C)(C)OC(=O)CSCCCCCCCO 62a_100000183872_100000760002 [0,2,0,0,0,0|2,0,0]=4 12694 B16R0.1193 CC(C)(C)OC(=O)CSCCCCCCCO 62a_100000760002_100000183872 [0,2,0,0,0,0|2,0,0]=4 12695 B16R0.1193 CC(C)(C)OC(=O)NCCCCCCCO[13CH3] 34a_100010409097_200025704644 [0,2,0,0,0,0|2,0,0]=4 12696 B16R0.1193 CC(C)(C)OC(=O)NCCCCCCCO[13CH3] 7a_100010409097_200025704644 [0,2,0,0,0,0|2,0,0]=4 12697 B16R0.1193 CC(C)(C)OC(=O)NCCCCCCCS[13CH3] 62a_100000720311_200025704644 [0,2,0,0,0,0|2,0,0]=4 12698 B16R0.1193 CC(C)(C)OC(=O)NCCCCCCCS[13CH3] 62a_200025704644_100000720311 [0,2,0,0,0,0|2,0,0]=4 12699 B16R0.1193 CC(C)(O)CC(=O)CCCCCCCCCO 1458a_100000693243_100009813782 [0,2,0,0,0,0|2,0,0]=4 12700 B16R0.1193 CCCCCCCCCCC(=O)CC(C)(C)O 1458a_100000693243_100000210319 [0,2,0,0,0,0|1,0,0]=3 12701 B16R0.1193 CCCCCCCCCCC(=O)CS(=O)(=O)C 1458a_100000744497_100000210319 [0,2,0,0,0,0|2,0,0]=4 12702 B16R0.1193 CCCCCCCCCCC(=O)C[N+](C)(C)C 1458a_100000033712_100000210319 [0,2,0,0,0,0|2,0,0]=4 12703 B16R0.1193 CCCCCCCCCCC(=O)NC(C)(C)C 11a_100000715429_100000210375 [0,2,0,0,0,0|1,0,0]=3 12704 B16R0.1193 CCCCCCCCCCC(=O)NC(C)(C)C 1626a_100000715429_100000210375 [0,2,0,0,0,0|1,0,0]=3 12705 B16R0.1193 CCCCCCCCCCC(=O)NC(C)(C)C 240690a_100000715429_100000210375 [0,2,0,0,0,0|1,0,0]=3 12706 B16R0.1193 CCCCCCCCCCC(=O)NS(=O)(=O)C 2740a_100000171171_100000210375 [0,2,0,0,0,0|2,0,0]=4 12707 B16R0.1193 CCCCCCCCCNC(=O)CC(C)(C)C 11a_100000212291_100000211214 [0,2,0,0,0,0|2,0,0]=4 12708 B16R0.1193 CCCCCCCCCNC(=O)CC(C)(C)C 1626a_100000212291_100000211214 [0,2,0,0,0,0|2,0,0]=4 12709 B16R0.1193 CCCCCCCCCNC(=O)CC(C)(C)C 240690a_100000212291_100000211214 [0,2,0,0,0,0|2,0,0]=4 12710 B16R0.1193 CCCCCCCCCNC(=O)CC(C)(C)C 527a_100000212291_100000211214 [0,2,0,0,0,0|2,0,0]=4 12711 B16R0.1193 CCCCCCCCCNC(=O)CC(C)(C)O 527a_100000212291_100000693243 [0,2,0,0,0,0|2,0,0]=4 12712 B16R0.1193 CCCCCCCCCNC(=O)NC(C)(C)C 2708a_100000212291_100000715429 [0,2,0,0,0,0|2,0,0]=4 12713 B16R0.1193 CCCCCCCCCNC(=O)NC(C)(C)C 273464a_100000212291_100000715429 [0,2,0,0,0,0|2,0,0]=4 12714 B16R0.1193 CCCCCCCCCNC(=O)NC(C)(C)C 273464a_100000715429_100000212291 [0,2,0,0,0,0|2,0,0]=4 12715 B16R0.1193 CCCCCCCCCNC(=O)NC(C)(C)C 512a_100000715429_100000212291 [0,2,0,0,0,0|2,0,0]=4 12716 B16R0.1193 CCCCCCCCNCC(=O)NC(C)(C)C 2230a_100000174917_100000210759 [0,2,0,0,0,0|2,0,0]=4 12717 B16R0.1193 CCCCCCCCNCC(=O)NC(C)(C)C 2230a_100000229939_100000182746 [0,2,0,0,0,0|2,0,0]=4 12718 B16R0.1193 CCCCCCCCNCC(=O)NC(C)(C)C 34a_100000174917_100000210759 [0,2,0,0,0,0|2,0,0]=4 12719 B16R0.1193 CCCCCCCCNCC(=O)NC(C)(C)C 34a_100000229939_100000182746 [0,2,0,0,0,0|2,0,0]=4 12720 B16R0.1193 CCCCCCCCNCC(=O)OC(C)(C)C 2230a_100000229939_100000183872 [0,2,0,0,0,0|1,0,0]=3 12721 B16R0.1193 CCCCCCCCNCC(=O)OC(C)(C)C 34a_100000229939_100000183872 [0,2,0,0,0,0|1,0,0]=3 12722 B16R0.1193 CCCCCCCCNCC(=O)O[Si](C)(C)C 2230a_100000229939_200009813336 [0,2,0,0,0,0|1,1,0]=4 12723 B16R0.1193 CCCCCCCCNCC(=O)O[Si](C)(C)C 34a_100000229939_200009813336 [0,2,0,0,0,0|1,1,0]=4 12724 B16R0.1193 CCCCCCCCOCC(=O)NC(C)(C)C 11a_100000715429_100000759886 [0,2,0,0,0,0|2,0,0]=4 12725 B16R0.1193 CCCCCCCCOCC(=O)NC(C)(C)C 1626a_100000715429_100000759886 [0,2,0,0,0,0|2,0,0]=4 12726 B16R0.1193 CCCCCCCCOCC(=O)NC(C)(C)C 240690a_100000715429_100000759886 [0,2,0,0,0,0|2,0,0]=4 12727 B16R0.1193 CCCCCCCCOCC(=O)NC(C)(C)C 34a_100000210232_100000182746 [0,2,0,0,0,0|2,0,0]=4 12728 B16R0.1193 CCCCCCCCOCC(=O)NC(C)(C)C 527a_100000715429_100000759886 [0,2,0,0,0,0|2,0,0]=4 12729 B16R0.1193 CCCCCCCCOCC(=O)NC(C)(C)C 7a_100000210232_100000182746 [0,2,0,0,0,0|2,0,0]=4 12730 B16R0.1193 CCCCCCCCOCC(=O)OC(C)(C)C 34a_100000210232_100000183872 [0,2,0,0,0,0|1,0,0]=3 12731 B16R0.1193 CCCCCCCCOCC(=O)OC(C)(C)C 34a_100000752683_100000210759 [0,2,0,0,0,0|1,0,0]=3 12732 B16R0.1193 CCCCCCCCOCC(=O)OC(C)(C)C 7a_100000210232_100000183872 [0,2,0,0,0,0|1,0,0]=3 12733 B16R0.1193 CCCCCCCCOCC(=O)O[Si](C)(C)C 34a_100000210232_200009813336 [0,2,0,0,0,0|1,1,0]=4 12734 B16R0.1193 CCCCCCCCOCC(=O)O[Si](C)(C)C 7a_100000210232_200009813336 [0,2,0,0,0,0|1,1,0]=4 12735 B16R0.1193 CCCCCCCCSCC(=O)NC(C)(C)C 62a_100000182746_100000210317 [0,2,0,0,0,0|2,0,0]=4 12736 B16R0.1193 CCCCCCCCSCC(=O)NC(C)(C)C 62a_100000210759_100000182746 [0,2,0,0,0,0|2,0,0]=4 12737 B16R0.1193 CCCCCCCCSCC(=O)OC(C)(C)C 62a_100000183872_100000210317 [0,2,0,0,0,0|1,0,0]=3 12738 B16R0.1193 CCCCCCCCSCC(=O)OC(C)(C)C 62a_100000210759_100000183872 [0,2,0,0,0,0|1,0,0]=3 12739 B16R0.1193 CCCCCCCCSCC(=O)O[Si](C)(C)C 62a_100000210759_200009813336 [0,2,0,0,0,0|1,1,0]=4 12740 B16R0.1193 CCCCCCCCSCC(=O)O[Si](C)(C)C 62a_200009813336_100000210317 [0,2,0,0,0,0|1,1,0]=4 12741 B16R0.1193 CCCCCCCNCCC(=O)NC(C)(C)C 2230a_100000229938_100011194433 [0,2,0,0,0,0|2,0,0]=4 12742 B16R0.1193 CCCCCCCNCCC(=O)OC(C)(C)C 2230a_100000229938_100009816755 [0,2,0,0,0,0|1,0,0]=3 12743 B16R0.1193 CCCCCCCOCCC(=O)NC(C)(C)C 7a_100000210272_100011194433 [0,2,0,0,0,0|2,0,0]=4 12744 B16R0.1193 CCCCCCCOCCC(=O)OC(C)(C)C 34a_100000210272_100009816755 [0,2,0,0,0,0|1,0,0]=3 12745 B16R0.1193 CCCCCCCOCCC(=O)OC(C)(C)C 34a_100011934494_100000210614 [0,2,0,0,0,0|1,0,0]=3 12746 B16R0.1193 CCCCCCCOCCC(=O)OC(C)(C)C 7a_100000210272_100009816755 [0,2,0,0,0,0|1,0,0]=3 12747 B16R0.1193 CCCCCCCOCCC(=O)OC(C)(C)C 7a_100011934494_100000210614 [0,2,0,0,0,0|1,0,0]=3 12748 B16R0.1193 CCCCCCCSCCC(=O)NC(C)(C)C 62a_100000210614_100011194433 [0,2,0,0,0,0|2,0,0]=4 12749 B16R0.1193 CCCCCCCSCCC(=O)NC(C)(C)C 62a_100011194433_100000210316 [0,2,0,0,0,0|2,0,0]=4 12750 B16R0.1193 CCCCCCCSCCC(=O)OC(C)(C)C 62a_100000210614_100009816755 [0,2,0,0,0,0|1,0,0]=3 12751 B16R0.1193 CCCCCCCSCCC(=O)OC(C)(C)C 62a_100009816755_100000210316 [0,2,0,0,0,0|1,0,0]=3 12752 B16R0.1193 CCCCCCNCCCC(=O)NC(C)(C)C 2230a_100000210581_100011194434 [0,2,0,0,0,0|2,0,0]=4 12753 B16R0.1193 CCCCCCNCCCC(=O)OC(C)(C)C 2230a_100000210581_100000708543 [0,2,0,0,0,0|1,0,0]=3 12754 B16R0.1193 CCCCCCNCCNC(=O)OC(C)(C)C 2230a_100000210581_100000691259 [0,2,0,0,0,0|2,0,0]=4 12755 B16R0.1193 CCCCCCOCCCC(=O)NC(C)(C)C 7a_100000210259_100011194434 [0,2,0,0,0,0|2,0,0]=4 12756 B16R0.1193 CCCCCCOCCCC(=O)OC(C)(C)C 34a_100000067108_100000210314 [0,2,0,0,0,0|1,0,0]=3 12757 B16R0.1193 CCCCCCOCCCC(=O)OC(C)(C)C 34a_100000210259_100000708543 [0,2,0,0,0,0|1,0,0]=3 12758 B16R0.1193 CCCCCCOCCCC(=O)OC(C)(C)C 7a_100000067108_100000210314 [0,2,0,0,0,0|1,0,0]=3 12759 B16R0.1193 CCCCCCOCCCC(=O)OC(C)(C)C 7a_100000210259_100000708543 [0,2,0,0,0,0|1,0,0]=3 12760 B16R0.1193 CCCCCCOCCNC(=O)OC(C)(C)C 34a_100000743822_100000210314 [0,2,0,0,0,0|2,0,0]=4 12761 B16R0.1193 CCCCCCOCCNC(=O)OC(C)(C)C 7a_100000210259_100000691259 [0,2,0,0,0,0|2,0,0]=4 12762 B16R0.1193 CCCCCCOCCNC(=O)OC(C)(C)C 7a_100000743822_100000210314 [0,2,0,0,0,0|2,0,0]=4 12763 B16R0.1193 CCCCCCSCCCC(=O)NC(C)(C)C 62a_100000210314_100011194434 [0,2,0,0,0,0|2,0,0]=4 12764 B16R0.1193 CCCCCCSCCCC(=O)NC(C)(C)C 62a_100011194434_100000210757 [0,2,0,0,0,0|2,0,0]=4 12765 B16R0.1193 CCCCCCSCCCC(=O)OC(C)(C)C 62a_100000210314_100000708543 [0,2,0,0,0,0|1,0,0]=3 12766 B16R0.1193 CCCCCCSCCCC(=O)OC(C)(C)C 62a_100000708543_100000210757 [0,2,0,0,0,0|1,0,0]=3 12767 B16R0.1193 CCCCCCSCCNC(=O)OC(C)(C)C 62a_100000210314_100000691259 [0,2,0,0,0,0|2,0,0]=4 12768 B16R0.1193 CCCCCCSCCNC(=O)OC(C)(C)C 62a_100000691259_100000210757 [0,2,0,0,0,0|2,0,0]=4 12769 B16R0.1193 CCCCCNCCCCC(=O)OC(C)(C)C 2230a_100000209983_100010889705 [0,2,0,0,0,0|1,0,0]=3 12770 B16R0.1193 CCCCCNCCCNC(=O)OC(C)(C)C 2230a_100000209983_100000725178 [0,2,0,0,0,0|2,0,0]=4 12771 B16R0.1193 CCCCCNCCOCC(=O)OC(C)(C)C 2230a_100000209983_100011092059 [0,2,0,0,0,0|2,0,0]=4 12772 B16R0.1193 CCCCCNCCOCC(=O)OC(C)(C)C 34a_100000224656_100000183872 [0,2,0,0,0,0|2,0,0]=4 12773 B16R0.1193 CCCCCOCCCCC(=O)OC(C)(C)C 34a_100000210253_100010889705 [0,2,0,0,0,0|1,0,0]=3 12774 B16R0.1193 CCCCCOCCCCC(=O)OC(C)(C)C 7a_100000210253_100010889705 [0,2,0,0,0,0|1,0,0]=3 12775 B16R0.1193 CCCCCOCCCNC(=O)OC(C)(C)C 34a_100000210253_100000725178 [0,2,0,0,0,0|2,0,0]=4 12776 B16R0.1193 CCCCCOCCCNC(=O)OC(C)(C)C 34a_100000743756_100000718602 [0,2,0,0,0,0|2,0,0]=4 12777 B16R0.1193 CCCCCOCCCNC(=O)OC(C)(C)C 7a_100000210253_100000725178 [0,2,0,0,0,0|2,0,0]=4 12778 B16R0.1193 CCCCCOCCCNC(=O)OC(C)(C)C 7a_100000743756_100000210326 [0,2,0,0,0,0|2,0,0]=4 12779 B16R0.1193 CCCCCOCCOCC(=O)OC(C)(C)C 34a_100000210253_100011092059 [0,2,0,0,0,0|2,0,0]=4 12780 B16R0.1193 CCCCCOCCOCC(=O)OC(C)(C)C 34a_100010982675_100000718602 [0,2,0,0,0,0|2,0,0]=4 12781 B16R0.1193 CCCCCOCCOCC(=O)OC(C)(C)C 34a_100011215259_100000183872 [0,2,0,0,0,0|2,0,0]=4 12782 B16R0.1193 CCCCCOCCOCC(=O)OC(C)(C)C 7a_100000210253_100011092059 [0,2,0,0,0,0|2,0,0]=4 12783 B16R0.1193 CCCCCOCCOCC(=O)OC(C)(C)C 7a_100010982675_100000210326 [0,2,0,0,0,0|2,0,0]=4 12784 B16R0.1193 CCCCCOCCOCC(=O)OC(C)(C)C 7a_100011215259_100000183872 [0,2,0,0,0,0|2,0,0]=4 12785 B16R0.1193 CCCCCSCCCCC(=O)OC(C)(C)C 62a_100000210326_100010889705 [0,2,0,0,0,0|1,0,0]=3 12786 B16R0.1193 CCCCCSCCCCC(=O)OC(C)(C)C 62a_100010889705_100000210326 [0,2,0,0,0,0|1,0,0]=3 12787 B16R0.1193 CCCCCSCCCNC(=O)OC(C)(C)C 62a_100000210326_100000725178 [0,2,0,0,0,0|2,0,0]=4 12788 B16R0.1193 CCCCCSCCCNC(=O)OC(C)(C)C 62a_100000725178_100000210326 [0,2,0,0,0,0|2,0,0]=4 12789 B16R0.1193 CCCCCSCCOCC(=O)OC(C)(C)C 62a_100000210326_100011092059 [0,2,0,0,0,0|2,0,0]=4 12790 B16R0.1193 CCCCCSCCOCC(=O)OC(C)(C)C 62a_100011092059_100000210326 [0,2,0,0,0,0|2,0,0]=4 12791 B16R0.1193 CCCCNCCCCCC(=O)OC(C)(C)C 2230a_100000102301_100010886488 [0,2,0,0,0,0|1,0,0]=3 12792 B16R0.1193 CCCCNCCCCCC(=O)OC(C)(C)C 7a_106832991798_100010886488 [0,2,0,0,0,0|1,0,0]=3 12793 B16R0.1193 CCCCNCCCCNC(=O)OC(C)(C)C 2230a_100000102301_100011218622 [0,2,0,0,0,0|2,0,0]=4 12794 B16R0.1193 CCCCNCCCCNC(=O)OC(C)(C)C 7a_106832991798_100011218622 [0,2,0,0,0,0|2,0,0]=4 12795 B16R0.1193 CCCCNCCOCCC(=O)OC(C)(C)C 2230a_100000102301_100161106493 [0,2,0,0,0,0|2,0,0]=4 12796 B16R0.1193 CCCCNCCOCCC(=O)OC(C)(C)C 7a_106832991798_100010730554 [0,2,0,0,0,0|2,0,0]=4 12797 B16R0.1193 CCCCOCCCCCC(=O)OC(C)(C)C 34a_100000097220_100000210210 [0,2,0,0,0,0|1,0,0]=3 12798 B16R0.1193 CCCCOCCCCCC(=O)OC(C)(C)C 34a_100000210227_100010886488 [0,2,0,0,0,0|1,0,0]=3 12799 B16R0.1193 CCCCOCCCCCC(=O)OC(C)(C)C 7a_100000097220_100000210211 [0,2,0,0,0,0|1,0,0]=3 12800 B16R0.1193 CCCCOCCCCCC(=O)OC(C)(C)C 7a_100000210227_100010886488 [0,2,0,0,0,0|1,0,0]=3 12801 B16R0.1193 CCCCOCCCCNC(=O)OC(C)(C)C 34a_100000210227_100011218622 [0,2,0,0,0,0|2,0,0]=4 12802 B16R0.1193 CCCCOCCCCNC(=O)OC(C)(C)C 34a_100011218717_100000210210 [0,2,0,0,0,0|2,0,0]=4 12803 B16R0.1193 CCCCOCCCCNC(=O)OC(C)(C)C 7a_100000210227_100011218622 [0,2,0,0,0,0|2,0,0]=4 12804 B16R0.1193 CCCCOCCCCNC(=O)OC(C)(C)C 7a_100011218717_100000210211 [0,2,0,0,0,0|2,0,0]=4 12805 B16R0.1193 CCCCOCCCNCC(=O)OC(C)(C)C 2230a_200000211371_100000183872 [0,2,0,0,0,0|2,0,0]=4 12806 B16R0.1193 CCCCOCCCNCC(=O)OC(C)(C)C 34a_200000211371_100000183872 [0,2,0,0,0,0|2,0,0]=4 12807 B16R0.1193 CCCCOCCCOCC(=O)OC(C)(C)C 34a_200011215613_100000183872 [0,2,0,0,0,0|2,0,0]=4 12808 B16R0.1193 CCCCOCCCOCC(=O)OC(C)(C)C 7a_200011215613_100000183872 [0,2,0,0,0,0|2,0,0]=4 12809 B16R0.1193 CCCCOCCOCCC(=O)OC(C)(C)C 34a_100000210227_100010730554 [0,2,0,0,0,0|2,0,0]=4 12810 B16R0.1193 CCCCOCCOCCC(=O)OC(C)(C)C 34a_100000210238_100009816755 [0,2,0,0,0,0|2,0,0]=4 12811 B16R0.1193 CCCCOCCOCCC(=O)OC(C)(C)C 34a_100010341235_100000210210 [0,2,0,0,0,0|2,0,0]=4 12812 B16R0.1193 CCCCOCCOCCC(=O)OC(C)(C)C 34a_100011934494_100000743108 [0,2,0,0,0,0|2,0,0]=4 12813 B16R0.1193 CCCCOCCOCCC(=O)OC(C)(C)C 7a_100000210227_100010730554 [0,2,0,0,0,0|2,0,0]=4 12814 B16R0.1193 CCCCOCCOCCC(=O)OC(C)(C)C 7a_100000210238_100009816755 [0,2,0,0,0,0|2,0,0]=4 12815 B16R0.1193 CCCCOCCOCCC(=O)OC(C)(C)C 7a_100010341235_100000210211 [0,2,0,0,0,0|2,0,0]=4 12816 B16R0.1193 CCCCOCCOCCC(=O)OC(C)(C)C 7a_100011934494_100000743108 [0,2,0,0,0,0|2,0,0]=4 12817 B16R0.1193 CCCCOCCSCCC(=O)OC(C)(C)C 62a_100000743108_100009816755 [0,2,0,0,0,0|2,0,0]=4 12818 B16R0.1193 CCCCOCCSCCC(=O)OC(C)(C)C 62a_100009816755_100000743108 [0,2,0,0,0,0|2,0,0]=4 12819 B16R0.1193 CCCCOCOCCCC(=O)OC(C)(C)C 34a_100000067108_100011995733 [0,2,0,0,0,0|2,0,0]=4 12820 B16R0.1193 CCCCOCSCCCC(=O)OC(C)(C)C 62a_100000708543_100011995733 [0,2,0,0,0,0|2,0,0]=4 12821 B16R0.1193 CCCCOCSCCCC(=O)OC(C)(C)C 62a_100011995733_100000708543 [0,2,0,0,0,0|2,0,0]=4 12822 B16R0.1193 CCCCSCCCCCC(=O)OC(C)(C)C 62a_100000210211_100010886488 [0,2,0,0,0,0|1,0,0]=3 12823 B16R0.1193 CCCCSCCCCCC(=O)OC(C)(C)C 62a_100010886488_100000210210 [0,2,0,0,0,0|1,0,0]=3 12824 B16R0.1193 CCCCSCCCCNC(=O)OC(C)(C)C 62a_100000210211_100011218622 [0,2,0,0,0,0|2,0,0]=4 12825 B16R0.1193 CCCCSCCCCNC(=O)OC(C)(C)C 62a_100011218622_100000210210 [0,2,0,0,0,0|2,0,0]=4 12826 B16R0.1193 CCCCSCCNCCC(=O)OC(C)(C)C 2230a_100025743550_100009816755 [0,2,0,0,0,0|2,0,0]=4 12827 B16R0.1193 CCCCSCCOCCC(=O)OC(C)(C)C 34a_200000230436_100009816755 [0,2,0,0,0,0|2,0,0]=4 12828 B16R0.1193 CCCCSCCOCCC(=O)OC(C)(C)C 62a_100000210211_100161106493 [0,2,0,0,0,0|2,0,0]=4 12829 B16R0.1193 CCCCSCCOCCC(=O)OC(C)(C)C 62a_100161106493_100000210210 [0,2,0,0,0,0|2,0,0]=4 12830 B16R0.1193 CCCCSCCOCCC(=O)OC(C)(C)C 7a_200000230436_100009816755 [0,2,0,0,0,0|2,0,0]=4 12831 B16R0.1193 CCCOCCCCCCC(=O)OC(C)(C)C 34a_100000210258_100010989376 [0,2,0,0,0,0|1,0,0]=3 12832 B16R0.1193 CCCOCCCCCCC(=O)OC(C)(C)C 34a_100048648013_100000210303 [0,2,0,0,0,0|1,0,0]=3 12833 B16R0.1193 CCCOCCCCCCC(=O)OC(C)(C)C 7a_100048648013_100000210303 [0,2,0,0,0,0|1,0,0]=3 12834 B16R0.1193 CCCOCCCCCNC(=O)OC(C)(C)C 34a_100000210258_100012340521 [0,2,0,0,0,0|2,0,0]=4 12835 B16R0.1193 CCCOCCCCCNC(=O)OC(C)(C)C 34a_100011218812_100000210303 [0,2,0,0,0,0|2,0,0]=4 12836 B16R0.1193 CCCOCCCCCNC(=O)OC(C)(C)C 7a_100011218812_100000210303 [0,2,0,0,0,0|2,0,0]=4 12837 B16R0.1193 CCCOCCCNCCC(=O)OC(C)(C)C 2230a_100011217757_100009816755 [0,2,0,0,0,0|2,0,0]=4 12838 B16R0.1193 CCCOCCCNCCC(=O)OC(C)(C)C 34a_100011217757_100009816755 [0,2,0,0,0,0|2,0,0]=4 12839 B16R0.1193 CCCOCCCOCCC(=O)OC(C)(C)C 34a_100134710649_100000210303 [0,2,0,0,0,0|2,0,0]=4 12840 B16R0.1193 CCCOCCCOCCC(=O)OC(C)(C)C 7a_100134710649_100000210303 [0,2,0,0,0,0|2,0,0]=4 12841 B16R0.1193 CCCOCCNCCCC(=O)OC(C)(C)C 2230a_100161115042_100000708543 [0,2,0,0,0,0|2,0,0]=4 12842 B16R0.1193 CCCOCCNCCCC(=O)OC(C)(C)C 34a_100161115042_100000708543 [0,2,0,0,0,0|2,0,0]=4 12843 B16R0.1193 CCCOCCOCCCC(=O)OC(C)(C)C 34a_100000067108_100011215938 [0,2,0,0,0,0|2,0,0]=4 12844 B16R0.1193 CCCOCCOCCCC(=O)OC(C)(C)C 34a_100000752267_100000708543 [0,2,0,0,0,0|2,0,0]=4 12845 B16R0.1193 CCCOCCOCCCC(=O)OC(C)(C)C 7a_100000067108_100011215938 [0,2,0,0,0,0|2,0,0]=4 12846 B16R0.1193 CCCOCCOCCCC(=O)OC(C)(C)C 7a_100000752267_100000708543 [0,2,0,0,0,0|2,0,0]=4 12847 B16R0.1193 CCCOCCSCCCC(=O)OC(C)(C)C 62a_100000708543_100011215938 [0,2,0,0,0,0|2,0,0]=4 12848 B16R0.1193 CCCOCCSCCCC(=O)OC(C)(C)C 62a_100011215938_100000708543 [0,2,0,0,0,0|2,0,0]=4 12849 B16R0.1193 CCCSCCCCCCC(=O)OC(C)(C)C 62a_100000210303_100010989376 [0,2,0,0,0,0|1,0,0]=3 12850 B16R0.1193 CCCSCCCCCCC(=O)OC(C)(C)C 62a_100010989376_100000210303 [0,2,0,0,0,0|1,0,0]=3 12851 B16R0.1193 CCCSCCCCCNC(=O)OC(C)(C)C 62a_100000210303_100012340521 [0,2,0,0,0,0|2,0,0]=4 12852 B16R0.1193 CCCSCCCCCNC(=O)OC(C)(C)C 62a_100012340521_100000210303 [0,2,0,0,0,0|2,0,0]=4 12853 B16R0.1193 CCCSCCNCCCC(=O)OC(C)(C)C 2230a_100020603323_100000708543 [0,2,0,0,0,0|2,0,0]=4 12854 B16R0.1193 CCCSCCOCCCC(=O)OC(C)(C)C 34a_200000230433_100000708543 [0,2,0,0,0,0|2,0,0]=4 12855 B16R0.1193 CCCSCCOCCCC(=O)OC(C)(C)C 7a_200000230433_100000708543 [0,2,0,0,0,0|2,0,0]=4 12856 B16R0.1193 CCNCCCCCCCC(=O)OC(C)(C)C 2230a_100015525214_100010978495 [0,2,0,0,0,0|1,0,0]=3 12857 B16R0.1193 CCNCCCCCCNC(=O)OC(C)(C)C 2230a_100015525214_100000734191 [0,2,0,0,0,0|2,0,0]=4 12858 B16R0.1193 CCOCCCCCCCC(=O)OC(C)(C)C 34a_100032214103_100000210202 [0,2,0,0,0,0|1,0,0]=3 12859 B16R0.1193 CCOCCCCCCCC(=O)OC(C)(C)C 34a_100121572206_100010978495 [0,2,0,0,0,0|1,0,0]=3 12860 B16R0.1193 CCOCCCCCCCC(=O)OC(C)(C)C 7a_100032214103_100000210202 [0,2,0,0,0,0|1,0,0]=3 12861 B16R0.1193 CCOCCCCCCNC(=O)OC(C)(C)C 34a_100011215889_100000210202 [0,2,0,0,0,0|2,0,0]=4 12862 B16R0.1193 CCOCCCCCCNC(=O)OC(C)(C)C 34a_100121572206_100000734191 [0,2,0,0,0,0|2,0,0]=4 12863 B16R0.1193 CCOCCCCCCNC(=O)OC(C)(C)C 7a_100011215889_100000210202 [0,2,0,0,0,0|2,0,0]=4 12864 B16R0.1193 CCOCCCNCCCC(=O)OC(C)(C)C 2230a_100000210961_100000708543 [0,2,0,0,0,0|2,0,0]=4 12865 B16R0.1193 CCOCCCNCCCC(=O)OC(C)(C)C 34a_100000210961_100000708543 [0,2,0,0,0,0|2,0,0]=4 12866 B16R0.1193 CCOCCCOCCCC(=O)OC(C)(C)C 34a_100000067108_100012232248 [0,2,0,0,0,0|2,0,0]=4 12867 B16R0.1193 CCOCCCOCCCC(=O)OC(C)(C)C 34a_100000757476_100000708543 [0,2,0,0,0,0|2,0,0]=4 12868 B16R0.1193 CCOCCCOCCCC(=O)OC(C)(C)C 7a_100000067108_100012232248 [0,2,0,0,0,0|2,0,0]=4 12869 B16R0.1193 CCOCCCOCCCC(=O)OC(C)(C)C 7a_100000757476_100000708543 [0,2,0,0,0,0|2,0,0]=4 12870 B16R0.1193 CCOCCCSCCCC(=O)OC(C)(C)C 62a_100000708543_100012232248 [0,2,0,0,0,0|2,0,0]=4 12871 B16R0.1193 CCOCCCSCCCC(=O)OC(C)(C)C 62a_100012232248_100000708543 [0,2,0,0,0,0|2,0,0]=4 12872 B16R0.1193 CCOCCNCCCCC(=O)OC(C)(C)C 2230a_102516460346_100010889705 [0,2,0,0,0,0|2,0,0]=4 12873 B16R0.1193 CCOCCNCCCCC(=O)OC(C)(C)C 34a_102516460346_100010889705 [0,2,0,0,0,0|2,0,0]=4 12874 B16R0.1193 CCOCCOCCCCC(=O)OC(C)(C)C 34a_100000210136_100010889705 [0,2,0,0,0,0|2,0,0]=4 12875 B16R0.1193 CCOCCOCCCCC(=O)OC(C)(C)C 7a_100000210136_100010889705 [0,2,0,0,0,0|2,0,0]=4 12876 B16R0.1193 CCOCCSCCCCC(=O)OC(C)(C)C 62a_100000210147_100010889705 [0,2,0,0,0,0|2,0,0]=4 12877 B16R0.1193 CCOCCSCCCCC(=O)OC(C)(C)C 62a_100010889705_100011215890 [0,2,0,0,0,0|2,0,0]=4 12878 B16R0.1193 CCOCSCCCCCC(=O)OC(C)(C)C 62a_100000739092_100010886488 [0,2,0,0,0,0|2,0,0]=4 12879 B16R0.1193 CCOCSCCCCCC(=O)OC(C)(C)C 62a_100010886488_100000739092 [0,2,0,0,0,0|2,0,0]=4 12880 B16R0.1193 CCSCCCCCCCC(=O)OC(C)(C)C 62a_100000210202_100010978495 [0,2,0,0,0,0|1,0,0]=3 12881 B16R0.1193 CCSCCCCCCCC(=O)OC(C)(C)C 62a_100010978495_100000210202 [0,2,0,0,0,0|1,0,0]=3 12882 B16R0.1193 CCSCCCCCCNC(=O)OC(C)(C)C 62a_100000210202_100000734191 [0,2,0,0,0,0|2,0,0]=4 12883 B16R0.1193 CCSCCCCCCNC(=O)OC(C)(C)C 62a_100000734191_100000210202 [0,2,0,0,0,0|2,0,0]=4 12884 B16R0.1193 CCSCCCOCCCC(=O)OC(C)(C)C 34a_100011216438_100000708543 [0,2,0,0,0,0|2,0,0]=4 12885 B16R0.1193 CCSCCCOCCCC(=O)OC(C)(C)C 7a_100011216438_100000708543 [0,2,0,0,0,0|2,0,0]=4 12886 B16R0.1193 CCSCCNCCCCC(=O)OC(C)(C)C 2230a_100000106463_100010889705 [0,2,0,0,0,0|2,0,0]=4 12887 B16R0.1193 CCSCCOCCCCC(=O)OC(C)(C)C 34a_100000212035_100010889705 [0,2,0,0,0,0|2,0,0]=4 12888 B16R0.1193 CCSCCOCCCCC(=O)OC(C)(C)C 7a_100000212035_100010889705 [0,2,0,0,0,0|2,0,0]=4 12889 B16R0.1193 CCSCCSCCCCC(=O)OC(C)(C)C 62a_100000757381_100010889705 [0,2,0,0,0,0|2,0,0]=4 12890 B16R0.1193 CCSCCSCCCCC(=O)OC(C)(C)C 62a_100010889705_100000757381 [0,2,0,0,0,0|2,0,0]=4 12891 B16R0.1193 CNCCCCCCCCC(=O)OC(C)(C)C 2230a_106832991635_100134616357 [0,2,0,0,0,0|1,0,0]=3 12892 B16R0.1193 CNCCCCCCCCC(=O)OC(C)(C)C 34a_100102657272_100134616357 [0,2,0,0,0,0|1,0,0]=3 12893 B16R0.1193 CNCCCCCCCCC(=O)OC(C)(C)C 7a_106832991635_100134616357 [0,2,0,0,0,0|1,0,0]=3 12894 B16R0.1193 CNCCCCCCCNC(=O)OC(C)(C)C 2230a_106832991635_100000720311 [0,2,0,0,0,0|2,0,0]=4 12895 B16R0.1193 CNCCCCCCCNC(=O)OC(C)(C)C 34a_100102657272_100000720311 [0,2,0,0,0,0|2,0,0]=4 12896 B16R0.1193 CNCCCCCCCNC(=O)OC(C)(C)C 7a_106832991635_100000720311 [0,2,0,0,0,0|2,0,0]=4 12897 B16R0.1193 CNCCCCCOCCC(=O)OC(C)(C)C 34a_100000722520_100009816755 [0,2,0,0,0,0|2,0,0]=4 12898 B16R0.1193 CNCCCOCCCCC(=O)OC(C)(C)C 34a_100000213112_100010889705 [0,2,0,0,0,0|2,0,0]=4 12899 B16R0.1193 COCCCCCCCCC(=O)OC(C)(C)C 34a_100138415774_100134616357 [0,2,0,0,0,0|1,0,0]=3 12900 B16R0.1193 COCCCCCCCNC(=O)OC(C)(C)C 34a_100010409097_200000210301 [0,2,0,0,0,0|2,0,0]=4 12901 B16R0.1193 COCCCCCCCNC(=O)OC(C)(C)C 34a_100138415774_100000720311 [0,2,0,0,0,0|2,0,0]=4 12902 B16R0.1193 COCCCCCCCNC(=O)OC(C)(C)C 7a_100010409097_200000210301 [0,2,0,0,0,0|2,0,0]=4 12903 B16R0.1193 COCCCCCCOCC(=O)OC(C)(C)C 34a_100000752683_100011998445 [0,2,0,0,0,0|2,0,0]=4 12904 B16R0.1193 COCCCCCCOCC(=O)OC(C)(C)C 34a_200012092642_100000183872 [0,2,0,0,0,0|2,0,0]=4 12905 B16R0.1193 COCCCCCCOCC(=O)OC(C)(C)C 7a_200012092642_100000183872 [0,2,0,0,0,0|2,0,0]=4 12906 B16R0.1193 COCCCCCCSCC(=O)OC(C)(C)C 62a_100000183872_100011998445 [0,2,0,0,0,0|2,0,0]=4 12907 B16R0.1193 COCCCCCCSCC(=O)OC(C)(C)C 62a_100011998445_100000183872 [0,2,0,0,0,0|2,0,0]=4 12908 B16R0.1193 COCCCCCNCCC(=O)OC(C)(C)C 2230a_100000747528_100009816755 [0,2,0,0,0,0|2,0,0]=4 12909 B16R0.1193 COCCCCCNCCC(=O)OC(C)(C)C 34a_100000747528_100009816755 [0,2,0,0,0,0|2,0,0]=4 12910 B16R0.1193 COCCCCOCCCC(=O)OC(C)(C)C 34a_100000067108_100000755781 [0,2,0,0,0,0|2,0,0]=4 12911 B16R0.1193 COCCCCOCCCC(=O)OC(C)(C)C 34a_100000740925_100000708543 [0,2,0,0,0,0|2,0,0]=4 12912 B16R0.1193 COCCCCOCCCC(=O)OC(C)(C)C 7a_100000067108_100000730899 [0,2,0,0,0,0|2,0,0]=4 12913 B16R0.1193 COCCCCSCCCC(=O)OC(C)(C)C 62a_100000708543_100000730899 [0,2,0,0,0,0|2,0,0]=4 12914 B16R0.1193 COCCCCSCCCC(=O)OC(C)(C)C 62a_100000730899_100000708543 [0,2,0,0,0,0|2,0,0]=4 12915 B16R0.1193 COCCCNCCCCC(=O)OC(C)(C)C 34a_100150723488_100010889705 [0,2,0,0,0,0|2,0,0]=4 12916 B16R0.1193 COCCCOCCCCC(=O)OC(C)(C)C 34a_100000740835_100010889705 [0,2,0,0,0,0|2,0,0]=4 12917 B16R0.1193 COCCCSCCCCC(=O)OC(C)(C)C 62a_100000709357_100010889705 [0,2,0,0,0,0|2,0,0]=4 12918 B16R0.1193 COCCCSCCCCC(=O)OC(C)(C)C 62a_100010889705_100000709357 [0,2,0,0,0,0|2,0,0]=4 12919 B16R0.1193 COCCNCCCCCC(=O)OC(C)(C)C 2230a_100000209980_100010886488 [0,2,0,0,0,0|2,0,0]=4 12920 B16R0.1193 COCCOCCCCCC(=O)OC(C)(C)C 34a_100000097220_100011201679 [0,2,0,0,0,0|2,0,0]=4 12921 B16R0.1193 COCCOCCCCCC(=O)OC(C)(C)C 34a_100000210237_100010886488 [0,2,0,0,0,0|2,0,0]=4 12922 B16R0.1193 COCCOCCCCCC(=O)OC(C)(C)C 7a_100000097220_100000233755 [0,2,0,0,0,0|2,0,0]=4 12923 B16R0.1193 COCCSCCCCCC(=O)OC(C)(C)C 62a_100000233755_100010886488 [0,2,0,0,0,0|2,0,0]=4 12924 B16R0.1193 COCCSCCCCCC(=O)OC(C)(C)C 62a_100010886488_100000233755 [0,2,0,0,0,0|2,0,0]=4 12925 B16R0.1193 COCSCCCCCCC(=O)OC(C)(C)C 62a_100000766300_100010989376 [0,2,0,0,0,0|2,0,0]=4 12926 B16R0.1193 COCSCCCCCCC(=O)OC(C)(C)C 62a_100010989376_100000766300 [0,2,0,0,0,0|2,0,0]=4 12927 B16R0.1193 CSCCCCCCCCC(=O)OC(C)(C)C 62a_100134616357_200000210301 [0,2,0,0,0,0|1,0,0]=3 12928 B16R0.1193 CSCCCCCCCCC(=O)OC(C)(C)C 62a_200000210301_100134616357 [0,2,0,0,0,0|1,0,0]=3 12929 B16R0.1193 CSCCCCCCCNC(=O)OC(C)(C)C 62a_100000720311_200000210301 [0,2,0,0,0,0|2,0,0]=4 12930 B16R0.1193 CSCCCCCCCNC(=O)OC(C)(C)C 62a_200000210301_100000720311 [0,2,0,0,0,0|2,0,0]=4 12931 B16R0.1193 CSCCCCOCCCC(=O)OC(C)(C)C 34a_100011217163_100000708543 [0,2,0,0,0,0|2,0,0]=4 12932 B16R0.1193 CSCCCCOCCCC(=O)OC(C)(C)C 7a_100011217163_100000708543 [0,2,0,0,0,0|2,0,0]=4 12933 B16R0.1193 CSCCCNCCCCC(=O)OC(C)(C)C 2230a_100000749238_100010889705 [0,2,0,0,0,0|2,0,0]=4 12934 B16R0.1193 CSCCCOCCCCC(=O)OC(C)(C)C 34a_100000690336_100010889705 [0,2,0,0,0,0|2,0,0]=4 12935 B16R0.1193 CSCCCOCCCCC(=O)OC(C)(C)C 7a_100000690336_100010889705 [0,2,0,0,0,0|2,0,0]=4 12936 B16R0.1193 CSCCNCCCCCC(=O)OC(C)(C)C 2230a_100020590264_100010886488 [0,2,0,0,0,0|2,0,0]=4 12937 B16R0.1193 CSCCOCCCCCC(=O)OC(C)(C)C 34a_100000097220_100000212216 [0,2,0,0,0,0|2,0,0]=4 12938 B16R0.1193 CSCCOCCCCCC(=O)OC(C)(C)C 34a_100000230434_100010886488 [0,2,0,0,0,0|2,0,0]=4 12939 B16R0.1193 CSCCOCCCCCC(=O)OC(C)(C)C 7a_100000097220_100000212216 [0,2,0,0,0,0|2,0,0]=4 12940 B16R0.1193 CSCCOCCCCCC(=O)OC(C)(C)C 7a_100000230434_100010886488 [0,2,0,0,0,0|2,0,0]=4 12941 B16R0.1193 CSCCSCCCCCC(=O)OC(C)(C)C 62a_100000212216_100010886488 [0,2,0,0,0,0|2,0,0]=4 12942 B16R0.1193 CSCCSCCCCCC(=O)OC(C)(C)C 62a_100010886488_100000751147 [0,2,0,0,0,0|2,0,0]=4 12943 B16R0.1193 CSCOCCCCCCC(=O)OC(C)(C)C 34a_100048648013_100011218213 [0,2,0,0,0,0|2,0,0]=4 12944 B16R0.1193 CSCSCCCCCCC(=O)OC(C)(C)C 62a_100010989376_100011218213 [0,2,0,0,0,0|2,0,0]=4 12945 B16R0.1193 CSCSCCCCCCC(=O)OC(C)(C)C 62a_100011218213_100010989376 [0,2,0,0,0,0|2,0,0]=4 12946 B16R0.1203 CC(C)OC(=O)[C@@H](C)OCCCCCCCO 34a_100015307928_100000760002 [0,2,0,0,0,0|2,0,0]=4 12947 B16R0.1203 CC(C)OC(=O)[C@@H](C)OCCCCCCCO 7a_100015307928_100000760002 [0,2,0,0,0,0|2,0,0]=4 12948 B16R0.1203 CC(C)OC(=O)[C@@H](N)COCCCCCCF 34a_100121572844_100015922095 [0,2,0,0,0,0|2,0,0]=4 12949 B16R0.1203 CC(C)OC(=O)[C@@H](N)COCCCCCCO 34a_100121572844_100000766143 [0,2,0,0,0,0|2,0,0]=4 12950 B16R0.1203 CCCCCCCCCC(=O)C(=O)NC(C)C 1458a_100011220036_100000210670 [0,2,0,0,0,0|1,0,1]=4 12951 B16R0.1203 CCCCCCCCCN(C)C(=O)CC(C)C 11a_100000232482_100000210554 [0,2,0,0,0,0|2,0,0]=4 12952 B16R0.1203 CCCCCCCCCN(C)C(=O)CC(C)C 1626a_100000232482_100000210554 [0,2,0,0,0,0|2,0,0]=4 12953 B16R0.1203 CCCCCCCCCN(C)C(=O)CC(C)C 240690a_100000232482_100000210554 [0,2,0,0,0,0|2,0,0]=4 12954 B16R0.1203 CCCCCCCCCN(C)C(=O)CC(C)C 527a_100000232482_100000210554 [0,2,0,0,0,0|2,0,0]=4 12955 B16R0.1203 CCCCCCCCCN(C)C(=O)C[C@@H](C)O 240690a_100000232482_100011933948 [0,2,0,0,0,0|2,0,0]=4 12956 B16R0.1203 CCCCCCCCCN(C)C(=O)NC(C)C 2708a_100138425928_100000232482 [0,2,0,0,0,0|2,0,0]=4 12957 B16R0.1203 CCCCCCCCCN(C)C(=O)NC(C)C 273464a_100138425928_100000232482 [0,2,0,0,0,0|2,0,0]=4 12958 B16R0.1203 CCCCCCCCNC(C)C(=O)NC(C)C 2230a_100000229939_100000195394 [0,2,0,0,0,0|2,0,0]=4 12959 B16R0.1203 CCCCCCCCNC(C)C(=O)NC(C)C 2230a_100015205314_100000210759 [0,2,0,0,0,0|2,0,0]=4 12960 B16R0.1203 CCCCCCCCNC(C)C(=O)NC(C)C 34a_100000229939_100000195394 [0,2,0,0,0,0|2,0,0]=4 12961 B16R0.1203 CCCCCCCCNC(C)C(=O)NC(C)C 34a_100015205314_100000210759 [0,2,0,0,0,0|2,0,0]=4 12962 B16R0.1203 CCCCCCCCOC(C)C(=O)NC(C)C 34a_100000210232_100000195394 [0,2,0,0,0,0|2,0,0]=4 12963 B16R0.1203 CCCCCCCCOC(C)C(=O)NC(C)C 7a_100000210232_100000195394 [0,2,0,0,0,0|2,0,0]=4 12964 B16R0.1203 CCCCCCCCO[C@H](C)C(=O)OC(C)C 34a_100015307928_100000210759 [0,2,0,0,0,0|1,0,0]=3 12965 B16R0.1203 CCCCCCCCO[C@H](C)C(=O)OC(C)C 7a_100015307928_100000210759 [0,2,0,0,0,0|1,0,0]=3 12966 B16R0.1203 CCCCCCCCSC(C)C(=O)NC(C)C 62a_100000195394_100000210317 [0,2,0,0,0,0|2,0,0]=4 12967 B16R0.1203 CCCCCCCCSC(C)C(=O)NC(C)C 62a_100000210759_100000195394 [0,2,0,0,0,0|2,0,0]=4 12968 B16R0.1203 CCCCCCCOC[C@H](N)C(=O)OC(C)C 34a_100121572844_100000210614 [0,2,0,0,0,0|1,0,0]=3 12969 B16R0.1203 CCCCOCCOC[C@H](N)C(=O)OC(C)C 34a_100121572844_100000743108 [0,2,0,0,0,0|2,0,0]=4 12970 B16R0.1203 COCCCCCCO[C@H](C)C(=O)OC(C)C 34a_100015307928_100011998445 [0,2,0,0,0,0|2,0,0]=4 12971 B16R0.1203 COCCCCCCO[C@H](C)C(=O)OC(C)C 7a_100015307928_100011998445 [0,2,0,0,0,0|2,0,0]=4 12972 B16R0.1473 CCCCCC(=O)CSCCC(=O)OC(C)C 62a_100000760027_200012276598 [0,2,0,0,0,0|1,0,1]=4 12973 B16R0.1473 CCCCCC(=O)CSCCC(=O)OC(C)C 62a_200012276598_100000760027 [0,2,0,0,0,0|1,0,1]=4 12974 B16R0.8617 CCCCCCCCCCS(=O)(=O)NC(C)C 270084a_100138425928_200011217601 [0,2,0,0,0,0|2,0,0]=4 12975 B16R0.8617 CCCCCCCCCCS(=O)(=O)NC(C)C 274078a_100138425928_200011217601 [0,2,0,0,0,0|2,0,0]=4 12976 B16R0.40 CCCC(=O)CNCCC(C)CCCC(C)C 2230a_102516457229_100000747444 [0,2,0,0,0,0|2,0,0]=4 12977 B16R0.40 CCCC(=O)COCCC(C)CCCC(C)C 7a_100000015991_100000747444 [0,2,0,0,0,0|2,0,0]=4 12978 B16R0.40 CCCC(=O)CSCCC(C)CCCC(C)C 62a_100000747444_100009816328 [0,2,0,0,0,0|2,0,0]=4 12979 B16R0.40 CCCC(=O)CSCCC(C)CCCC(C)C 62a_100009816328_100000747444 [0,2,0,0,0,0|2,0,0]=4 12980 B16R0.40 CCNC(=O)CNCCC(C)CCCC(C)C 2230a_100016988866_100009816328 [0,2,0,0,0,0|2,0,0]=4 12981 B16R0.40 CCNC(=O)CNCCC(C)CCCC(C)C 2230a_102516457229_100000183381 [0,2,0,0,0,0|2,0,0]=4 12982 B16R0.40 CCNC(=O)COCCC(C)CCCC(C)C 34a_100000015991_100000183381 [0,2,0,0,0,0|2,0,0]=4 12983 B16R0.40 CCNC(=O)COCCC(C)CCCC(C)C 7a_100000015991_100000183381 [0,2,0,0,0,0|2,0,0]=4 12984 B16R0.40 CCNC(=O)CSCCC(C)CCCC(C)C 62a_100000183381_100009816328 [0,2,0,0,0,0|2,0,0]=4 12985 B16R0.40 CCNC(=O)CSCCC(C)CCCC(C)C 62a_100009816328_100000183381 [0,2,0,0,0,0|2,0,0]=4 12986 B16R0.40 CCOC(=O)CCCCC(=O)CCCC(=O)C 1458a_100011217402_100011215641 [0,2,0,0,0,0|0,0,2]=4 12987 B16R0.40 CCOC(=O)CCCCC(=O)CCCC(C)C 1458a_100011216857_100000750268 [0,2,0,0,0,0|0,0,1]=3 12988 B16R0.40 CCOC(=O)CCCCC(=O)CCCC(C)C 1458a_100011217402_100011214892 [0,2,0,0,0,0|0,0,1]=3 12989 B16R0.40 CCOC(=O)CCCCC(=O)CCCC(C)O 1458a_100011217402_200000718107 [0,2,0,0,0,0|0,0,1]=3 12990 B16R0.40 CCOC(=O)CCCCC(=O)CCCN(C)C 1458a_100011217402_100000695564 [0,2,0,0,0,0|1,0,1]=4 12991 B16R0.40 CCOC(=O)CCCCC(=O)CCOC(C)C 1458a_100011217402_100000211751 [0,2,0,0,0,0|1,0,1]=4 12992 B16R0.40 CCOC(=O)CCCCC(=O)CCSC(C)C 1458a_100011217402_100000730970 [0,2,0,0,0,0|1,0,1]=4 12993 B16R0.40 CCOC(=O)CCCCC(=O)COCC(C)C 1458a_100011223364_100000750268 [0,2,0,0,0,0|1,0,1]=4 12994 B16R0.40 CCOC(=O)CCCCC(=O)NCCC(C)C 11a_100000210545_100011217402 [0,2,0,0,0,0|1,0,1]=4 12995 B16R0.40 CCOC(=O)CCCCC(=O)NCCC(C)C 1626a_100000210545_100011217402 [0,2,0,0,0,0|1,0,1]=4 12996 B16R0.40 CCOC(=O)CCCCC(=O)NCCC(C)C 240690a_100000210545_100011217402 [0,2,0,0,0,0|1,0,1]=4 12997 B16R0.40 CCOC(=O)CCCCC(=O)NCCC(C)C 527a_100000210545_100011217402 [0,2,0,0,0,0|1,0,1]=4 12998 B16R0.40 CCOC(=O)CCCCC(=O)NCCC(C)O 240690a_200000755665_100011217402 [0,2,0,0,0,0|1,0,1]=4 12999 B16R0.40 CCOC(=O)CCCCC(=O)NCCC(C)O 527a_200000755665_100011217402 [0,2,0,0,0,0|1,0,1]=4 13000 B16R0.40 CCOC(=O)CCCCN(C)CCCN(C)C 269982a_100000225831_100000750268 [0,2,0,0,0,0|2,0,0]=4 13001 B16R0.40 CCOC(=O)CCCNC(=O)CCCC(C)C 188690a_100000211256_100011216857 [0,2,0,0,0,0|1,0,1]=4 13002 B16R0.40 CCOC(=O)CCCNC(=O)CCCC(C)O 188690a_100000211256_100000761597 [0,2,0,0,0,0|1,0,1]=4 13003 B16R0.40 CCOC(=O)CCCNC(C)CCCC(C)C 2230a_100000210607_100009991533 [0,2,0,0,0,0|1,0,0]=3 13004 B16R0.40 CCOC(=O)CCCOC(C)CCCC(C)C 34a_200011218570_100009991533 [0,2,0,0,0,0|1,0,0]=3 13005 B16R0.40 CCOC(=O)CCCOC(C)CCCC(C)C 7a_200011218570_100011215271 [0,2,0,0,0,0|1,0,0]=3 13006 B16R0.40 CCOC(=O)CNCCC(C)CCCC(C)C 2230a_102516457229_100000188475 [0,2,0,0,0,0|1,0,0]=3 13007 B16R0.40 CCOC(=O)COCCC(=O)CCCC(C)C 1458a_100011216857_100000088970 [0,2,0,0,0,0|1,0,1]=4 13008 B16R0.40 CCOC(=O)COCCC(C)CCCC(C)C 34a_100000015991_100000188475 [0,2,0,0,0,0|1,0,0]=3 13009 B16R0.40 CCOC(=O)COCCC(C)CCCC(C)C 7a_100000015991_100000188475 [0,2,0,0,0,0|1,0,0]=3 13010 B16R0.40 CCOC(=O)CSCCC(C)CCCC(C)C 62a_100000188475_100009816328 [0,2,0,0,0,0|1,0,0]=3 13011 B16R0.40 CCOC(=O)CSCCC(C)CCCC(C)C 62a_100009816328_100000188475 [0,2,0,0,0,0|1,0,0]=3 13012 B16R0.40 CCOC(=O)NCCOC(C)CCCC(C)C 7a_200011218570_200011445536 [0,2,0,0,0,0|2,0,0]=4 13013 B16R0.103 CCN(C)C(=O)CNCCCCCCC(C)C 2230a_100000211014_100000738999 [0,2,0,0,0,0|2,0,0]=4 13014 B16R0.103 CCN(C)C(=O)CNCCCCCCC(C)C 34a_100000211014_100000738999 [0,2,0,0,0,0|2,0,0]=4 13015 B16R0.131 C=C(CNCCCCCCC(C)C)OCOC 34a_100000211014_100000042856 [0,2,0,0,0,0|2,0,0]=4 13016 B16R0.131 C=CCOC(=O)CNCCCCCCC(C)C 2230a_100000211014_100000033060 [0,2,0,0,0,0|1,0,1]=4 13017 B16R0.131 C=CCOC(=O)CNCCCCCCC(C)C 34a_100000211014_100000033060 [0,2,0,0,0,0|1,0,1]=4 13018 B16R0.131 CCCNC(=O)CCCOCCCCC(C)C 7a_100011214890_100011194427 [0,2,0,0,0,0|2,0,0]=4 13019 B16R0.131 CCCNC(=O)CCCSCCCCC(C)C 62a_100011194427_100011216152 [0,2,0,0,0,0|2,0,0]=4 13020 B16R0.131 CCCNC(=O)CCCSCCCCC(C)C 62a_100011216152_100011194427 [0,2,0,0,0,0|2,0,0]=4 13021 B16R0.131 CCCNC(=O)CNCCCCCCC(C)C 2230a_100000211014_100000183358 [0,2,0,0,0,0|2,0,0]=4 13022 B16R0.131 CCCNC(=O)CNCCCCCCC(C)C 34a_100000211014_100000183358 [0,2,0,0,0,0|2,0,0]=4 13023 B16R0.131 CCCOC(=O)CNCCCCCCC(C)C 2230a_100000211014_200011215008 [0,2,0,0,0,0|1,0,0]=3 13024 B16R0.131 CCCOC(=O)CNCCCCCCC(C)C 34a_100000211014_200011215008 [0,2,0,0,0,0|1,0,0]=3 13025 B16R0.131 CCCOC(=O)COCCCCCNC(C)C 34a_100011629493_200011215008 [0,2,0,0,0,0|2,0,0]=4 13026 B16R0.131 CCCOC(=O)OCNCCCCCC(C)C 34a_100011290863_200000139673 [0,2,0,0,0,0|2,0,0]=4 13027 B16R0.131 CCCOC(=O)OCOCCCCCC(C)C 34a_100011995859_200000139673 [0,2,0,0,0,0|2,0,0]=4 13028 B16R0.131 CCCOC(=O)OCOCCCCCC(C)C 7a_100011995859_200000139673 [0,2,0,0,0,0|2,0,0]=4 13029 B16R0.131 CCCOC(=O)OCSCCCCCC(C)C 62a_100000210682_200000139673 [0,2,0,0,0,0|2,0,0]=4 13030 B16R0.252 C=C(CNCCCCCC(C)C)C(=O)OCC 34a_100011290863_100000755967 [0,2,0,0,0,0|1,0,1]=4 13031 B16R0.252 C=C(COCCCCCC(C)C)C(=O)OCC 34a_100011995859_100000755967 [0,2,0,0,0,0|1,0,1]=4 13032 B16R0.252 C=C(COCCCCCC(C)C)C(=O)OCC 7a_100011995859_100000755967 [0,2,0,0,0,0|1,0,1]=4 13033 B16R0.252 C=C(CSCCCCCC(C)C)C(=O)OCC 62a_100000210682_100000755967 [0,2,0,0,0,0|1,0,1]=4 13034 B16R0.252 C=C(CSCCCCCC(C)C)C(=O)OCC 62a_100000755967_100000210682 [0,2,0,0,0,0|1,0,1]=4 13035 B16R0.252 CCNC(=O)C(C)NCCCCCCC(C)C 2230a_100000211014_100000230173 [0,2,0,0,0,0|2,0,0]=4 13036 B16R0.252 CCNC(=O)C(C)NCCCCCCC(C)C 34a_100000211014_100000230173 [0,2,0,0,0,0|2,0,0]=4 13037 B16R0.252 CCOC(=O)C(=O)CCCCCNCC(C)C 2230a_100000210953_100000068741 [0,2,0,0,0,0|1,0,1]=4 13038 B16R0.252 CCOC(=O)C(=O)CCCCCNCC(C)O 2230a_100000210904_100000068741 [0,2,0,0,0,0|1,0,1]=4 13039 B16R0.252 CCOC(=O)C(=O)CCCCCSCC(C)C 62a_100000210624_100000068741 [0,2,0,0,0,0|1,0,1]=4 13040 B16R0.252 CCOC(=O)C(=O)CCCCCSCC(C)O 62a_100011218427_100000068741 [0,2,0,0,0,0|1,0,1]=4 13041 B16R0.252 CCOC(=O)C(=O)CCCCCSC[C@@H](C)O 62a_100009817552_100000068741 [0,2,0,0,0,0|1,0,1]=4 13042 B16R0.252 CCOC(=O)C(=O)CSCCCCCC(C)C 62a_100000210682_100000211299 [0,2,0,0,0,0|1,0,1]=4 13043 B16R0.252 CCOC(=O)C(=O)CSCCCCCC(C)C 62a_100000211299_100000210682 [0,2,0,0,0,0|1,0,1]=4 13044 B16R0.252 CCOC(=O)C(=O)NCCCCCCC(C)C 11a_100000211014_100014798877 [0,2,0,0,0,0|1,0,1]=4 13045 B16R0.252 CCOC(=O)C(=O)NCCCCCCC(C)C 1626a_100000211014_100014798877 [0,2,0,0,0,0|1,0,1]=4 13046 B16R0.252 CCOC(=O)C(=O)NCCCCCCC(C)C 240690a_100000211014_100014798877 [0,2,0,0,0,0|1,0,1]=4 13047 B16R0.252 CCOC(=O)C(C)NCCCCCCC(C)C 2230a_100000211014_100011215307 [0,2,0,0,0,0|1,0,0]=3 13048 B16R0.252 CCOC(=O)C(C)NCCCCCCC(C)C 34a_100000211014_100011216346 [0,2,0,0,0,0|1,0,0]=3 13049 B16R0.252 CCOC(=O)C(C)OCCCCCNC(C)C 34a_100011629493_100011216346 [0,2,0,0,0,0|2,0,0]=4 13050 B16R0.252 CCOC(=O)C(F)NCCCCCCC(C)C 2230a_100000211014_100000760018 [0,2,0,0,0,0|1,0,0]=3 13051 B16R0.252 CCOC(=O)C(F)NCCCCCCC(C)C 34a_100000211014_100000760018 [0,2,0,0,0,0|1,0,0]=3 13052 B16R0.252 CCOC(=O)C(F)OCCCCCNC(C)C 34a_100011629493_100000760018 [0,2,0,0,0,0|2,0,0]=4 13053 B16R0.323 CCCC(=O)CC(=O)CCCCCCC(C)C 1458a_100000040743_100000747444 [0,2,0,0,0,0|1,0,1]=4 13054 B16R0.323 CCNC(=O)CC(=O)CCCCCCC(C)C 1458a_100000040743_100000183381 [0,2,0,0,0,0|1,0,1]=4 13055 B16R0.323 CCOC(=O)CC(=O)CCCCCCC(C)C 1458a_100000040743_100000188475 [0,2,0,0,0,0|0,0,1]=3 13056 B16R0.323 CCOC(=O)CC(=O)CSCCCCC(C)C 62a_100000210311_100011216152 [0,2,0,0,0,0|1,0,1]=4 13057 B16R0.323 CCOC(=O)CC(=O)CSCCCCC(C)C 62a_100011216152_100000210311 [0,2,0,0,0,0|1,0,1]=4 13058 B16R0.323 CCOC(=O)CC(=O)NCCCCCC(C)C 240690a_100011290863_100000243816 [0,2,0,0,0,0|1,0,1]=4 13059 B16R0.323 CCOC(=O)CC(C)NCCCCCC(C)C 2230a_100011290863_100009817359 [0,2,0,0,0,0|1,0,0]=3 13060 B16R0.323 CCOC(=O)CC(C)NCCCOCC(C)C 2230a_100000205972_100009817359 [0,2,0,0,0,0|2,0,0]=4 13061 B16R0.323 CCOC(=O)CC(C)OCCCCCC(C)C 7a_100011995859_100009817359 [0,2,0,0,0,0|1,0,0]=3 13062 B16R0.323 CCOC(=O)CC(C)SCCCCCC(C)C 62a_100000210682_100009817359 [0,2,0,0,0,0|1,0,0]=3 13063 B16R0.323 CCOC(=O)CC(C)SCCCCCC(C)C 62a_100009817359_100000210682 [0,2,0,0,0,0|1,0,0]=3 13064 B16R0.323 CCOC(=O)C[C@@H](C)OCCCCCC(C)C 7a_100009816390_100000210682 [0,2,0,0,0,0|1,0,0]=3 13065 B16R0.323 CCOC(=O)C[C@H](O)CNCCCOC(C)C 34a_100000737246_100000688340 [0,2,0,0,0,0|2,0,0]=4 13066 B16R0.323 CCOC(=O)C[C@H](O)COCCCCC(C)C 34a_100011214890_100000688340 [0,2,0,0,0,0|1,0,0]=3 13067 B16R0.323 CCOC(=O)C[C@H](O)COCCCCC(C)C 7a_100011214890_100000688340 [0,2,0,0,0,0|1,0,0]=3 13068 B16R0.323 CCOC(=O)C[C@H](O)COCCCNC(C)C 34a_100000182298_100000688340 [0,2,0,0,0,0|2,0,0]=4 13069 B16R0.323 CCOC(=O)C[C@H](O)COCCNCC(C)C 34a_100015185251_100000688340 [0,2,0,0,0,0|2,0,0]=4 13070 B16R0.323 CCOC(=O)C[C@H](O)COCCOCC(C)C 34a_100000703358_100000688340 [0,2,0,0,0,0|2,0,0]=4 13071 B16R0.323 CCOC(=O)C[C@H](O)COCCOCC(C)C 7a_100000703358_100000688340 [0,2,0,0,0,0|2,0,0]=4 13072 B16R0.323 CCOC(=O)C[C@H](O)COCCSCC(C)C 34a_200000230437_100000688340 [0,2,0,0,0,0|2,0,0]=4 13073 B16R0.323 CCOC(=O)C[C@H](O)COCCSCC(C)C 7a_200000230437_100000688340 [0,2,0,0,0,0|2,0,0]=4 13074 B16R0.323 CCOC(=O)C[C@H](O)CSCCCCC(=O)C 62a_100000688340_100000735457 [0,2,0,0,0,0|1,0,1]=4 13075 B16R0.323 CCOC(=O)C[C@H](O)CSCCCCC(=O)C 62a_100000735457_100000688340 [0,2,0,0,0,0|1,0,1]=4 13076 B16R0.323 CCOC(=O)C[C@H](O)CSCCCCC(C)C 62a_100000688340_100011216152 [0,2,0,0,0,0|1,0,0]=3 13077 B16R0.323 CCOC(=O)C[C@H](O)CSCCCCC(C)C 62a_100011216152_100000688340 [0,2,0,0,0,0|1,0,0]=3 13078 B16R0.323 CCOC(=O)C[C@H](O)CSCCCCN(C)C 62a_100000688340_100000690147 [0,2,0,0,0,0|2,0,0]=4 13079 B16R0.323 CCOC(=O)OC(C)SCCCCCC(C)C 62a_100000036008_100000210682 [0,2,0,0,0,0|2,0,0]=4 13080 B16R0.323 CCOC(=O)OC(C)SCCCCCC(C)C 62a_100000210682_100000036008 [0,2,0,0,0,0|2,0,0]=4 13081 B16R0.806 C#CC(=O)CCCCCCCCC(=O)OCC 1458a_100000211873_100010175975 [0,2,0,0,0,0|0,0,2]=4 13082 B16R0.806 C#CC(C)NCCCCCCCC(=O)OCC 2230a_100000707721_100009991516 [0,2,0,0,0,0|1,0,0]=3 13083 B16R0.806 C#CC(C)NCCCCCCCC(=O)OCC 34a_100000707721_100009991516 [0,2,0,0,0,0|1,0,0]=3 13084 B16R0.806 C#CC(C)SCCCCCCCC(=O)OCC 62a_200000035995_100009991516 [0,2,0,0,0,0|1,0,0]=3 13085 B16R0.806 C#CC(O)CCCCCSCCC(=O)OCC 62a_100000765890_200010408556 [0,2,0,0,0,0|0,0,2]=4 13086 B16R0.806 C#CC(O)CCCCCSCCC(=O)OCC 62a_200010408556_100000765890 [0,2,0,0,0,0|0,0,2]=4 13087 B16R0.806 C#C[C@@H](C)OCCCCCCCC(=O)OCC 34a_100009815206_100009991516 [0,2,0,0,0,0|1,0,0]=3 13088 B16R0.806 C#C[C@@H](C)OCCCCCCCC(=O)OCC 7a_100009815206_100009991516 [0,2,0,0,0,0|1,0,0]=3 13089 B16R0.806 C=CC(=O)CCCCCCCCC(=O)OCC 1458a_100000185746_100010175975 [0,2,0,0,0,0|0,0,2]=4 13090 B16R0.806 C=CC(C)COCCCCCCC(=O)OCC 34a_100011215527_100009814379 [0,2,0,0,0,0|1,0,0]=3 13091 B16R0.806 C=CC(C)COCCCCCCC(=O)OCC 7a_100011215527_100009814379 [0,2,0,0,0,0|1,0,0]=3 13092 B16R0.806 C=CC(C)OCCCCCCCC(=O)OCC 34a_100000695699_100009991516 [0,2,0,0,0,0|1,0,0]=3 13093 B16R0.806 C=CC(C)SCCCCCCCC(=O)OCC 62a_100011215867_100009991516 [0,2,0,0,0,0|1,0,0]=3 13094 B16R0.806 C=CC(O)CSCCCCCCC(=O)OCC 62a_100000730141_100009814379 [0,2,0,0,0,0|0,0,2]=4 13095 B16R0.806 C=C[C@H](N)COCCCCCCC(=O)OCC 34a_100016989147_100009814379 [0,2,0,0,0,0|0,0,2]=4 13096 B16R0.806 CCCC(=O)CCCCCCCCC(=O)OC 1458a_100000036616_100000210303 [0,2,0,0,0,0|1,0,1]=4 13097 B16R0.806 CCCC(=O)CCCCCCCCC(=O)OC 1458a_100000211992_100010282707 [0,2,0,0,0,0|1,0,1]=4 13098 B16R0.806 CCNC(=O)CCCCCCCCC(=O)OC 11a_100015525214_100000036616 [0,2,0,0,0,0|1,0,1]=4 13099 B16R0.806 CCNC(=O)CCCCCCCCC(=O)OC 240690a_100015525214_100000036616 [0,2,0,0,0,0|1,0,1]=4 13100 B16R0.806 CCNC(=O)CCOCCCCCC(C)CC 7a_200000035636_100000737597 [0,2,0,0,0,0|1,0,0]=3 13101 B16R0.806 CCOC(=O)CCCCC=NNCC(O)CC 4a_100015206393_100012182868 [0,2,0,0,0,0|1,0,1]=4 13102 B16R0.806 CCOC(=O)CCCCCC=NNC(C)CC 4a_100000718999_100000085164 [0,2,0,0,0,0|1,0,1]=4 13103 B16R0.806 CCOC(=O)CCCCCCCCC(=O)CC 1458a_100000210414_100010175975 [0,2,0,0,0,0|0,0,0]=2 13104 B16R0.806 CCOC(=O)CCCCCCCCC(=O)CC 1458a_200000016031_100000210202 [0,2,0,0,0,0|0,0,0]=2 13105 B16R0.806 CCOC(=O)CCCCCCCCC(=O)CF 1458a_200000016031_100015361967 [0,2,0,0,0,0|0,0,1]=3 13106 B16R0.806 CCOC(=O)CCCCCCCCC(=O)CO 1458a_100000210174_100010175975 [0,2,0,0,0,0|0,0,1]=3 13107 B16R0.806 CCOC(=O)CCCCCCCCC(=O)NC 11a_106832991635_200000016031 [0,2,0,0,0,0|0,0,1]=3 13108 B16R0.806 CCOC(=O)CCCCCCCCC(=O)NC 1626a_100102657272_200000016031 [0,2,0,0,0,0|0,0,1]=3 13109 B16R0.806 CCOC(=O)CCCCCCCCC(=O)NC 240690a_100102657272_200000016031 [0,2,0,0,0,0|0,0,1]=3 13110 B16R0.806 CCOC(=O)CCCCCCCCC(=O)NC 527a_100102657272_200000016031 [0,2,0,0,0,0|0,0,1]=3 13111 B16R0.806 CCOC(=O)CCCCCCCCN(C)CC 2230a_100000225621_100010175975 [0,2,0,0,0,0|0,0,0]=2 13112 B16R0.806 CCOC(=O)CCCCCCCCN(C)CC 269982a_100000225621_100010175975 [0,2,0,0,0,0|0,0,0]=2 13113 B16R0.806 CCOC(=O)CCCCCCCNC(C)C#N 2230a_100000737613_100009991516 [0,2,0,0,0,0|1,0,0]=3 13114 B16R0.806 CCOC(=O)CCCCCCCNC(C)CC 2230a_100000209981_100009991516 [0,2,0,0,0,0|0,0,0]=2 13115 B16R0.806 CCOC(=O)CCCCCCCN[C@H](C)CO 2230a_100000737577_100009991516 [0,2,0,0,0,0|1,0,0]=3 13116 B16R0.806 CCOC(=O)CCCCCCCOC(C)C#N 34a_100011218135_100009991516 [0,2,0,0,0,0|1,0,0]=3 13117 B16R0.806 CCOC(=O)CCCCCCCOC(C)CC 7a_100000210228_100009991516 [0,2,0,0,0,0|0,0,0]=2 13118 B16R0.806 CCOC(=O)CCCCCCCOC(C)CF 34a_100016041109_100009991516 [0,2,0,0,0,0|1,0,0]=3 13119 B16R0.806 CCOC(=O)CCCCCCCOC(C)CF 7a_100016041109_100009991516 [0,2,0,0,0,0|1,0,0]=3 13120 B16R0.806 CCOC(=O)CCCCCCCOC(C)CN 34a_100000210904_100009991516 [0,2,0,0,0,0|1,0,0]=3 13121 B16R0.806 CCOC(=O)CCCCCCCSC(C)C#N 62a_100000703298_100009991516 [0,2,0,0,0,0|1,0,0]=3 13122 B16R0.806 CCOC(=O)CCCCCCCSC(C)CC 62a_100000758301_100009991516 [0,2,0,0,0,0|0,0,0]=2 13123 B16R0.806 CCOC(=O)CCCCCCCSC(C)CO 62a_100012180447_100009991516 [0,2,0,0,0,0|1,0,0]=3 13124 B16R0.806 CCOC(=O)CCCCCCCSC(C)OC 62a_100009879195_100009991516 [0,2,0,0,0,0|1,0,0]=3 13125 B16R0.806 CCOC(=O)CCCCCCCSC(F)C#N 62a_200000117898_100009991516 [0,2,0,0,0,0|1,0,1]=4 13126 B16R0.806 CCOC(=O)CCCCCCCS[C@H](C)CO 62a_100016084084_100009991516 [0,2,0,0,0,0|1,0,0]=3 13127 B16R0.806 CCOC(=O)CCCCCCNCC(=O)NC 2230a_100000693194_100009814379 [0,2,0,0,0,0|1,0,1]=4 13128 B16R0.806 CCOC(=O)CCCCCCNCC(C)CC 2230a_100020588543_100009814379 [0,2,0,0,0,0|0,0,0]=2 13129 B16R0.806 CCOC(=O)CCCCCCNCC(C)CO 34a_100000744482_100009814379 [0,2,0,0,0,0|1,0,0]=3 13130 B16R0.806 CCOC(=O)CCCCCCNCC(O)CC 2230a_100011218483_100009814379 [0,2,0,0,0,0|0,0,0]=2 13131 B16R0.806 CCOC(=O)CCCCCCNC[C@@H](C)OC 2230a_100020591295_100009814379 [0,2,0,0,0,0|1,0,0]=3 13132 B16R0.806 CCOC(=O)CCCCCCNC[C@@H](F)CO 34a_100015665980_100009814379 [0,2,0,0,0,0|1,0,0]=3 13133 B16R0.806 CCOC(=O)CCCCCCNC[C@H](O)CO 2230a_100020644852_100009814379 [0,2,0,0,0,0|1,0,0]=3 13134 B16R0.806 CCOC(=O)CCCCCCOCC(=O)CC 34a_100000725409_100009814379 [0,2,0,0,0,0|0,0,1]=3 13135 B16R0.806 CCOC(=O)CCCCCCOCC(=O)NC 34a_100000750040_100009814379 [0,2,0,0,0,0|1,0,1]=4 13136 B16R0.806 CCOC(=O)CCCCCCOCC(C)CN 34a_100000744482_100009814379 [0,2,0,0,0,0|1,0,0]=3 13137 B16R0.806 CCOC(=O)CCCCCCOCC(C)OC 34a_100000690652_100009814379 [0,2,0,0,0,0|1,0,0]=3 13138 B16R0.806 CCOC(=O)CCCCCCOCC(Cl)CCl 34a_100000033668_100009814379 [0,2,0,0,0,0|1,0,0]=3 13139 B16R0.806 CCOC(=O)CCCCCCOC[C@@H](C)CC 7a_100009816381_100009814379 [0,2,0,0,0,0|0,0,0]=2 13140 B16R0.806 CCOC(=O)CCCCCCOC[C@H](F)CN 34a_100015665980_100009814379 [0,2,0,0,0,0|1,0,0]=3 13141 B16R0.806 CCOC(=O)CCCCCCSCC(=O)CC 62a_100000747405_100009814379 [0,2,0,0,0,0|0,0,1]=3 13142 B16R0.806 CCOC(=O)CCCCCCSCC(=O)NC 62a_100000183359_100009814379 [0,2,0,0,0,0|1,0,1]=4 13143 B16R0.806 CCOC(=O)CCCCCCSCC(=O)OC 62a_100000747449_100009814379 [0,2,0,0,0,0|1,0,1]=4 13144 B16R0.806 CCOC(=O)CCCCCCSCC(C)CC 62a_100000748023_100009814379 [0,2,0,0,0,0|0,0,0]=2 13145 B16R0.806 CCOC(=O)CCCCCCSCC(O)CC 62a_100011218378_100009814379 [0,2,0,0,0,0|0,0,0]=2 13146 B16R0.806 CCOC(=O)CCCCCCSCC(O)CO 62a_100011219619_100009814379 [0,2,0,0,0,0|1,0,0]=3 13147 B16R0.806 CCOC(=O)CCCCCCSC[C@@H](C)CC 62a_100009816398_100009814379 [0,2,0,0,0,0|0,0,0]=2 13148 B16R0.806 CCOC(=O)CCCCCCSC[C@@H](C)CO 62a_100000059175_100009814379 [0,2,0,0,0,0|1,0,0]=3 13149 B16R0.806 CCOC(=O)CCCCCCSC[C@@H](O)CF 62a_100015614560_100009814379 [0,2,0,0,0,0|1,0,0]=3 13150 B16R0.806 CCOC(=O)CCCCCCSC[C@@H](O)CO 62a_100009815848_100009814379 [0,2,0,0,0,0|1,0,0]=3 13151 B16R0.806 CCOC(=O)CCCCCNCCC(=O)NC 2230a_100000738227_100000755133 [0,2,0,0,0,0|1,0,1]=4 13152 B16R0.806 CCOC(=O)CCCCCNCCC(=O)NC 34a_100000738227_100000755133 [0,2,0,0,0,0|1,0,1]=4 13153 B16R0.806 CCOC(=O)CCCCCNCCC(C)CC 2230a_100020591266_100000755133 [0,2,0,0,0,0|0,0,0]=2 13154 B16R0.806 CCOC(=O)CCCCCNCCC(C)CO 2230a_106354213184_100000755133 [0,2,0,0,0,0|1,0,0]=3 13155 B16R0.806 CCOC(=O)CCCCCNCCC(C)CO 34a_106354213184_100000755133 [0,2,0,0,0,0|1,0,0]=3 13156 B16R0.806 CCOC(=O)CCCCCOCCC(=O)NC 34a_100000754576_100000755133 [0,2,0,0,0,0|1,0,1]=4 13157 B16R0.806 CCOC(=O)CCCCCOCCC(=O)NC 7a_100011214988_100000737683 [0,2,0,0,0,0|1,0,1]=4 13158 B16R0.806 CCOC(=O)CCCCCOCCC(=O)OC 7a_100011214988_100000204255 [0,2,0,0,0,0|1,0,1]=4 13159 B16R0.806 CCOC(=O)CCCCCOCCC(C)CC 7a_100011215188_100000755133 [0,2,0,0,0,0|0,0,0]=2 13160 B16R0.806 CCOC(=O)CCCCCOCCC(C)OC 7a_100000764861_100000755133 [0,2,0,0,0,0|1,0,0]=3 13161 B16R0.806 CCOC(=O)CCCCCSCCC(=O)NC 62a_100000737683_100000755133 [0,2,0,0,0,0|1,0,1]=4 13162 B16R0.806 CCOC(=O)CCCCCSCCC(=O)NC 62a_100000755133_100000737683 [0,2,0,0,0,0|1,0,1]=4 13163 B16R0.806 CCOC(=O)CCCCCSCCC(=O)OC 62a_100000204255_100000755133 [0,2,0,0,0,0|1,0,1]=4 13164 B16R0.806 CCOC(=O)CCCCCSCCC(=O)OC 62a_100000755133_100000204255 [0,2,0,0,0,0|1,0,1]=4 13165 B16R0.806 CCOC(=O)CCCCNCCCC(=O)NC 2230a_100000740002_100000750268 [0,2,0,0,0,0|1,0,1]=4 13166 B16R0.806 CCOC(=O)CCCCNCCCC(=O)NC 34a_100000740002_100000750268 [0,2,0,0,0,0|1,0,1]=4 13167 B16R0.806 CCOC(=O)CCCCNCCNC(=O)CC 34a_100132302217_100000750268 [0,2,0,0,0,0|1,0,1]=4 13168 B16R0.806 CCOC(=O)CCCCOCCCC(C)CC 7a_100011216074_100000750268 [0,2,0,0,0,0|0,0,0]=2 13169 B16R0.806 CCOC(=O)CCCCOCCC[C@@H](C)CN 34a_100160569302_100000750268 [0,2,0,0,0,0|1,0,0]=3 13170 B16R0.806 CCOC(=O)CCCCOCCNC(=O)CC 34a_200000158885_100000750268 [0,2,0,0,0,0|1,0,1]=4 13171 B16R0.806 CCOC(=O)CCCCOCCNC(=O)CC 7a_200000158885_100000750268 [0,2,0,0,0,0|1,0,1]=4 13172 B16R0.806 CCOC(=O)CCCCOCCOC(=O)CC 7a_200000031056_100000750268 [0,2,0,0,0,0|1,0,1]=4 13173 B16R0.806 CCOC(=O)CCCCSCCCC(=O)NC 62a_100000741757_100000750268 [0,2,0,0,0,0|1,0,1]=4 13174 B16R0.806 CCOC(=O)CCCCSCCCC(=O)NC 62a_100000750268_100000741757 [0,2,0,0,0,0|1,0,1]=4 13175 B16R0.806 CCOC(=O)CCCCSCCCC(=O)OC 62a_100000750268_100011218270 [0,2,0,0,0,0|1,0,1]=4 13176 B16R0.806 CCOC(=O)CCCCSCCCC(=O)OC 62a_100011218270_100000750268 [0,2,0,0,0,0|1,0,1]=4 13177 B16R0.806 CCOC(=O)CCCCSCCCN(C)CC 62a_100000750268_100015186262 [0,2,0,0,0,0|1,0,0]=3 13178 B16R0.806 CCOC(=O)CCCOCCCCC(=O)OC 34a_100000059025_100009991533 [0,2,0,0,0,0|1,0,1]=4 13179 B16R0.806 CCOC(=O)CCCOCCCCC(=O)OC 7a_100000059025_100011215271 [0,2,0,0,0,0|1,0,1]=4 13180 B16R0.806 CCOC(=O)CCCOCCCCC(=O)OC 7a_100012001163_100000204269 [0,2,0,0,0,0|1,0,1]=4 13181 B16R0.806 CCOC(=O)CCCSCCCCC(=O)OC 62a_100000204269_100009991533 [0,2,0,0,0,0|1,0,1]=4 13182 B16R0.806 CCOC(=O)CCCSCCCCC(=O)OC 62a_100009991533_100000204269 [0,2,0,0,0,0|1,0,1]=4 13183 B16R0.806 CCOC(=O)CCOCCCCCC(=O)OC 34a_100000074720_100000765890 [0,2,0,0,0,0|1,0,1]=4 13184 B16R0.806 CCOC(=O)CCOCCCCCC(=O)OC 7a_100000074720_100011206558 [0,2,0,0,0,0|1,0,1]=4 13185 B16R0.806 CCOC(=O)CCOCCCCCC(C)CC 7a_200000035636_100011206558 [0,2,0,0,0,0|0,0,0]=2 13186 B16R0.806 CCOC(=O)CCOCCOCCC(=O)CC 1458a_100000067408_100000210202 [0,2,0,0,0,0|1,0,1]=4 13187 B16R0.806 CCOC(=O)CCSCCCCCC(=O)OC 62a_100000765890_100009816466 [0,2,0,0,0,0|1,0,1]=4 13188 B16R0.806 CCOC(=O)CCSCCCCCC(=O)OC 62a_100009816466_100000765890 [0,2,0,0,0,0|1,0,1]=4 13189 B16R0.806 CCOC(=O)COCCCCCCC(=O)OC 34a_100009863599_100000188475 [0,2,0,0,0,0|1,0,1]=4 13190 B16R0.806 CCOC(=O)COCCCCCCC(=O)OC 7a_100009863599_100000188475 [0,2,0,0,0,0|1,0,1]=4 13191 B16R0.806 CCOC(=O)COCCCNCCC(C)CC 2230a_100020591266_100009893628 [0,2,0,0,0,0|1,0,0]=3 13192 B16R0.806 CCOC(=O)COCCCNCCC(C)CO 2230a_106354213184_100009893628 [0,2,0,0,0,0|2,0,0]=4 13193 B16R0.806 CCOC(=O)COCCCNCCC(C)CO 34a_106354213184_100009893628 [0,2,0,0,0,0|2,0,0]=4 13194 B16R0.806 CCOC(=O)COCCCOCCC(C)CC 7a_100011215188_100009893628 [0,2,0,0,0,0|1,0,0]=3 13195 B16R0.806 CCOC(=O)COCCCOCCC(C)OC 7a_100000764861_100009893628 [0,2,0,0,0,0|2,0,0]=4 13196 B16R0.806 CCOC(=O)COCCOCCCC(C)CC 7a_100011216074_100000088970 [0,2,0,0,0,0|1,0,0]=3 13197 B16R0.806 CCOC(=O)COCCOCCC[C@@H](C)CN 34a_100160569302_100000088970 [0,2,0,0,0,0|2,0,0]=4 13198 B16R0.806 CCOC(=O)COCCSCCCN(C)CC 62a_100000088970_100015186262 [0,2,0,0,0,0|2,0,0]=4 13199 B16R0.806 CCOC(=O)CSCCCCCCC(=O)OC 62a_100000188475_100009815986 [0,2,0,0,0,0|1,0,1]=4 13200 B16R0.806 CCOC(=O)CSCCCCCCC(=O)OC 62a_100009815986_100000188475 [0,2,0,0,0,0|1,0,1]=4 13201 B16R0.806 CCOC(=O)CSCCOCCCN(C)CC 7a_200000230590_100015186262 [0,2,0,0,0,0|2,0,0]=4 13202 B16R0.808 C=C(C)C(=O)CCCCCCCC(=O)OCC 1458a_100000185857_100009991516 [0,2,0,0,0,0|0,0,2]=4 13203 B16R0.808 CCOC(=O)CCCCCCCC(=O)C(C)C 1458a_100000210198_100009991516 [0,2,0,0,0,0|0,0,1]=3 13204 B16R0.808 CCOC(=O)CCCCCCCC(=O)C(C)F 1458a_100000062450_100009991516 [0,2,0,0,0,0|0,0,1]=3 13205 B16R0.808 CCOC(=O)CCCCCCCC(=O)C(O)O 1458a_100000233687_100009991516 [0,2,0,0,0,0|1,0,1]=4 13206 B16R0.808 CCOC(=O)CCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100009991516 [0,2,0,0,0,0|0,0,1]=3 13207 B16R0.808 CCOC(=O)CCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100009991516 [0,2,0,0,0,0|0,0,1]=3 13208 B16R0.808 CCOC(=O)CCCCCCCN(C)C(C)C 269982a_200000211004_100009991516 [0,2,0,0,0,0|1,0,0]=3 13209 B16R0.808 CCOC(=O)CCCCCCNC(=O)C(C)C 188690a_100000741137_100000210198 [0,2,0,0,0,0|1,0,1]=4 13210 B16R0.808 CCOC(=O)CCCCCCNC(=O)C(C)F 188690a_100000741137_100000062450 [0,2,0,0,0,0|1,0,1]=4 13211 B16R0.808 CCOC(=O)CCCCCCNC(=O)[C@@H](C)O 188690a_100000741137_100000717761 [0,2,0,0,0,0|1,0,1]=4 13212 B16R0.808 CCOC(=O)CCCCCCNC(=O)[C@H](C)O 188690a_100000741137_217856618621 [0,2,0,0,0,0|1,0,1]=4 13213 B16R0.808 CCOC(=O)CCCCCCNC(C)C(C)C 2230a_100000211541_100009814379 [0,2,0,0,0,0|1,0,0]=3 13214 B16R0.808 CCOC(=O)CCCCCCOC(C)C(=O)C 34a_100000212229_100009814379 [0,2,0,0,0,0|1,0,1]=4 13215 B16R0.808 CCOC(=O)CCCCCCOC(C)C(C)C 7a_100000748068_100009814379 [0,2,0,0,0,0|1,0,0]=3 13216 B16R0.808 CCOC(=O)CCCCCCSC(C)C(=O)C 62a_100009814033_100009814379 [0,2,0,0,0,0|1,0,1]=4 13217 B16R0.808 CCOC(=O)CCCCCNCC(O)C(C)C 2230a_100000759067_100000755133 [0,2,0,0,0,0|1,0,0]=3 13218 B16R0.808 CCOC(=O)CCCCCNCC(O)C(C)C 34a_100000759067_100000755133 [0,2,0,0,0,0|1,0,0]=3 13219 B16R0.808 CCOC(=O)CCCCCOCC(=O)C(C)C 7a_100011214988_100000753385 [0,2,0,0,0,0|1,0,1]=4 13220 B16R0.808 CCOC(=O)CCCCCOCC(C)C(=O)C 34a_100000032740_100000755133 [0,2,0,0,0,0|1,0,1]=4 13221 B16R0.808 CCOC(=O)CCCCCOCC(C)C(=O)C 7a_100000032740_100000755133 [0,2,0,0,0,0|1,0,1]=4 13222 B16R0.808 CCOC(=O)CCCCCOC[C@H](N)C(C)C 34a_100011830312_100000755133 [0,2,0,0,0,0|1,0,0]=3 13223 B16R0.808 CCOC(=O)CCCCCSCC(=O)C(C)C 62a_100000753385_100000755133 [0,2,0,0,0,0|1,0,1]=4 13224 B16R0.808 CCOC(=O)CCCCCSCC(=O)C(C)C 62a_100000755133_100000753385 [0,2,0,0,0,0|1,0,1]=4 13225 B16R0.808 CCOC(=O)CCCCOCCC(N)C(C)C 34a_100161115045_100000750268 [0,2,0,0,0,0|1,0,0]=3 13226 B16R0.808 CCOC(=O)COCCCNCC(O)C(C)C 2230a_100000759067_100009893628 [0,2,0,0,0,0|2,0,0]=4 13227 B16R0.808 CCOC(=O)COCCCNCC(O)C(C)C 34a_100000759067_100009893628 [0,2,0,0,0,0|2,0,0]=4 13228 B16R0.808 CCOC(=O)COCCCOC[C@H](N)C(C)C 34a_100011830312_100009893628 [0,2,0,0,0,0|2,0,0]=4 13229 B16R0.808 CCOC(=O)COCCOCCC(N)C(C)C 34a_100161115045_100000088970 [0,2,0,0,0,0|2,0,0]=4 13230 B16R0.3231 CCNC(=O)CCNCCCCCC(C)(C)O 34a_100025743525_100010402123 [0,2,0,0,0,0|2,0,0]=4 13231 B16R0.3231 CCNC(=O)CCSCCCCCC(C)(C)O 62a_100000737597_100010402123 [0,2,0,0,0,0|2,0,0]=4 13232 B16R0.3231 CCNC(=O)CCSCCCCCC(C)(C)O 62a_100010402123_100000737597 [0,2,0,0,0,0|2,0,0]=4 13233 B16R0.3231 CCOC(=O)CCCCCCCNC(C)(C)C 2230a_100000715429_100009991516 [0,2,0,0,0,0|1,0,0]=3 13234 B16R0.3231 CCOC(=O)CCCCCCCOC(C)(C)C 34a_100015890283_100009991516 [0,2,0,0,0,0|1,0,0]=3 13235 B16R0.3231 CCOC(=O)CCCCCCCOC(C)(C)C 7a_100015890283_100009991516 [0,2,0,0,0,0|1,0,0]=3 13236 B16R0.3231 CCOC(=O)CCCCCCCSC(C)(C)C 62a_100000211941_100009991516 [0,2,0,0,0,0|1,0,0]=3 13237 B16R0.3231 CCOC(=O)CCCCCCCSC(F)(F)F 62a_200000243211_100009991516 [0,2,0,0,0,0|2,0,0]=4 13238 B16R0.3231 CCOC(=O)CCCCCCNCC(C)(C)C 2230a_100000743828_100009814379 [0,2,0,0,0,0|1,0,0]=3 13239 B16R0.3231 CCOC(=O)CCCCCCNCC(C)(C)F 2230a_100020643315_100009814379 [0,2,0,0,0,0|1,0,0]=3 13240 B16R0.3231 CCOC(=O)CCCCCCNCC(C)(C)O 2230a_100000751335_100009814379 [0,2,0,0,0,0|1,0,0]=3 13241 B16R0.3231 CCOC(=O)CCCCCCNCC(F)(F)F 34a_100000717047_100009814379 [0,2,0,0,0,0|2,0,0]=4 13242 B16R0.3231 CCOC(=O)CCCCCCOCC(C)(C)F 34a_100000716592_100009814379 [0,2,0,0,0,0|1,0,0]=3 13243 B16R0.3231 CCOC(=O)CCCCCCOCC(C)(F)F 34a_100000068830_100009814379 [0,2,0,0,0,0|1,0,0]=3 13244 B16R0.3231 CCOC(=O)CCCCCCOCC(F)(F)Br 34a_100011217949_100009814379 [0,2,0,0,0,0|2,0,0]=4 13245 B16R0.3231 CCOC(=O)CCCCCCOCC(F)(F)Cl 34a_100000734434_100009814379 [0,2,0,0,0,0|2,0,0]=4 13246 B16R0.3231 CCOC(=O)CCCCCCOCC(F)(F)F 34a_100000210435_100009814379 [0,2,0,0,0,0|2,0,0]=4 13247 B16R0.3231 CCOC(=O)CCCCCCSCC(C)(C)C 62a_100011219605_100009814379 [0,2,0,0,0,0|1,0,0]=3 13248 B16R0.3231 CCOC(=O)CCCCCCSCC(C)(C)F 62a_100011997219_100009814379 [0,2,0,0,0,0|1,0,0]=3 13249 B16R0.3231 CCOC(=O)CCCCCCSCC(C)(C)O 62a_100000764493_100009814379 [0,2,0,0,0,0|1,0,0]=3 13250 B16R0.3231 CCOC(=O)CCCCCCSCC(F)(F)F 62a_100000763148_100009814379 [0,2,0,0,0,0|2,0,0]=4 13251 B16R0.3231 CCOC(=O)CCCCCCSC[N+](C)(C)C 62a_200000036245_100009814379 [0,2,0,0,0,0|2,0,0]=4 13252 B16R0.3231 CCOC(=O)CCCCCCSC[Si](C)(C)C 62a_100000037933_100009814379 [0,2,0,0,0,0|1,1,0]=4 13253 B16R0.3231 CCOC(=O)CCCCCNCCC(C)(C)C 2230a_100000738805_100000755133 [0,2,0,0,0,0|1,0,0]=3 13254 B16R0.3231 CCOC(=O)CCCCCNCCC(C)(C)F 2230a_100016253952_100000755133 [0,2,0,0,0,0|1,0,0]=3 13255 B16R0.3231 CCOC(=O)CCCCCNCCC(F)(F)F 2230a_100000740434_100000755133 [0,2,0,0,0,0|2,0,0]=4 13256 B16R0.3231 CCOC(=O)CCCCCNCCC(F)(F)F 34a_100000740434_100000755133 [0,2,0,0,0,0|2,0,0]=4 13257 B16R0.3231 CCOC(=O)CCCCCNCCS(=O)(=O)C 2230a_100000740961_100000755133 [0,2,0,0,0,0|2,0,0]=4 13258 B16R0.3231 CCOC(=O)CCCCCNCCS(=O)(=O)C 34a_100000740961_100000755133 [0,2,0,0,0,0|2,0,0]=4 13259 B16R0.3231 CCOC(=O)CCCCCOCCC(C)(C)C 7a_100000765024_100000755133 [0,2,0,0,0,0|1,0,0]=3 13260 B16R0.3231 CCOC(=O)CCCCCOCCC(C)(C)C 7a_100011214988_100000755188 [0,2,0,0,0,0|1,0,0]=3 13261 B16R0.3231 CCOC(=O)CCCCCOCCC(C)(C)O 7a_100011214988_100000702414 [0,2,0,0,0,0|1,0,0]=3 13262 B16R0.3231 CCOC(=O)CCCCCOCCC(F)(F)F 34a_100000752437_100000755133 [0,2,0,0,0,0|2,0,0]=4 13263 B16R0.3231 CCOC(=O)CCCCCOCCC(F)(F)F 7a_100011214988_100011219754 [0,2,0,0,0,0|2,0,0]=4 13264 B16R0.3231 CCOC(=O)CCCCCOCCS(=O)(=O)C 34a_100000211924_100000755133 [0,2,0,0,0,0|2,0,0]=4 13265 B16R0.3231 CCOC(=O)CCCCCOCCS(=O)(=O)C 7a_100000211924_100000755133 [0,2,0,0,0,0|2,0,0]=4 13266 B16R0.3231 CCOC(=O)CCCCCOCCS(=O)(=O)C 7a_100011214988_100000230027 [0,2,0,0,0,0|2,0,0]=4 13267 B16R0.3231 CCOC(=O)CCCCCOCC[N+](C)(C)C 7a_100011214988_100000085578 [0,2,0,0,0,0|2,0,0]=4 13268 B16R0.3231 CCOC(=O)CCCCCOCC[N+](C)(C)C 7a_200020618287_100000755133 [0,2,0,0,0,0|2,0,0]=4 13269 B16R0.3231 CCOC(=O)CCCCCOCC[Si](C)(C)C 7a_100000039746_100000755133 [0,2,0,0,0,0|1,1,0]=4 13270 B16R0.3231 CCOC(=O)CCCCCOCC[Si](C)(C)C 7a_100011214988_200000733723 [0,2,0,0,0,0|1,1,0]=4 13271 B16R0.3231 CCOC(=O)CCCCCSCCC(C)(C)C 62a_100000755133_100000755188 [0,2,0,0,0,0|1,0,0]=3 13272 B16R0.3231 CCOC(=O)CCCCCSCCC(C)(C)C 62a_100000755188_100000755133 [0,2,0,0,0,0|1,0,0]=3 13273 B16R0.3231 CCOC(=O)CCCCCSCCC(C)(C)O 62a_100000702414_100000755133 [0,2,0,0,0,0|1,0,0]=3 13274 B16R0.3231 CCOC(=O)CCCCCSCCC(C)(C)O 62a_100000755133_100000702414 [0,2,0,0,0,0|1,0,0]=3 13275 B16R0.3231 CCOC(=O)CCCCCSCCC(F)(F)F 62a_100000755133_100011219754 [0,2,0,0,0,0|2,0,0]=4 13276 B16R0.3231 CCOC(=O)CCCCCSCCC(F)(F)F 62a_100011219754_100000755133 [0,2,0,0,0,0|2,0,0]=4 13277 B16R0.3231 CCOC(=O)CCCCCSCCS(=O)(=O)C 62a_100000731031_100000755133 [0,2,0,0,0,0|2,0,0]=4 13278 B16R0.3231 CCOC(=O)CCCCCSCCS(=O)(=O)C 62a_100000755133_100000230027 [0,2,0,0,0,0|2,0,0]=4 13279 B16R0.3231 CCOC(=O)CCCCCSCC[N+](C)(C)C 62a_100000085578_100000755133 [0,2,0,0,0,0|2,0,0]=4 13280 B16R0.3231 CCOC(=O)CCCCCSCC[N+](C)(C)C 62a_100000755133_100000085578 [0,2,0,0,0,0|2,0,0]=4 13281 B16R0.3231 CCOC(=O)CCCCCSCC[Si](C)(C)C 62a_100000755133_200000733723 [0,2,0,0,0,0|1,1,0]=4 13282 B16R0.3231 CCOC(=O)CCCCCSCC[Si](C)(C)C 62a_200000733723_100000755133 [0,2,0,0,0,0|1,1,0]=4 13283 B16R0.3231 CCOC(=O)CCCCNCCCC(F)(F)F 2230a_100000727188_100000750268 [0,2,0,0,0,0|2,0,0]=4 13284 B16R0.3231 CCOC(=O)CCCCNCCCC(F)(F)F 34a_100000727188_100000750268 [0,2,0,0,0,0|2,0,0]=4 13285 B16R0.3231 CCOC(=O)CCCCNCCCS(=O)(=O)C 2230a_100000742409_100000750268 [0,2,0,0,0,0|2,0,0]=4 13286 B16R0.3231 CCOC(=O)CCCCNCCCS(=O)(=O)C 34a_100000742409_100000750268 [0,2,0,0,0,0|2,0,0]=4 13287 B16R0.3231 CCOC(=O)CCCCNCCOC(C)(C)C 2230a_100000747557_100000750268 [0,2,0,0,0,0|2,0,0]=4 13288 B16R0.3231 CCOC(=O)CCCCNCCSC(C)(C)C 2230a_100000689375_100000750268 [0,2,0,0,0,0|2,0,0]=4 13289 B16R0.3231 CCOC(=O)CCCCOCCCC(F)(F)F 34a_100000749235_100000750268 [0,2,0,0,0,0|2,0,0]=4 13290 B16R0.3231 CCOC(=O)CCCCOCCCS(=O)(=O)C 34a_100000689940_100000750268 [0,2,0,0,0,0|2,0,0]=4 13291 B16R0.3231 CCOC(=O)CCCCOCCCS(=O)(=O)C 7a_100000689940_100000750268 [0,2,0,0,0,0|2,0,0]=4 13292 B16R0.3231 CCOC(=O)CCCCOCCC[Si](C)(C)C 7a_200011215415_100000750268 [0,2,0,0,0,0|1,1,0]=4 13293 B16R0.3231 CCOC(=O)CCCCOCCOC(C)(C)C 34a_100000693234_100000750268 [0,2,0,0,0,0|2,0,0]=4 13294 B16R0.3231 CCOC(=O)CCCCOCCOC(C)(C)C 7a_100000693234_100000750268 [0,2,0,0,0,0|2,0,0]=4 13295 B16R0.3231 CCOC(=O)CCCCSCCCC(C)(C)O 62a_100000750268_100009888830 [0,2,0,0,0,0|1,0,0]=3 13296 B16R0.3231 CCOC(=O)CCCCSCCCC(C)(C)O 62a_100009888830_100000750268 [0,2,0,0,0,0|1,0,0]=3 13297 B16R0.3231 CCOC(=O)CCCCSCCCC(F)(F)F 62a_100000750268_100011216173 [0,2,0,0,0,0|2,0,0]=4 13298 B16R0.3231 CCOC(=O)CCCCSCCCC(F)(F)F 62a_100011216173_100000750268 [0,2,0,0,0,0|2,0,0]=4 13299 B16R0.3231 CCOC(=O)CCCCSCCCS(=O)(=O)C 62a_100000750268_100000754308 [0,2,0,0,0,0|2,0,0]=4 13300 B16R0.3231 CCOC(=O)CCCCSCCCS(=O)(=O)C 62a_100000754308_100000750268 [0,2,0,0,0,0|2,0,0]=4 13301 B16R0.3231 CCOC(=O)CCCCSCCC[N+](C)(C)C 62a_100000750268_100016990835 [0,2,0,0,0,0|2,0,0]=4 13302 B16R0.3231 CCOC(=O)CCCCSCCC[N+](C)(C)C 62a_100016990835_100000750268 [0,2,0,0,0,0|2,0,0]=4 13303 B16R0.3231 CCOC(=O)CCCCSCCC[Si](C)(C)C 62a_100000750268_100011219597 [0,2,0,0,0,0|1,1,0]=4 13304 B16R0.3231 CCOC(=O)CCCCSCCC[Si](C)(C)C 62a_100011219597_100000750268 [0,2,0,0,0,0|1,1,0]=4 13305 B16R0.3231 CCOC(=O)CCCNCCCOC(C)(C)C 2230a_100011250582_100009991533 [0,2,0,0,0,0|2,0,0]=4 13306 B16R0.3231 CCOC(=O)CCCOCCCCC(F)(F)F 34a_100000749236_100009991533 [0,2,0,0,0,0|2,0,0]=4 13307 B16R0.3231 CCOC(=O)CCCOCCCCC(F)(F)F 7a_100000749236_100011215271 [0,2,0,0,0,0|2,0,0]=4 13308 B16R0.3231 CCOC(=O)CCCOCCCCC(F)(F)F 7a_100012001163_100000692467 [0,2,0,0,0,0|2,0,0]=4 13309 B16R0.3231 CCOC(=O)CCCOCCCC[Si](C)(C)C 7a_200009881916_100011215271 [0,2,0,0,0,0|1,1,0]=4 13310 B16R0.3231 CCOC(=O)CCCSCCCCC(F)(F)F 62a_100000692467_100009991533 [0,2,0,0,0,0|2,0,0]=4 13311 B16R0.3231 CCOC(=O)CCCSCCCCC(F)(F)F 62a_100009991533_100000692467 [0,2,0,0,0,0|2,0,0]=4 13312 B16R0.3231 CCOC(=O)CCSCCCCCC(C)(C)O 62a_100000765890_100010402123 [0,2,0,0,0,0|1,0,0]=3 13313 B16R0.3231 CCOC(=O)CCSCCCCCC(C)(C)O 62a_100010402123_100000765890 [0,2,0,0,0,0|1,0,0]=3 13314 B16R0.3231 CCOC(=O)CCSCCCCCC(F)(F)F 62a_100000765890_100010187589 [0,2,0,0,0,0|2,0,0]=4 13315 B16R0.3231 CCOC(=O)CCSCCCCCC(F)(F)F 62a_100010187589_100000765890 [0,2,0,0,0,0|2,0,0]=4 13316 B16R0.3231 CCOC(=O)CCSCCCCC[N+](C)(C)C 62a_100000765890_100009813293 [0,2,0,0,0,0|2,0,0]=4 13317 B16R0.3231 CCOC(=O)CCSCCCCC[N+](C)(C)C 62a_100009813293_100000765890 [0,2,0,0,0,0|2,0,0]=4 13318 B16R0.3231 CCOC(=O)COCCCNCCC(C)(C)C 2230a_100000738805_100009893628 [0,2,0,0,0,0|2,0,0]=4 13319 B16R0.3231 CCOC(=O)COCCCNCCC(C)(C)F 2230a_100016253952_100009893628 [0,2,0,0,0,0|2,0,0]=4 13320 B16R0.3231 CCOC(=O)COCCCOCCC(C)(C)C 7a_100000765024_100009893628 [0,2,0,0,0,0|2,0,0]=4 13321 B16R0.3231 CCOC(=O)COCCCSCCC(C)(C)C 62a_100000755188_100009893628 [0,2,0,0,0,0|2,0,0]=4 13322 B16R0.3231 CCOC(=O)COCCCSCCC(C)(C)C 62a_100009893628_100000755188 [0,2,0,0,0,0|2,0,0]=4 13323 B16R0.3231 CCOC(=O)COCCCSCCC(C)(C)O 62a_100000702414_100009893628 [0,2,0,0,0,0|2,0,0]=4 13324 B16R0.3231 CCOC(=O)COCCCSCCC(C)(C)O 62a_100009893628_100000702414 [0,2,0,0,0,0|2,0,0]=4 13325 B16R0.3231 CCOC(=O)COCCSCCCC(C)(C)O 62a_100000088970_100009888830 [0,2,0,0,0,0|2,0,0]=4 13326 B16R0.3231 CCOC(=O)COCCSCCCC(C)(C)O 62a_100009888830_100000088970 [0,2,0,0,0,0|2,0,0]=4 13327 B16R0.3231 CCOC(=O)CSCCCCCC[N+](C)(C)C 62a_100000188475_100009996864 [0,2,0,0,0,0|2,0,0]=4 13328 B16R0.3231 CCOC(=O)CSCCCCCC[N+](C)(C)C 62a_100009996864_100000188475 [0,2,0,0,0,0|2,0,0]=4 13329 B16R0.3231 CCOC(=O)CSCCOCCCC(C)(C)O 7a_200000230590_100009888830 [0,2,0,0,0,0|2,0,0]=4 13330 B16R0.3231 CCOC(=O)OCSCCCCCC(C)(C)O 62a_100010402123_100000075025 [0,2,0,0,0,0|2,0,0]=4 13331 B16R0.5761 CCNC(=O)CCC(=O)CCCCCC(C)C 1458a_100000199579_100000210682 [0,2,0,0,0,0|1,0,1]=4 13332 B16R0.5761 CCOC(=O)CCC(=O)CCCCCC(C)C 1458a_100000183558_100000210682 [0,2,0,0,0,0|0,0,1]=3 13333 B16R0.5761 CCOC(=O)CCC(C)NCCCOC(C)C 2230a_100000737246_100000748298 [0,2,0,0,0,0|2,0,0]=4 13334 B16R0.5761 CCOC(=O)CCC(C)NCCCOC(C)C 34a_100000737246_100000748298 [0,2,0,0,0,0|2,0,0]=4 13335 B16R0.5761 CCOC(=O)CCC(C)OCCCCC(C)C 34a_100011214890_100000748298 [0,2,0,0,0,0|1,0,0]=3 13336 B16R0.5761 CCOC(=O)CCC(C)OCCCCC(C)C 7a_100011214890_100000748298 [0,2,0,0,0,0|1,0,0]=3 13337 B16R0.5761 CCOC(=O)CCC(C)OCCCNC(C)C 34a_100000182298_100000748298 [0,2,0,0,0,0|2,0,0]=4 13338 B16R0.5761 CCOC(=O)CCC(C)OCCNCC(C)C 34a_100015185251_100000748298 [0,2,0,0,0,0|2,0,0]=4 13339 B16R0.5761 CCOC(=O)CCC(C)OCCOCC(C)C 34a_100000703358_100000748298 [0,2,0,0,0,0|2,0,0]=4 13340 B16R0.5761 CCOC(=O)CCC(C)OCCOCC(C)C 7a_100000703358_100000748298 [0,2,0,0,0,0|2,0,0]=4 13341 B16R0.5761 CCOC(=O)CCC(C)OCCSCC(C)C 34a_200000230437_100000748298 [0,2,0,0,0,0|2,0,0]=4 13342 B16R0.5761 CCOC(=O)CCC(C)OCCSCC(C)C 7a_200000230437_100000748298 [0,2,0,0,0,0|2,0,0]=4 13343 B16R0.5761 CCOC(=O)CCC(C)SCCCCC(=O)C 62a_100000735457_100000748298 [0,2,0,0,0,0|1,0,1]=4 13344 B16R0.5761 CCOC(=O)CCC(C)SCCCCC(=O)C 62a_100000748298_100000735457 [0,2,0,0,0,0|1,0,1]=4 13345 B16R0.5761 CCOC(=O)CCC(C)SCCCCC(C)C 62a_100000748298_100011216152 [0,2,0,0,0,0|1,0,0]=3 13346 B16R0.5761 CCOC(=O)CCC(C)SCCCCC(C)C 62a_100011216152_100000748298 [0,2,0,0,0,0|1,0,0]=3 13347 B16R0.5761 CCOC(=O)CCC(C)SCCCCN(C)C 62a_100000748298_100000690147 [0,2,0,0,0,0|2,0,0]=4 13348 B16R0.5761 CCOC(=O)CCN(C)CCCCCC(C)C 2230a_100000745921_100000210682 [0,2,0,0,0,0|1,0,0]=3 13349 B16R0.5761 CCOC(=O)CCN(C)CCCCCC(C)C 269982a_100000745921_100000210682 [0,2,0,0,0,0|1,0,0]=3 13350 B16R0.5761 CCOC(=O)CNC(=O)CCCCCC(C)C 188690a_100000741813_100000766313 [0,2,0,0,0,0|1,0,1]=4 13351 B16R0.5761 CCOC(=O)NCC(=O)CCCCCC(C)C 1458a_100000190774_100000210682 [0,2,0,0,0,0|1,0,1]=4 13352 B16R0.115 C=C(CN(C)CCCCCCC)C(=O)OCC 269982a_100000228206_100000755967 [0,2,0,0,0,0|1,0,1]=4 13353 B16R0.115 CCCCCCCC(=O)N[C@H](C)C(=O)OCC 188690a_100016988386_100000211969 [0,2,0,0,0,0|1,0,1]=4 13354 B16R0.115 CCCCCCCC(C)NC(C)C(=O)NCC 2230a_100000736553_200011218727 [0,2,0,0,0,0|2,0,0]=4 13355 B16R0.115 CCCCCCCC(C)NC(C)C(=O)NCC 270004a_100000736553_100000210596 [0,2,0,0,0,0|2,0,0]=4 13356 B16R0.115 CCCCCCCC(C)NC(C)C(=O)NCC 34a_100000736553_200011218727 [0,2,0,0,0,0|2,0,0]=4 13357 B16R0.115 CCCCCCCC(C)N[C@@H](C)C(=O)SCC 2230a_100103168634_200011218727 [0,2,0,0,0,0|1,1,0]=4 13358 B16R0.115 CCCCCCCC(C)OC(C)C(=O)NCC 34a_200011215852_100000230173 [0,2,0,0,0,0|2,0,0]=4 13359 B16R0.115 CCCCCCCC(C)OC(C)C(=O)NCC 7a_200011215852_100000230173 [0,2,0,0,0,0|2,0,0]=4 13360 B16R0.115 CCCCCCCC(C)OC(C)C(=O)OCC 34a_200011215852_100011216346 [0,2,0,0,0,0|1,0,0]=3 13361 B16R0.115 CCCCCCCC(C)OC(C)C(=O)OCC 7a_200011215852_100011216346 [0,2,0,0,0,0|1,0,0]=3 13362 B16R0.115 CCCCCCCC(C)OC(F)C(=O)OCC 34a_200011215852_100000760018 [0,2,0,0,0,0|1,0,0]=3 13363 B16R0.115 CCCCCCCC(C)OC(F)C(=O)OCC 7a_200011215852_100000040065 [0,2,0,0,0,0|1,0,0]=3 13364 B16R0.115 CCCCCCCC(C)O[C@@H](C)C(=O)OCC 7a_100000751109_200011218727 [0,2,0,0,0,0|1,0,0]=3 13365 B16R0.115 CCCCCCCC(C)SC(C)C(=O)NCC 62a_100000230173_200011218727 [0,2,0,0,0,0|2,0,0]=4 13366 B16R0.115 CCCCCCCC(C)SC(C)C(=O)NCC 62a_200011218727_100000230173 [0,2,0,0,0,0|2,0,0]=4 13367 B16R0.115 CCCCCCCC(C)SC(C)C(=O)OCC 62a_100011216346_200011218727 [0,2,0,0,0,0|1,0,0]=3 13368 B16R0.115 CCCCCCCC(C)SC(C)C(=O)OCC 62a_200011218727_100011216346 [0,2,0,0,0,0|1,0,0]=3 13369 B16R0.115 CCCCCCCC(C)SC(F)C(=O)OCC 62a_100000760018_200011218727 [0,2,0,0,0,0|1,0,0]=3 13370 B16R0.115 CCCCCCCC(C)SC(F)C(=O)OCC 62a_200011218727_100000760018 [0,2,0,0,0,0|1,0,0]=3 13371 B16R0.115 CCCCCCCN(C)CC(=O)C(=O)OCC 269982a_100000228206_100000211299 [0,2,0,0,0,0|1,0,1]=4 13372 B16R0.127 CCCCCCCC(C)OCC(=O)N(C)CC 34a_200011215852_100000738999 [0,2,0,0,0,0|2,0,0]=4 13373 B16R0.127 CCCCCCCC(C)OCC(=O)N(C)CC 7a_200011215852_100000738999 [0,2,0,0,0,0|2,0,0]=4 13374 B16R0.127 CCCCCCCC(C)SCC(=O)N(C)CC 62a_100000738999_200011218727 [0,2,0,0,0,0|2,0,0]=4 13375 B16R0.127 CCCCCCCC(C)SCC(=O)N(C)CC 62a_200011218727_100000738999 [0,2,0,0,0,0|2,0,0]=4 13376 B16R0.137 C#CCCCCCCC(=O)CCC(=O)OCC 1458a_100000183558_100012276617 [0,2,0,0,0,0|0,0,2]=4 13377 B16R0.137 C#CCCCCCCN(C)CCC(=O)OCC 2230a_100000745921_100012276617 [0,2,0,0,0,0|0,0,2]=4 13378 B16R0.137 C#CCCCCCCN(C)CCC(=O)OCC 269982a_100000745921_100012276617 [0,2,0,0,0,0|0,0,2]=4 13379 B16R0.137 C#CCCCCCOC(C)CCC(=O)OCC 34a_100000766912_100000748298 [0,2,0,0,0,0|0,0,2]=4 13380 B16R0.137 C#CCCCCCOC(C)CCC(=O)OCC 7a_100000766912_100000748298 [0,2,0,0,0,0|0,0,2]=4 13381 B16R0.137 C#CCCCCCSC(C)CCC(=O)OCC 62a_100000748298_100012094781 [0,2,0,0,0,0|0,0,2]=4 13382 B16R0.137 C#CCCCCCSC(C)CCC(=O)OCC 62a_100012094781_100000748298 [0,2,0,0,0,0|0,0,2]=4 13383 B16R0.137 C=CCCCCCCC(=O)CCC(=O)OCC 1458a_100000183558_100011215473 [0,2,0,0,0,0|0,0,2]=4 13384 B16R0.137 C=CCCCCCCN(C)CCC(=O)OCC 2230a_100000745921_100011215473 [0,2,0,0,0,0|0,0,2]=4 13385 B16R0.137 C=CCCCCCCN(C)CCC(=O)OCC 269982a_100000745921_100011215473 [0,2,0,0,0,0|0,0,2]=4 13386 B16R0.137 C=CCCCCCOC(C)CCC(=O)OCC 34a_100011216702_100000748298 [0,2,0,0,0,0|0,0,2]=4 13387 B16R0.137 C=CCCCCCOC(C)CCC(=O)OCC 7a_100011216702_100000748298 [0,2,0,0,0,0|0,0,2]=4 13388 B16R0.137 C=CCCCCCSC(C)CCC(=O)OCC 62a_100000700193_100000748298 [0,2,0,0,0,0|0,0,2]=4 13389 B16R0.137 C=CCCCCCSC(C)CCC(=O)OCC 62a_100000748298_100000700193 [0,2,0,0,0,0|0,0,2]=4 13390 B16R0.137 C=COC(=O)COC(C)CCCCCCCC 34a_100000210740_100000036128 [0,2,0,0,0,0|0,0,2]=4 13391 B16R0.137 CC/C=C/CCCOC(C)CCC(=O)OCC 34a_100016287902_100000748298 [0,2,0,0,0,0|0,0,2]=4 13392 B16R0.137 CC/C=C/CCCOC(C)CCC(=O)OCC 7a_100016287902_100000748298 [0,2,0,0,0,0|0,0,2]=4 13393 B16R0.137 CCCC#CCCOC(C)CCC(=O)OCC 34a_100000042726_100000748298 [0,2,0,0,0,0|0,0,2]=4 13394 B16R0.137 CCCC#CCCOC(C)CCC(=O)OCC 7a_100000042726_100000748298 [0,2,0,0,0,0|0,0,2]=4 13395 B16R0.137 CCCC/C=C/COC(C)CCC(=O)OCC 34a_200016272032_100000748298 [0,2,0,0,0,0|0,0,2]=4 13396 B16R0.137 CCCC/C=C/COC(C)CCC(=O)OCC 7a_200016272032_100000748298 [0,2,0,0,0,0|0,0,2]=4 13397 B16R0.137 CCCCC#CCOC(C)CCC(=O)OCC 34a_200000034558_100000748298 [0,2,0,0,0,0|0,0,2]=4 13398 B16R0.137 CCCCC#CCOC(C)CCC(=O)OCC 7a_200000034558_100000748298 [0,2,0,0,0,0|0,0,2]=4 13399 B16R0.137 CCCCCC#CCC(=O)CCC(=O)OCC 1458a_100000183558_100009816472 [0,2,0,0,0,0|0,0,2]=4 13400 B16R0.137 CCCCCC#CCN(C)CCC(=O)OCC 2230a_100000745921_100009816472 [0,2,0,0,0,0|0,0,2]=4 13401 B16R0.137 CCCCCC#CCN(C)CCC(=O)OCC 269982a_100000745921_100009816472 [0,2,0,0,0,0|0,0,2]=4 13402 B16R0.137 CCCCCCCCC(=O)C=CC(=O)OCC 1458a_100000210415_100000210759 [0,2,0,0,0,0|0,0,2]=4 13403 B16R0.137 CCCCCCCCC(=O)CCC(=O)NCC 1458a_100000199579_100000210759 [0,2,0,0,0,0|1,0,0]=3 13404 B16R0.137 CCCCCCCCC(=O)CCC(=O)OCC 1458a_100000183558_100000210759 [0,2,0,0,0,0|0,0,0]=2 13405 B16R0.137 CCCCCCCCC(=O)CNC(=O)OCC 1458a_100000190774_100000210759 [0,2,0,0,0,0|0,0,1]=3 13406 B16R0.137 CCCCCCCCC(=O)COC(=O)CCC 1458a_100000210188_100000034017 [0,2,0,0,0,0|1,0,1]=4 13407 B16R0.137 CCCCCCCCC(=O)NCC(=O)NCC 11a_100016988866_100000210188 [0,2,0,0,0,0|1,0,1]=4 13408 B16R0.137 CCCCCCCCC(=O)NCC(=O)NCC 1626a_100016988866_100000210188 [0,2,0,0,0,0|1,0,1]=4 13409 B16R0.137 CCCCCCCCC(=O)NCC(=O)NCC 240690a_100016988866_100000210188 [0,2,0,0,0,0|1,0,1]=4 13410 B16R0.137 CCCCCCCCC(=O)NCC(=O)NCC 527a_100016988866_100000210188 [0,2,0,0,0,0|1,0,1]=4 13411 B16R0.137 CCCCCCCCC(=O)NCC(=O)OCC 188690a_100000741813_100000210188 [0,2,0,0,0,0|0,0,1]=3 13412 B16R0.137 CCCCCCCCC(C)NCC(=O)NCC 270004a_100016988866_100011216694 [0,2,0,0,0,0|1,0,0]=3 13413 B16R0.137 CCCCCCCCC(C)OCC(=O)CCC 7a_100000210740_100000747444 [0,2,0,0,0,0|1,0,0]=3 13414 B16R0.137 CCCCCCCCC(C)OCC(=O)NCC 34a_100000210740_100000183381 [0,2,0,0,0,0|1,0,0]=3 13415 B16R0.137 CCCCCCCCC(C)OCC(=O)NCC 7a_100000210740_100000183381 [0,2,0,0,0,0|1,0,0]=3 13416 B16R0.137 CCCCCCCCC(C)OCC(=O)NCO 34a_100000210740_100000185155 [0,2,0,0,0,0|2,0,0]=4 13417 B16R0.137 CCCCCCCCC(C)OCC(=O)NCO 7a_100000210740_100000185155 [0,2,0,0,0,0|2,0,0]=4 13418 B16R0.137 CCCCCCCCC(C)OCC(=O)OCC 34a_100000210740_100000188475 [0,2,0,0,0,0|0,0,0]=2 13419 B16R0.137 CCCCCCCCC(C)OCC(=O)OCC 7a_100000210740_100000188475 [0,2,0,0,0,0|0,0,0]=2 13420 B16R0.137 CCCCCCCCN(C)CCC(=O)NCC 2230a_100000207567_100000737597 [0,2,0,0,0,0|1,0,0]=3 13421 B16R0.137 CCCCCCCCN(C)CCC(=O)NCC 269982a_100000207567_100000737597 [0,2,0,0,0,0|1,0,0]=3 13422 B16R0.137 CCCCCCCCN(C)CCC(=O)OCC 2230a_100000207567_100011206558 [0,2,0,0,0,0|0,0,0]=2 13423 B16R0.137 CCCCCCCCN(C)CCC(=O)OCC 2230a_100000745921_100000210759 [0,2,0,0,0,0|0,0,0]=2 13424 B16R0.137 CCCCCCCCN(C)CCC(=O)OCC 269982a_100000207567_100011206558 [0,2,0,0,0,0|0,0,0]=2 13425 B16R0.137 CCCCCCCCN(C)CCC(=O)OCC 269982a_100000745921_100000210759 [0,2,0,0,0,0|0,0,0]=2 13426 B16R0.137 CCCCCCCCN(C)COC(=O)CCC 2230a_100000207567_100000034017 [0,2,0,0,0,0|2,0,0]=4 13427 B16R0.137 CCCCCCCCN(C)COC(=O)CCC 269982a_100000207567_100000034017 [0,2,0,0,0,0|2,0,0]=4 13428 B16R0.137 CCCCCCCNC(=O)CCC(=O)NCC 11a_100000229938_100000199579 [0,2,0,0,0,0|1,0,1]=4 13429 B16R0.137 CCCCCCCNC(=O)CCC(=O)NCC 1626a_100000229938_100000199579 [0,2,0,0,0,0|1,0,1]=4 13430 B16R0.137 CCCCCCCNC(=O)CCC(=O)NCC 240690a_100000229938_100000199579 [0,2,0,0,0,0|1,0,1]=4 13431 B16R0.137 CCCCCCCNC(=O)CCC(=O)OCC 11a_100000229938_100000183558 [0,2,0,0,0,0|0,0,1]=3 13432 B16R0.137 CCCCCCCNC(=O)CCC(=O)OCC 1626a_100000229938_100000183558 [0,2,0,0,0,0|0,0,1]=3 13433 B16R0.137 CCCCCCCNC(=O)CCC(=O)OCC 240690a_100000229938_100000183558 [0,2,0,0,0,0|0,0,1]=3 13434 B16R0.137 CCCCCCCNC(=O)CNC(=O)OCC 11a_100000229938_100000190774 [0,2,0,0,0,0|1,0,1]=4 13435 B16R0.137 CCCCCCCNC(=O)CNC(=O)OCC 1626a_100000229938_100000190774 [0,2,0,0,0,0|1,0,1]=4 13436 B16R0.137 CCCCCCCNC(=O)CNC(=O)OCC 240690a_100000229938_100000190774 [0,2,0,0,0,0|1,0,1]=4 13437 B16R0.137 CCCCCCCNC(=O)CNC(=O)OCC 527a_100000229938_100000190774 [0,2,0,0,0,0|1,0,1]=4 13438 B16R0.137 CCCCCCCNC(C)CCC(=O)OCC 2230a_100000229938_100000748298 [0,2,0,0,0,0|0,0,0]=2 13439 B16R0.137 CCCCCCCOC(C)CCC(=O)OCC 34a_100000210272_100000748298 [0,2,0,0,0,0|0,0,0]=2 13440 B16R0.137 CCCCCCCOC(C)CCC(=O)OCC 7a_100000210272_100000748298 [0,2,0,0,0,0|0,0,0]=2 13441 B16R0.137 CCCCCCCSC(C)CCC(=O)OCC 62a_100000210614_100000748298 [0,2,0,0,0,0|0,0,0]=2 13442 B16R0.137 CCCCCCCSC(C)CCC(=O)OCC 62a_100000748298_100000210316 [0,2,0,0,0,0|0,0,0]=2 13443 B16R0.137 CCCCCCNCC(=O)NCC(=O)OCC 2230a_100000210581_100011215850 [0,2,0,0,0,0|1,0,1]=4 13444 B16R0.137 CCCCCCOCC(=O)NCC(=O)OCC 34a_100000210259_100011215850 [0,2,0,0,0,0|1,0,1]=4 13445 B16R0.137 CCCCCCOCC(=O)NCC(=O)OCC 7a_100000210259_100011215850 [0,2,0,0,0,0|1,0,1]=4 13446 B16R0.137 CCCCCCSCC(=O)NCC(=O)OCC 62a_100000210314_100011215850 [0,2,0,0,0,0|1,0,1]=4 13447 B16R0.137 CCCCCCSCC(=O)NCC(=O)OCC 62a_100011215850_100000210757 [0,2,0,0,0,0|1,0,1]=4 13448 B16R0.137 CCCCOCCOC(C)CCC(=O)OCC 34a_100000210238_100000748298 [0,2,0,0,0,0|1,0,0]=3 13449 B16R0.137 CCCCOCCOC(C)CCC(=O)OCC 7a_100000210238_100000748298 [0,2,0,0,0,0|1,0,0]=3 13450 B16R0.137 CCCCOCCSC(C)CCC(=O)OCC 62a_100000743108_100000748298 [0,2,0,0,0,0|1,0,0]=3 13451 B16R0.137 CCCCOCCSC(C)CCC(=O)OCC 62a_100000748298_100000743108 [0,2,0,0,0,0|1,0,0]=3 13452 B16R0.137 CCCCSCCNC(=O)CCC(=O)OCC 11a_100025743550_100000183558 [0,2,0,0,0,0|1,0,1]=4 13453 B16R0.137 CCCCSCCNC(=O)CCC(=O)OCC 1626a_100025743550_100000183558 [0,2,0,0,0,0|1,0,1]=4 13454 B16R0.137 CCCCSCCNC(=O)CCC(=O)OCC 240690a_100025743550_100000183558 [0,2,0,0,0,0|1,0,1]=4 13455 B16R0.137 CCCCSCCNC(C)CCC(=O)OCC 2230a_100025743550_100000748298 [0,2,0,0,0,0|1,0,0]=3 13456 B16R0.137 CCCCSCCOC(C)CCC(=O)OCC 34a_200000230436_100000748298 [0,2,0,0,0,0|1,0,0]=3 13457 B16R0.137 CCCCSCCOC(C)CCC(=O)OCC 7a_200000230436_100000748298 [0,2,0,0,0,0|1,0,0]=3 13458 B16R0.137 CCCOCCCNC(=O)CCC(=O)OCC 1626a_100011217757_100000183558 [0,2,0,0,0,0|1,0,1]=4 13459 B16R0.137 CCCOCCCNC(=O)CCC(=O)OCC 240690a_100011217757_100000183558 [0,2,0,0,0,0|1,0,1]=4 13460 B16R0.137 CCCOCCCNC(C)CCC(=O)OCC 2230a_100011217757_100000748298 [0,2,0,0,0,0|1,0,0]=3 13461 B16R0.137 CCCOCCCNC(C)CCC(=O)OCC 34a_100011217757_100000748298 [0,2,0,0,0,0|1,0,0]=3 13462 B16R0.137 CCNC(=O)CCC(=O)CCCCCCCO 1458a_100000199579_100000760002 [0,2,0,0,0,0|1,0,1]=4 13463 B16R0.137 CCNC(=O)CCC(=O)CCCCCCOC 1458a_100000199579_100011998445 [0,2,0,0,0,0|1,0,1]=4 13464 B16R0.137 CCOC(=O)CCC(=O)CCCCCCC#N 1458a_100000183558_100009813337 [0,2,0,0,0,0|0,0,2]=4 13465 B16R0.137 CCOC(=O)CCC(=O)CCCCCCCO 1458a_100000183558_100000760002 [0,2,0,0,0,0|0,0,1]=3 13466 B16R0.137 CCOC(=O)CCC(=O)CCCCCCOC 1458a_100000183558_100011998445 [0,2,0,0,0,0|0,0,1]=3 13467 B16R0.137 CCOC(=O)CCC(=O)CCCOCCOC 1458a_100000183558_100011216529 [0,2,0,0,0,0|1,0,1]=4 13468 B16R0.137 CCOC(=O)CCC(=O)NCCCCCCO 240690a_100000686447_100000183558 [0,2,0,0,0,0|1,0,1]=4 13469 B16R0.137 CCOC(=O)CCC(=O)NCCCCCOC 11a_100000747528_100000183558 [0,2,0,0,0,0|1,0,1]=4 13470 B16R0.137 CCOC(=O)CCC(=O)NCCCCCOC 1626a_100000747528_100000183558 [0,2,0,0,0,0|1,0,1]=4 13471 B16R0.137 CCOC(=O)CCC(=O)NCCCCCOC 240690a_100000747528_100000183558 [0,2,0,0,0,0|1,0,1]=4 13472 B16R0.137 CCOC(=O)CCC(C)NCCCCCCO 2230a_100000686447_100000748298 [0,2,0,0,0,0|1,0,0]=3 13473 B16R0.137 CCOC(=O)CCC(C)NCCCCCCO 34a_100000686447_100000748298 [0,2,0,0,0,0|1,0,0]=3 13474 B16R0.137 CCOC(=O)CCC(C)NCCCCCOC 2230a_100000747528_100000748298 [0,2,0,0,0,0|1,0,0]=3 13475 B16R0.137 CCOC(=O)CCC(C)NCCCCCOC 34a_100000747528_100000748298 [0,2,0,0,0,0|1,0,0]=3 13476 B16R0.137 CCOC(=O)CCC(C)NCCOCCOC 2230a_100000745349_100000748298 [0,2,0,0,0,0|2,0,0]=4 13477 B16R0.137 CCOC(=O)CCC(C)NCCOCCOC 34a_100000745349_100000748298 [0,2,0,0,0,0|2,0,0]=4 13478 B16R0.137 CCOC(=O)CCC(C)OCCCCCCBr 34a_100011215345_100000748298 [0,2,0,0,0,0|1,0,0]=3 13479 B16R0.137 CCOC(=O)CCC(C)OCCCCCCBr 7a_100011215345_100000748298 [0,2,0,0,0,0|1,0,0]=3 13480 B16R0.137 CCOC(=O)CCC(C)OCCCCCCCl 34a_100000766143_100000748298 [0,2,0,0,0,0|1,0,0]=3 13481 B16R0.137 CCOC(=O)CCC(C)OCCCCCCCl 7a_100000766143_100000748298 [0,2,0,0,0,0|1,0,0]=3 13482 B16R0.137 CCOC(=O)CCC(C)OCCCCCCF 34a_100000732779_100000748298 [0,2,0,0,0,0|1,0,0]=3 13483 B16R0.137 CCOC(=O)CCC(C)OCCCCCCF 7a_100000732779_100000748298 [0,2,0,0,0,0|1,0,0]=3 13484 B16R0.137 CCOC(=O)CCC(C)OCCCCCCN 34a_100000686447_100000748298 [0,2,0,0,0,0|1,0,0]=3 13485 B16R0.137 CCOC(=O)CCC(C)OCCCCCNC 34a_100000722520_100000748298 [0,2,0,0,0,0|1,0,0]=3 13486 B16R0.137 CCOC(=O)CCC(C)OCCOCCNC 34a_100000228057_100000748298 [0,2,0,0,0,0|2,0,0]=4 13487 B16R0.137 CCOC(=O)CCC(C)OCCOCCOC 34a_100011215163_100000748298 [0,2,0,0,0,0|2,0,0]=4 13488 B16R0.137 CCOC(=O)CCC(C)OCCOCCOC 7a_100011215163_100000748298 [0,2,0,0,0,0|2,0,0]=4 13489 B16R0.137 CCOC(=O)CCC(C)SCCCCCC#N 62a_100000748298_100009813376 [0,2,0,0,0,0|1,0,1]=4 13490 B16R0.137 CCOC(=O)CCC(C)SCCCCCC#N 62a_100009813376_100000748298 [0,2,0,0,0,0|1,0,1]=4 13491 B16R0.137 CCOC(=O)CCC(C)SCCCCCC=O 62a_100000139337_100000748298 [0,2,0,0,0,0|1,0,1]=4 13492 B16R0.137 CCOC(=O)CCC(C)SCCCCCC=O 62a_100000748298_100000139337 [0,2,0,0,0,0|1,0,1]=4 13493 B16R0.137 CCOC(=O)CCC(C)SCCCCCCF 62a_100000748298_100015922095 [0,2,0,0,0,0|1,0,0]=3 13494 B16R0.137 CCOC(=O)CCC(C)SCCCCCCF 62a_100015922095_100000748298 [0,2,0,0,0,0|1,0,0]=3 13495 B16R0.137 CCOC(=O)CCC(C)SCCCCCCO 62a_100000748298_100000766143 [0,2,0,0,0,0|1,0,0]=3 13496 B16R0.137 CCOC(=O)CCC(C)SCCCCCCO 62a_100000766143_100000748298 [0,2,0,0,0,0|1,0,0]=3 13497 B16R0.137 CCOC(=O)CCC(C)SCCOCCOC 62a_100000695917_100000748298 [0,2,0,0,0,0|2,0,0]=4 13498 B16R0.137 CCOC(=O)CCC(C)SCCOCCOC 62a_100000748298_100000695917 [0,2,0,0,0,0|2,0,0]=4 13499 B16R0.137 CCOC(=O)CCN(C)CCCCCCC#N 2230a_100000745921_100009813337 [0,2,0,0,0,0|1,0,1]=4 13500 B16R0.137 CCOC(=O)CCN(C)CCCCCCC#N 269982a_100000745921_100009813337 [0,2,0,0,0,0|1,0,1]=4 13501 B16R0.137 CCOC(=O)CCN(C)CCCCCCCO 2230a_100000745921_100000760002 [0,2,0,0,0,0|1,0,0]=3 13502 B16R0.137 CCOC(=O)CCN(C)CCCCCCCO 269982a_100000745921_100000760002 [0,2,0,0,0,0|1,0,0]=3 13503 B16R0.137 CCOC(=O)CCN(C)CCCCCCOC 2230a_100000745921_100011998445 [0,2,0,0,0,0|1,0,0]=3 13504 B16R0.137 CCOC(=O)CCN(C)CCCCCCOC 269982a_100000745921_100011998445 [0,2,0,0,0,0|1,0,0]=3 13505 B16R0.137 CCOC(=O)CCN(C)CCCOCCOC 2230a_100000745921_100011216529 [0,2,0,0,0,0|2,0,0]=4 13506 B16R0.137 CCOC(=O)CCN(C)CCCOCCOC 269982a_100000745921_100011216529 [0,2,0,0,0,0|2,0,0]=4 13507 B16R0.137 CCOC(=O)CNC(=O)CCCCCCCO 188690a_100000741813_100011219782 [0,2,0,0,0,0|1,0,1]=4 13508 B16R0.137 CCOC(=O)NCC(=O)CCCCCCCO 1458a_100000190774_100000760002 [0,2,0,0,0,0|1,0,1]=4 13509 B16R0.137 CCOC(=O)NCC(=O)CCCCCCOC 1458a_100000190774_100011998445 [0,2,0,0,0,0|1,0,1]=4 13510 B16R0.137 CCOCCOCCC(=O)CCC(=O)OCC 1458a_100000183558_100011211534 [0,2,0,0,0,0|1,0,1]=4 13511 B16R0.137 CCOCCOCCN(C)CCC(=O)OCC 2230a_100000745921_100011211534 [0,2,0,0,0,0|2,0,0]=4 13512 B16R0.137 CCOCCOCCN(C)CCC(=O)OCC 269982a_100000745921_100011211534 [0,2,0,0,0,0|2,0,0]=4 13513 B16R0.789 C=C(COC(C)CCCCCCC)OCOC 34a_200011215852_100000042856 [0,2,0,0,0,0|2,0,0]=4 13514 B16R0.789 C=C(CSC(C)CCCCCCC)OCOC 62a_100000042856_200011218727 [0,2,0,0,0,0|2,0,0]=4 13515 B16R0.789 C=C(CSC(C)CCCCCCC)OCOC 62a_200011218727_100000042856 [0,2,0,0,0,0|2,0,0]=4 13516 B16R0.789 C=CCOC(=O)COC(C)CCCCCCC 34a_200011215852_100000033060 [0,2,0,0,0,0|1,0,1]=4 13517 B16R0.789 C=CCOC(=O)COC(C)CCCCCCC 7a_200011215852_100000033060 [0,2,0,0,0,0|1,0,1]=4 13518 B16R0.789 C=CCOC(=O)CSC(C)CCCCCCC 62a_100000033060_200011218727 [0,2,0,0,0,0|1,0,1]=4 13519 B16R0.789 C=CCOC(=O)CSC(C)CCCCCCC 62a_200011218727_100000033060 [0,2,0,0,0,0|1,0,1]=4 13520 B16R0.789 CCCCCCCC(=O)CCC(=O)NCCC 1458a_100000199543_100000210614 [0,2,0,0,0,0|1,0,1]=4 13521 B16R0.789 CCCCCCCC(=O)COC(=O)OCCC 1458a_100000211969_200000139673 [0,2,0,0,0,0|1,0,1]=4 13522 B16R0.789 CCCCCCCC(=O)OCC(=O)COCC 1458a_100000211967_100009852258 [0,2,0,0,0,0|1,0,1]=4 13523 B16R0.789 CCCCCCCC(C)NCC(=O)NCCC 2230a_100000174927_200011218727 [0,2,0,0,0,0|2,0,0]=4 13524 B16R0.789 CCCCCCCC(C)NCC(=O)NCCC 270004a_100000174927_100000210596 [0,2,0,0,0,0|2,0,0]=4 13525 B16R0.789 CCCCCCCC(C)NCC(=O)NCCF 2230a_100000725713_200011218727 [0,2,0,0,0,0|2,0,0]=4 13526 B16R0.789 CCCCCCCC(C)NCC(=O)NCCF 270004a_100000725713_100000210596 [0,2,0,0,0,0|2,0,0]=4 13527 B16R0.789 CCCCCCCC(C)OCC(=O)NCCC 34a_200011215852_100000183358 [0,2,0,0,0,0|2,0,0]=4 13528 B16R0.789 CCCCCCCC(C)OCC(=O)NCCC 7a_200011215852_100000183358 [0,2,0,0,0,0|2,0,0]=4 13529 B16R0.789 CCCCCCCC(C)OCC(=O)OCCC 34a_200011215852_200011215008 [0,2,0,0,0,0|1,0,0]=3 13530 B16R0.789 CCCCCCCC(C)OCC(=O)OCCC 7a_200011215852_200011215008 [0,2,0,0,0,0|1,0,0]=3 13531 B16R0.789 CCCCCCCC(C)SCC(=O)NCCC 62a_100000183358_200011218727 [0,2,0,0,0,0|2,0,0]=4 13532 B16R0.789 CCCCCCCC(C)SCC(=O)NCCC 62a_200011218727_100000183358 [0,2,0,0,0,0|2,0,0]=4 13533 B16R0.789 CCCCCCCC(C)SCC(=O)OCCC 62a_200011215008_200011218727 [0,2,0,0,0,0|1,0,0]=3 13534 B16R0.789 CCCCCCCC(C)SCC(=O)OCCC 62a_200011218727_200011215008 [0,2,0,0,0,0|1,0,0]=3 13535 B16R0.789 CCCCCCCN(C)COC(=O)OCCC 269982a_100000228206_200000139673 [0,2,0,0,0,0|2,0,0]=4 13536 B16R0.946 C=CC(CCCCCCC)OCC(=O)CCC 7a_200011934235_100000747444 [0,2,0,0,0,0|2,0,0]=4 13537 B16R0.946 C=CC(CCCCCCC)OCC(=O)NCC 34a_200011934235_100000183381 [0,2,0,0,0,0|2,0,0]=4 13538 B16R0.946 C=CC(CCCCCCC)OCC(=O)NCC 7a_200011934235_100000183381 [0,2,0,0,0,0|2,0,0]=4 13539 B16R0.946 C=CC(CCCCCCC)OCC(=O)OCC 34a_200011934235_100000188475 [0,2,0,0,0,0|1,0,0]=3 13540 B16R0.946 C=CC(CCCCCCC)OCC(=O)OCC 7a_200011934235_100000188475 [0,2,0,0,0,0|1,0,0]=3 13541 B16R0.946 CCCCCCCC(CC)NCC(=O)NCC 270004a_100016988866_200011217162 [0,2,0,0,0,0|2,0,0]=4 13542 B16R0.946 CCCCCCCC(CC)OCC(=O)CCC 7a_200011217053_100000747444 [0,2,0,0,0,0|2,0,0]=4 13543 B16R0.946 CCCCCCCC(CC)OCC(=O)NCC 34a_200011217053_100000183381 [0,2,0,0,0,0|2,0,0]=4 13544 B16R0.946 CCCCCCCC(CC)OCC(=O)NCC 7a_200011217053_100000183381 [0,2,0,0,0,0|2,0,0]=4 13545 B16R0.946 CCCCCCCC(CC)OCC(=O)OCC 34a_200011217053_100000188475 [0,2,0,0,0,0|1,0,0]=3 13546 B16R0.946 CCCCCCCC(CC)OCC(=O)OCC 7a_200011217053_100000188475 [0,2,0,0,0,0|1,0,0]=3 13547 B16R0.946 CCCCCCCN(CC)CCC(=O)NCC 2230a_100000228213_100000737597 [0,2,0,0,0,0|2,0,0]=4 13548 B16R0.946 CCCCCCCN(CC)CCC(=O)NCC 269982a_100000228213_100000737597 [0,2,0,0,0,0|2,0,0]=4 13549 B16R0.946 CCCCCCCN(CC)CCC(=O)OCC 2230a_100000228213_100011206558 [0,2,0,0,0,0|1,0,0]=3 13550 B16R0.946 CCCCCCCN(CC)CCC(=O)OCC 2230a_200011277716_100000210681 [0,2,0,0,0,0|1,0,0]=3 13551 B16R0.946 CCCCCCCN(CC)CCC(=O)OCC 269982a_100000228213_100011206558 [0,2,0,0,0,0|1,0,0]=3 13552 B16R0.946 CCCCCCCN(CC)CCC(=O)OCC 269982a_200011277716_100000210681 [0,2,0,0,0,0|1,0,0]=3 13553 B16R0.946 CCCCOCCN(CC)CCC(=O)OCC 2230a_200011277716_100000743108 [0,2,0,0,0,0|2,0,0]=4 13554 B16R0.946 CCCCOCCN(CC)CCC(=O)OCC 269982a_200011277716_100000743108 [0,2,0,0,0,0|2,0,0]=4 13555 B16R0.946 CCOC(=O)CCN(CC)CCCCCCF 2230a_200011277716_100015922095 [0,2,0,0,0,0|2,0,0]=4 13556 B16R0.946 CCOC(=O)CCN(CC)CCCCCCF 269982a_200011277716_100015922095 [0,2,0,0,0,0|2,0,0]=4 13557 B16R0.946 CCOC(=O)CCN(CC)CCCCCCO 2230a_200011277716_100000766143 [0,2,0,0,0,0|2,0,0]=4 13558 B16R0.946 CCOC(=O)CCN(CC)CCCCCCO 269982a_200011277716_100000766143 [0,2,0,0,0,0|2,0,0]=4 13559 B16R0.3455 CCCCCC(=O)CC(=O)CCC(=O)OCC 1458a_100000183558_200012276598 [0,2,0,0,0,0|0,0,2]=4 13560 B16R0.3455 CCCCCC(=O)CN(C)CCC(=O)OCC 2230a_100000745921_200012276598 [0,2,0,0,0,0|1,0,1]=4 13561 B16R0.3455 CCCCCC(=O)CN(C)CCC(=O)OCC 269982a_100000745921_200012276598 [0,2,0,0,0,0|1,0,1]=4 13562 B16R0.3455 CCCCCC(C)NC(=O)CCC(=O)OCC 11a_100000211957_100000183558 [0,2,0,0,0,0|1,0,1]=4 13563 B16R0.3455 CCCCCC(C)NC(=O)CCC(=O)OCC 1626a_100000211957_100000183558 [0,2,0,0,0,0|1,0,1]=4 13564 B16R0.3455 CCCCCC(C)NC(=O)CCC(=O)OCC 240690a_100000211957_100000183558 [0,2,0,0,0,0|1,0,1]=4 13565 B16R0.3455 CCCCCC(C)NC(C)CCC(=O)OCC 2230a_100000211957_100000748298 [0,2,0,0,0,0|1,0,0]=3 13566 B16R0.3455 CCCCCC(C)OC(C)CCC(=O)OCC 34a_100011215632_100000748298 [0,2,0,0,0,0|1,0,0]=3 13567 B16R0.3455 CCCCCC(C)OC(C)CCC(=O)OCC 7a_100011215632_100000748298 [0,2,0,0,0,0|1,0,0]=3 13568 B16R0.3455 CCCCCC(C)SC(C)CCC(=O)OCC 62a_100000748298_200011218191 [0,2,0,0,0,0|1,0,0]=3 13569 B16R0.3455 CCCCCC(C)SC(C)CCC(=O)OCC 62a_200011218191_100000748298 [0,2,0,0,0,0|1,0,0]=3 13570 B16R0.3455 CCOC(=O)CCC(C)OC(C)CCCOC 34a_200011539412_100000748298 [0,2,0,0,0,0|2,0,0]=4 13571 B16R0.3455 CCOC(=O)CCC(C)OC(C)CCCOC 7a_200011539412_100000748298 [0,2,0,0,0,0|2,0,0]=4 13572 B16R0.5005 CCCCCCCC(C)(C)SCC(=O)NCC 62a_100000183381_200000046972 [0,2,0,0,0,0|2,0,0]=4 13573 B16R0.5005 CCCCCCCC(C)(C)SCC(=O)NCC 62a_200000046972_100000183381 [0,2,0,0,0,0|2,0,0]=4 13574 B16R0.5005 CCCCCCCC(C)(C)SCC(=O)OCC 62a_100000188475_200000046972 [0,2,0,0,0,0|1,0,0]=3 13575 B16R0.5005 CCCCCCCC(C)(C)SCC(=O)OCC 62a_200000046972_100000188475 [0,2,0,0,0,0|1,0,0]=3 13576 B16R0.5197 CCCCCCCC(=O)C(C)CC(=O)OCC 1458a_100000211969_100009817359 [0,2,0,0,0,0|0,0,1]=3 13577 B16R0.5197 CCCCCCCC(=O)N(C)CC(=O)OCC 11a_100000220588_100000211969 [0,2,0,0,0,0|1,0,1]=4 13578 B16R0.5197 CCCCCCCC(=O)N(C)CC(=O)OCC 1626a_100000220588_100000211969 [0,2,0,0,0,0|1,0,1]=4 13579 B16R0.5197 CCCCCCCC(=O)N(C)CC(=O)OCC 240690a_100000220588_100000211969 [0,2,0,0,0,0|1,0,1]=4 13580 B16R0.5197 CCCCCCCC(=O)N(C)CC(=O)OCC 527a_100000220588_100000211969 [0,2,0,0,0,0|1,0,1]=4 13581 B16R0.5197 CCCCCCCC(C)C(=O)CC(=O)OCC 1458a_100000243816_200011218727 [0,2,0,0,0,0|0,0,1]=3 13582 B16R0.5197 CCCCCCCC(C)N(C)CC(=O)NCC 2230a_100000741943_200011218727 [0,2,0,0,0,0|2,0,0]=4 13583 B16R0.5197 CCCCCCCC(C)N(C)CC(=O)NCC 269982a_100000741943_200011218727 [0,2,0,0,0,0|2,0,0]=4 13584 B16R0.5197 CCCCCCCC(C)N(C)CC(=O)NCC 270004a_100000741943_100000210596 [0,2,0,0,0,0|2,0,0]=4 13585 B16R0.5197 CCCCCCCC(C)N(C)CC(=O)OCC 2230a_100000220588_200011218727 [0,2,0,0,0,0|1,0,0]=3 13586 B16R0.5197 CCCCCCCC(C)N(C)CC(=O)OCC 270004a_100000220588_100000210596 [0,2,0,0,0,0|1,0,0]=3 13587 B16R0.5197 CCCCCCCN(C)C(=O)CC(=O)OCC 240690a_100000228206_100000243816 [0,2,0,0,0,0|1,0,1]=4 13588 B16R0.5197 CCCCCCCN(C)C(C)CC(=O)OCC 2230a_100000228206_100009817359 [0,2,0,0,0,0|1,0,0]=3 13589 B16R0.5197 CCCCCCCN(C)C(C)CC(=O)OCC 269982a_100000228206_100009817359 [0,2,0,0,0,0|1,0,0]=3 13590 B16R0.5197 CCCCCCCN(C)C(C)OC(=O)OCC 269982a_100000228206_100000036008 [0,2,0,0,0,0|2,0,0]=4 13591 B16R0.5197 CCCCCCSC(C)C(=O)CC(=O)OCC 62a_100000210314_100010090504 [0,2,0,0,0,0|1,0,1]=4 13592 B16R0.5197 CCCCCCSC(C)C(=O)CC(=O)OCC 62a_100010090504_100000210757 [0,2,0,0,0,0|1,0,1]=4 13593 B16R0.5197 CCOC(=O)CC(C)C(=O)CCCCCCO 1458a_100011996774_100009817359 [0,2,0,0,0,0|1,0,1]=4 13594 B16R0.5197 CCOC(=O)CC(C)C(=O)CCCCCOC 1458a_100011935119_100009817359 [0,2,0,0,0,0|1,0,1]=4 13595 B16R0.5760 CCOC(=O)CCC(C)OCCCC(C)CC 7a_100011216074_100000748298 [0,2,0,0,0,0|1,0,0]=3 13596 B16R0.5760 CCOC(=O)CCC(C)OCCC[C@@H](C)CN 34a_100160569302_100000748298 [0,2,0,0,0,0|2,0,0]=4 13597 B16R0.5760 CCOC(=O)CCC(C)SCCCN(C)CC 62a_100000748298_100015186262 [0,2,0,0,0,0|2,0,0]=4 13598 B16R0.99 C=C(CCC)CC(=O)CCCCC(=O)OCC 1458a_100000138376_100000750268 [0,2,0,0,0,0|0,0,2]=4 13599 B16R0.99 CCCC(=O)CC(=O)CCCCC(=O)OCC 1458a_100011217402_100000747444 [0,2,0,0,0,0|0,0,2]=4 13600 B16R0.99 CCCC(C)CC(=O)CCCCC(=O)OCC 1458a_100000748435_100000750268 [0,2,0,0,0,0|0,0,1]=3 13601 B16R0.99 CCCC(C)CC(=O)CCCCC(=O)OCC 1458a_100011217402_100011216630 [0,2,0,0,0,0|0,0,1]=3 13602 B16R0.99 CCCC(C)CC(=O)CCOCC(=O)OCC 1458a_100000748435_100000088970 [0,2,0,0,0,0|1,0,1]=4 13603 B16R0.99 CCCC(C)CC(=O)NCCCC(=O)OCC 188690a_100000211256_100000748435 [0,2,0,0,0,0|1,0,1]=4 13604 B16R0.99 CCCC(C)CCCOC(C)CC(=O)OCC 7a_100011713154_100009817359 [0,2,0,0,0,0|1,0,0]=3 13605 B16R0.99 CCCC(C)CCOC[C@@H](O)CC(=O)OCC 34a_100011217855_100000688340 [0,2,0,0,0,0|1,0,0]=3 13606 B16R0.99 CCCC(C)CCOC[C@@H](O)CC(=O)OCC 7a_100011217855_100000688340 [0,2,0,0,0,0|1,0,0]=3 13607 B16R0.99 CCCC(C)NC(=O)CCCCC(=O)OCC 11a_100000741246_100011217402 [0,2,0,0,0,0|1,0,1]=4 13608 B16R0.99 CCCC(C)NC(=O)CCCCC(=O)OCC 1626a_100000741246_100011217402 [0,2,0,0,0,0|1,0,1]=4 13609 B16R0.99 CCCC(C)NC(=O)CCCCC(=O)OCC 240690a_100000741246_100011217402 [0,2,0,0,0,0|1,0,1]=4 13610 B16R0.99 CCCC(C)NC(=O)CCCCC(=O)OCC 527a_100000741246_100011217402 [0,2,0,0,0,0|1,0,1]=4 13611 B16R0.99 CCCS(=O)CC(=O)CCCCC(=O)OCC 1458a_100011387404_100000750268 [0,2,0,0,0,0|1,0,1]=4 13612 B16R0.99 CCC[C@H](N)CCOC[C@@H](O)CC(=O)OCC 34a_100015193777_100000688340 [0,2,0,0,0,0|1,0,0]=3 13613 B16R0.99 CCOC(=O)CCCCC(=O)CC(C)SCC 1458a_200011311441_100000750268 [0,2,0,0,0,0|1,0,1]=4 13614 B16R0.99 CCOC(=O)CCCCN(C)CC(O)COC 2230a_100000739405_100000750268 [0,2,0,0,0,0|2,0,0]=4 13615 B16R0.99 CCOC(=O)CCCCN(C)CC(O)COC 269982a_100000739405_100000750268 [0,2,0,0,0,0|2,0,0]=4 13616 B16R0.183 C#CCCCCC(=O)CCCCC(=O)OCC 1458a_100000696528_100000750268 [0,2,0,0,0,0|0,0,2]=4 13617 B16R0.183 C#CCCCCC(=O)CCCCC(=O)OCC 1458a_100011217402_100010269958 [0,2,0,0,0,0|0,0,2]=4 13618 B16R0.183 C=CCCCCC(=O)CCCCC(=O)OCC 1458a_100011215552_100000750268 [0,2,0,0,0,0|0,0,2]=4 13619 B16R0.183 C=CCCCCC(=O)CCCCC(=O)OCC 1458a_100011217402_100011215482 [0,2,0,0,0,0|0,0,2]=4 13620 B16R0.183 C=CCCCCN(C)CCCCC(=O)OCC 2230a_100012000471_100000750268 [0,2,0,0,0,0|0,0,2]=4 13621 B16R0.183 C=CCCCCN(C)CCCCC(=O)OCC 269982a_100012000471_100000750268 [0,2,0,0,0,0|0,0,2]=4 13622 B16R0.183 C=COC(=O)COCCC(C)CCCCCC 34a_200011024964_100000036128 [0,2,0,0,0,0|0,0,2]=4 13623 B16R0.183 CC/C=C\CCC(=O)CCCCC(=O)OCC 1458a_100011217402_100015370543 [0,2,0,0,0,0|0,0,2]=4 13624 B16R0.183 CCC/C=C/CC(=O)CCCCC(=O)OCC 1458a_200016266809_100000750268 [0,2,0,0,0,0|0,0,2]=4 13625 B16R0.183 CCCCC=CC(=O)CCCCC(=O)OCC 1458a_100016266645_100000750268 [0,2,0,0,0,0|0,0,2]=4 13626 B16R0.183 CCCCCCC(=O)CCCCC(=O)OCC 1458a_100011217402_100000210757 [0,2,0,0,0,0|0,0,0]=2 13627 B16R0.183 CCCCCCC(=O)CCCCC(=O)OCC 1458a_100102632555_100000750268 [0,2,0,0,0,0|0,0,0]=2 13628 B16R0.183 CCCCCCC(=O)CCOCC(=O)OCC 1458a_100102632555_100000088970 [0,2,0,0,0,0|0,0,1]=3 13629 B16R0.183 CCCCCCC(=O)NCCCC(=O)OCC 188690a_100000211256_100102632555 [0,2,0,0,0,0|0,0,1]=3 13630 B16R0.183 CCCCCCC(C)CCOCC(=O)CCC 7a_200011024964_100000747444 [0,2,0,0,0,0|1,0,0]=3 13631 B16R0.183 CCCCCCC(C)CCOCC(=O)NCC 34a_200011024964_100000183381 [0,2,0,0,0,0|1,0,0]=3 13632 B16R0.183 CCCCCCC(C)CCOCC(=O)NCC 7a_200011024964_100000183381 [0,2,0,0,0,0|1,0,0]=3 13633 B16R0.183 CCCCCCC(C)CCOCC(=O)NCO 34a_200011024964_100000185155 [0,2,0,0,0,0|2,0,0]=4 13634 B16R0.183 CCCCCCC(C)CCOCC(=O)NCO 7a_200011024964_100000185155 [0,2,0,0,0,0|2,0,0]=4 13635 B16R0.183 CCCCCCC(C)CCOCC(=O)OCC 34a_200011024964_100000188475 [0,2,0,0,0,0|0,0,0]=2 13636 B16R0.183 CCCCCCC(C)CCOCC(=O)OCC 7a_200011024964_100000188475 [0,2,0,0,0,0|0,0,0]=2 13637 B16R0.183 CCCCCCC(C)NC/C=C/C(=O)OCC 2230a_100000210919_100016267167 [0,2,0,0,0,0|0,0,2]=4 13638 B16R0.183 CCCCCCC(C)NC/C=C/C(=O)OCC 34a_100000210919_100016267167 [0,2,0,0,0,0|0,0,2]=4 13639 B16R0.183 CCCCCCC(C)NCCCC(=O)OCC 2230a_100000210919_100009991533 [0,2,0,0,0,0|0,0,0]=2 13640 B16R0.183 CCCCCCC(C)NCCCC(=O)OCC 34a_100000210919_100009991533 [0,2,0,0,0,0|0,0,0]=2 13641 B16R0.183 CCCCCCC(C)OC/C=C/C(=O)OCC 34a_100000210265_100016267167 [0,2,0,0,0,0|0,0,2]=4 13642 B16R0.183 CCCCCCC(C)OC/C=C/C(=O)OCC 7a_100000210265_100016267167 [0,2,0,0,0,0|0,0,2]=4 13643 B16R0.183 CCCCCCC(C)OCCCC(=O)OCC 34a_100000210265_100009991533 [0,2,0,0,0,0|0,0,0]=2 13644 B16R0.183 CCCCCCC(C)OCCCC(=O)OCC 7a_100000210265_100011215271 [0,2,0,0,0,0|0,0,0]=2 13645 B16R0.183 CCCCCCC(C)OCCCC(=O)OCC 7a_100012001163_100011215978 [0,2,0,0,0,0|0,0,0]=2 13646 B16R0.183 CCCCCCC(C)OCCNC(=O)OCC 34a_100000158857_100011215978 [0,2,0,0,0,0|1,0,0]=3 13647 B16R0.183 CCCCCCC(C)OCCNC(=O)OCC 7a_100000210265_200011445536 [0,2,0,0,0,0|1,0,0]=3 13648 B16R0.183 CCCCCCC(C)SC/C=C/C(=O)OCC 62a_100011215978_100016267167 [0,2,0,0,0,0|0,0,2]=4 13649 B16R0.183 CCCCCCC(C)SC/C=C/C(=O)OCC 62a_100016267167_100011215978 [0,2,0,0,0,0|0,0,2]=4 13650 B16R0.183 CCCCCCC(C)SCCCC(=O)OCC 62a_100009991533_100011215978 [0,2,0,0,0,0|0,0,0]=2 13651 B16R0.183 CCCCCCC(C)SCCCC(=O)OCC 62a_100011215978_100009991533 [0,2,0,0,0,0|0,0,0]=2 13652 B16R0.183 CCCCCCC(C)SCCNC(=O)OCC 62a_100011215978_200011445536 [0,2,0,0,0,0|1,0,0]=3 13653 B16R0.183 CCCCCCN(C)CCCCC(=O)OCC 2230a_106256046315_100000750268 [0,2,0,0,0,0|0,0,0]=2 13654 B16R0.183 CCCCCCN(C)CCCCC(=O)OCC 269982a_106256046315_100000750268 [0,2,0,0,0,0|0,0,0]=2 13655 B16R0.183 CCCCCCN(C)CCOCC(=O)OCC 2230a_106256046315_100000088970 [0,2,0,0,0,0|1,0,0]=3 13656 B16R0.183 CCCCCCN(C)CCOCC(=O)OCC 269982a_106256046315_100000088970 [0,2,0,0,0,0|1,0,0]=3 13657 B16R0.183 CCCCCNC(=O)CCCCC(=O)OCC 11a_100000209983_100011217402 [0,2,0,0,0,0|0,0,1]=3 13658 B16R0.183 CCCCCNC(=O)CCCCC(=O)OCC 1626a_100000209983_100011217402 [0,2,0,0,0,0|0,0,1]=3 13659 B16R0.183 CCCCCNC(=O)CCCCC(=O)OCC 240690a_100000209983_100011217402 [0,2,0,0,0,0|0,0,1]=3 13660 B16R0.183 CCCCCNC(=O)CCCCC(=O)OCC 527a_100000209983_100011217402 [0,2,0,0,0,0|0,0,1]=3 13661 B16R0.183 CCCCCNC(=O)CSCCC(=O)OCC 62a_100000230301_100000765890 [0,2,0,0,0,0|1,0,1]=4 13662 B16R0.183 CCCCCNC(=O)CSCCC(=O)OCC 62a_100000765890_100000230301 [0,2,0,0,0,0|1,0,1]=4 13663 B16R0.183 CCCCNCC(=O)NCCCC(=O)OCC 2230a_100000102301_100000183181 [0,2,0,0,0,0|1,0,1]=4 13664 B16R0.183 CCCCNCC(=O)NCCCC(=O)OCC 7a_106832991798_100000183181 [0,2,0,0,0,0|1,0,1]=4 13665 B16R0.183 CCCCNNC(=O)CCCCC(=O)OCC 22a_100025702795_100011217402 [0,2,0,0,0,0|1,0,1]=4 13666 B16R0.183 CCCCOCC(=O)CCCCC(=O)OCC 1458a_100000757543_100000750268 [0,2,0,0,0,0|0,0,1]=3 13667 B16R0.183 CCCCOCC(=O)CCCCC(=O)OCC 1458a_100011217402_100011995733 [0,2,0,0,0,0|0,0,1]=3 13668 B16R0.183 CCCCOCC(=O)CCOCC(=O)OCC 1458a_100000757543_100000088970 [0,2,0,0,0,0|1,0,1]=4 13669 B16R0.183 CCCCOCC(=O)NCCCC(=O)OCC 188690a_100000211256_100000757543 [0,2,0,0,0,0|1,0,1]=4 13670 B16R0.183 CCCCOCC(=O)NCCCC(=O)OCC 34a_100000210227_100000183181 [0,2,0,0,0,0|1,0,1]=4 13671 B16R0.183 CCCCOCC(=O)NCCCC(=O)OCC 7a_100000210227_100000183181 [0,2,0,0,0,0|1,0,1]=4 13672 B16R0.183 CCCCOCC(C)OCCCC(=O)OCC 34a_100011217071_100009991533 [0,2,0,0,0,0|1,0,0]=3 13673 B16R0.183 CCCCOCC(C)OCCCC(=O)OCC 7a_100011217071_100011215271 [0,2,0,0,0,0|1,0,0]=3 13674 B16R0.183 CCCCOCC(C)OCCNC(=O)OCC 7a_100011217071_200011445536 [0,2,0,0,0,0|2,0,0]=4 13675 B16R0.183 CCCCSCC(=O)CCCCC(=O)OCC 1458a_100000191162_100000750268 [0,2,0,0,0,0|0,0,1]=3 13676 B16R0.183 CCCCSCC(=O)CCOCC(=O)OCC 1458a_100000191162_100000088970 [0,2,0,0,0,0|1,0,1]=4 13677 B16R0.183 CCCCSCC(=O)NCCCC(=O)OCC 188690a_100000211256_100000191162 [0,2,0,0,0,0|1,0,1]=4 13678 B16R0.183 CCCCSCC(=O)NCCCC(=O)OCC 62a_100000183181_100000210210 [0,2,0,0,0,0|1,0,1]=4 13679 B16R0.183 CCCCSCC(=O)NCCCC(=O)OCC 62a_100000210211_100000183181 [0,2,0,0,0,0|1,0,1]=4 13680 B16R0.183 CCCOCCC(=O)CCCCC(=O)OCC 1458a_100011217402_100011215938 [0,2,0,0,0,0|0,0,1]=3 13681 B16R0.183 CCOC(=O)CCCCC(=O)CCCCC#N 1458a_100011217402_100000211819 [0,2,0,0,0,0|0,0,2]=4 13682 B16R0.183 CCOC(=O)CCCCC(=O)CCCCCF 1458a_100011217402_100000729378 [0,2,0,0,0,0|0,0,1]=3 13683 B16R0.183 CCOC(=O)CCCCC(=O)CCCCCO 1458a_100011217402_100000746330 [0,2,0,0,0,0|0,0,1]=3 13684 B16R0.183 CCOC(=O)CCCCC(=O)CCCCCO 1458a_100102619762_100000750268 [0,2,0,0,0,0|0,0,1]=3 13685 B16R0.183 CCOC(=O)CCCCC(=O)CCCCOC 1458a_100011217402_100000755781 [0,2,0,0,0,0|0,0,1]=3 13686 B16R0.183 CCOC(=O)CCCCC(=O)CCOCCO 1458a_100011217402_100011215305 [0,2,0,0,0,0|1,0,1]=4 13687 B16R0.183 CCOC(=O)CCCCC(=O)CCOCCO 1458a_100011229844_100000750268 [0,2,0,0,0,0|1,0,1]=4 13688 B16R0.183 CCOC(=O)CCCCC(=O)COCCOC 1458a_100000211095_100000750268 [0,2,0,0,0,0|1,0,1]=4 13689 B16R0.183 CCOC(=O)CCCCC(=O)NCCCCO 240690a_100000750430_100011217402 [0,2,0,0,0,0|1,0,1]=4 13690 B16R0.183 CCOC(=O)CCCCC(=O)NCCCCO 527a_100000750430_100011217402 [0,2,0,0,0,0|1,0,1]=4 13691 B16R0.183 CCOC(=O)CCCCC(=O)NCCCOC 1626a_100150723488_100011217402 [0,2,0,0,0,0|1,0,1]=4 13692 B16R0.183 CCOC(=O)CCCCC(=O)NCCCOC 240690a_100150723488_100011217402 [0,2,0,0,0,0|1,0,1]=4 13693 B16R0.183 CCOC(=O)CCCCC(=O)NCCCOC 527a_100150723488_100011217402 [0,2,0,0,0,0|1,0,1]=4 13694 B16R0.183 CCOC(=O)CCCCC(=O)NCCCSC 11a_100000749238_100011217402 [0,2,0,0,0,0|1,0,1]=4 13695 B16R0.183 CCOC(=O)CCCCC(=O)NCCCSC 1626a_100000749238_100011217402 [0,2,0,0,0,0|1,0,1]=4 13696 B16R0.183 CCOC(=O)CCCCC(=O)NCCCSC 240690a_100000749238_100011217402 [0,2,0,0,0,0|1,0,1]=4 13697 B16R0.183 CCOC(=O)CCCCC(=O)NCCCSC 527a_100000749238_100011217402 [0,2,0,0,0,0|1,0,1]=4 13698 B16R0.183 CCOC(=O)CCCCC(=O)NCCSCC 11a_100000106463_100011217402 [0,2,0,0,0,0|1,0,1]=4 13699 B16R0.183 CCOC(=O)CCCCC(=O)NCCSCC 1626a_100000106463_100011217402 [0,2,0,0,0,0|1,0,1]=4 13700 B16R0.183 CCOC(=O)CCCCC(=O)NCCSCC 240690a_100000106463_100011217402 [0,2,0,0,0,0|1,0,1]=4 13701 B16R0.183 CCOC(=O)CCCCC(=O)NCCSCC 527a_100000106463_100011217402 [0,2,0,0,0,0|1,0,1]=4 13702 B16R0.183 CCOC(=O)CCCCN(C)CCCCCO 2230a_100000722520_100000750268 [0,2,0,0,0,0|1,0,0]=3 13703 B16R0.183 CCOC(=O)CCCCN(C)CCCCCO 269982a_100000722520_100000750268 [0,2,0,0,0,0|1,0,0]=3 13704 B16R0.183 CCOC(=O)CCCCN(C)CCOCCO 2230a_100000228057_100000750268 [0,2,0,0,0,0|2,0,0]=4 13705 B16R0.183 CCOC(=O)CCCCN(C)CCOCCO 269982a_100000228057_100000750268 [0,2,0,0,0,0|2,0,0]=4 13706 B16R0.183 CCOC(=O)CCCNC(=O)CCCCCO 188690a_100000211256_100102619762 [0,2,0,0,0,0|1,0,1]=4 13707 B16R0.183 CCOC(=O)COCCC(=O)CCCCCO 1458a_100102619762_100000088970 [0,2,0,0,0,0|1,0,1]=4 13708 B16R0.183 CCOC(=O)COCCN(C)CCCCCO 2230a_100000722520_100000088970 [0,2,0,0,0,0|2,0,0]=4 13709 B16R0.183 CCOC(=O)COCCN(C)CCCCCO 269982a_100000722520_100000088970 [0,2,0,0,0,0|2,0,0]=4 13710 B16R0.183 CCOCCCC(=O)CCCCC(=O)OCC 1458a_100011217402_100012232248 [0,2,0,0,0,0|0,0,1]=3 13711 B16R0.183 CCOCCNC(=O)CCCCC(=O)OCC 11a_100011200944_100011217402 [0,2,0,0,0,0|1,0,1]=4 13712 B16R0.183 CCOCCNC(=O)CCCCC(=O)OCC 1626a_102516460346_100011217402 [0,2,0,0,0,0|1,0,1]=4 13713 B16R0.183 CCOCCNC(=O)CCCCC(=O)OCC 240690a_100011200944_100011217402 [0,2,0,0,0,0|1,0,1]=4 13714 B16R0.183 CCOCCNC(=O)CCCCC(=O)OCC 527a_100011200944_100011217402 [0,2,0,0,0,0|1,0,1]=4 13715 B16R0.591 C#CC(CCCCC)OCCCC(=O)OCC 34a_100011216489_100009991533 [0,2,0,0,0,0|1,0,0]=3 13716 B16R0.591 C#CC(CCCCC)OCCCC(=O)OCC 7a_100011216489_100011215271 [0,2,0,0,0,0|1,0,0]=3 13717 B16R0.591 C#CC(CCCCC)OCCNC(=O)OCC 7a_100011216489_200011445536 [0,2,0,0,0,0|2,0,0]=4 13718 B16R0.591 C=CC(CCCCC)OCCCC(=O)OCC 34a_100011216863_100009991533 [0,2,0,0,0,0|1,0,0]=3 13719 B16R0.591 C=CC(CCCCC)OCCCC(=O)OCC 7a_100011216863_100011215271 [0,2,0,0,0,0|1,0,0]=3 13720 B16R0.591 C=CC(CCCCC)OCCNC(=O)OCC 7a_100011216863_200011445536 [0,2,0,0,0,0|2,0,0]=4 13721 B16R0.591 CCCCCC(CC)OCCCC(=O)OCC 34a_100011215405_100009991533 [0,2,0,0,0,0|1,0,0]=3 13722 B16R0.591 CCCCCC(CC)OCCCC(=O)OCC 7a_100011215405_100011215271 [0,2,0,0,0,0|1,0,0]=3 13723 B16R0.591 CCCCCC(CC)OCCNC(=O)OCC 7a_100011215405_200011445536 [0,2,0,0,0,0|2,0,0]=4 13724 B16R0.591 CCOC(=O)CCCCN(CC)CCCCO 2230a_100011217355_100000750268 [0,2,0,0,0,0|2,0,0]=4 13725 B16R0.591 CCOC(=O)CCCCN(CC)CCCCO 269982a_100011217355_100000750268 [0,2,0,0,0,0|2,0,0]=4 13726 B16R0.1685 CCCCCC(C)NCCCC(=O)NCCC 2230a_100000211957_100011194427 [0,2,0,0,0,0|2,0,0]=4 13727 B16R0.1685 CCCCCC(C)OCCCC(=O)NCCC 7a_100011215632_100011194427 [0,2,0,0,0,0|2,0,0]=4 13728 B16R0.1685 CCCCCC(C)SCCCC(=O)NCCC 62a_100011194427_200011218191 [0,2,0,0,0,0|2,0,0]=4 13729 B16R0.1685 CCCCCC(C)SCCCC(=O)NCCC 62a_200011218191_100011194427 [0,2,0,0,0,0|2,0,0]=4 13730 B16R0.3258 CCCCCC(=O)CO[C@H](C)CC(=O)OCC 7a_100009816390_200012276598 [0,2,0,0,0,0|1,0,1]=4 13731 B16R0.3258 CCCCCC(=O)CSC(C)CC(=O)OCC 62a_100009817359_200012276598 [0,2,0,0,0,0|1,0,1]=4 13732 B16R0.3258 CCCCCC(=O)CSC(C)CC(=O)OCC 62a_200012276598_100009817359 [0,2,0,0,0,0|1,0,1]=4 13733 B16R0.3258 CCCCCC(C)CCC(=O)CC(=O)CCC 1458a_100000034243_100000747444 [0,2,0,0,0,0|1,0,1]=4 13734 B16R0.3258 CCCCCC(C)CCC(=O)CC(=O)NCC 1458a_100000034243_100000183381 [0,2,0,0,0,0|1,0,1]=4 13735 B16R0.3258 CCCCCC(C)CCC(=O)CC(=O)OCC 1458a_100000034243_100000188475 [0,2,0,0,0,0|0,0,1]=3 13736 B16R0.3258 CCCCCC(C)OC[C@@H](O)CC(=O)OCC 34a_100011215632_100000688340 [0,2,0,0,0,0|1,0,0]=3 13737 B16R0.3258 CCCCCC(C)OC[C@@H](O)CC(=O)OCC 7a_100011215632_100000688340 [0,2,0,0,0,0|1,0,0]=3 13738 B16R0.3258 CCCCCC(C)SCC(=O)CC(=O)OCC 62a_100000210311_200011218191 [0,2,0,0,0,0|1,0,1]=4 13739 B16R0.3258 CCCCCC(C)SCC(=O)CC(=O)OCC 62a_200011218191_100000210311 [0,2,0,0,0,0|1,0,1]=4 13740 B16R0.3258 CCCCCC(C)SC[C@@H](O)CC(=O)OCC 62a_100000688340_200011218191 [0,2,0,0,0,0|1,0,0]=3 13741 B16R0.3258 CCCCCC(C)SC[C@@H](O)CC(=O)OCC 62a_200011218191_100000688340 [0,2,0,0,0,0|1,0,0]=3 13742 B16R0.3258 CCCCCN(C)CCC(=O)CC(=O)OCC 1458a_100016987678_100000188475 [0,2,0,0,0,0|1,0,1]=4 13743 B16R0.3258 CCOC(=O)C[C@H](O)COC(C)CCCOC 34a_200011539412_100000688340 [0,2,0,0,0,0|2,0,0]=4 13744 B16R0.3258 CCOC(=O)C[C@H](O)COC(C)CCCOC 7a_200011539412_100000688340 [0,2,0,0,0,0|2,0,0]=4 13745 B16R0.5780 CCOC(=O)CCCCC(=O)CCC(C)CC 1458a_100000701222_100000750268 [0,2,0,0,0,0|0,0,1]=3 13746 B16R0.5780 CCOC(=O)CCCCC(=O)CCN(C)CC 1458a_100000755305_100000750268 [0,2,0,0,0,0|1,0,1]=4 13747 B16R0.5780 CCOC(=O)CCCCC(=O)CCS(=O)CC 1458a_100011387550_100000750268 [0,2,0,0,0,0|1,0,1]=4 13748 B16R0.5780 CCOC(=O)CCCCC(=O)NCC(C)CC 11a_100020588543_100011217402 [0,2,0,0,0,0|1,0,1]=4 13749 B16R0.5780 CCOC(=O)CCCCC(=O)NCC(C)CC 1626a_100020588543_100011217402 [0,2,0,0,0,0|1,0,1]=4 13750 B16R0.5780 CCOC(=O)CCCCC(=O)NCC(C)CC 240690a_100020588543_100011217402 [0,2,0,0,0,0|1,0,1]=4 13751 B16R0.5780 CCOC(=O)CCCCC(=O)NCC(C)CC 527a_100020588543_100011217402 [0,2,0,0,0,0|1,0,1]=4 13752 B16R0.5780 CCOC(=O)CCCCC(=O)NCC(O)CC 11a_100011218483_100011217402 [0,2,0,0,0,0|1,0,1]=4 13753 B16R0.5780 CCOC(=O)CCCCC(=O)NCC(O)CC 240690a_100011218483_100011217402 [0,2,0,0,0,0|1,0,1]=4 13754 B16R0.5780 CCOC(=O)CCCCC(=O)NCC(O)CC 527a_100011218483_100011217402 [0,2,0,0,0,0|1,0,1]=4 13755 B16R0.5780 CCOC(=O)CCCNC(=O)CCC(C)CC 188690a_100000211256_100000701222 [0,2,0,0,0,0|1,0,1]=4 13756 B16R0.5780 CCOC(=O)CCCNC(=O)CCC(O)CC 188690a_100000211256_203496584001 [0,2,0,0,0,0|1,0,1]=4 13757 B16R0.5780 CCOC(=O)CCCOC(C)CCC(C)CC 7a_200011216552_100011215271 [0,2,0,0,0,0|1,0,0]=3 13758 B16R0.5780 CCOC(=O)COCCC(=O)CCC(C)CC 1458a_100000701222_100000088970 [0,2,0,0,0,0|1,0,1]=4 13759 B16R0.5780 CCOC(=O)NCCOC(C)CCC(C)CC 7a_200011216552_200011445536 [0,2,0,0,0,0|2,0,0]=4 13760 B16R0.70 C/C=C(\C)/C(=O)CCCCCCCCCCO 1458a_100020587367_100009813290 [0,2,0,0,0,0|1,0,1]=4 13761 B16R0.70 C/C=C(\C)/C(=O)NCCCCCCCCCC 11a_100000684558_100020587367 [0,2,0,0,0,0|1,0,1]=4 13762 B16R0.70 C/C=C(\C)/C(=O)NCCCCCCCCCC 1626a_100000684558_100020587367 [0,2,0,0,0,0|1,0,1]=4 13763 B16R0.70 C=CCCCCCCCCCC(=O)C(O)CC 1458a_100011196387_100009814027 [0,2,0,0,0,0|1,0,1]=4 13764 B16R0.70 CCC(C)C(=O)CCCCCCCCCCO 1458a_100011192722_100009813290 [0,2,0,0,0,0|1,0,0]=3 13765 B16R0.70 CCC(C)C(=O)NCCCCCCCCCO 240690a_100000078944_100011192722 [0,2,0,0,0,0|2,0,0]=4 13766 B16R0.70 CCC(O)C(=O)CCCCCCCCCCO 1458a_100011196387_100009813290 [0,2,0,0,0,0|1,0,0]=3 13767 B16R0.70 CCC(O)C(=O)NCCCCCCCCCO 240690a_100000078944_100011196387 [0,2,0,0,0,0|2,0,0]=4 13768 B16R0.70 CCCCCCCCCC=CC(=O)N(C)CC 11a_100000225621_200015352897 [0,2,0,0,0,0|1,0,1]=4 13769 B16R0.70 CCCCCCCCCC=CC(=O)N(C)CC 1626a_100000225621_200015352897 [0,2,0,0,0,0|1,0,1]=4 13770 B16R0.70 CCCCCCCCCC=CC(=O)N(C)CC 240690a_100000225621_200015352897 [0,2,0,0,0,0|1,0,1]=4 13771 B16R0.70 CCCCCCCCCCCC(=O)C(=O)NC 1458a_100011218921_100011215454 [0,2,0,0,0,0|2,0,0]=4 13772 B16R0.70 CCCCCCCCCCCC(=O)C(C)OC 1458a_100000743197_100011215454 [0,2,0,0,0,0|2,0,0]=4 13773 B16R0.70 CCCCCCCCCCCC(=O)C(O)CC 1458a_100011196387_100011215454 [0,2,0,0,0,0|1,0,0]=3 13774 B16R0.70 CCCCCCCCCCCC(=O)C(O)CO 1458a_100011215603_100011215454 [0,2,0,0,0,0|2,0,0]=4 13775 B16R0.70 CCCCCCCCCCCC(=O)N(C)CC 11a_100000225621_100000210736 [0,2,0,0,0,0|1,0,0]=3 13776 B16R0.70 CCCCCCCCCCCC(=O)N(C)CC 1626a_100000225621_100000210736 [0,2,0,0,0,0|1,0,0]=3 13777 B16R0.70 CCCCCCCCCCCC(=O)N(C)CC 240690a_100000225621_100000210736 [0,2,0,0,0,0|1,0,0]=3 13778 B16R0.70 CCCCCCCCCCNC(=O)C(=O)NC 1626a_100000684558_100011218921 [0,2,0,0,0,0|2,0,0]=4 13779 B16R0.70 CCCCCCCCCCNC(=O)C(=O)NC 240690a_100000684558_100011218921 [0,2,0,0,0,0|2,0,0]=4 13780 B16R0.70 CCCCCCCCCCNC(=O)C(=O)NC 527a_100000684558_100011218921 [0,2,0,0,0,0|2,0,0]=4 13781 B16R0.70 CCCCCCCCCCNC(=O)C(=O)OC 11a_100000684558_100000024059 [0,2,0,0,0,0|2,0,0]=4 13782 B16R0.70 CCCCCCCCCCNC(=O)C(=O)OC 1626a_100000684558_100000024059 [0,2,0,0,0,0|2,0,0]=4 13783 B16R0.70 CCCCCCCCCCNC(=O)C(=O)OC 240690a_100000684558_100000024059 [0,2,0,0,0,0|2,0,0]=4 13784 B16R0.70 CCCCCCCCCCNC(=O)C(=O)OC 527a_100000684558_100000024059 [0,2,0,0,0,0|2,0,0]=4 13785 B16R0.70 CCCCCCCCCCNC(=O)C(C)CC 11a_100000684558_100011192722 [0,2,0,0,0,0|1,0,0]=3 13786 B16R0.70 CCCCCCCCCCNC(=O)C(C)CC 1626a_100000684558_100011192722 [0,2,0,0,0,0|1,0,0]=3 13787 B16R0.70 CCCCCCCCCCNC(=O)C(C)CC 240690a_100000684558_100011192722 [0,2,0,0,0,0|1,0,0]=3 13788 B16R0.70 CCCCCCCCCCNC(=O)C(C)CC 527a_100000684558_100011192722 [0,2,0,0,0,0|1,0,0]=3 13789 B16R0.70 CCCCCCCCCCNC(=O)C(C)OC 11a_100000684558_100000743197 [0,2,0,0,0,0|2,0,0]=4 13790 B16R0.70 CCCCCCCCCCNC(=O)C(C)OC 1626a_100000684558_100000743197 [0,2,0,0,0,0|2,0,0]=4 13791 B16R0.70 CCCCCCCCCCNC(=O)C(C)OC 240690a_100000684558_100000743197 [0,2,0,0,0,0|2,0,0]=4 13792 B16R0.70 CCCCCCCCCCNC(=O)C(C)OC 527a_100000684558_100000743197 [0,2,0,0,0,0|2,0,0]=4 13793 B16R0.70 CCCCCCCCCCNC(=O)C(C)SC 11a_100000684558_100000149566 [0,2,0,0,0,0|2,0,0]=4 13794 B16R0.70 CCCCCCCCCCNC(=O)C(C)SC 1626a_100000684558_100000149566 [0,2,0,0,0,0|2,0,0]=4 13795 B16R0.70 CCCCCCCCCCNC(=O)C(C)SC 240690a_100000684558_100000149566 [0,2,0,0,0,0|2,0,0]=4 13796 B16R0.70 CCCCCCCCCCNC(=O)C(C)SC 527a_100000684558_100000149566 [0,2,0,0,0,0|2,0,0]=4 13797 B16R0.70 CCCCCCCCCCNC(=O)C(O)CC 240690a_100000684558_100011196387 [0,2,0,0,0,0|1,0,0]=3 13798 B16R0.70 CCCCCCCCCCNC(=O)C(O)CO 240690a_100000684558_100011215603 [0,2,0,0,0,0|2,0,0]=4 13799 B16R0.70 CCCCCCCCCCNC(=O)N(C)CC 2708a_100000684558_100000225621 [0,2,0,0,0,0|1,0,0]=3 13800 B16R0.70 CCCCCCCCCCNC(=O)N(C)CC 273464a_100000684558_100000225621 [0,2,0,0,0,0|1,0,0]=3 13801 B16R0.70 CCCCCCCCCNCC(=O)C(=O)OC 34a_100000212291_100011610305 [0,2,0,0,0,0|2,0,0]=4 13802 B16R0.70 CCCCCCCCCNCC(=O)N(C)CC 2230a_100000212291_100000738999 [0,2,0,0,0,0|1,0,0]=3 13803 B16R0.70 CCCCCCCCCNCC(=O)N(C)CC 34a_100000212291_100000738999 [0,2,0,0,0,0|1,0,0]=3 13804 B16R0.70 CCCCCCCCCNCC(=O)N(C)OC 2230a_100000212291_100000764215 [0,2,0,0,0,0|2,0,0]=4 13805 B16R0.70 CCCCCCCCCNCC(=O)N(C)OC 2230a_100015207273_100011214924 [0,2,0,0,0,0|2,0,0]=4 13806 B16R0.70 CCCCCCCCCOCC(=O)C(=O)OC 34a_100000210712_100011610305 [0,2,0,0,0,0|2,0,0]=4 13807 B16R0.70 CCCCCCCCCOCC(=O)N(C)CC 34a_100000210712_100000738999 [0,2,0,0,0,0|1,0,0]=3 13808 B16R0.70 CCCCCCCCCOCC(=O)N(C)CC 7a_100000210712_100000738999 [0,2,0,0,0,0|1,0,0]=3 13809 B16R0.70 CCCCCCCCCOCC(=O)N(C)OC 7a_100000210712_100000764215 [0,2,0,0,0,0|2,0,0]=4 13810 B16R0.70 CCCCCCCCCSCC(=O)C(=O)OC 62a_100011610305_100000210670 [0,2,0,0,0,0|2,0,0]=4 13811 B16R0.70 CCCCCCCCCSCC(=O)N(C)CC 62a_100000738999_100000210670 [0,2,0,0,0,0|1,0,0]=3 13812 B16R0.70 CCCCCCCCCSCC(=O)N(C)OC 62a_100000764215_100000210670 [0,2,0,0,0,0|2,0,0]=4 13813 B16R0.70 CCCCCCCOCCCC(=O)N(C)OC 7a_100000210272_100011842776 [0,2,0,0,0,0|2,0,0]=4 13814 B16R0.70 CCCCCCCSCCCC(=O)N(C)OC 62a_100000210614_100011842776 [0,2,0,0,0,0|2,0,0]=4 13815 B16R0.70 CCCCCCCSCCCC(=O)N(C)OC 62a_100011842776_100000210316 [0,2,0,0,0,0|2,0,0]=4 13816 B16R0.70 CCCCCCOCCOCC(=O)N(C)CC 34a_100000691444_100000738999 [0,2,0,0,0,0|2,0,0]=4 13817 B16R0.70 CCCCCCOCCOCC(=O)N(C)CC 7a_100000691444_100000738999 [0,2,0,0,0,0|2,0,0]=4 13818 B16R0.70 CCCCNCCCCOCC(=O)N(C)CC 34a_200011216965_100000738999 [0,2,0,0,0,0|2,0,0]=4 13819 B16R0.70 CCCCOCCCCOCC(=O)N(C)CC 34a_200000760531_100000738999 [0,2,0,0,0,0|2,0,0]=4 13820 B16R0.70 CCCCOCCCCOCC(=O)N(C)CC 7a_200000760531_100000738999 [0,2,0,0,0,0|2,0,0]=4 13821 B16R0.70 CCN(C)C(=O)CCCCCCCCCCO 240690a_100000225621_200000016029 [0,2,0,0,0,0|1,0,0]=3 13822 B16R0.70 CCN(C)C(=O)CNCCCCCCCCO 2230a_102515433106_100000738999 [0,2,0,0,0,0|2,0,0]=4 13823 B16R0.70 CCN(C)C(=O)CNCCCCCCCCO 34a_102515433106_100000738999 [0,2,0,0,0,0|2,0,0]=4 13824 B16R0.70 CCN(C)C(=O)COCCCCCCCCBr 34a_100009813846_100000738999 [0,2,0,0,0,0|2,0,0]=4 13825 B16R0.70 CCN(C)C(=O)COCCCCCCCCBr 7a_100009813846_100000738999 [0,2,0,0,0,0|2,0,0]=4 13826 B16R0.70 CCN(C)C(=O)COCCCCCCCCCl 34a_100000033203_100000738999 [0,2,0,0,0,0|2,0,0]=4 13827 B16R0.70 CCN(C)C(=O)COCCCCCCCCCl 7a_100000033203_100000738999 [0,2,0,0,0,0|2,0,0]=4 13828 B16R0.70 CCN(C)C(=O)COCCCCCCCCN 34a_102515433106_100000738999 [0,2,0,0,0,0|2,0,0]=4 13829 B16R0.70 CCN(C)C(=O)CSCCCCCCCCO 62a_100000033203_100000738999 [0,2,0,0,0,0|2,0,0]=4 13830 B16R0.70 CCN(C)C(=O)CSCCCCCCCCO 62a_100000738999_100000033203 [0,2,0,0,0,0|2,0,0]=4 13831 B16R0.70 CCN(C)C(=O)NCCCCCCCCCO 2708a_100000078944_100000225621 [0,2,0,0,0,0|2,0,0]=4 13832 B16R0.70 CCN(C)C(=O)NCCCCCCCCCO 273464a_100000078944_100000225621 [0,2,0,0,0,0|2,0,0]=4 13833 B16R0.70 CNC(=O)C(=O)CCCCCCCCCCO 1458a_100011218921_100009813290 [0,2,0,0,0,0|2,0,0]=4 13834 B16R0.70 COC(C)C(=O)CCCCCCCCCCO 1458a_100000743197_100009813290 [0,2,0,0,0,0|2,0,0]=4 13835 B16R0.70 CSC(C)C(=O)CCCCCCCCCCO 1458a_100000149566_100009813290 [0,2,0,0,0,0|2,0,0]=4 13836 B16R0.70 O=C(CCCCCCCCCCO)C(O)CO 1458a_100011215603_100009813290 [0,2,0,0,0,0|2,0,0]=4 13837 B16R0.312 CCOC(=O)CCCCCCC(=O)C(C)CC 1458a_100000031895_100000758301 [0,2,0,0,0,0|0,0,1]=3 13838 B16R0.312 CCOC(=O)CCCCCCC(=O)C(C)CC 1458a_100011192722_100009814379 [0,2,0,0,0,0|0,0,1]=3 13839 B16R0.312 CCOC(=O)CCCCCCC(=O)C(C)OC 1458a_100000743197_100009814379 [0,2,0,0,0,0|1,0,1]=4 13840 B16R0.312 CCOC(=O)CCCCCCC(=O)C(C)SC 1458a_100000149566_100009814379 [0,2,0,0,0,0|1,0,1]=4 13841 B16R0.312 CCOC(=O)CCCCCCC(=O)C(O)CC 1458a_100011196387_100009814379 [0,2,0,0,0,0|0,0,1]=3 13842 B16R0.312 CCOC(=O)CCCCCCC(=O)C(O)CO 1458a_100011215603_100009814379 [0,2,0,0,0,0|1,0,1]=4 13843 B16R0.312 CCOC(=O)CCCCCCC(=O)N(C)CC 11a_100000225621_100000031895 [0,2,0,0,0,0|1,0,1]=4 13844 B16R0.312 CCOC(=O)CCCCCCC(=O)N(C)CC 1626a_100000225621_100000031895 [0,2,0,0,0,0|1,0,1]=4 13845 B16R0.312 CCOC(=O)CCCCCCC(=O)N(C)CC 240690a_100000225621_100000031895 [0,2,0,0,0,0|1,0,1]=4 13846 B16R0.312 CCOC(=O)CCCCCCC(=O)N(C)CC 527a_100000225621_100000031895 [0,2,0,0,0,0|1,0,1]=4 13847 B16R0.312 CCOC(=O)CCCCCCN(C)C(C)CC 2230a_100000741768_100009814379 [0,2,0,0,0,0|1,0,0]=3 13848 B16R0.312 CCOC(=O)CCCCCCN(C)C(C)CC 269982a_100000741768_100009814379 [0,2,0,0,0,0|1,0,0]=3 13849 B16R0.312 CCOC(=O)CCCCCCN(C)C(C)CO 2230a_100000693034_100009814379 [0,2,0,0,0,0|2,0,0]=4 13850 B16R0.312 CCOC(=O)CCCCCCN(C)C(C)CO 269982a_100000693034_100009814379 [0,2,0,0,0,0|2,0,0]=4 13851 B16R0.312 CCOC(=O)CCCCCNC(=O)C(C)CC 188690a_100000062434_100011192722 [0,2,0,0,0,0|1,0,1]=4 13852 B16R0.312 CCOC(=O)CCCCCNC(=O)C(O)CC 188690a_100000062434_100011196387 [0,2,0,0,0,0|1,0,1]=4 13853 B16R0.312 CCOC(=O)CCCCCOC(C)C(=O)CC 7a_100011214988_100000742827 [0,2,0,0,0,0|1,0,1]=4 13854 B16R0.312 CCOC(=O)CCCCCOC(C)C(C)CC 7a_100011215189_100000755133 [0,2,0,0,0,0|1,0,0]=3 13855 B16R0.312 CCOC(=O)CCCCCSC(C)C(=O)CC 62a_100000742827_100000755133 [0,2,0,0,0,0|1,0,1]=4 13856 B16R0.312 CCOC(=O)CCCCCSC(C)C(=O)CC 62a_100000755133_100000742827 [0,2,0,0,0,0|1,0,1]=4 13857 B16R0.312 CCOC(=O)CCCCOCC(C)N(C)CC 7a_100000732741_100000750268 [0,2,0,0,0,0|2,0,0]=4 13858 B16R0.312 CCOC(=O)COCCCOC(C)C(C)CC 7a_100011215189_100009893628 [0,2,0,0,0,0|2,0,0]=4 13859 B16R0.690 CCC(C)(C)C(=O)CCCCCCCCCO 1458a_100000749717_100009813782 [0,2,0,0,0,0|2,0,0]=4 13860 B16R0.690 CCC(C)(O)C(=O)CCCCCCCCCO 1458a_100011219770_100009813782 [0,2,0,0,0,0|2,0,0]=4 13861 B16R0.690 CCC(F)(F)C(=O)CCCCCCCCCO 1458a_100000061896_100009813782 [0,2,0,0,0,0|2,0,0]=4 13862 B16R0.690 CCCCCCCCCCC(=O)C(C)(C)CO 1458a_100000749806_100000210319 [0,2,0,0,0,0|2,0,0]=4 13863 B16R0.690 CCCCCCCCCCC(=O)C(C)(C)OC 1458a_100000753492_100000210319 [0,2,0,0,0,0|2,0,0]=4 13864 B16R0.690 CCCCCCCCCCC(=O)C(C)(O)CC 1458a_100011219770_100000210319 [0,2,0,0,0,0|1,0,0]=3 13865 B16R0.690 CCCCCCCCCNC(=O)C(C)(C)CC 11a_100000212291_100000749717 [0,2,0,0,0,0|2,0,0]=4 13866 B16R0.690 CCCCCCCCCNC(=O)C(C)(C)CC 1626a_100000212291_100000749717 [0,2,0,0,0,0|2,0,0]=4 13867 B16R0.690 CCCCCCCCCNC(=O)C(C)(C)CC 240690a_100000212291_100000749717 [0,2,0,0,0,0|2,0,0]=4 13868 B16R0.690 CCCCCCCCCNC(=O)C(C)(C)CC 527a_100000212291_100000749717 [0,2,0,0,0,0|2,0,0]=4 13869 B16R0.690 CCCCCCCCCNC(=O)C(C)(O)CC 240690a_100000212291_100011219770 [0,2,0,0,0,0|2,0,0]=4 13870 B16R0.690 CCCCCCCCCNC(=O)C(F)(F)CC 11a_100000212291_100000061896 [0,2,0,0,0,0|2,0,0]=4 13871 B16R0.690 CCCCCCCCCNC(=O)C(F)(F)CC 1626a_100000212291_100000061896 [0,2,0,0,0,0|2,0,0]=4 13872 B16R0.690 CCCCCCCCCNC(=O)C(F)(F)CC 240690a_100000212291_100000061896 [0,2,0,0,0,0|2,0,0]=4 13873 B16R0.690 CCCCCCCCCNC(=O)C(F)(F)CC 527a_100000212291_100000061896 [0,2,0,0,0,0|2,0,0]=4 13874 B16R0.1183 C#CCCCCCCCOC(C)C(=O)OCC 34a_100000054614_100011216346 [0,2,0,0,0,0|0,0,2]=4 13875 B16R0.1183 C#CCCCCCCCOC(C)C(=O)OCC 7a_100000054614_100011216346 [0,2,0,0,0,0|0,0,2]=4 13876 B16R0.1183 C#CCCCCCCCOC(F)C(=O)OCC 34a_100000054614_100000760018 [0,2,0,0,0,0|0,0,2]=4 13877 B16R0.1183 C#CCCCCCCCOC(F)C(=O)OCC 7a_100000054614_100000040065 [0,2,0,0,0,0|0,0,2]=4 13878 B16R0.1183 C#CCCCCCCCO[C@@H](C)C(=O)OCC 7a_100000751109_100153394163 [0,2,0,0,0,0|0,0,2]=4 13879 B16R0.1183 C#CCCCCCCCSC(C)C(=O)OCC 62a_100011216346_100153394163 [0,2,0,0,0,0|0,0,2]=4 13880 B16R0.1183 C#CCCCCCCCSC(C)C(=O)OCC 62a_100153394163_100011216346 [0,2,0,0,0,0|0,0,2]=4 13881 B16R0.1183 C#CCCCCCCCSC(F)C(=O)OCC 62a_100000760018_100153394163 [0,2,0,0,0,0|0,0,2]=4 13882 B16R0.1183 C#CCCCCCCCSC(F)C(=O)OCC 62a_100153394163_100000760018 [0,2,0,0,0,0|0,0,2]=4 13883 B16R0.1183 C#CCN(C)C(=O)CCCCCCCCCC 11a_100000225692_100000210375 [0,2,0,0,0,0|1,0,1]=4 13884 B16R0.1183 C#CCN(C)C(=O)CCCCCCCCCC 1626a_100000225692_100000210375 [0,2,0,0,0,0|1,0,1]=4 13885 B16R0.1183 C=C(CNCCCCCCCC)C(=O)OCC 34a_100000229939_100000755967 [0,2,0,0,0,0|0,0,1]=3 13886 B16R0.1183 C=C(CNCCCCCCCO)C(=O)OCC 34a_100011996573_100000755967 [0,2,0,0,0,0|1,0,1]=4 13887 B16R0.1183 C=C(CNCCCOCCCC)C(=O)OCC 34a_200000211371_100000755967 [0,2,0,0,0,0|1,0,1]=4 13888 B16R0.1183 C=C(COCCCCCCCBr)C(=O)OCC 34a_100000760002_100000755967 [0,2,0,0,0,0|1,0,1]=4 13889 B16R0.1183 C=C(COCCCCCCCBr)C(=O)OCC 7a_100000760002_100000755967 [0,2,0,0,0,0|1,0,1]=4 13890 B16R0.1183 C=C(COCCCCCCCC)C(=O)OCC 34a_100000210232_100000755967 [0,2,0,0,0,0|0,0,1]=3 13891 B16R0.1183 C=C(COCCCCCCCC)C(=O)OCC 7a_100000210232_100000755967 [0,2,0,0,0,0|0,0,1]=3 13892 B16R0.1183 C=C(COCCCCCCCN)C(=O)OCC 34a_100011996573_100000755967 [0,2,0,0,0,0|1,0,1]=4 13893 B16R0.1183 C=C(COCCCCCCOC)C(=O)OCC 34a_200012092642_100000755967 [0,2,0,0,0,0|1,0,1]=4 13894 B16R0.1183 C=C(COCCCCCCOC)C(=O)OCC 7a_200012092642_100000755967 [0,2,0,0,0,0|1,0,1]=4 13895 B16R0.1183 C=C(COCCCOCCCC)C(=O)OCC 34a_200011215613_100000755967 [0,2,0,0,0,0|1,0,1]=4 13896 B16R0.1183 C=C(COCCCOCCCC)C(=O)OCC 7a_200011215613_100000755967 [0,2,0,0,0,0|1,0,1]=4 13897 B16R0.1183 C=C(COCCNCCCCC)C(=O)OCC 34a_100000224656_100000755967 [0,2,0,0,0,0|1,0,1]=4 13898 B16R0.1183 C=C(COCCOCCCCC)C(=O)OCC 34a_100011215259_100000755967 [0,2,0,0,0,0|1,0,1]=4 13899 B16R0.1183 C=C(COCCOCCCCC)C(=O)OCC 7a_100011215259_100000755967 [0,2,0,0,0,0|1,0,1]=4 13900 B16R0.1183 C=C(CSCCCCCCCC)C(=O)OCC 62a_100000210759_100000755967 [0,2,0,0,0,0|0,0,1]=3 13901 B16R0.1183 C=C(CSCCCCCCCC)C(=O)OCC 62a_100000755967_100000210317 [0,2,0,0,0,0|0,0,1]=3 13902 B16R0.1183 C=C(CSCCCCCCCO)C(=O)OCC 62a_100000755967_100000760002 [0,2,0,0,0,0|1,0,1]=4 13903 B16R0.1183 C=C(CSCCCCCCCO)C(=O)OCC 62a_100000760002_100000755967 [0,2,0,0,0,0|1,0,1]=4 13904 B16R0.1183 C=C(CSCCCCCCOC)C(=O)OCC 62a_100000755967_100011998445 [0,2,0,0,0,0|1,0,1]=4 13905 B16R0.1183 C=C(CSCCCCCCOC)C(=O)OCC 62a_100011998445_100000755967 [0,2,0,0,0,0|1,0,1]=4 13906 B16R0.1183 C=CCCCCCCCCC(=O)C(C)OCC 1458a_100000739345_100011933949 [0,2,0,0,0,0|0,0,2]=4 13907 B16R0.1183 C=CCCCCCCCOC(C)C(=O)OCC 34a_100000730831_100011216346 [0,2,0,0,0,0|0,0,2]=4 13908 B16R0.1183 C=CCCCCCCCOC(C)C(=O)OCC 7a_100000730831_100011216346 [0,2,0,0,0,0|0,0,2]=4 13909 B16R0.1183 C=CCCCCCCCOC(F)C(=O)OCC 34a_100000730831_100000760018 [0,2,0,0,0,0|0,0,2]=4 13910 B16R0.1183 C=CCCCCCCCOC(F)C(=O)OCC 7a_100000730831_100000040065 [0,2,0,0,0,0|0,0,2]=4 13911 B16R0.1183 C=CCCCCCCCO[C@@H](C)C(=O)OCC 7a_100000751109_100012355270 [0,2,0,0,0,0|0,0,2]=4 13912 B16R0.1183 C=CCCCCCCCSC(C)C(=O)OCC 62a_100011216346_100012355270 [0,2,0,0,0,0|0,0,2]=4 13913 B16R0.1183 C=CCCCCCCCSC(C)C(=O)OCC 62a_100012355270_100011216346 [0,2,0,0,0,0|0,0,2]=4 13914 B16R0.1183 C=CCCCCCCCSC(F)C(=O)OCC 62a_100000760018_100012355270 [0,2,0,0,0,0|0,0,2]=4 13915 B16R0.1183 C=CCCCCCCCSC(F)C(=O)OCC 62a_100012355270_100000760018 [0,2,0,0,0,0|0,0,2]=4 13916 B16R0.1183 C=CCN(C)C(=O)CCCCCCCCCC 11a_100000225617_100000210375 [0,2,0,0,0,0|1,0,1]=4 13917 B16R0.1183 C=CCN(C)C(=O)CCCCCCCCCC 1626a_100000225617_100000210375 [0,2,0,0,0,0|1,0,1]=4 13918 B16R0.1183 C=CCN(C)C(=O)CCCCCCCCCC 240690a_100000225617_100000210375 [0,2,0,0,0,0|1,0,1]=4 13919 B16R0.1183 CC(CCO)C(=O)CCCCCCCCCF 1458a_200009909015_100009893172 [0,2,0,0,0,0|2,0,0]=4 13920 B16R0.1183 CC/C=C(\C)/C(=O)CCCCCCCCCO 1458a_100016988807_100009813782 [0,2,0,0,0,0|2,0,0]=4 13921 B16R0.1183 CC/C=C(\C)/C(=O)NCCCCCCCCC 11a_100000212291_100016988807 [0,2,0,0,0,0|2,0,0]=4 13922 B16R0.1183 CC/C=C(\C)/C(=O)NCCCCCCCCC 1626a_100000212291_100016988807 [0,2,0,0,0,0|2,0,0]=4 13923 B16R0.1183 CC/C=C(\C)/C(=O)NCCCCCCCCC 240690a_100000212291_100016988807 [0,2,0,0,0,0|2,0,0]=4 13924 B16R0.1183 CC/C=C(\C)/C(=O)NCCCCCCCCC 527a_100000212291_100016988807 [0,2,0,0,0,0|2,0,0]=4 13925 B16R0.1183 CC/C=C\CCCCCOC(C)C(=O)OCC 34a_100016268722_100011216346 [0,2,0,0,0,0|0,0,2]=4 13926 B16R0.1183 CC/C=C\CCCCCOC(C)C(=O)OCC 7a_100016268722_100011216346 [0,2,0,0,0,0|0,0,2]=4 13927 B16R0.1183 CC/C=C\CCCCCOC(F)C(=O)OCC 34a_100016268722_100000760018 [0,2,0,0,0,0|0,0,2]=4 13928 B16R0.1183 CC/C=C\CCCCCOC(F)C(=O)OCC 7a_100016268722_100000040065 [0,2,0,0,0,0|0,0,2]=4 13929 B16R0.1183 CC=CC(=O)N(C)CCCCCCCCCC 11a_100000207566_100000210699 [0,2,0,0,0,0|1,0,1]=4 13930 B16R0.1183 CC=CC(=O)N(C)CCCCCCCCCC 1626a_100000207566_100000210699 [0,2,0,0,0,0|1,0,1]=4 13931 B16R0.1183 CC=CC(=O)N(C)CCCCCCCCCC 240690a_100000207566_100000210699 [0,2,0,0,0,0|1,0,1]=4 13932 B16R0.1183 CCC#CCCCCCCC(=O)C(C)OCC 1458a_100000739345_200000036426 [0,2,0,0,0,0|0,0,2]=4 13933 B16R0.1183 CCCC(C)C(=O)CCCCCCCCCO 1458a_100000210906_100009813782 [0,2,0,0,0,0|2,0,0]=4 13934 B16R0.1183 CCCCC#CCCCO[C@@H](C)C(=O)OCC 7a_100000751109_200000047210 [0,2,0,0,0,0|0,0,2]=4 13935 B16R0.1183 CCCCC#CCCCSC(C)C(=O)OCC 62a_100011216346_200000047210 [0,2,0,0,0,0|0,0,2]=4 13936 B16R0.1183 CCCCC#CCCCSC(C)C(=O)OCC 62a_200000047210_100011216346 [0,2,0,0,0,0|0,0,2]=4 13937 B16R0.1183 CCCCC#CCCCSC(F)C(=O)OCC 62a_100000760018_200000047210 [0,2,0,0,0,0|0,0,2]=4 13938 B16R0.1183 CCCCC#CCCCSC(F)C(=O)OCC 62a_200000047210_100000760018 [0,2,0,0,0,0|0,0,2]=4 13939 B16R0.1183 CCCCC/C=C\CCOC(C)C(=O)OCC 34a_100016277358_100011216346 [0,2,0,0,0,0|0,0,2]=4 13940 B16R0.1183 CCCCC/C=C\CCOC(C)C(=O)OCC 7a_100016277358_100011216346 [0,2,0,0,0,0|0,0,2]=4 13941 B16R0.1183 CCCCC/C=C\CCOC(F)C(=O)OCC 34a_100016277358_100000760018 [0,2,0,0,0,0|0,0,2]=4 13942 B16R0.1183 CCCCC/C=C\CCOC(F)C(=O)OCC 7a_100016277358_100000040065 [0,2,0,0,0,0|0,0,2]=4 13943 B16R0.1183 CCCCCC#CCCOC(C)C(=O)OCC 34a_200000042877_100011216346 [0,2,0,0,0,0|0,0,2]=4 13944 B16R0.1183 CCCCCC#CCCOC(C)C(=O)OCC 7a_200000042877_100011216346 [0,2,0,0,0,0|0,0,2]=4 13945 B16R0.1183 CCCCCC#CCCOC(F)C(=O)OCC 34a_200000042877_100000760018 [0,2,0,0,0,0|0,0,2]=4 13946 B16R0.1183 CCCCCC#CCCOC(F)C(=O)OCC 7a_200000042877_100000040065 [0,2,0,0,0,0|0,0,2]=4 13947 B16R0.1183 CCCCCC/C=C/COC(C)C(=O)OCC 34a_200016276170_100011216346 [0,2,0,0,0,0|0,0,2]=4 13948 B16R0.1183 CCCCCC/C=C/COC(C)C(=O)OCC 7a_200016276170_100011216346 [0,2,0,0,0,0|0,0,2]=4 13949 B16R0.1183 CCCCCC/C=C/COC(F)C(=O)OCC 34a_200016276170_100000760018 [0,2,0,0,0,0|0,0,2]=4 13950 B16R0.1183 CCCCCC/C=C/COC(F)C(=O)OCC 7a_200016276170_100000040065 [0,2,0,0,0,0|0,0,2]=4 13951 B16R0.1183 CCCCCCC#CCOC(C)C(=O)OCC 34a_200000037284_100011216346 [0,2,0,0,0,0|0,0,2]=4 13952 B16R0.1183 CCCCCCC#CCOC(C)C(=O)OCC 7a_200000037284_100011216346 [0,2,0,0,0,0|0,0,2]=4 13953 B16R0.1183 CCCCCCC#CCOC(F)C(=O)OCC 34a_200000037284_100000760018 [0,2,0,0,0,0|0,0,2]=4 13954 B16R0.1183 CCCCCCC#CCOC(F)C(=O)OCC 7a_200000037284_100000040065 [0,2,0,0,0,0|0,0,2]=4 13955 B16R0.1183 CCCCCCCCCCC(=O)/C(=N/OC)/C 1458a_100160996864_100000210319 [0,2,0,0,0,0|2,0,0]=4 13956 B16R0.1183 CCCCCCCCCCC(=O)C(=O)NCC 1458a_200011297158_100000210319 [0,2,0,0,0,0|1,0,0]=3 13957 B16R0.1183 CCCCCCCCCCC(=O)C(C)CC#N 1458a_100000210375_100009813641 [0,2,0,0,0,0|1,0,1]=4 13958 B16R0.1183 CCCCCCCCCCC(=O)C(C)CCO 1458a_100000210375_100009893172 [0,2,0,0,0,0|1,0,0]=3 13959 B16R0.1183 CCCCCCCCCCC(=O)C(C)COC 1458a_100000210375_100000765312 [0,2,0,0,0,0|1,0,0]=3 13960 B16R0.1183 CCCCCCCCCCC(=O)C(C)COC 1458a_100000751857_100000210319 [0,2,0,0,0,0|1,0,0]=3 13961 B16R0.1183 CCCCCCCCCCC(=O)C(C)OCC 1458a_100000739345_100000210319 [0,2,0,0,0,0|0,0,0]=2 13962 B16R0.1183 CCCCCCCCCCC(=O)N(C)CC#N 11a_100000748184_100000210375 [0,2,0,0,0,0|1,0,1]=4 13963 B16R0.1183 CCCCCCCCCCC(=O)N(C)CC#N 1626a_100000748184_100000210375 [0,2,0,0,0,0|1,0,1]=4 13964 B16R0.1183 CCCCCCCCCCC(=O)N(C)CCC 11a_100000747261_100000210375 [0,2,0,0,0,0|1,0,0]=3 13965 B16R0.1183 CCCCCCCCCCC(=O)N(C)CCC 1626a_100000747261_100000210375 [0,2,0,0,0,0|1,0,0]=3 13966 B16R0.1183 CCCCCCCCCCC(=O)N(C)CCC 240690a_100000747261_100000210375 [0,2,0,0,0,0|1,0,0]=3 13967 B16R0.1183 CCCCCCCCCCC(=O)N(C)CCO 240690a_100000210263_100000210375 [0,2,0,0,0,0|1,0,0]=3 13968 B16R0.1183 CCCCCCCCCCC(=O)[C@@H](O)CCC 1458a_100009822183_100000210319 [0,2,0,0,0,0|1,0,0]=3 13969 B16R0.1183 CCCCCCCCCCN(C)C(=O)CCC 11a_100000207566_100000211992 [0,2,0,0,0,0|1,0,0]=3 13970 B16R0.1183 CCCCCCCCCCN(C)C(=O)CCC 1626a_100000207566_100000211992 [0,2,0,0,0,0|1,0,0]=3 13971 B16R0.1183 CCCCCCCCCCN(C)C(=O)CCC 240690a_100000207566_100000211992 [0,2,0,0,0,0|1,0,0]=3 13972 B16R0.1183 CCCCCCCCCCN(C)C(=O)CCC 527a_100000207566_100000211992 [0,2,0,0,0,0|1,0,0]=3 13973 B16R0.1183 CCCCCCCCCCN(C)C(=O)CCO 240690a_100000207566_100011216618 [0,2,0,0,0,0|2,0,0]=4 13974 B16R0.1183 CCCCCCCCCCN(C)C(=O)COC 11a_100000207566_100000210968 [0,2,0,0,0,0|2,0,0]=4 13975 B16R0.1183 CCCCCCCCCCN(C)C(=O)COC 1626a_100000207566_100000210968 [0,2,0,0,0,0|2,0,0]=4 13976 B16R0.1183 CCCCCCCCCCN(C)C(=O)COC 240690a_100000207566_100000210968 [0,2,0,0,0,0|2,0,0]=4 13977 B16R0.1183 CCCCCCCCCCN(C)C(=O)COC 527a_100000207566_100000210968 [0,2,0,0,0,0|2,0,0]=4 13978 B16R0.1183 CCCCCCCCCCN(C)C(=O)CSC 11a_100000207566_100000184570 [0,2,0,0,0,0|2,0,0]=4 13979 B16R0.1183 CCCCCCCCCCN(C)C(=O)CSC 1626a_100000207566_100000184570 [0,2,0,0,0,0|2,0,0]=4 13980 B16R0.1183 CCCCCCCCCCN(C)C(=O)CSC 240690a_100000207566_100000184570 [0,2,0,0,0,0|2,0,0]=4 13981 B16R0.1183 CCCCCCCCCCN(C)C(=O)CSC 527a_100000207566_100000184570 [0,2,0,0,0,0|2,0,0]=4 13982 B16R0.1183 CCCCCCCCCCN(C)C(=O)NCC 2708a_100015525214_100000207566 [0,2,0,0,0,0|1,0,0]=3 13983 B16R0.1183 CCCCCCCCCCN(C)C(=O)NCC 273464a_100015525214_100000207566 [0,2,0,0,0,0|1,0,0]=3 13984 B16R0.1183 CCCCCCCCCNC(=O)C(=O)NCC 1626a_100000212291_200011297158 [0,2,0,0,0,0|1,0,1]=4 13985 B16R0.1183 CCCCCCCCCNC(=O)C(=O)NCC 240690a_100000212291_200011297158 [0,2,0,0,0,0|1,0,1]=4 13986 B16R0.1183 CCCCCCCCCNC(=O)C(=O)NCC 527a_100000212291_200011297158 [0,2,0,0,0,0|1,0,1]=4 13987 B16R0.1183 CCCCCCCCCNC(=O)C(=O)OCC 11a_100000212291_100014798877 [0,2,0,0,0,0|0,0,1]=3 13988 B16R0.1183 CCCCCCCCCNC(=O)C(=O)OCC 1626a_100000212291_100014798877 [0,2,0,0,0,0|0,0,1]=3 13989 B16R0.1183 CCCCCCCCCNC(=O)C(=O)OCC 240690a_100000212291_100014798877 [0,2,0,0,0,0|0,0,1]=3 13990 B16R0.1183 CCCCCCCCCNC(=O)C(C)CCC 11a_100000212291_100000210906 [0,2,0,0,0,0|2,0,0]=4 13991 B16R0.1183 CCCCCCCCCNC(=O)C(C)CCC 1626a_100000212291_100000210906 [0,2,0,0,0,0|2,0,0]=4 13992 B16R0.1183 CCCCCCCCCNC(=O)C(C)CCC 240690a_100000212291_100000210906 [0,2,0,0,0,0|2,0,0]=4 13993 B16R0.1183 CCCCCCCCCNC(=O)C(C)CCC 527a_100000212291_100000210906 [0,2,0,0,0,0|2,0,0]=4 13994 B16R0.1183 CCCCCCCCCNC(=O)C(C)COC 11a_100000212291_100000751857 [0,2,0,0,0,0|2,0,0]=4 13995 B16R0.1183 CCCCCCCCCNC(=O)C(C)COC 1626a_100000212291_100000751857 [0,2,0,0,0,0|2,0,0]=4 13996 B16R0.1183 CCCCCCCCCNC(=O)C(C)COC 240690a_100000212291_100000751857 [0,2,0,0,0,0|2,0,0]=4 13997 B16R0.1183 CCCCCCCCCNC(=O)C(C)COC 527a_100000212291_100000751857 [0,2,0,0,0,0|2,0,0]=4 13998 B16R0.1183 CCCCCCCCCNC(=O)C(C)CSC 11a_100000212291_100000753918 [0,2,0,0,0,0|2,0,0]=4 13999 B16R0.1183 CCCCCCCCCNC(=O)C(C)CSC 1626a_100000212291_100000753918 [0,2,0,0,0,0|2,0,0]=4 14000 B16R0.1183 CCCCCCCCCNC(=O)C(C)CSC 240690a_100000212291_100000753918 [0,2,0,0,0,0|2,0,0]=4 14001 B16R0.1183 CCCCCCCCCNC(=O)C(C)CSC 527a_100000212291_100000753918 [0,2,0,0,0,0|2,0,0]=4 14002 B16R0.1183 CCCCCCCCCNC(=O)C(C)OCC 11a_100000212291_100000739345 [0,2,0,0,0,0|1,0,0]=3 14003 B16R0.1183 CCCCCCCCCNC(=O)C(C)OCC 1626a_100000212291_100000739345 [0,2,0,0,0,0|1,0,0]=3 14004 B16R0.1183 CCCCCCCCCNC(=O)C(C)OCC 240690a_100000212291_100000739345 [0,2,0,0,0,0|1,0,0]=3 14005 B16R0.1183 CCCCCCCCCNC(=O)C(C)OCC 527a_100000212291_100000739345 [0,2,0,0,0,0|1,0,0]=3 14006 B16R0.1183 CCCCCCCCCNC(=O)C(C)SCC 11a_100000212291_100000230601 [0,2,0,0,0,0|1,1,0]=4 14007 B16R0.1183 CCCCCCCCCNC(=O)C(C)SCC 1626a_100000212291_100000230601 [0,2,0,0,0,0|1,1,0]=4 14008 B16R0.1183 CCCCCCCCCNC(=O)C(C)SCC 240690a_100000212291_100000230601 [0,2,0,0,0,0|1,1,0]=4 14009 B16R0.1183 CCCCCCCCCNC(=O)C(C)SCC 527a_100000212291_100000230601 [0,2,0,0,0,0|1,1,0]=4 14010 B16R0.1183 CCCCCCCCCNC(=O)N(C)CCC 2708a_100000212291_100000747261 [0,2,0,0,0,0|2,0,0]=4 14011 B16R0.1183 CCCCCCCCCNC(=O)N(C)CCC 273464a_100000212291_100000747261 [0,2,0,0,0,0|2,0,0]=4 14012 B16R0.1183 CCCCCCCCCNC(=O)N(C)CCO 2708a_100000212291_100000210263 [0,2,0,0,0,0|2,0,0]=4 14013 B16R0.1183 CCCCCCCCCNC(=O)N(C)CCO 273464a_100000212291_100000210263 [0,2,0,0,0,0|2,0,0]=4 14014 B16R0.1183 CCCCCCCCCNC(=O)[C@@H](O)CCC 240690a_100000212291_100009822183 [0,2,0,0,0,0|2,0,0]=4 14015 B16R0.1183 CCCCCCCCCNC(C)C(=O)NCC 2230a_100000212291_100000230173 [0,2,0,0,0,0|1,0,0]=3 14016 B16R0.1183 CCCCCCCCCNC(C)C(=O)NCC 2230a_100000736553_100011214924 [0,2,0,0,0,0|1,0,0]=3 14017 B16R0.1183 CCCCCCCCCNC(C)C(=O)NCC 34a_100000212291_100000230173 [0,2,0,0,0,0|1,0,0]=3 14018 B16R0.1183 CCCCCCCCCNC(C)C(=O)NCC 34a_100000736553_100011214924 [0,2,0,0,0,0|1,0,0]=3 14019 B16R0.1183 CCCCCCCCCNC(C)C(=O)OCC 2230a_100000212291_100011215307 [0,2,0,0,0,0|0,0,0]=2 14020 B16R0.1183 CCCCCCCCCNC(C)C(=O)OCC 34a_100000212291_100011216346 [0,2,0,0,0,0|0,0,0]=2 14021 B16R0.1183 CCCCCCCCCNC(F)C(=O)OCC 2230a_100000212291_100000760018 [0,2,0,0,0,0|0,0,0]=2 14022 B16R0.1183 CCCCCCCCCNC(F)C(=O)OCC 34a_100000212291_100000760018 [0,2,0,0,0,0|0,0,0]=2 14023 B16R0.1183 CCCCCCCCCN[C@@H](C)C(=O)SCC 2230a_100103168634_100011214924 [0,2,0,0,0,0|0,1,0]=3 14024 B16R0.1183 CCCCCCCCCOC(C)C(=O)NCC 34a_100000210712_100000230173 [0,2,0,0,0,0|1,0,0]=3 14025 B16R0.1183 CCCCCCCCCOC(C)C(=O)NCC 7a_100000210712_100000230173 [0,2,0,0,0,0|1,0,0]=3 14026 B16R0.1183 CCCCCCCCCOC(C)C(=O)OCC 34a_100000210712_100011216346 [0,2,0,0,0,0|0,0,0]=2 14027 B16R0.1183 CCCCCCCCCOC(C)C(=O)OCC 7a_100000210712_100011216346 [0,2,0,0,0,0|0,0,0]=2 14028 B16R0.1183 CCCCCCCCCOC(F)C(=O)OCC 34a_100000210712_100000760018 [0,2,0,0,0,0|0,0,0]=2 14029 B16R0.1183 CCCCCCCCCOC(F)C(=O)OCC 7a_100000210712_100000040065 [0,2,0,0,0,0|0,0,0]=2 14030 B16R0.1183 CCCCCCCCCO[C@@H](C)C(=O)OCC 7a_100000751109_100000210328 [0,2,0,0,0,0|0,0,0]=2 14031 B16R0.1183 CCCCCCCCCSC(C)C(=O)NCC 62a_100000230173_100000210670 [0,2,0,0,0,0|1,0,0]=3 14032 B16R0.1183 CCCCCCCCCSC(C)C(=O)OCC 62a_100011216346_100000210670 [0,2,0,0,0,0|0,0,0]=2 14033 B16R0.1183 CCCCCCCCCSC(F)C(=O)OCC 62a_100000760018_100000210670 [0,2,0,0,0,0|0,0,0]=2 14034 B16R0.1183 CCCCCCCCOCC(=O)C(C)CCC 1458a_100000759886_100000766640 [0,2,0,0,0,0|2,0,0]=4 14035 B16R0.1183 CCCCCCCCOCC(=O)C(C)CCO 1458a_100000759886_100009893172 [0,2,0,0,0,0|2,0,0]=4 14036 B16R0.1183 CCCCCCCCOCC(=O)C(C)COC 1458a_100000759886_100000765312 [0,2,0,0,0,0|2,0,0]=4 14037 B16R0.1183 CCCCCCCCOCC(=O)N(C)CCC 11a_100000747261_100000759886 [0,2,0,0,0,0|2,0,0]=4 14038 B16R0.1183 CCCCCCCCOCC(=O)N(C)CCC 1626a_100000747261_100000759886 [0,2,0,0,0,0|2,0,0]=4 14039 B16R0.1183 CCCCCCCCOCC(=O)N(C)CCC 240690a_100000747261_100000759886 [0,2,0,0,0,0|2,0,0]=4 14040 B16R0.1183 CCCCCCCCOCC(=O)N(C)CCC 527a_100000747261_100000759886 [0,2,0,0,0,0|2,0,0]=4 14041 B16R0.1183 CCCCCCCCOCC(=O)N(C)CCO 240690a_100000210263_100000759886 [0,2,0,0,0,0|2,0,0]=4 14042 B16R0.1183 CCCCCCCCOCC(=O)N(C)CCO 527a_100000210263_100000759886 [0,2,0,0,0,0|2,0,0]=4 14043 B16R0.1183 CCCCCCCCSCC(=O)C(=O)OCC 62a_100000210759_100000211299 [0,2,0,0,0,0|0,0,1]=3 14044 B16R0.1183 CCCCCCCCSCC(=O)C(=O)OCC 62a_100000211299_100000210317 [0,2,0,0,0,0|0,0,1]=3 14045 B16R0.1183 CCCCCCOCCOC(C)C(=O)NCC 34a_100000691444_100000230173 [0,2,0,0,0,0|2,0,0]=4 14046 B16R0.1183 CCCCCCOCCOC(C)C(=O)NCC 7a_100000691444_100000230173 [0,2,0,0,0,0|2,0,0]=4 14047 B16R0.1183 CCCCCCOCCOC(C)C(=O)OCC 34a_100000691444_100011216346 [0,2,0,0,0,0|1,0,0]=3 14048 B16R0.1183 CCCCCCOCCOC(C)C(=O)OCC 7a_100000691444_100011216346 [0,2,0,0,0,0|1,0,0]=3 14049 B16R0.1183 CCCCCCOCCOC(F)C(=O)OCC 34a_100000691444_100000760018 [0,2,0,0,0,0|1,0,0]=3 14050 B16R0.1183 CCCCCCOCCOC(F)C(=O)OCC 7a_100000691444_100000040065 [0,2,0,0,0,0|1,0,0]=3 14051 B16R0.1183 CCCCNCCCCCC(=O)C(=O)OCC 2230a_100000102301_100000068741 [0,2,0,0,0,0|0,0,1]=3 14052 B16R0.1183 CCCCNCCCCOC(C)C(=O)NCC 34a_200011216965_100000230173 [0,2,0,0,0,0|2,0,0]=4 14053 B16R0.1183 CCCCNCCCCOC(C)C(=O)OCC 34a_200011216965_100011216346 [0,2,0,0,0,0|1,0,0]=3 14054 B16R0.1183 CCCCNCCCCOC(F)C(=O)OCC 34a_200011216965_100000760018 [0,2,0,0,0,0|1,0,0]=3 14055 B16R0.1183 CCCCOCCCCOC(C)C(=O)NCC 34a_200000760531_100000230173 [0,2,0,0,0,0|2,0,0]=4 14056 B16R0.1183 CCCCOCCCCOC(C)C(=O)NCC 7a_200000760531_100000230173 [0,2,0,0,0,0|2,0,0]=4 14057 B16R0.1183 CCCCOCCCCOC(C)C(=O)OCC 34a_200000760531_100011216346 [0,2,0,0,0,0|1,0,0]=3 14058 B16R0.1183 CCCCOCCCCOC(C)C(=O)OCC 7a_200000760531_100011216346 [0,2,0,0,0,0|1,0,0]=3 14059 B16R0.1183 CCCCOCCCCOC(F)C(=O)OCC 34a_200000760531_100000760018 [0,2,0,0,0,0|1,0,0]=3 14060 B16R0.1183 CCCCOCCCCOC(F)C(=O)OCC 7a_200000760531_100000040065 [0,2,0,0,0,0|1,0,0]=3 14061 B16R0.1183 CCCCSCCCCCC(=O)C(=O)OCC 62a_100000210211_100000068741 [0,2,0,0,0,0|0,0,1]=3 14062 B16R0.1183 CCCN(C)C(=O)CCCCCCCCCF 11a_100000747261_200009909015 [0,2,0,0,0,0|2,0,0]=4 14063 B16R0.1183 CCCN(C)C(=O)CCCCCCCCCF 240690a_100000747261_200009909015 [0,2,0,0,0,0|2,0,0]=4 14064 B16R0.1183 CCCN(C)C(=O)CCCCCCCCCF 527a_100000747261_200009909015 [0,2,0,0,0,0|2,0,0]=4 14065 B16R0.1183 CCCN(C)C(=O)CCCCCCCCCO 240690a_100000747261_100000032657 [0,2,0,0,0,0|2,0,0]=4 14066 B16R0.1183 CCCOCCOCCNC(C)C(=O)OCC 2230a_200011904461_100011215307 [0,2,0,0,0,0|2,0,0]=4 14067 B16R0.1183 CCCOCCOCCNC(C)C(=O)OCC 34a_200011904461_100011216346 [0,2,0,0,0,0|2,0,0]=4 14068 B16R0.1183 CCCOCCOCCNC(F)C(=O)OCC 2230a_200011904461_100000760018 [0,2,0,0,0,0|2,0,0]=4 14069 B16R0.1183 CCCOCCOCCNC(F)C(=O)OCC 34a_200011904461_100000760018 [0,2,0,0,0,0|2,0,0]=4 14070 B16R0.1183 CCC[C@H](O)C(=O)CCCCCCCCCO 1458a_100009822183_100009813782 [0,2,0,0,0,0|2,0,0]=4 14071 B16R0.1183 CCNC(=O)C(=O)CCCCCCCCCO 1458a_200011297158_100009813782 [0,2,0,0,0,0|1,0,1]=4 14072 B16R0.1183 CCNC(=O)C(C)NCCCCCCCCO 2230a_100000736553_100000033203 [0,2,0,0,0,0|2,0,0]=4 14073 B16R0.1183 CCNC(=O)C(C)NCCCCCCCCO 2230a_102515433106_100000230173 [0,2,0,0,0,0|2,0,0]=4 14074 B16R0.1183 CCNC(=O)C(C)NCCCCCCCCO 34a_100000736553_100000033203 [0,2,0,0,0,0|2,0,0]=4 14075 B16R0.1183 CCNC(=O)C(C)NCCCCCCCCO 34a_102515433106_100000230173 [0,2,0,0,0,0|2,0,0]=4 14076 B16R0.1183 CCNC(=O)C(C)OCCCCCCCCBr 34a_100009813846_100000230173 [0,2,0,0,0,0|2,0,0]=4 14077 B16R0.1183 CCNC(=O)C(C)OCCCCCCCCBr 7a_100009813846_100000230173 [0,2,0,0,0,0|2,0,0]=4 14078 B16R0.1183 CCNC(=O)C(C)OCCCCCCCCCl 34a_100000033203_100000230173 [0,2,0,0,0,0|2,0,0]=4 14079 B16R0.1183 CCNC(=O)C(C)OCCCCCCCCCl 7a_100000033203_100000230173 [0,2,0,0,0,0|2,0,0]=4 14080 B16R0.1183 CCNC(=O)C(C)OCCCCCCCCN 34a_102515433106_100000230173 [0,2,0,0,0,0|2,0,0]=4 14081 B16R0.1183 CCNC(=O)C(C)SCCCCCCCCO 62a_100000033203_100000230173 [0,2,0,0,0,0|2,0,0]=4 14082 B16R0.1183 CCNC(=O)C(C)SCCCCCCCCO 62a_100000230173_100000033203 [0,2,0,0,0,0|2,0,0]=4 14083 B16R0.1183 CCOC(=O)C(=O)CCCCCNCCCF 2230a_100015189416_100000068741 [0,2,0,0,0,0|1,0,1]=4 14084 B16R0.1183 CCOC(=O)C(=O)CCCCCNCCOC 2230a_100000209980_100000068741 [0,2,0,0,0,0|1,0,1]=4 14085 B16R0.1183 CCOC(=O)C(=O)CCCCCNCCSC 2230a_100020590264_100000068741 [0,2,0,0,0,0|1,0,1]=4 14086 B16R0.1183 CCOC(=O)C(=O)CCCCCSCCCF 62a_100011934791_100000068741 [0,2,0,0,0,0|1,0,1]=4 14087 B16R0.1183 CCOC(=O)C(=O)CCCCCSCCCO 62a_100011215043_100000068741 [0,2,0,0,0,0|1,0,1]=4 14088 B16R0.1183 CCOC(=O)C(=O)CCCCCSCCOC 62a_100000233755_100000068741 [0,2,0,0,0,0|1,0,1]=4 14089 B16R0.1183 CCOC(=O)C(=O)CCCCCSCCSC 62a_100000212216_100000068741 [0,2,0,0,0,0|1,0,1]=4 14090 B16R0.1183 CCOC(=O)C(=O)CSCCCCCCCO 62a_100000211299_100000760002 [0,2,0,0,0,0|1,0,1]=4 14091 B16R0.1183 CCOC(=O)C(=O)CSCCCCCCCO 62a_100000760002_100000211299 [0,2,0,0,0,0|1,0,1]=4 14092 B16R0.1183 CCOC(=O)C(=O)CSCCCCCCOC 62a_100000211299_100011998445 [0,2,0,0,0,0|1,0,1]=4 14093 B16R0.1183 CCOC(=O)C(=O)CSCCCCCCOC 62a_100011998445_100000211299 [0,2,0,0,0,0|1,0,1]=4 14094 B16R0.1183 CCOC(=O)C(=O)NCCCCCCCCO 240690a_102515433106_100014798877 [0,2,0,0,0,0|1,0,1]=4 14095 B16R0.1183 CCOC(=O)C(C)NCCCCCCCCO 2230a_102515433106_100011215307 [0,2,0,0,0,0|1,0,0]=3 14096 B16R0.1183 CCOC(=O)C(C)NCCCCCCCCO 34a_102515433106_100011216346 [0,2,0,0,0,0|1,0,0]=3 14097 B16R0.1183 CCOC(=O)C(C)OCCCCCCCCBr 34a_100009813846_100011216346 [0,2,0,0,0,0|1,0,0]=3 14098 B16R0.1183 CCOC(=O)C(C)OCCCCCCCCBr 7a_100009813846_100011216346 [0,2,0,0,0,0|1,0,0]=3 14099 B16R0.1183 CCOC(=O)C(C)OCCCCCCCCCl 34a_100000033203_100011216346 [0,2,0,0,0,0|1,0,0]=3 14100 B16R0.1183 CCOC(=O)C(C)OCCCCCCCCCl 7a_100000033203_100011216346 [0,2,0,0,0,0|1,0,0]=3 14101 B16R0.1183 CCOC(=O)C(C)OCCCCCCCCN 34a_102515433106_100011216346 [0,2,0,0,0,0|1,0,0]=3 14102 B16R0.1183 CCOC(=O)C(C)OCCCCCNCCN 34a_103619048469_100011216346 [0,2,0,0,0,0|2,0,0]=4 14103 B16R0.1183 CCOC(=O)C(C)OCCCOCCCOC 34a_200011215475_100011216346 [0,2,0,0,0,0|2,0,0]=4 14104 B16R0.1183 CCOC(=O)C(C)OCCCOCCCOC 7a_200011215475_100011216346 [0,2,0,0,0,0|2,0,0]=4 14105 B16R0.1183 CCOC(=O)C(C)SCCCCCCCCO 62a_100000033203_100011216346 [0,2,0,0,0,0|1,0,0]=3 14106 B16R0.1183 CCOC(=O)C(C)SCCCCCCCCO 62a_100011216346_100000033203 [0,2,0,0,0,0|1,0,0]=3 14107 B16R0.1183 CCOC(=O)C(F)NCCCCCCCCO 2230a_102515433106_100000760018 [0,2,0,0,0,0|1,0,0]=3 14108 B16R0.1183 CCOC(=O)C(F)NCCCCCCCCO 34a_102515433106_100000760018 [0,2,0,0,0,0|1,0,0]=3 14109 B16R0.1183 CCOC(=O)C(F)OCCCCCCCCBr 34a_100009813846_100000760018 [0,2,0,0,0,0|1,0,0]=3 14110 B16R0.1183 CCOC(=O)C(F)OCCCCCCCCBr 7a_100009813846_100000040065 [0,2,0,0,0,0|1,0,0]=3 14111 B16R0.1183 CCOC(=O)C(F)OCCCCCCCCCl 34a_100000033203_100000760018 [0,2,0,0,0,0|1,0,0]=3 14112 B16R0.1183 CCOC(=O)C(F)OCCCCCCCCCl 7a_100000033203_100000040065 [0,2,0,0,0,0|1,0,0]=3 14113 B16R0.1183 CCOC(=O)C(F)OCCCCCCCCN 34a_102515433106_100000760018 [0,2,0,0,0,0|1,0,0]=3 14114 B16R0.1183 CCOC(=O)C(F)OCCCCCNCCN 34a_103619048469_100000760018 [0,2,0,0,0,0|2,0,0]=4 14115 B16R0.1183 CCOC(=O)C(F)OCCCOCCCOC 34a_200011215475_100000760018 [0,2,0,0,0,0|2,0,0]=4 14116 B16R0.1183 CCOC(=O)C(F)OCCCOCCCOC 7a_200011215475_100000040065 [0,2,0,0,0,0|2,0,0]=4 14117 B16R0.1183 CCOC(=O)C(F)SCCCCCCCCO 62a_100000033203_100000760018 [0,2,0,0,0,0|1,0,0]=3 14118 B16R0.1183 CCOC(=O)C(F)SCCCCCCCCO 62a_100000760018_100000033203 [0,2,0,0,0,0|1,0,0]=3 14119 B16R0.1183 CCOC(=O)[C@H](C)OCCCCCCCCO 7a_100000751109_100000033203 [0,2,0,0,0,0|1,0,0]=3 14120 B16R0.1183 CCOC(C)C(=O)CCCCCCCCCO 1458a_100000739345_100009813782 [0,2,0,0,0,0|1,0,0]=3 14121 B16R0.1183 CCOC(C)C(=O)NCCCCCCCCO 240690a_102515433106_100000739345 [0,2,0,0,0,0|2,0,0]=4 14122 B16R0.1183 CCOCSCCCCCC(=O)C(=O)OCC 62a_100000739092_100000068741 [0,2,0,0,0,0|1,0,1]=4 14123 B16R0.1183 CCSC(=O)[C@H](C)NCCCCCCCCO 2230a_100103168634_100000033203 [0,2,0,0,0,0|1,1,0]=4 14124 B16R0.1183 CCSC(C)C(=O)CCCCCCCCCO 1458a_100000230601_100009813782 [0,2,0,0,0,0|1,1,0]=4 14125 B16R0.1183 CN(CCO)C(=O)CCCCCCCCCF 240690a_100000210263_200009909015 [0,2,0,0,0,0|2,0,0]=4 14126 B16R0.1183 CN(CCO)C(=O)CCCCCCCCCF 527a_100000210263_200009909015 [0,2,0,0,0,0|2,0,0]=4 14127 B16R0.1183 CN(CCO)C(=O)CCCCCCCCCO 240690a_100000210263_100000032657 [0,2,0,0,0,0|2,0,0]=4 14128 B16R0.1183 COCC(C)C(=O)CCCCCCCCCF 1458a_200009909015_100000765312 [0,2,0,0,0,0|2,0,0]=4 14129 B16R0.1183 COCC(C)C(=O)CCCCCCCCCO 1458a_100000751857_100009813782 [0,2,0,0,0,0|2,0,0]=4 14130 B16R0.1183 CSCC(C)C(=O)CCCCCCCCCO 1458a_100000753918_100009813782 [0,2,0,0,0,0|2,0,0]=4 14131 B16R0.1185 CCC(CC)C(=O)CCCCCCCCCO 1458a_100000211163_100009813782 [0,2,0,0,0,0|2,0,0]=4 14132 B16R0.1185 CCC(OC)C(=O)CCCCCCCCCO 1458a_100000747056_100009813782 [0,2,0,0,0,0|2,0,0]=4 14133 B16R0.1185 CCCCCCCCCCC(=O)C(CC)OC 1458a_100000747056_100000210319 [0,2,0,0,0,0|1,0,0]=3 14134 B16R0.1185 CCCCCCCCCCC(=O)C(OC)OC 1458a_100000046285_100000210319 [0,2,0,0,0,0|2,0,0]=4 14135 B16R0.1185 CCCCCCCCCCC(=O)N(CC)CC 11a_100000724800_100000210375 [0,2,0,0,0,0|1,0,0]=3 14136 B16R0.1185 CCCCCCCCCCC(=O)N(CC)CC 1626a_100000724800_100000210375 [0,2,0,0,0,0|1,0,0]=3 14137 B16R0.1185 CCCCCCCCCCC(=O)N(CC)CC 240690a_100000724800_100000210375 [0,2,0,0,0,0|1,0,0]=3 14138 B16R0.1185 CCCCCCCCCNC(=O)C(CC)CC 11a_100000212291_100000211163 [0,2,0,0,0,0|2,0,0]=4 14139 B16R0.1185 CCCCCCCCCNC(=O)C(CC)CC 1626a_100000212291_100000211163 [0,2,0,0,0,0|2,0,0]=4 14140 B16R0.1185 CCCCCCCCCNC(=O)C(CC)CC 240690a_100000212291_100000211163 [0,2,0,0,0,0|2,0,0]=4 14141 B16R0.1185 CCCCCCCCCNC(=O)C(CC)CC 527a_100000212291_100000211163 [0,2,0,0,0,0|2,0,0]=4 14142 B16R0.1185 CCCCCCCCCNC(=O)C(CC)OC 11a_100000212291_100000747056 [0,2,0,0,0,0|2,0,0]=4 14143 B16R0.1185 CCCCCCCCCNC(=O)C(CC)OC 1626a_100000212291_100000747056 [0,2,0,0,0,0|2,0,0]=4 14144 B16R0.1185 CCCCCCCCCNC(=O)C(CC)OC 240690a_100000212291_100000747056 [0,2,0,0,0,0|2,0,0]=4 14145 B16R0.1185 CCCCCCCCCNC(=O)C(CC)OC 527a_100000212291_100000747056 [0,2,0,0,0,0|2,0,0]=4 14146 B16R0.1185 CCCCCCCCCNC(=O)N(CC)CC 2708a_100000212291_100000724800 [0,2,0,0,0,0|2,0,0]=4 14147 B16R0.1185 CCCCCCCCCNC(=O)N(CC)CC 273464a_100000212291_100000724800 [0,2,0,0,0,0|2,0,0]=4 14148 B16R0.1185 CCCCCCCCNCC(=O)N(CC)CC 2230a_100000174916_100000210759 [0,2,0,0,0,0|2,0,0]=4 14149 B16R0.1185 CCCCCCCCNCC(=O)N(CC)CC 2230a_100000229939_100000211521 [0,2,0,0,0,0|2,0,0]=4 14150 B16R0.1185 CCCCCCCCNCC(=O)N(CC)CC 34a_100000229939_100000211521 [0,2,0,0,0,0|2,0,0]=4 14151 B16R0.1185 CCCCCCCCOCC(=O)C(CC)CC 1458a_100000759886_100000210505 [0,2,0,0,0,0|2,0,0]=4 14152 B16R0.1185 CCCCCCCCOCC(=O)N(CC)CC 11a_100000724800_100000759886 [0,2,0,0,0,0|2,0,0]=4 14153 B16R0.1185 CCCCCCCCOCC(=O)N(CC)CC 1626a_100000724800_100000759886 [0,2,0,0,0,0|2,0,0]=4 14154 B16R0.1185 CCCCCCCCOCC(=O)N(CC)CC 240690a_100000724800_100000759886 [0,2,0,0,0,0|2,0,0]=4 14155 B16R0.1185 CCCCCCCCOCC(=O)N(CC)CC 34a_100000210232_100000211521 [0,2,0,0,0,0|2,0,0]=4 14156 B16R0.1185 CCCCCCCCOCC(=O)N(CC)CC 527a_100000724800_100000759886 [0,2,0,0,0,0|2,0,0]=4 14157 B16R0.1185 CCCCCCCCOCC(=O)N(CC)CC 7a_100000210232_100000211521 [0,2,0,0,0,0|2,0,0]=4 14158 B16R0.1185 CCCCCCCCOCC(=O)N(CC)CC 7a_200000238847_100000210759 [0,2,0,0,0,0|2,0,0]=4 14159 B16R0.1185 CCCCCCCCSCC(=O)N(CC)CC 62a_100000210759_100000211521 [0,2,0,0,0,0|2,0,0]=4 14160 B16R0.1185 CCCCCCCCSCC(=O)N(CC)CC 62a_100000211521_100000210317 [0,2,0,0,0,0|2,0,0]=4 14161 B16R0.1185 CCCCCCCNCCC(=O)N(CC)CC 2230a_100000229938_100011194432 [0,2,0,0,0,0|2,0,0]=4 14162 B16R0.1185 CCCCCCCOCCC(=O)N(CC)CC 7a_100000210272_100011194432 [0,2,0,0,0,0|2,0,0]=4 14163 B16R0.1185 CCCCCCCSCCC(=O)N(CC)CC 62a_100000210614_100011194432 [0,2,0,0,0,0|2,0,0]=4 14164 B16R0.1185 CCCCCCOCCCC(=O)N(CC)CC 7a_100000210259_100000183999 [0,2,0,0,0,0|2,0,0]=4 14165 B16R0.1185 CCCCCCSCCCC(=O)N(CC)CC 62a_100000210314_100000183999 [0,2,0,0,0,0|2,0,0]=4 14166 B16R0.1185 CCN(CC)C(=O)CCCCCCCCCF 11a_100000724800_200009909015 [0,2,0,0,0,0|2,0,0]=4 14167 B16R0.1185 CCN(CC)C(=O)CCCCCCCCCF 240690a_100000724800_200009909015 [0,2,0,0,0,0|2,0,0]=4 14168 B16R0.1185 CCN(CC)C(=O)CCCCCCCCCF 527a_100000724800_200009909015 [0,2,0,0,0,0|2,0,0]=4 14169 B16R0.1185 CCN(CC)C(=O)CCCCCCCCCO 240690a_100000724800_100000032657 [0,2,0,0,0,0|2,0,0]=4 14170 B16R0.1284 CCC(C)CCCCCOCC(=O)N(C)CC 7a_200000035636_100000738999 [0,2,0,0,0,0|2,0,0]=4 14171 B16R0.1831 CCCCCCCCC(=O)CC(=O)N(C)CC 1458a_100000210188_100011894763 [0,2,0,0,0,0|1,0,1]=4 14172 B16R0.1831 CCCCCCCCN(C)CC(=O)N(C)CC 2230a_100000207567_100000738999 [0,2,0,0,0,0|2,0,0]=4 14173 B16R0.1831 CCCCCCCCN(C)CC(=O)N(C)CC 269982a_100000207567_100000738999 [0,2,0,0,0,0|2,0,0]=4 14174 B16R0.4852 CCCCCCCCCN(C)C(=O)C(C)CC 11a_100000232482_100011192722 [0,2,0,0,0,0|2,0,0]=4 14175 B16R0.4852 CCCCCCCCCN(C)C(=O)C(C)CC 1626a_100000232482_100011192722 [0,2,0,0,0,0|2,0,0]=4 14176 B16R0.4852 CCCCCCCCCN(C)C(=O)C(C)CC 240690a_100000232482_100011192722 [0,2,0,0,0,0|2,0,0]=4 14177 B16R0.4852 CCCCCCCCCN(C)C(=O)C(C)CC 527a_100000232482_100011192722 [0,2,0,0,0,0|2,0,0]=4 14178 B16R0.4852 CCCCCCCCCN(C)C(=O)C(O)CC 240690a_100000232482_100011196387 [0,2,0,0,0,0|2,0,0]=4 14179 B16R0.4852 CCCCCCCCNC(C)C(=O)N(C)CC 2230a_100000229939_200012002205 [0,2,0,0,0,0|2,0,0]=4 14180 B16R0.4852 CCCCCCCCNC(C)C(=O)N(C)CC 34a_100000229939_200012002205 [0,2,0,0,0,0|2,0,0]=4 14181 B16R0.4852 CCCCCCCCOC(C)C(=O)N(C)CC 34a_100000210232_200012002205 [0,2,0,0,0,0|2,0,0]=4 14182 B16R0.4852 CCCCCCCCOC(C)C(=O)N(C)CC 7a_100000210232_200012002205 [0,2,0,0,0,0|2,0,0]=4 14183 B16R0.4852 CCCCCCCCSC(C)C(=O)N(C)CC 62a_100000210759_200012002205 [0,2,0,0,0,0|2,0,0]=4 14184 B16R0.4852 CCCCCCCCSC(C)C(=O)N(C)CC 62a_200012002205_100000210317 [0,2,0,0,0,0|2,0,0]=4 14185 B16R0.8619 CCCCCCCCCCS(=O)(=O)N(C)CC 270084a_100000225621_200011217601 [0,2,0,0,0,0|2,0,0]=4 14186 B16R0.8619 CCCCCCCCCCS(=O)(=O)N(C)CC 274078a_100000225621_200011217601 [0,2,0,0,0,0|2,0,0]=4 14187 B16R0.41 C=C(Br)CCOCCCCCCC(=O)OCC 34a_100009813270_100009814379 [0,2,0,0,0,0|0,0,2]=4 14188 B16R0.41 C=C(C)CCOCCCCCCC(=O)OCC 34a_100000764851_100009814379 [0,2,0,0,0,0|0,0,1]=3 14189 B16R0.41 C=C(C)CCSCCCCCCC(=O)OCC 62a_100000730704_100009814379 [0,2,0,0,0,0|0,0,1]=3 14190 B16R0.41 C=C(C)COCCCCCCCC(=O)OCC 34a_100000210245_100009991516 [0,2,0,0,0,0|0,0,1]=3 14191 B16R0.41 C=C(C)CSCCCCCCCC(=O)OCC 62a_100000748629_100009991516 [0,2,0,0,0,0|0,0,1]=3 14192 B16R0.41 C=C(F)COCCCCCCCC(=O)OCC 34a_200010262243_100009991516 [0,2,0,0,0,0|0,0,2]=4 14193 B16R0.41 C=C(F)CSCCCCCCCC(=O)OCC 62a_100000042424_100009991516 [0,2,0,0,0,0|0,0,2]=4 14194 B16R0.41 C=COC(=O)COCCCCCCCC(C)C 34a_200000210741_100000036128 [0,2,0,0,0,0|0,0,2]=4 14195 B16R0.41 CC(C)CCCCCCCOCC(=O)NCO 34a_200000210741_100000185155 [0,2,0,0,0,0|2,0,0]=4 14196 B16R0.41 CC(C)CCCCCCCOCC(=O)NCO 7a_200000210741_100000185155 [0,2,0,0,0,0|2,0,0]=4 14197 B16R0.41 CCCC(=O)COCCCCCCCC(C)C 7a_200000210741_100000747444 [0,2,0,0,0,0|1,0,0]=3 14198 B16R0.41 CCCC(=O)OCNCCCCCCC(C)C 2230a_100000211014_100000034017 [0,2,0,0,0,0|2,0,0]=4 14199 B16R0.41 CCCC(=O)OCNCCCCCCC(C)C 34a_100000211014_100000034017 [0,2,0,0,0,0|2,0,0]=4 14200 B16R0.41 CCNC(=O)CCNCCCCCCC(C)C 2230a_100000211014_100000737597 [0,2,0,0,0,0|1,0,0]=3 14201 B16R0.41 CCNC(=O)COCCCCCCCC(C)C 34a_200000210741_100000183381 [0,2,0,0,0,0|1,0,0]=3 14202 B16R0.41 CCNC(=O)COCCCCCCCC(C)C 7a_200000210741_100000183381 [0,2,0,0,0,0|1,0,0]=3 14203 B16R0.41 CCOC(=O)/C=C/CNCCCCCC(C)C 2230a_100011290863_100016267167 [0,2,0,0,0,0|0,0,2]=4 14204 B16R0.41 CCOC(=O)/C=C/CNCCCCCC(C)C 34a_100011290863_100016267167 [0,2,0,0,0,0|0,0,2]=4 14205 B16R0.41 CCOC(=O)/C=C/COCCCCCC(C)C 34a_100011995859_100016267167 [0,2,0,0,0,0|0,0,2]=4 14206 B16R0.41 CCOC(=O)/C=C/COCCCCCC(C)C 7a_100011995859_100016267167 [0,2,0,0,0,0|0,0,2]=4 14207 B16R0.41 CCOC(=O)/C=C/CSCCCCCC(C)C 62a_100000210682_100016267167 [0,2,0,0,0,0|0,0,2]=4 14208 B16R0.41 CCOC(=O)/C=C/CSCCCCCC(C)C 62a_100016267167_100000210682 [0,2,0,0,0,0|0,0,2]=4 14209 B16R0.41 CCOC(=O)CCCCCC=NNCC(C)O 4a_200000730056_100000085164 [0,2,0,0,0,0|1,0,1]=4 14210 B16R0.41 CCOC(=O)CCCCCCCCCC(=O)C 1458a_100000070787_100009828014 [0,2,0,0,0,0|0,0,0]=2 14211 B16R0.41 CCOC(=O)CCCCCCCCCN(C)C 2230a_100102631434_100009828014 [0,2,0,0,0,0|0,0,0]=2 14212 B16R0.41 CCOC(=O)CCCCCCCCCN(C)C 269982a_100102631434_100009828014 [0,2,0,0,0,0|0,0,0]=2 14213 B16R0.41 CCOC(=O)CCCCCCCCNC(C)C 2230a_100138425928_100010175975 [0,2,0,0,0,0|0,0,0]=2 14214 B16R0.41 CCOC(=O)CCCCCCCCNC(C)C 34a_100138425928_100010175975 [0,2,0,0,0,0|0,0,0]=2 14215 B16R0.41 CCOC(=O)CCCCCCCCOC(C)C 34a_100000212225_100010175975 [0,2,0,0,0,0|0,0,0]=2 14216 B16R0.41 CCOC(=O)CCCCCCCCSC(C)C 62a_100000210206_100010175975 [0,2,0,0,0,0|0,0,0]=2 14217 B16R0.41 CCOC(=O)CCCCCCCNCC(=O)N 2230a_100000711301_100009991516 [0,2,0,0,0,0|1,0,1]=4 14218 B16R0.41 CCOC(=O)CCCCCCCNCC(=O)O 269956a_100016091260_100009991516 [0,2,0,0,0,0|1,0,1]=4 14219 B16R0.41 CCOC(=O)CCCCCCCNCC(C)C 2230a_100000210953_100009991516 [0,2,0,0,0,0|0,0,0]=2 14220 B16R0.41 CCOC(=O)CCCCCCCNCC(C)C 34a_100000210953_100009991516 [0,2,0,0,0,0|0,0,0]=2 14221 B16R0.41 CCOC(=O)CCCCCCCNCC(C)O 2230a_100000210904_100009991516 [0,2,0,0,0,0|0,0,0]=2 14222 B16R0.41 CCOC(=O)CCCCCCCNCC(C)O 34a_100000210904_100009991516 [0,2,0,0,0,0|0,0,0]=2 14223 B16R0.41 CCOC(=O)CCCCCCCNCC(F)F 34a_100000765723_100009991516 [0,2,0,0,0,0|1,0,0]=3 14224 B16R0.41 CCOC(=O)CCCCCCCOCC(=O)C 34a_100000211253_100009991516 [0,2,0,0,0,0|0,0,1]=3 14225 B16R0.41 CCOC(=O)CCCCCCCOCC(C)Br 34a_100012180447_100009991516 [0,2,0,0,0,0|0,0,0]=2 14226 B16R0.41 CCOC(=O)CCCCCCCOCC(C)C 34a_100000210257_100009991516 [0,2,0,0,0,0|0,0,0]=2 14227 B16R0.41 CCOC(=O)CCCCCCCOCC(C)F 34a_100015925927_100009991516 [0,2,0,0,0,0|0,0,0]=2 14228 B16R0.41 CCOC(=O)CCCCCCCOCC(F)F 34a_100000743014_100009991516 [0,2,0,0,0,0|1,0,0]=3 14229 B16R0.41 CCOC(=O)CCCCCCCOC[C@@H](C)Cl 34a_100016084084_100009991516 [0,2,0,0,0,0|0,0,0]=2 14230 B16R0.41 CCOC(=O)CCCCCCCOC[C@@H](C)N 34a_100000737577_100009991516 [0,2,0,0,0,0|0,0,0]=2 14231 B16R0.41 CCOC(=O)CCCCCCCSCC(=O)N 62a_100000747473_100009991516 [0,2,0,0,0,0|1,0,1]=4 14232 B16R0.41 CCOC(=O)CCCCCCCSCC(=O)[O-] 62a_100020667443_100009991516 [0,2,0,0,0,0|1,0,1]=4 14233 B16R0.41 CCOC(=O)CCCCCCCSCC(C)C 62a_100000210624_100009991516 [0,2,0,0,0,0|0,0,0]=2 14234 B16R0.41 CCOC(=O)CCCCCCCSCC(C)O 62a_100011218427_100009991516 [0,2,0,0,0,0|0,0,0]=2 14235 B16R0.41 CCOC(=O)CCCCCCCSCC(F)F 62a_100011934356_100009991516 [0,2,0,0,0,0|1,0,0]=3 14236 B16R0.41 CCOC(=O)CCCCCCCSC[C@@H](C)O 62a_100009817552_100009991516 [0,2,0,0,0,0|0,0,0]=2 14237 B16R0.41 CCOC(=O)CCCCCCNCC=C(C)C 34a_100000718196_100009814379 [0,2,0,0,0,0|0,0,2]=4 14238 B16R0.41 CCOC(=O)CCCCCCNCCC(C)O 2230a_200000755665_100009814379 [0,2,0,0,0,0|0,0,0]=2 14239 B16R0.41 CCOC(=O)CCCCCCOCC=C(C)C 34a_100000753907_100009814379 [0,2,0,0,0,0|0,0,2]=4 14240 B16R0.41 CCOC(=O)CCCCCCOCCC(=O)C 34a_100000759926_100009814379 [0,2,0,0,0,0|0,0,1]=3 14241 B16R0.41 CCOC(=O)CCCCCCOCCC(=O)C 7a_100000759926_100009814379 [0,2,0,0,0,0|0,0,1]=3 14242 B16R0.41 CCOC(=O)CCCCCCOCCC(=O)N 34a_100000757172_100009814379 [0,2,0,0,0,0|1,0,1]=4 14243 B16R0.41 CCOC(=O)CCCCCCOCCC(=O)N 7a_100000757172_100009814379 [0,2,0,0,0,0|1,0,1]=4 14244 B16R0.41 CCOC(=O)CCCCCCOCCC(C)Br 34a_100009893172_100009814379 [0,2,0,0,0,0|0,0,0]=2 14245 B16R0.41 CCOC(=O)CCCCCCOCCC(C)C 34a_100000210254_100009814379 [0,2,0,0,0,0|0,0,0]=2 14246 B16R0.41 CCOC(=O)CCCCCCOCCC(C)C 7a_100000210254_100009814379 [0,2,0,0,0,0|0,0,0]=2 14247 B16R0.41 CCOC(=O)CCCCCCOCCC(F)F 34a_100103093639_100009814379 [0,2,0,0,0,0|1,0,0]=3 14248 B16R0.41 CCOC(=O)CCCCCCOCC[C@@H](C)N 34a_100000706166_100009814379 [0,2,0,0,0,0|0,0,0]=2 14249 B16R0.41 CCOC(=O)CCCCCCSCC=C(C)C 62a_100000761012_100009814379 [0,2,0,0,0,0|0,0,2]=4 14250 B16R0.41 CCOC(=O)CCCCCCSCCC(=O)C 62a_100000053229_100009814379 [0,2,0,0,0,0|0,0,1]=3 14251 B16R0.41 CCOC(=O)CCCCCCSCCC(=O)N 62a_100000744528_100009814379 [0,2,0,0,0,0|1,0,1]=4 14252 B16R0.41 CCOC(=O)CCCCCCSCCC(C)C 62a_100000210312_100009814379 [0,2,0,0,0,0|0,0,0]=2 14253 B16R0.41 CCOC(=O)CCCCCCSCCC(C)O 62a_100012276601_100009814379 [0,2,0,0,0,0|0,0,0]=2 14254 B16R0.41 CCOC(=O)CCCCCCSCOC(=O)C 62a_100000076356_100009814379 [0,2,0,0,0,0|1,0,1]=4 14255 B16R0.41 CCOC(=O)CCCCCCSCOC(C)C 62a_100000709892_100009814379 [0,2,0,0,0,0|1,0,0]=3 14256 B16R0.41 CCOC(=O)CCCCCNCCCC(=O)N 34a_100000739312_100000755133 [0,2,0,0,0,0|1,0,1]=4 14257 B16R0.41 CCOC(=O)CCCCCNCCCC(C)C 2230a_200000737386_100000755133 [0,2,0,0,0,0|0,0,0]=2 14258 B16R0.41 CCOC(=O)CCCCCNCCCC(C)C 34a_200000737386_100000755133 [0,2,0,0,0,0|0,0,0]=2 14259 B16R0.41 CCOC(=O)CCCCCNCCCS(=O)C 2230a_200000753449_100000755133 [0,2,0,0,0,0|1,0,0]=3 14260 B16R0.41 CCOC(=O)CCCCCNCCNC(=O)C 2230a_100000209853_100000755133 [0,2,0,0,0,0|1,0,1]=4 14261 B16R0.41 CCOC(=O)CCCCCNCCOC(C)C 2230a_100000701111_100000755133 [0,2,0,0,0,0|1,0,0]=3 14262 B16R0.41 CCOC(=O)CCCCCNCCOC(C)C 34a_100000701111_100000755133 [0,2,0,0,0,0|1,0,0]=3 14263 B16R0.41 CCOC(=O)CCCCCNCCSC(C)C 2230a_100000731138_100000755133 [0,2,0,0,0,0|1,0,0]=3 14264 B16R0.41 CCOC(=O)CCCCCNCCSC(C)C 34a_100000731138_100000755133 [0,2,0,0,0,0|1,0,0]=3 14265 B16R0.41 CCOC(=O)CCCCCOCCC=C(C)C 7a_100011214988_100011217483 [0,2,0,0,0,0|0,0,2]=4 14266 B16R0.41 CCOC(=O)CCCCCOCCCC(=O)C 34a_100000759063_100000755133 [0,2,0,0,0,0|0,0,1]=3 14267 B16R0.41 CCOC(=O)CCCCCOCCCC(=O)C 7a_100000759063_100000755133 [0,2,0,0,0,0|0,0,1]=3 14268 B16R0.41 CCOC(=O)CCCCCOCCCC(=O)C 7a_100011214988_100011215641 [0,2,0,0,0,0|0,0,1]=3 14269 B16R0.41 CCOC(=O)CCCCCOCCCC(=O)N 7a_100011214988_100102525003 [0,2,0,0,0,0|1,0,1]=4 14270 B16R0.41 CCOC(=O)CCCCCOCCCC(C)C 34a_100000210774_100000755133 [0,2,0,0,0,0|0,0,0]=2 14271 B16R0.41 CCOC(=O)CCCCCOCCCC(C)C 7a_100000210774_100000755133 [0,2,0,0,0,0|0,0,0]=2 14272 B16R0.41 CCOC(=O)CCCCCOCCCC(C)C 7a_100011214988_100011214892 [0,2,0,0,0,0|0,0,0]=2 14273 B16R0.41 CCOC(=O)CCCCCOCCCC(C)O 7a_100011214988_200000718107 [0,2,0,0,0,0|0,0,0]=2 14274 B16R0.41 CCOC(=O)CCCCCOCCCN(C)C 7a_100011214988_100000757444 [0,2,0,0,0,0|1,0,0]=3 14275 B16R0.41 CCOC(=O)CCCCCOCCC[N+](=O)[O-] 34a_200000037920_100000755133 [0,2,0,0,0,0|2,0,0]=4 14276 B16R0.41 CCOC(=O)CCCCCOCCNC(=O)C 34a_100000158858_100000755133 [0,2,0,0,0,0|1,0,1]=4 14277 B16R0.41 CCOC(=O)CCCCCOCCNC(=O)C 7a_100011214988_100000189650 [0,2,0,0,0,0|1,0,1]=4 14278 B16R0.41 CCOC(=O)CCCCCOCCNC(C)C 34a_100000224655_100000755133 [0,2,0,0,0,0|1,0,0]=3 14279 B16R0.41 CCOC(=O)CCCCCOCCOC(=O)C 7a_100011214988_100009814007 [0,2,0,0,0,0|1,0,1]=4 14280 B16R0.41 CCOC(=O)CCCCCOCCOC(C)C 34a_100000211219_100000755133 [0,2,0,0,0,0|1,0,0]=3 14281 B16R0.41 CCOC(=O)CCCCCOCCOC(C)C 7a_100000211219_100000755133 [0,2,0,0,0,0|1,0,0]=3 14282 B16R0.41 CCOC(=O)CCCCCOCCOC(C)C 7a_100011214988_100000211751 [0,2,0,0,0,0|1,0,0]=3 14283 B16R0.41 CCOC(=O)CCCCCOCCSC(C)C 34a_200011212901_100000755133 [0,2,0,0,0,0|1,0,0]=3 14284 B16R0.41 CCOC(=O)CCCCCOCCSC(C)C 7a_100011214988_100000730970 [0,2,0,0,0,0|1,0,0]=3 14285 B16R0.41 CCOC(=O)CCCCCOCCSC(C)C 7a_200011212901_100000755133 [0,2,0,0,0,0|1,0,0]=3 14286 B16R0.41 CCOC(=O)CCCCCSCCC=C(C)C 62a_100000755133_100011217483 [0,2,0,0,0,0|0,0,2]=4 14287 B16R0.41 CCOC(=O)CCCCCSCCC=C(C)C 62a_100011217483_100000755133 [0,2,0,0,0,0|0,0,2]=4 14288 B16R0.41 CCOC(=O)CCCCCSCCCC(=O)C 62a_100000755133_100011215641 [0,2,0,0,0,0|0,0,1]=3 14289 B16R0.41 CCOC(=O)CCCCCSCCCC(=O)C 62a_100011215641_100000755133 [0,2,0,0,0,0|0,0,1]=3 14290 B16R0.41 CCOC(=O)CCCCCSCCCC(=O)N 62a_100000755133_100102525003 [0,2,0,0,0,0|1,0,1]=4 14291 B16R0.41 CCOC(=O)CCCCCSCCCC(=O)N 62a_100102525003_100000755133 [0,2,0,0,0,0|1,0,1]=4 14292 B16R0.41 CCOC(=O)CCCCCSCCCC(C)C 62a_100000755133_100011214892 [0,2,0,0,0,0|0,0,0]=2 14293 B16R0.41 CCOC(=O)CCCCCSCCCC(C)C 62a_100011214892_100000755133 [0,2,0,0,0,0|0,0,0]=2 14294 B16R0.41 CCOC(=O)CCCCCSCCCC(C)O 62a_100000755133_200000718107 [0,2,0,0,0,0|0,0,0]=2 14295 B16R0.41 CCOC(=O)CCCCCSCCCC(C)O 62a_200000718107_100000755133 [0,2,0,0,0,0|0,0,0]=2 14296 B16R0.41 CCOC(=O)CCCCCSCCCN(C)C 62a_100000755133_100000757444 [0,2,0,0,0,0|1,0,0]=3 14297 B16R0.41 CCOC(=O)CCCCCSCCNC(=O)C 62a_100000189650_100000755133 [0,2,0,0,0,0|1,0,1]=4 14298 B16R0.41 CCOC(=O)CCCCCSCCNC(=O)C 62a_100000755133_100000189650 [0,2,0,0,0,0|1,0,1]=4 14299 B16R0.41 CCOC(=O)CCCCCSCCOC(=O)C 62a_100000755133_100009814007 [0,2,0,0,0,0|1,0,1]=4 14300 B16R0.41 CCOC(=O)CCCCCSCCOC(=O)C 62a_100009814007_100000755133 [0,2,0,0,0,0|1,0,1]=4 14301 B16R0.41 CCOC(=O)CCCCCSCCOC(C)C 62a_100000211751_100000755133 [0,2,0,0,0,0|1,0,0]=3 14302 B16R0.41 CCOC(=O)CCCCCSCCOC(C)C 62a_100000755133_100000211751 [0,2,0,0,0,0|1,0,0]=3 14303 B16R0.41 CCOC(=O)CCCCCSCCSC(C)C 62a_100000730970_100000755133 [0,2,0,0,0,0|1,0,0]=3 14304 B16R0.41 CCOC(=O)CCCCCSCCSC(C)C 62a_100000755133_100000730970 [0,2,0,0,0,0|1,0,0]=3 14305 B16R0.41 CCOC(=O)CCCCNCCCCC(=O)N 34a_100000696515_100000750268 [0,2,0,0,0,0|1,0,1]=4 14306 B16R0.41 CCOC(=O)CCCCNCCCNC(=O)C 34a_100000736810_100000750268 [0,2,0,0,0,0|1,0,1]=4 14307 B16R0.41 CCOC(=O)CCCCNCCCOC(C)C 2230a_100000737246_100000750268 [0,2,0,0,0,0|1,0,0]=3 14308 B16R0.41 CCOC(=O)CCCCNCCCOC(C)C 34a_100000737246_100000750268 [0,2,0,0,0,0|1,0,0]=3 14309 B16R0.41 CCOC(=O)CCCCOCCCCC(=O)N 34a_100012022536_100000750268 [0,2,0,0,0,0|1,0,1]=4 14310 B16R0.41 CCOC(=O)CCCCOCCCCC(=O)N 7a_100012022536_100000750268 [0,2,0,0,0,0|1,0,1]=4 14311 B16R0.41 CCOC(=O)CCCCOCCCCC(C)C 34a_100011214890_100000750268 [0,2,0,0,0,0|0,0,0]=2 14312 B16R0.41 CCOC(=O)CCCCOCCCCC(C)C 7a_100011214890_100000750268 [0,2,0,0,0,0|0,0,0]=2 14313 B16R0.41 CCOC(=O)CCCCOCCCC[N+](=O)[O-] 34a_200015379883_100000750268 [0,2,0,0,0,0|2,0,0]=4 14314 B16R0.41 CCOC(=O)CCCCOCCCC[N+](=O)[O-] 7a_200015379883_100000750268 [0,2,0,0,0,0|2,0,0]=4 14315 B16R0.41 CCOC(=O)CCCCOCCCNC(=O)C 34a_100000752032_100000750268 [0,2,0,0,0,0|1,0,1]=4 14316 B16R0.41 CCOC(=O)CCCCOCCCNC(C)C 34a_100000182298_100000750268 [0,2,0,0,0,0|1,0,0]=3 14317 B16R0.41 CCOC(=O)CCCCOCCNCC(C)C 34a_100015185251_100000750268 [0,2,0,0,0,0|1,0,0]=3 14318 B16R0.41 CCOC(=O)CCCCOCCOCC(C)C 34a_100000703358_100000750268 [0,2,0,0,0,0|1,0,0]=3 14319 B16R0.41 CCOC(=O)CCCCOCCOCC(C)C 7a_100000703358_100000750268 [0,2,0,0,0,0|1,0,0]=3 14320 B16R0.41 CCOC(=O)CCCCOCCOCC(F)F 34a_100000704375_100000750268 [0,2,0,0,0,0|2,0,0]=4 14321 B16R0.41 CCOC(=O)CCCCOCCOCC(F)F 7a_100000704375_100000750268 [0,2,0,0,0,0|2,0,0]=4 14322 B16R0.41 CCOC(=O)CCCCOCCSCC(C)C 34a_200000230437_100000750268 [0,2,0,0,0,0|1,0,0]=3 14323 B16R0.41 CCOC(=O)CCCCOCCSCC(C)C 7a_200000230437_100000750268 [0,2,0,0,0,0|1,0,0]=3 14324 B16R0.41 CCOC(=O)CCCCSCCCCB(O)O 62a_100000750268_200009817182 [0,2,0,0,0,0|2,0,0]=4 14325 B16R0.41 CCOC(=O)CCCCSCCCCB(O)O 62a_200009817182_100000750268 [0,2,0,0,0,0|2,0,0]=4 14326 B16R0.41 CCOC(=O)CCCCSCCCCC(=O)C 62a_100000735457_100000750268 [0,2,0,0,0,0|0,0,1]=3 14327 B16R0.41 CCOC(=O)CCCCSCCCCC(=O)C 62a_100000750268_100000735457 [0,2,0,0,0,0|0,0,1]=3 14328 B16R0.41 CCOC(=O)CCCCSCCCCC(C)C 62a_100000750268_100011216152 [0,2,0,0,0,0|0,0,0]=2 14329 B16R0.41 CCOC(=O)CCCCSCCCCC(C)C 62a_100011216152_100000750268 [0,2,0,0,0,0|0,0,0]=2 14330 B16R0.41 CCOC(=O)CCCCSCCCCN(C)C 62a_100000750268_100000690147 [0,2,0,0,0,0|1,0,0]=3 14331 B16R0.41 CCOC(=O)CCCCSCCCOC(=O)C 62a_100000042594_100000750268 [0,2,0,0,0,0|1,0,1]=4 14332 B16R0.41 CCOC(=O)CCCCSCCCOC(=O)C 62a_100000750268_100000042594 [0,2,0,0,0,0|1,0,1]=4 14333 B16R0.41 CCOC(=O)CCCCSCCCOC(=S)C 62a_100000750268_200135323944 [0,2,0,0,0,0|1,0,1]=4 14334 B16R0.41 CCOC(=O)CCCCSCCCOC(=S)C 62a_200135323944_100000750268 [0,2,0,0,0,0|1,0,1]=4 14335 B16R0.41 CCOC(=O)CCCCSCCCSC(=O)C 62a_100000038929_100000750268 [0,2,0,0,0,0|1,0,1]=4 14336 B16R0.41 CCOC(=O)CCCCSCCCSC(=O)C 62a_100000750268_100000038929 [0,2,0,0,0,0|1,0,1]=4 14337 B16R0.41 CCOC(=O)CCCCSCCOCC(F)F 62a_100000750268_200012177212 [0,2,0,0,0,0|2,0,0]=4 14338 B16R0.41 CCOC(=O)CCCCSCCOCC(F)F 62a_200012177212_100000750268 [0,2,0,0,0,0|2,0,0]=4 14339 B16R0.41 CCOC(=O)CCCNCCCCCC(C)C 2230a_100011290863_100009991533 [0,2,0,0,0,0|0,0,0]=2 14340 B16R0.41 CCOC(=O)CCCNCCCCCC(C)C 34a_100011290863_100009991533 [0,2,0,0,0,0|0,0,0]=2 14341 B16R0.41 CCOC(=O)CCCNCCCCNC(=O)C 2230a_200011368371_100009991533 [0,2,0,0,0,0|1,0,1]=4 14342 B16R0.41 CCOC(=O)CCCNCCCCNC(=O)C 34a_200011368371_100009991533 [0,2,0,0,0,0|1,0,1]=4 14343 B16R0.41 CCOC(=O)CCCNCCCOCC(C)C 2230a_100000205972_100009991533 [0,2,0,0,0,0|1,0,0]=3 14344 B16R0.41 CCOC(=O)CCCNCCCOCC(C)C 34a_100000205972_100009991533 [0,2,0,0,0,0|1,0,0]=3 14345 B16R0.41 CCOC(=O)CCCOCCCCCB(O)O 7a_100012001163_200009817188 [0,2,0,0,0,0|2,0,0]=4 14346 B16R0.41 CCOC(=O)CCCOCCCCCC(=O)N 34a_100000123541_100009991533 [0,2,0,0,0,0|1,0,1]=4 14347 B16R0.41 CCOC(=O)CCCOCCCCCC(=O)N 7a_100000123541_100011215271 [0,2,0,0,0,0|1,0,1]=4 14348 B16R0.41 CCOC(=O)CCCOCCCCCC(=O)N 7a_100012001163_100009817443 [0,2,0,0,0,0|1,0,1]=4 14349 B16R0.41 CCOC(=O)CCCOCCCCCC(=O)[O-] 7a_100102619762_100011215271 [0,2,0,0,0,0|1,0,1]=4 14350 B16R0.41 CCOC(=O)CCCOCCCCCC(C)C 34a_100011995859_100009991533 [0,2,0,0,0,0|0,0,0]=2 14351 B16R0.41 CCOC(=O)CCCOCCCCCC(C)C 7a_100011995859_100011215271 [0,2,0,0,0,0|0,0,0]=2 14352 B16R0.41 CCOC(=O)CCCOCCCCCC(C)C 7a_100012001163_100000210682 [0,2,0,0,0,0|0,0,0]=2 14353 B16R0.41 CCOC(=O)CCCOCCCCNC(C)C 34a_100011521146_100009991533 [0,2,0,0,0,0|1,0,0]=3 14354 B16R0.41 CCOC(=O)CCCOCCCCOC(=O)C 34a_100000073216_100009991533 [0,2,0,0,0,0|1,0,1]=4 14355 B16R0.41 CCOC(=O)CCCOCCCCOC(=O)C 7a_100000073216_100011215271 [0,2,0,0,0,0|1,0,1]=4 14356 B16R0.41 CCOC(=O)CCCOCCCCOC(=O)C 7a_100012001163_100000033659 [0,2,0,0,0,0|1,0,1]=4 14357 B16R0.41 CCOC(=O)CCCOCCCCSC(=O)C 7a_100012001163_200010402107 [0,2,0,0,0,0|1,0,1]=4 14358 B16R0.41 CCOC(=O)CCCSCCCCCB(O)O 62a_100009991533_200009817188 [0,2,0,0,0,0|2,0,0]=4 14359 B16R0.41 CCOC(=O)CCCSCCCCCB(O)O 62a_200009817188_100009991533 [0,2,0,0,0,0|2,0,0]=4 14360 B16R0.41 CCOC(=O)CCCSCCCCCC(=O)N 62a_100009817443_100009991533 [0,2,0,0,0,0|1,0,1]=4 14361 B16R0.41 CCOC(=O)CCCSCCCCCC(=O)N 62a_100009991533_100009817443 [0,2,0,0,0,0|1,0,1]=4 14362 B16R0.41 CCOC(=O)CCCSCCCCCC(C)C 62a_100000210682_100009991533 [0,2,0,0,0,0|0,0,0]=2 14363 B16R0.41 CCOC(=O)CCCSCCCCCC(C)C 62a_100009991533_100000210682 [0,2,0,0,0,0|0,0,0]=2 14364 B16R0.41 CCOC(=O)CCCSCCCCOC(=O)C 62a_100000033659_100009991533 [0,2,0,0,0,0|1,0,1]=4 14365 B16R0.41 CCOC(=O)CCCSCCCCOC(=O)C 62a_100009991533_100000033659 [0,2,0,0,0,0|1,0,1]=4 14366 B16R0.41 CCOC(=O)CCCSCCCCSC(=O)C 62a_100009991533_200010402107 [0,2,0,0,0,0|1,0,1]=4 14367 B16R0.41 CCOC(=O)CCCSCCCCSC(=O)C 62a_200010402107_100009991533 [0,2,0,0,0,0|1,0,1]=4 14368 B16R0.41 CCOC(=O)CCNCCCCCCC(C)C 2230a_100000211014_100011206558 [0,2,0,0,0,0|0,0,0]=2 14369 B16R0.41 CCOC(=O)CCNCCCCCCC(C)C 34a_100000211014_100000765890 [0,2,0,0,0,0|0,0,0]=2 14370 B16R0.41 CCOC(=O)CCNCCCCCNC(=O)C 2230a_200012022750_100011206558 [0,2,0,0,0,0|1,0,1]=4 14371 B16R0.41 CCOC(=O)CCNCCCCCNC(=O)C 34a_200012022750_100000765890 [0,2,0,0,0,0|1,0,1]=4 14372 B16R0.41 CCOC(=O)CCOCCCCCNC(C)C 34a_100011629493_100000765890 [0,2,0,0,0,0|1,0,0]=3 14373 B16R0.41 CCOC(=O)CCOCCCOCCC(=O)C 1458a_200020626524_200000210301 [0,2,0,0,0,0|1,0,1]=4 14374 B16R0.41 CCOC(=O)CCOCCCOCCC(=O)[13CH3] 1458a_200020626524_200025704644 [0,2,0,0,0,0|1,0,1]=4 14375 B16R0.41 CCOC(=O)CCOCCOCCOC(C)C 34a_100010737887_100000210206 [0,2,0,0,0,0|2,0,0]=4 14376 B16R0.41 CCOC(=O)CCOCCOCCOC(C)C 7a_100010737887_100000210206 [0,2,0,0,0,0|2,0,0]=4 14377 B16R0.41 CCOC(=O)CCSCCCCCCB(O)O 62a_100000765890_100009817187 [0,2,0,0,0,0|2,0,0]=4 14378 B16R0.41 CCOC(=O)CCSCCCCCCB(O)O 62a_100009817187_100000765890 [0,2,0,0,0,0|2,0,0]=4 14379 B16R0.41 CCOC(=O)CCSCCCCCOC(=O)C 62a_100000033007_100000765890 [0,2,0,0,0,0|1,0,1]=4 14380 B16R0.41 CCOC(=O)CCSCCCCCOC(=O)C 62a_100000765890_100000033007 [0,2,0,0,0,0|1,0,1]=4 14381 B16R0.41 CCOC(=O)CNCCCCCCNC(=O)C 2230a_200011996284_100000188475 [0,2,0,0,0,0|1,0,1]=4 14382 B16R0.41 CCOC(=O)CNCCCCCCNC(=O)C 34a_200011996284_100000188475 [0,2,0,0,0,0|1,0,1]=4 14383 B16R0.41 CCOC(=O)COCCCCCCCC(C)C 34a_200000210741_100000188475 [0,2,0,0,0,0|0,0,0]=2 14384 B16R0.41 CCOC(=O)COCCCCCCCC(C)C 7a_200000210741_100000188475 [0,2,0,0,0,0|0,0,0]=2 14385 B16R0.41 CCOC(=O)COCCCNCCCC(C)C 2230a_200000737386_100009893628 [0,2,0,0,0,0|1,0,0]=3 14386 B16R0.41 CCOC(=O)COCCCNCCCC(C)C 34a_200000737386_100009893628 [0,2,0,0,0,0|1,0,0]=3 14387 B16R0.41 CCOC(=O)COCCCNCCCS(=O)C 2230a_200000753449_100009893628 [0,2,0,0,0,0|2,0,0]=4 14388 B16R0.41 CCOC(=O)COCCCNCCOC(C)C 2230a_100000701111_100009893628 [0,2,0,0,0,0|2,0,0]=4 14389 B16R0.41 CCOC(=O)COCCCNCCOC(C)C 34a_100000701111_100009893628 [0,2,0,0,0,0|2,0,0]=4 14390 B16R0.41 CCOC(=O)COCCCNCCSC(C)C 2230a_100000731138_100009893628 [0,2,0,0,0,0|2,0,0]=4 14391 B16R0.41 CCOC(=O)COCCCNCCSC(C)C 34a_100000731138_100009893628 [0,2,0,0,0,0|2,0,0]=4 14392 B16R0.41 CCOC(=O)COCCCOCCCC(=O)C 34a_100000759063_100009893628 [0,2,0,0,0,0|1,0,1]=4 14393 B16R0.41 CCOC(=O)COCCCOCCCC(=O)C 7a_100000759063_100009893628 [0,2,0,0,0,0|1,0,1]=4 14394 B16R0.41 CCOC(=O)COCCCOCCCC(C)C 34a_100000210774_100009893628 [0,2,0,0,0,0|1,0,0]=3 14395 B16R0.41 CCOC(=O)COCCCOCCCC(C)C 7a_100000210774_100009893628 [0,2,0,0,0,0|1,0,0]=3 14396 B16R0.41 CCOC(=O)COCCCOCCNC(C)C 34a_100000224655_100009893628 [0,2,0,0,0,0|2,0,0]=4 14397 B16R0.41 CCOC(=O)COCCCOCCOC(C)C 34a_100000211219_100009893628 [0,2,0,0,0,0|2,0,0]=4 14398 B16R0.41 CCOC(=O)COCCCOCCOC(C)C 7a_100000211219_100009893628 [0,2,0,0,0,0|2,0,0]=4 14399 B16R0.41 CCOC(=O)COCCCOCCSC(C)C 34a_200011212901_100009893628 [0,2,0,0,0,0|2,0,0]=4 14400 B16R0.41 CCOC(=O)COCCCOCCSC(C)C 7a_200011212901_100009893628 [0,2,0,0,0,0|2,0,0]=4 14401 B16R0.41 CCOC(=O)COCCCSCCCC(=O)C 62a_100009893628_100011215641 [0,2,0,0,0,0|1,0,1]=4 14402 B16R0.41 CCOC(=O)COCCCSCCCC(=O)C 62a_100011215641_100009893628 [0,2,0,0,0,0|1,0,1]=4 14403 B16R0.41 CCOC(=O)COCCCSCCCC(C)C 62a_100009893628_100011214892 [0,2,0,0,0,0|1,0,0]=3 14404 B16R0.41 CCOC(=O)COCCCSCCCC(C)C 62a_100011214892_100009893628 [0,2,0,0,0,0|1,0,0]=3 14405 B16R0.41 CCOC(=O)COCCCSCCCC(C)O 62a_100009893628_200000718107 [0,2,0,0,0,0|1,0,0]=3 14406 B16R0.41 CCOC(=O)COCCCSCCCC(C)O 62a_200000718107_100009893628 [0,2,0,0,0,0|1,0,0]=3 14407 B16R0.41 CCOC(=O)COCCCSCCCN(C)C 62a_100009893628_100000757444 [0,2,0,0,0,0|2,0,0]=4 14408 B16R0.41 CCOC(=O)COCCCSCCOC(C)C 62a_100000211751_100009893628 [0,2,0,0,0,0|2,0,0]=4 14409 B16R0.41 CCOC(=O)COCCCSCCOC(C)C 62a_100009893628_100000211751 [0,2,0,0,0,0|2,0,0]=4 14410 B16R0.41 CCOC(=O)COCCCSCCSC(C)C 62a_100000730970_100009893628 [0,2,0,0,0,0|2,0,0]=4 14411 B16R0.41 CCOC(=O)COCCCSCCSC(C)C 62a_100009893628_100000730970 [0,2,0,0,0,0|2,0,0]=4 14412 B16R0.41 CCOC(=O)COCCNCCCOC(C)C 2230a_100000737246_100000088970 [0,2,0,0,0,0|2,0,0]=4 14413 B16R0.41 CCOC(=O)COCCNCCCOC(C)C 34a_100000737246_100000088970 [0,2,0,0,0,0|2,0,0]=4 14414 B16R0.41 CCOC(=O)COCCOCCCCC(C)C 34a_100011214890_100000088970 [0,2,0,0,0,0|1,0,0]=3 14415 B16R0.41 CCOC(=O)COCCOCCCCC(C)C 7a_100011214890_100000088970 [0,2,0,0,0,0|1,0,0]=3 14416 B16R0.41 CCOC(=O)COCCOCCCNC(C)C 34a_100000182298_100000088970 [0,2,0,0,0,0|2,0,0]=4 14417 B16R0.41 CCOC(=O)COCCOCCNCC(C)C 34a_100015185251_100000088970 [0,2,0,0,0,0|2,0,0]=4 14418 B16R0.41 CCOC(=O)COCCOCCOCC(C)C 34a_100000703358_100000088970 [0,2,0,0,0,0|2,0,0]=4 14419 B16R0.41 CCOC(=O)COCCOCCOCC(C)C 7a_100000703358_100000088970 [0,2,0,0,0,0|2,0,0]=4 14420 B16R0.41 CCOC(=O)COCCOCCSCC(C)C 34a_200000230437_100000088970 [0,2,0,0,0,0|2,0,0]=4 14421 B16R0.41 CCOC(=O)COCCOCCSCC(C)C 7a_200000230437_100000088970 [0,2,0,0,0,0|2,0,0]=4 14422 B16R0.41 CCOC(=O)COCCSCCCCC(=O)C 62a_100000088970_100000735457 [0,2,0,0,0,0|1,0,1]=4 14423 B16R0.41 CCOC(=O)COCCSCCCCC(=O)C 62a_100000735457_100000088970 [0,2,0,0,0,0|1,0,1]=4 14424 B16R0.41 CCOC(=O)COCCSCCCCC(C)C 62a_100000088970_100011216152 [0,2,0,0,0,0|1,0,0]=3 14425 B16R0.41 CCOC(=O)COCCSCCCCC(C)C 62a_100011216152_100000088970 [0,2,0,0,0,0|1,0,0]=3 14426 B16R0.41 CCOC(=O)COCCSCCCCN(C)C 62a_100000088970_100000690147 [0,2,0,0,0,0|2,0,0]=4 14427 B16R0.41 CCOC(=O)CSCCOCCCCC(=O)C 7a_200000230590_100000735457 [0,2,0,0,0,0|1,0,1]=4 14428 B16R0.41 CCOC(=O)CSCCOCCCCC(C)C 7a_200000230590_100011216152 [0,2,0,0,0,0|1,0,0]=3 14429 B16R0.41 CCOC(=O)NCCOCCCCCC(C)C 34a_100000158857_100000210682 [0,2,0,0,0,0|1,0,0]=3 14430 B16R0.41 CCOC(=O)NCCOCCCCCC(C)C 7a_100011995859_200011445536 [0,2,0,0,0,0|1,0,0]=3 14431 B16R0.41 CCOC(=O)NCCSCCCCCC(C)C 62a_100000210682_200011445536 [0,2,0,0,0,0|1,0,0]=3 14432 B16R0.61 C#CCCCCCCCCOCC(=O)CCC 7a_100000065265_100000747444 [0,2,0,0,0,0|1,0,1]=4 14433 B16R0.61 C#CCCCCCCCCOCC(=O)NCC 34a_100000065265_100000183381 [0,2,0,0,0,0|1,0,1]=4 14434 B16R0.61 C#CCCCCCCCCOCC(=O)NCC 7a_100000065265_100000183381 [0,2,0,0,0,0|1,0,1]=4 14435 B16R0.61 C#CCCCCCCCCOCC(=O)OCC 34a_100000065265_100000188475 [0,2,0,0,0,0|0,0,1]=3 14436 B16R0.61 C#CCCCCCCCCOCC(=O)OCC 7a_100000065265_100000188475 [0,2,0,0,0,0|0,0,1]=3 14437 B16R0.61 C#CCCCCCCCNCCC(=O)NCC 34a_100025743525_100153394163 [0,2,0,0,0,0|1,0,1]=4 14438 B16R0.61 C#CCCCCCCCOCCC(=O)NCC 7a_100000054614_100000737597 [0,2,0,0,0,0|1,0,1]=4 14439 B16R0.61 C#CCCCCCCCOCCC(=O)OCC 34a_100000054614_100000765890 [0,2,0,0,0,0|0,0,1]=3 14440 B16R0.61 C#CCCCCCCCOCCC(=O)OCC 7a_100000054614_100011206558 [0,2,0,0,0,0|0,0,1]=3 14441 B16R0.61 C#CCCCCCCCSCCC(=O)NCC 62a_100000737597_100153394163 [0,2,0,0,0,0|1,0,1]=4 14442 B16R0.61 C#CCCCCCCCSCCC(=O)NCC 62a_100153394163_100000737597 [0,2,0,0,0,0|1,0,1]=4 14443 B16R0.61 C#CCCCCCCCSCCC(=O)OCC 62a_100000765890_100153394163 [0,2,0,0,0,0|0,0,1]=3 14444 B16R0.61 C#CCCCCCCCSCCC(=O)OCC 62a_100153394163_100000765890 [0,2,0,0,0,0|0,0,1]=3 14445 B16R0.61 C#CCCCCCCCSCOC(=O)OCC 62a_100153394163_100000075025 [0,2,0,0,0,0|0,0,2]=4 14446 B16R0.61 C#CCCCCCCOCCCC(=O)OCC 34a_100011217361_100009991533 [0,2,0,0,0,0|0,0,1]=3 14447 B16R0.61 C#CCCCCCCOCCCC(=O)OCC 7a_100011217361_100011215271 [0,2,0,0,0,0|0,0,1]=3 14448 B16R0.61 C#CCCCCCCOCCCC(=O)OCC 7a_100012001163_100012276617 [0,2,0,0,0,0|0,0,1]=3 14449 B16R0.61 C#CCCCCCCOCCNC(=O)OCC 34a_100000158857_100012276617 [0,2,0,0,0,0|0,0,2]=4 14450 B16R0.61 C#CCCCCCCOCCNC(=O)OCC 7a_100011217361_200011445536 [0,2,0,0,0,0|0,0,2]=4 14451 B16R0.61 C#CCCCCCCSCCCC(=O)OCC 62a_100009991533_100012276617 [0,2,0,0,0,0|0,0,1]=3 14452 B16R0.61 C#CCCCCCCSCCCC(=O)OCC 62a_100012276617_100009991533 [0,2,0,0,0,0|0,0,1]=3 14453 B16R0.61 C#CCCCCCCSCCNC(=O)OCC 62a_100012276617_200011445536 [0,2,0,0,0,0|0,0,2]=4 14454 B16R0.61 C#CCCCCCOCCCCC(=O)OCC 34a_100000766912_100000750268 [0,2,0,0,0,0|0,0,1]=3 14455 B16R0.61 C#CCCCCCOCCCCC(=O)OCC 7a_100000766912_100000750268 [0,2,0,0,0,0|0,0,1]=3 14456 B16R0.61 C#CCCCCCOCCOCC(=O)OCC 34a_100000766912_100000088970 [0,2,0,0,0,0|0,0,2]=4 14457 B16R0.61 C#CCCCCCOCCOCC(=O)OCC 7a_100000766912_100000088970 [0,2,0,0,0,0|0,0,2]=4 14458 B16R0.61 C#CCCCCCOCCSCC(=O)OCC 7a_200000230590_100012094781 [0,2,0,0,0,0|0,0,2]=4 14459 B16R0.61 C#CCCCCCSCCCCC(=O)OCC 62a_100000750268_100012094781 [0,2,0,0,0,0|0,0,1]=3 14460 B16R0.61 C#CCCCCCSCCCCC(=O)OCC 62a_100012094781_100000750268 [0,2,0,0,0,0|0,0,1]=3 14461 B16R0.61 C#CCCCCCSCCOCC(=O)OCC 62a_100000088970_100012094781 [0,2,0,0,0,0|0,0,2]=4 14462 B16R0.61 C#CCCCCCSCCOCC(=O)OCC 62a_100012094781_100000088970 [0,2,0,0,0,0|0,0,2]=4 14463 B16R0.61 C#CCCCCNCCCCCC(=O)OCC 2230a_100000706060_100000755133 [0,2,0,0,0,0|0,0,1]=3 14464 B16R0.61 C#CCCCCNCCCCCC(=O)OCC 34a_100000706060_100000755133 [0,2,0,0,0,0|0,0,1]=3 14465 B16R0.61 C#CCCCCNCCCOCC(=O)OCC 2230a_100000706060_100009893628 [0,2,0,0,0,0|0,0,2]=4 14466 B16R0.61 C#CCCCCNCCCOCC(=O)OCC 34a_100000706060_100009893628 [0,2,0,0,0,0|0,0,2]=4 14467 B16R0.61 C#CCCCCOCCCCCC(=O)OCC 34a_100000766709_100000755133 [0,2,0,0,0,0|0,0,1]=3 14468 B16R0.61 C#CCCCCOCCCCCC(=O)OCC 7a_100000766709_100000755133 [0,2,0,0,0,0|0,0,1]=3 14469 B16R0.61 C#CCCCCOCCCCCC(=O)OCC 7a_100011214988_100010269958 [0,2,0,0,0,0|0,0,1]=3 14470 B16R0.61 C#CCCCCOCCCOCC(=O)OCC 34a_100000766709_100009893628 [0,2,0,0,0,0|0,0,2]=4 14471 B16R0.61 C#CCCCCOCCCOCC(=O)OCC 7a_100000766709_100009893628 [0,2,0,0,0,0|0,0,2]=4 14472 B16R0.61 C#CCCCCSCCCCCC(=O)OCC 62a_100000755133_100010269958 [0,2,0,0,0,0|0,0,1]=3 14473 B16R0.61 C#CCCCCSCCCCCC(=O)OCC 62a_100010269958_100000755133 [0,2,0,0,0,0|0,0,1]=3 14474 B16R0.61 C#CCCCCSCCCOCC(=O)OCC 62a_100009893628_100010269958 [0,2,0,0,0,0|0,0,2]=4 14475 B16R0.61 C#CCCCCSCCCOCC(=O)OCC 62a_100010269958_100009893628 [0,2,0,0,0,0|0,0,2]=4 14476 B16R0.61 C#CCCCNCCCCCCC(=O)OCC 34a_100000718082_100009814379 [0,2,0,0,0,0|0,0,1]=3 14477 B16R0.61 C#CCCCOCCCCCCC(=O)OCC 34a_100000215630_100009814379 [0,2,0,0,0,0|0,0,1]=3 14478 B16R0.61 C#CCCCOCCCCCCC(=O)OCC 7a_100000215630_100009814379 [0,2,0,0,0,0|0,0,1]=3 14479 B16R0.61 C#CCCCSCCCCCCC(=O)OCC 62a_100011215417_100009814379 [0,2,0,0,0,0|0,0,1]=3 14480 B16R0.61 C#CCCNCCCCCCCC(=O)OCC 34a_100000755551_100009991516 [0,2,0,0,0,0|0,0,1]=3 14481 B16R0.61 C#CCCOCCCCCCCC(=O)OCC 34a_100011215631_100009991516 [0,2,0,0,0,0|0,0,1]=3 14482 B16R0.61 C#CCCSCCCCCCCC(=O)OCC 62a_100000688953_100009991516 [0,2,0,0,0,0|0,0,1]=3 14483 B16R0.61 C#CCNCCCCCCCCC(=O)OCC 34a_100000212058_100010175975 [0,2,0,0,0,0|0,0,1]=3 14484 B16R0.61 C#CCOCCCCCCCCC(=O)OCC 34a_100000210247_100010175975 [0,2,0,0,0,0|0,0,1]=3 14485 B16R0.61 C#CCOCCCCCCOCC(=O)OCC 34a_200011021349_100000188475 [0,2,0,0,0,0|0,0,2]=4 14486 B16R0.61 C#CCOCCCCCCOCC(=O)OCC 7a_200011021349_100000188475 [0,2,0,0,0,0|0,0,2]=4 14487 B16R0.61 C#CCOCCNCCCCCC(=O)OCC 2230a_100000700922_100000755133 [0,2,0,0,0,0|0,0,2]=4 14488 B16R0.61 C#CCOCCNCCCCCC(=O)OCC 34a_100000700922_100000755133 [0,2,0,0,0,0|0,0,2]=4 14489 B16R0.61 C#CCOCCOCCCCCC(=O)OCC 34a_100000054580_100000755133 [0,2,0,0,0,0|0,0,2]=4 14490 B16R0.61 C#CCOCCOCCCCCC(=O)OCC 7a_100000054580_100000755133 [0,2,0,0,0,0|0,0,2]=4 14491 B16R0.61 C#CCOCCOCCCCCC(=O)OCC 7a_100011214988_100010402529 [0,2,0,0,0,0|0,0,2]=4 14492 B16R0.61 C#CCOCCSCCCCCC(=O)OCC 62a_100000755133_100010402529 [0,2,0,0,0,0|0,0,2]=4 14493 B16R0.61 C#CCOCCSCCCCCC(=O)OCC 62a_100010402529_100000755133 [0,2,0,0,0,0|0,0,2]=4 14494 B16R0.61 C#CCSCCCCCCCCC(=O)OCC 62a_100000038162_100010175975 [0,2,0,0,0,0|0,0,1]=3 14495 B16R0.61 C/C=C/CCOCCCCCCC(=O)OCC 34a_100016278192_100009814379 [0,2,0,0,0,0|0,0,1]=3 14496 B16R0.61 C/C=C/COCCCCCCCC(=O)OCC 34a_100016270725_100009991516 [0,2,0,0,0,0|0,0,1]=3 14497 B16R0.61 C/C=C/CSCCCCCCCC(=O)OCC 62a_100102629194_100009991516 [0,2,0,0,0,0|0,0,1]=3 14498 B16R0.61 C=CCCCCCCCCCCC(=O)C#CC 1458a_100000763181_100011093070 [0,2,0,0,0,0|1,0,1]=4 14499 B16R0.61 C=CCCCCCCCCCCC(=O)CCO 1458a_100011216618_100011093070 [0,2,0,0,0,0|2,0,0]=4 14500 B16R0.61 C=CCCCCCCCCCCC(=O)COC 1458a_100000210968_100011093070 [0,2,0,0,0,0|2,0,0]=4 14501 B16R0.61 C=CCCCCCCCCCNC(=O)CCC 11a_100000081888_100000211992 [0,2,0,0,0,0|1,0,1]=4 14502 B16R0.61 C=CCCCCCCCCCNC(=O)CCC 1626a_100000081888_100000211992 [0,2,0,0,0,0|1,0,1]=4 14503 B16R0.61 C=CCCCCCCCCCNC(=O)CCC 240690a_100000081888_100000211992 [0,2,0,0,0,0|1,0,1]=4 14504 B16R0.61 C=CCCCCCCCCCNC(=O)CCC 527a_100000081888_100000211992 [0,2,0,0,0,0|1,0,1]=4 14505 B16R0.61 C=CCCCCCCCCCNC(=O)NCC 2708a_100000081888_100015525214 [0,2,0,0,0,0|1,0,1]=4 14506 B16R0.61 C=CCCCCCCCCCNC(=O)NCC 2708a_100015525214_100000081888 [0,2,0,0,0,0|1,0,1]=4 14507 B16R0.61 C=CCCCCCCCCCNC(=O)NCC 273464a_100000081888_100015525214 [0,2,0,0,0,0|1,0,1]=4 14508 B16R0.61 C=CCCCCCCCCCNC(=O)NCC 273464a_100015525214_100000081888 [0,2,0,0,0,0|1,0,1]=4 14509 B16R0.61 C=CCCCCCCCCCNC(=O)NCC 512a_100000081888_100015525214 [0,2,0,0,0,0|1,0,1]=4 14510 B16R0.61 C=CCCCCCCCCCNC(=O)NCC 512a_100015525214_100000081888 [0,2,0,0,0,0|1,0,1]=4 14511 B16R0.61 C=CCCCCCCCCNCC(=O)NCC 2230a_100016988866_100011933949 [0,2,0,0,0,0|1,0,1]=4 14512 B16R0.61 C=CCCCCCCCCOCC(=O)CCC 7a_100011215194_100000747444 [0,2,0,0,0,0|1,0,1]=4 14513 B16R0.61 C=CCCCCCCCCOCC(=O)NCC 34a_100011215194_100000183381 [0,2,0,0,0,0|1,0,1]=4 14514 B16R0.61 C=CCCCCCCCCOCC(=O)NCC 7a_100011215194_100000183381 [0,2,0,0,0,0|1,0,1]=4 14515 B16R0.61 C=CCCCCCCCCOCC(=O)OCC 34a_100011215194_100000188475 [0,2,0,0,0,0|0,0,1]=3 14516 B16R0.61 C=CCCCCCCCCOCC(=O)OCC 7a_100011215194_100000188475 [0,2,0,0,0,0|0,0,1]=3 14517 B16R0.61 C=CCCCCCCCCSCC(=O)NCC 62a_100000183381_100011933949 [0,2,0,0,0,0|1,0,1]=4 14518 B16R0.61 C=CCCCCCCCCSCC(=O)NCC 62a_100011933949_100000183381 [0,2,0,0,0,0|1,0,1]=4 14519 B16R0.61 C=CCCCCCCCCSCC(=O)OCC 62a_100000188475_100011933949 [0,2,0,0,0,0|0,0,1]=3 14520 B16R0.61 C=CCCCCCCCCSCC(=O)OCC 62a_100011933949_100000188475 [0,2,0,0,0,0|0,0,1]=3 14521 B16R0.61 C=CCCCCCCCNCCC(=O)NCC 34a_100025743525_100012355270 [0,2,0,0,0,0|1,0,1]=4 14522 B16R0.61 C=CCCCCCCCOCCC(=O)NCC 7a_100000730831_100000737597 [0,2,0,0,0,0|1,0,1]=4 14523 B16R0.61 C=CCCCCCCCOCCC(=O)OCC 34a_100000730831_100000765890 [0,2,0,0,0,0|0,0,1]=3 14524 B16R0.61 C=CCCCCCCCOCCC(=O)OCC 7a_100000730831_100011206558 [0,2,0,0,0,0|0,0,1]=3 14525 B16R0.61 C=CCCCCCCCSCCC(=O)NCC 62a_100000737597_100012355270 [0,2,0,0,0,0|1,0,1]=4 14526 B16R0.61 C=CCCCCCCCSCCC(=O)NCC 62a_100012355270_100000737597 [0,2,0,0,0,0|1,0,1]=4 14527 B16R0.61 C=CCCCCCCCSCCC(=O)OCC 62a_100000765890_100012355270 [0,2,0,0,0,0|0,0,1]=3 14528 B16R0.61 C=CCCCCCCCSCCC(=O)OCC 62a_100012355270_100000765890 [0,2,0,0,0,0|0,0,1]=3 14529 B16R0.61 C=CCCCCCCCSCOC(=O)OCC 62a_100012355270_100000075025 [0,2,0,0,0,0|0,0,2]=4 14530 B16R0.61 C=CCCCCCCOCCCC(=O)OCC 34a_200011216477_100009991533 [0,2,0,0,0,0|0,0,1]=3 14531 B16R0.61 C=CCCCCCCOCCCC(=O)OCC 7a_100012001163_100011215473 [0,2,0,0,0,0|0,0,1]=3 14532 B16R0.61 C=CCCCCCCOCCCC(=O)OCC 7a_200011216477_100011215271 [0,2,0,0,0,0|0,0,1]=3 14533 B16R0.61 C=CCCCCCCOCCNC(=O)OCC 34a_100000158857_100011215473 [0,2,0,0,0,0|0,0,2]=4 14534 B16R0.61 C=CCCCCCCOCCNC(=O)OCC 7a_200011216477_200011445536 [0,2,0,0,0,0|0,0,2]=4 14535 B16R0.61 C=CCCCCCCSCCCC(=O)OCC 62a_100009991533_100011215473 [0,2,0,0,0,0|0,0,1]=3 14536 B16R0.61 C=CCCCCCCSCCCC(=O)OCC 62a_100011215473_100009991533 [0,2,0,0,0,0|0,0,1]=3 14537 B16R0.61 C=CCCCCCCSCCNC(=O)OCC 62a_100011215473_200011445536 [0,2,0,0,0,0|0,0,2]=4 14538 B16R0.61 C=CCCCCCOCCCCC(=O)OCC 34a_100011216702_100000750268 [0,2,0,0,0,0|0,0,1]=3 14539 B16R0.61 C=CCCCCCOCCCCC(=O)OCC 7a_100011216702_100000750268 [0,2,0,0,0,0|0,0,1]=3 14540 B16R0.61 C=CCCCCCOCCOCC(=O)OCC 34a_100011216702_100000088970 [0,2,0,0,0,0|0,0,2]=4 14541 B16R0.61 C=CCCCCCOCCOCC(=O)OCC 7a_100011216702_100000088970 [0,2,0,0,0,0|0,0,2]=4 14542 B16R0.61 C=CCCCCCOCCSCC(=O)OCC 7a_200000230590_100000700193 [0,2,0,0,0,0|0,0,2]=4 14543 B16R0.61 C=CCCCCCSCCCCC(=O)OCC 62a_100000700193_100000750268 [0,2,0,0,0,0|0,0,1]=3 14544 B16R0.61 C=CCCCCCSCCCCC(=O)OCC 62a_100000750268_100000700193 [0,2,0,0,0,0|0,0,1]=3 14545 B16R0.61 C=CCCCCCSCCOCC(=O)OCC 62a_100000088970_100000700193 [0,2,0,0,0,0|0,0,2]=4 14546 B16R0.61 C=CCCCCCSCCOCC(=O)OCC 62a_100000700193_100000088970 [0,2,0,0,0,0|0,0,2]=4 14547 B16R0.61 C=CCCCCNCCCCCC(=O)OCC 2230a_100000703577_100000755133 [0,2,0,0,0,0|0,0,1]=3 14548 B16R0.61 C=CCCCCNCCCCCC(=O)OCC 34a_100000703577_100000755133 [0,2,0,0,0,0|0,0,1]=3 14549 B16R0.61 C=CCCCCNCCCOCC(=O)OCC 2230a_100000703577_100009893628 [0,2,0,0,0,0|0,0,2]=4 14550 B16R0.61 C=CCCCCNCCCOCC(=O)OCC 34a_100000703577_100009893628 [0,2,0,0,0,0|0,0,2]=4 14551 B16R0.61 C=CCCCCOCCCCCC(=O)OCC 34a_100000766645_100000755133 [0,2,0,0,0,0|0,0,1]=3 14552 B16R0.61 C=CCCCCOCCCCCC(=O)OCC 7a_100000766645_100000755133 [0,2,0,0,0,0|0,0,1]=3 14553 B16R0.61 C=CCCCCOCCCCCC(=O)OCC 7a_100011214988_100011215482 [0,2,0,0,0,0|0,0,1]=3 14554 B16R0.61 C=CCCCCOCCCOCC(=O)OCC 34a_100000766645_100009893628 [0,2,0,0,0,0|0,0,2]=4 14555 B16R0.61 C=CCCCCOCCCOCC(=O)OCC 7a_100000766645_100009893628 [0,2,0,0,0,0|0,0,2]=4 14556 B16R0.61 C=CCCCCSCCCCCC(=O)OCC 62a_100000755133_100011215482 [0,2,0,0,0,0|0,0,1]=3 14557 B16R0.61 C=CCCCCSCCCCCC(=O)OCC 62a_100011215482_100000755133 [0,2,0,0,0,0|0,0,1]=3 14558 B16R0.61 C=CCCCCSCCCOCC(=O)OCC 62a_100009893628_100011215482 [0,2,0,0,0,0|0,0,2]=4 14559 B16R0.61 C=CCCCCSCCCOCC(=O)OCC 62a_100011215482_100009893628 [0,2,0,0,0,0|0,0,2]=4 14560 B16R0.61 C=CCCCNCCCCCCC(=O)OCC 2230a_100000700776_100009814379 [0,2,0,0,0,0|0,0,1]=3 14561 B16R0.61 C=CCCCNCCCCCCC(=O)OCC 34a_100000700776_100009814379 [0,2,0,0,0,0|0,0,1]=3 14562 B16R0.61 C=CCCCOCCCCCCC(=O)OCC 34a_100000758997_100009814379 [0,2,0,0,0,0|0,0,1]=3 14563 B16R0.61 C=CCCCOCCCCCCC(=O)OCC 7a_100000758997_100009814379 [0,2,0,0,0,0|0,0,1]=3 14564 B16R0.61 C=CCCCSCCCCCCC(=O)OCC 62a_100011713584_100009814379 [0,2,0,0,0,0|0,0,1]=3 14565 B16R0.61 C=CCCNCCCCCCCC(=O)OCC 2230a_100015191253_100009991516 [0,2,0,0,0,0|0,0,1]=3 14566 B16R0.61 C=CCCOCCCCCCCC(=O)OCC 34a_100011205117_100009991516 [0,2,0,0,0,0|0,0,1]=3 14567 B16R0.61 C=CCCSCCCCCCCC(=O)OCC 62a_100000754431_100009991516 [0,2,0,0,0,0|0,0,1]=3 14568 B16R0.61 C=CCNCCCCCCCCC(=O)OCC 2230a_100020586998_100010175975 [0,2,0,0,0,0|0,0,1]=3 14569 B16R0.61 C=CCOCCCCCCCCC(=O)OCC 34a_200000210373_100010175975 [0,2,0,0,0,0|0,0,1]=3 14570 B16R0.61 C=CCOCCOCCCCCC(=O)OCC 34a_100000037705_100000755133 [0,2,0,0,0,0|0,0,2]=4 14571 B16R0.61 C=CCOCCOCCCCCC(=O)OCC 7a_100000037705_100000755133 [0,2,0,0,0,0|0,0,2]=4 14572 B16R0.61 C=CCSCCCCCCCCC(=O)OCC 62a_100000210623_100010175975 [0,2,0,0,0,0|0,0,1]=3 14573 B16R0.61 C=COC(=O)CNCCCCCCCCCC 2230a_100000684558_100000036128 [0,2,0,0,0,0|0,0,2]=4 14574 B16R0.61 C=COC(=O)CNCCCCCCCCCC 34a_100000684558_100000036128 [0,2,0,0,0,0|0,0,2]=4 14575 B16R0.61 C=COC(=O)CNCCCCCCCCCO 2230a_100000078944_100000036128 [0,2,0,0,0,0|0,0,2]=4 14576 B16R0.61 C=COC(=O)CNCCCCCCCCCO 34a_100000078944_100000036128 [0,2,0,0,0,0|0,0,2]=4 14577 B16R0.61 C=COC(=O)COCCCCCCCCCBr 34a_100009813782_100000036128 [0,2,0,0,0,0|0,0,2]=4 14578 B16R0.61 C=COC(=O)COCCCCCCCCCC 34a_100000210711_100000036128 [0,2,0,0,0,0|0,0,2]=4 14579 B16R0.61 C=COC(=O)COCCCCCCCCCCl 34a_100009868337_100000036128 [0,2,0,0,0,0|0,0,2]=4 14580 B16R0.61 C=COC(=O)COCCCCCCCCCN 34a_100000078944_100000036128 [0,2,0,0,0,0|0,0,2]=4 14581 B16R0.61 C=COC(=O)CSCCCCCCCCCC 62a_100000036128_100000210320 [0,2,0,0,0,0|0,0,2]=4 14582 B16R0.61 C=COC(=O)CSCCCCCCCCCO 62a_100000036128_100009813782 [0,2,0,0,0,0|0,0,2]=4 14583 B16R0.61 C=COC(=O)CSCCCCCCCCCO 62a_100009813782_100000036128 [0,2,0,0,0,0|0,0,2]=4 14584 B16R0.61 C=COCCCCOCCCCC(=O)OCC 34a_100000031558_100000750268 [0,2,0,0,0,0|0,0,2]=4 14585 B16R0.61 C=COCCCCOCCCCC(=O)OCC 7a_100000031558_100000750268 [0,2,0,0,0,0|0,0,2]=4 14586 B16R0.61 C=COCCCNCCCCCC(=O)OCC 2230a_100000210767_100000755133 [0,2,0,0,0,0|0,0,2]=4 14587 B16R0.61 C=COCCCNCCCCCC(=O)OCC 34a_100000210767_100000755133 [0,2,0,0,0,0|0,0,2]=4 14588 B16R0.61 C=COCCOCCCCCCC(=O)OCC 34a_100000033082_100009814379 [0,2,0,0,0,0|0,0,2]=4 14589 B16R0.61 C=COCCSCCCCCCC(=O)OCC 62a_100000039644_100009814379 [0,2,0,0,0,0|0,0,2]=4 14590 B16R0.61 CC#CC(=O)CCCCCCC#CCCCC 1458a_100000763181_200000043322 [0,2,0,0,0,0|1,0,1]=4 14591 B16R0.61 CC#CC(=O)CCCCCCCCCCCC 1458a_100000763181_100000759014 [0,2,0,0,0,0|1,0,1]=4 14592 B16R0.61 CC#CC(=O)CCCCCCCCCCCO 1458a_100000763181_100009812471 [0,2,0,0,0,0|1,0,1]=4 14593 B16R0.61 CC#CCCOCCCCCCC(=O)OCC 34a_100000750427_100009814379 [0,2,0,0,0,0|0,0,1]=3 14594 B16R0.61 CC#CCNCCCCCCCC(=O)OCC 2230a_100000685387_100009991516 [0,2,0,0,0,0|0,0,1]=3 14595 B16R0.61 CC#CCNCCCCCCCC(=O)OCC 34a_100000685387_100009991516 [0,2,0,0,0,0|0,0,1]=3 14596 B16R0.61 CC#CCOCCCCCCCC(=O)OCC 34a_100000761923_100009991516 [0,2,0,0,0,0|0,0,1]=3 14597 B16R0.61 CC#CCSCCCCCCCC(=O)OCC 62a_100000748600_100009991516 [0,2,0,0,0,0|0,0,1]=3 14598 B16R0.61 CC/C=C/CCCOCCCCC(=O)OCC 34a_100016287902_100000750268 [0,2,0,0,0,0|0,0,1]=3 14599 B16R0.61 CC/C=C/CCCOCCCCC(=O)OCC 7a_100016287902_100000750268 [0,2,0,0,0,0|0,0,1]=3 14600 B16R0.61 CC/C=C/CCCOCCOCC(=O)OCC 34a_100016287902_100000088970 [0,2,0,0,0,0|0,0,2]=4 14601 B16R0.61 CC/C=C/CCCOCCOCC(=O)OCC 7a_100016287902_100000088970 [0,2,0,0,0,0|0,0,2]=4 14602 B16R0.61 CC/C=C\CCCCCNCCC(=O)NCC 269862a_100025743525_100016288537 [0,2,0,0,0,0|1,0,1]=4 14603 B16R0.61 CC/C=C\CCCCCOCCC(=O)NCC 7a_100016268722_100000737597 [0,2,0,0,0,0|1,0,1]=4 14604 B16R0.61 CC/C=C\CCCCCOCCC(=O)OCC 34a_100016268722_100000765890 [0,2,0,0,0,0|0,0,1]=3 14605 B16R0.61 CC/C=C\CCCCCOCCC(=O)OCC 7a_100016268722_100011206558 [0,2,0,0,0,0|0,0,1]=3 14606 B16R0.61 CC/C=C\CCCCOCCCC(=O)OCC 34a_100016287862_100009991533 [0,2,0,0,0,0|0,0,1]=3 14607 B16R0.61 CC/C=C\CCCCOCCCC(=O)OCC 7a_100016287862_100011215271 [0,2,0,0,0,0|0,0,1]=3 14608 B16R0.61 CC/C=C\CCCCOCCNC(=O)OCC 7a_100016287862_200011445536 [0,2,0,0,0,0|0,0,2]=4 14609 B16R0.61 CC/C=C\CCOCCCCCC(=O)OCC 34a_100016288707_100000755133 [0,2,0,0,0,0|0,0,1]=3 14610 B16R0.61 CC/C=C\CCOCCCCCC(=O)OCC 7a_100011214988_100015370543 [0,2,0,0,0,0|0,0,1]=3 14611 B16R0.61 CC/C=C\CCOCCCCCC(=O)OCC 7a_100016288707_100000755133 [0,2,0,0,0,0|0,0,1]=3 14612 B16R0.61 CC/C=C\CCOCCCOCC(=O)OCC 34a_100016288707_100009893628 [0,2,0,0,0,0|0,0,2]=4 14613 B16R0.61 CC/C=C\CCOCCCOCC(=O)OCC 7a_100016288707_100009893628 [0,2,0,0,0,0|0,0,2]=4 14614 B16R0.61 CC/C=C\CCSCCCCCC(=O)OCC 62a_100000755133_100015370543 [0,2,0,0,0,0|0,0,1]=3 14615 B16R0.61 CC/C=C\CCSCCCCCC(=O)OCC 62a_100015370543_100000755133 [0,2,0,0,0,0|0,0,1]=3 14616 B16R0.61 CC/C=C\CCSCCCOCC(=O)OCC 62a_100009893628_100015370543 [0,2,0,0,0,0|0,0,2]=4 14617 B16R0.61 CC/C=C\CCSCCCOCC(=O)OCC 62a_100015370543_100009893628 [0,2,0,0,0,0|0,0,2]=4 14618 B16R0.61 CC/C=C\COCCCCCCC(=O)OCC 34a_100016268518_100009814379 [0,2,0,0,0,0|0,0,1]=3 14619 B16R0.61 CC/C=C\CSCCCCCCC(=O)OCC 62a_100103147603_100009814379 [0,2,0,0,0,0|0,0,1]=3 14620 B16R0.61 CC=C=CCCOCCCCCC(=O)OCC 34a_100011020354_100000755133 [0,2,0,0,0,0|0,0,2]=4 14621 B16R0.61 CC=CC(=O)CCCCCCC#CCCCC 1458a_100000210699_200000043322 [0,2,0,0,0,0|1,0,1]=4 14622 B16R0.61 CC=CC(=O)CCCCCCCCCCCO 1458a_100000210699_100009812471 [0,2,0,0,0,0|1,0,1]=4 14623 B16R0.61 CC=CC(=O)NCCCCCCCCCCC 11a_200011215754_100000210699 [0,2,0,0,0,0|1,0,1]=4 14624 B16R0.61 CC=CC(=O)NCCCCCCCCCCC 1626a_200011215754_100000210699 [0,2,0,0,0,0|1,0,1]=4 14625 B16R0.61 CC=CC(=O)NCCCCCCCCCCC 240690a_200011215754_100000210699 [0,2,0,0,0,0|1,0,1]=4 14626 B16R0.61 CC=CC(=O)NCCCCCCCCCCO 240690a_100000066964_100000210699 [0,2,0,0,0,0|1,0,1]=4 14627 B16R0.61 CC=CCCCOCCCCCC(=O)OCC 34a_100020645299_100000755133 [0,2,0,0,0,0|0,0,1]=3 14628 B16R0.61 CC=CCCCOCCCOCC(=O)OCC 34a_100020645299_100009893628 [0,2,0,0,0,0|0,0,2]=4 14629 B16R0.61 CC=CCSCCCCCCCC(=O)OCC 62a_100000070051_100009991516 [0,2,0,0,0,0|0,0,1]=3 14630 B16R0.61 CCC#CCCCCCCNCC(=O)NCC 2230a_100016988866_200000036426 [0,2,0,0,0,0|1,0,1]=4 14631 B16R0.61 CCC#CCCCCCCSCC(=O)CCC 62a_100000747444_200000036426 [0,2,0,0,0,0|1,0,1]=4 14632 B16R0.61 CCC#CCCCCCCSCC(=O)CCC 62a_200000036426_100000747444 [0,2,0,0,0,0|1,0,1]=4 14633 B16R0.61 CCC#CCCCCCCSCC(=O)NCC 62a_100000183381_200000036426 [0,2,0,0,0,0|1,0,1]=4 14634 B16R0.61 CCC#CCCCCCCSCC(=O)NCC 62a_200000036426_100000183381 [0,2,0,0,0,0|1,0,1]=4 14635 B16R0.61 CCC#CCCCCCCSCC(=O)OCC 62a_100000188475_200000036426 [0,2,0,0,0,0|0,0,1]=3 14636 B16R0.61 CCC#CCCCCCCSCC(=O)OCC 62a_200000036426_100000188475 [0,2,0,0,0,0|0,0,1]=3 14637 B16R0.61 CCC#CCCOCCCCCC(=O)OCC 34a_100000036655_100000755133 [0,2,0,0,0,0|0,0,1]=3 14638 B16R0.61 CCC#CCCOCCCCCC(=O)OCC 7a_100000036655_100000755133 [0,2,0,0,0,0|0,0,1]=3 14639 B16R0.61 CCC#CCCOCCCOCC(=O)OCC 34a_100000036655_100009893628 [0,2,0,0,0,0|0,0,2]=4 14640 B16R0.61 CCC#CCCOCCCOCC(=O)OCC 7a_100000036655_100009893628 [0,2,0,0,0,0|0,0,2]=4 14641 B16R0.61 CCC#CCOCCCCCCC(=O)OCC 34a_100000032950_100009814379 [0,2,0,0,0,0|0,0,1]=3 14642 B16R0.61 CCC#CCSCCCCCCC(=O)OCC 62a_100009813939_100009814379 [0,2,0,0,0,0|0,0,1]=3 14643 B16R0.61 CCC/C=C/COCCCCCC(=O)OCC 34a_100016278788_100000755133 [0,2,0,0,0,0|0,0,1]=3 14644 B16R0.61 CCC/C=C/COCCCCCC(=O)OCC 7a_100016278788_100000755133 [0,2,0,0,0,0|0,0,1]=3 14645 B16R0.61 CCC/C=C/COCCCOCC(=O)OCC 34a_100016278788_100009893628 [0,2,0,0,0,0|0,0,2]=4 14646 B16R0.61 CCC/C=C/COCCCOCC(=O)OCC 7a_100016278788_100009893628 [0,2,0,0,0,0|0,0,2]=4 14647 B16R0.61 CCCC#CCCOCCCCC(=O)OCC 34a_100000042726_100000750268 [0,2,0,0,0,0|0,0,1]=3 14648 B16R0.61 CCCC#CCCOCCCCC(=O)OCC 7a_100000042726_100000750268 [0,2,0,0,0,0|0,0,1]=3 14649 B16R0.61 CCCC#CCCOCCOCC(=O)OCC 34a_100000042726_100000088970 [0,2,0,0,0,0|0,0,2]=4 14650 B16R0.61 CCCC#CCCOCCOCC(=O)OCC 7a_100000042726_100000088970 [0,2,0,0,0,0|0,0,2]=4 14651 B16R0.61 CCCC#CCOCCCCCC(=O)OCC 34a_100000034806_100000755133 [0,2,0,0,0,0|0,0,1]=3 14652 B16R0.61 CCCC#CCOCCCCCC(=O)OCC 7a_100000034806_100000755133 [0,2,0,0,0,0|0,0,1]=3 14653 B16R0.61 CCCC#CCOCCCOCC(=O)OCC 34a_100000034806_100009893628 [0,2,0,0,0,0|0,0,2]=4 14654 B16R0.61 CCCC#CCOCCCOCC(=O)OCC 7a_100000034806_100009893628 [0,2,0,0,0,0|0,0,2]=4 14655 B16R0.61 CCCC(=O)CCCCCCCCCCCO 1458a_100000211992_100009812471 [0,2,0,0,0,0|1,0,0]=3 14656 B16R0.61 CCCC(=O)CNCCCCCCCCCO 2230a_100000078944_100000747444 [0,2,0,0,0,0|1,0,0]=3 14657 B16R0.61 CCCC(=O)COCCCCCCCCCBr 7a_100009813782_100000747444 [0,2,0,0,0,0|1,0,0]=3 14658 B16R0.61 CCCC(=O)COCCCCCCCCCCl 7a_100009868337_100000747444 [0,2,0,0,0,0|1,0,0]=3 14659 B16R0.61 CCCC(=O)CSCCCCCCCCCO 62a_100000747444_100009813782 [0,2,0,0,0,0|1,0,0]=3 14660 B16R0.61 CCCC(=O)CSCCCCCCCCCO 62a_100009813782_100000747444 [0,2,0,0,0,0|1,0,0]=3 14661 B16R0.61 CCCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000211992 [0,2,0,0,0,0|1,0,0]=3 14662 B16R0.61 CCCC(=O)OCNCCCCCCCCO 2230a_102515433106_100000034017 [0,2,0,0,0,0|2,0,0]=4 14663 B16R0.61 CCCC(=O)OCNCCCCCCCCO 34a_102515433106_100000034017 [0,2,0,0,0,0|2,0,0]=4 14664 B16R0.61 CCCC(=O)OCOCCCCCCCCBr 34a_100009813846_100000034017 [0,2,0,0,0,0|2,0,0]=4 14665 B16R0.61 CCCC(=O)OCOCCCCCCCCCl 34a_100000033203_100000034017 [0,2,0,0,0,0|2,0,0]=4 14666 B16R0.61 CCCC(=O)OCOCCCCCCCCN 34a_102515433106_100000034017 [0,2,0,0,0,0|2,0,0]=4 14667 B16R0.61 CCCC(=O)OCSCCCCCCCCO 62a_100000033203_100000034017 [0,2,0,0,0,0|2,0,0]=4 14668 B16R0.61 CCCC/C=C/CCCCOCC(=O)CCC 7a_200020645093_100000747444 [0,2,0,0,0,0|1,0,1]=4 14669 B16R0.61 CCCC/C=C/CCCCOCC(=O)NCC 34a_200020645093_100000183381 [0,2,0,0,0,0|1,0,1]=4 14670 B16R0.61 CCCC/C=C/CCCCOCC(=O)NCC 7a_200020645093_100000183381 [0,2,0,0,0,0|1,0,1]=4 14671 B16R0.61 CCCC/C=C/CCCCOCC(=O)OCC 34a_200020645093_100000188475 [0,2,0,0,0,0|0,0,1]=3 14672 B16R0.61 CCCC/C=C/CCCCOCC(=O)OCC 7a_200020645093_100000188475 [0,2,0,0,0,0|0,0,1]=3 14673 B16R0.61 CCCC/C=C/COCCCCC(=O)OCC 34a_200016272032_100000750268 [0,2,0,0,0,0|0,0,1]=3 14674 B16R0.61 CCCC/C=C/COCCCCC(=O)OCC 7a_200016272032_100000750268 [0,2,0,0,0,0|0,0,1]=3 14675 B16R0.61 CCCC/C=C/COCCOCC(=O)OCC 34a_200016272032_100000088970 [0,2,0,0,0,0|0,0,2]=4 14676 B16R0.61 CCCC/C=C/COCCOCC(=O)OCC 7a_200016272032_100000088970 [0,2,0,0,0,0|0,0,2]=4 14677 B16R0.61 CCCC/C=C\CCOCCCC(=O)OCC 34a_200016286491_100009991533 [0,2,0,0,0,0|0,0,1]=3 14678 B16R0.61 CCCC/C=C\CCOCCCC(=O)OCC 7a_200016286491_100011215271 [0,2,0,0,0,0|0,0,1]=3 14679 B16R0.61 CCCC/C=C\CCOCCNC(=O)OCC 7a_200016286491_200011445536 [0,2,0,0,0,0|0,0,2]=4 14680 B16R0.61 CCCCC#CCCCCCCC(=O)CCC 1458a_100000211992_200000043322 [0,2,0,0,0,0|1,0,0]=3 14681 B16R0.61 CCCCC#CCCCCCCC(=O)CCO 1458a_100011216618_200000043322 [0,2,0,0,0,0|2,0,0]=4 14682 B16R0.61 CCCCC#CCCCCCCC(=O)COC 1458a_100000210968_200000043322 [0,2,0,0,0,0|2,0,0]=4 14683 B16R0.61 CCCCC#CCCCCCCC(=O)CSC 1458a_100000184570_200000043322 [0,2,0,0,0,0|2,0,0]=4 14684 B16R0.61 CCCCC#CCCCCOCC(=O)CCC 7a_200000066234_100000747444 [0,2,0,0,0,0|1,0,1]=4 14685 B16R0.61 CCCCC#CCCCCOCC(=O)NCC 34a_200000066234_100000183381 [0,2,0,0,0,0|1,0,1]=4 14686 B16R0.61 CCCCC#CCCCCOCC(=O)NCC 7a_200000066234_100000183381 [0,2,0,0,0,0|1,0,1]=4 14687 B16R0.61 CCCCC#CCCCCOCC(=O)OCC 34a_200000066234_100000188475 [0,2,0,0,0,0|0,0,1]=3 14688 B16R0.61 CCCCC#CCCCCOCC(=O)OCC 7a_200000066234_100000188475 [0,2,0,0,0,0|0,0,1]=3 14689 B16R0.61 CCCCC#CCCCNCCC(=O)NCC 34a_100025743525_200000047210 [0,2,0,0,0,0|1,0,1]=4 14690 B16R0.61 CCCCC#CCCCSCCC(=O)NCC 62a_100000737597_200000047210 [0,2,0,0,0,0|1,0,1]=4 14691 B16R0.61 CCCCC#CCCCSCCC(=O)NCC 62a_200000047210_100000737597 [0,2,0,0,0,0|1,0,1]=4 14692 B16R0.61 CCCCC#CCCCSCCC(=O)OCC 62a_100000765890_200000047210 [0,2,0,0,0,0|0,0,1]=3 14693 B16R0.61 CCCCC#CCCCSCCC(=O)OCC 62a_200000047210_100000765890 [0,2,0,0,0,0|0,0,1]=3 14694 B16R0.61 CCCCC#CCCCSCOC(=O)OCC 62a_200000047210_100000075025 [0,2,0,0,0,0|0,0,2]=4 14695 B16R0.61 CCCCC#CCCOCCCC(=O)OCC 34a_100000037610_100009991533 [0,2,0,0,0,0|0,0,1]=3 14696 B16R0.61 CCCCC#CCCOCCCC(=O)OCC 7a_100000037610_100011215271 [0,2,0,0,0,0|0,0,1]=3 14697 B16R0.61 CCCCC#CCCOCCNC(=O)OCC 7a_100000037610_200011445536 [0,2,0,0,0,0|0,0,2]=4 14698 B16R0.61 CCCCC#CCOCCCCC(=O)OCC 34a_200000034558_100000750268 [0,2,0,0,0,0|0,0,1]=3 14699 B16R0.61 CCCCC#CCOCCCCC(=O)OCC 7a_200000034558_100000750268 [0,2,0,0,0,0|0,0,1]=3 14700 B16R0.61 CCCCC#CCOCCOCC(=O)OCC 34a_200000034558_100000088970 [0,2,0,0,0,0|0,0,2]=4 14701 B16R0.61 CCCCC#CCOCCOCC(=O)OCC 7a_200000034558_100000088970 [0,2,0,0,0,0|0,0,2]=4 14702 B16R0.61 CCCCC/C=C/COCCCC(=O)OCC 34a_100016258190_100009991533 [0,2,0,0,0,0|0,0,1]=3 14703 B16R0.61 CCCCC/C=C/COCCCC(=O)OCC 7a_100016258190_100011215271 [0,2,0,0,0,0|0,0,1]=3 14704 B16R0.61 CCCCC/C=C/COCCNC(=O)OCC 7a_100016258190_200011445536 [0,2,0,0,0,0|0,0,2]=4 14705 B16R0.61 CCCCC/C=C\CCCOCC(=O)CCC 7a_100020655193_100000747444 [0,2,0,0,0,0|1,0,1]=4 14706 B16R0.61 CCCCC/C=C\CCCOCC(=O)NCC 34a_100020655193_100000183381 [0,2,0,0,0,0|1,0,1]=4 14707 B16R0.61 CCCCC/C=C\CCCOCC(=O)NCC 7a_100020655193_100000183381 [0,2,0,0,0,0|1,0,1]=4 14708 B16R0.61 CCCCC/C=C\CCCOCC(=O)OCC 34a_100020655193_100000188475 [0,2,0,0,0,0|0,0,1]=3 14709 B16R0.61 CCCCC/C=C\CCCOCC(=O)OCC 7a_100020655193_100000188475 [0,2,0,0,0,0|0,0,1]=3 14710 B16R0.61 CCCCC/C=C\CCOCCC(=O)NCC 7a_100016277358_100000737597 [0,2,0,0,0,0|1,0,1]=4 14711 B16R0.61 CCCCC/C=C\CCOCCC(=O)OCC 34a_100016277358_100000765890 [0,2,0,0,0,0|0,0,1]=3 14712 B16R0.61 CCCCC/C=C\CCOCCC(=O)OCC 7a_100016277358_100011206558 [0,2,0,0,0,0|0,0,1]=3 14713 B16R0.61 CCCCCC#CCCOCCC(=O)NCC 7a_200000042877_100000737597 [0,2,0,0,0,0|1,0,1]=4 14714 B16R0.61 CCCCCC#CCCOCCC(=O)OCC 34a_200000042877_100000765890 [0,2,0,0,0,0|0,0,1]=3 14715 B16R0.61 CCCCCC#CCCOCCC(=O)OCC 7a_200000042877_100011206558 [0,2,0,0,0,0|0,0,1]=3 14716 B16R0.61 CCCCCC#CCOCCCC(=O)OCC 34a_200000033628_100009991533 [0,2,0,0,0,0|0,0,1]=3 14717 B16R0.61 CCCCCC#CCOCCCC(=O)OCC 7a_100012001163_100009816472 [0,2,0,0,0,0|0,0,1]=3 14718 B16R0.61 CCCCCC#CCOCCCC(=O)OCC 7a_200000033628_100011215271 [0,2,0,0,0,0|0,0,1]=3 14719 B16R0.61 CCCCCC#CCOCCNC(=O)OCC 34a_100000158857_100009816472 [0,2,0,0,0,0|0,0,2]=4 14720 B16R0.61 CCCCCC#CCOCCNC(=O)OCC 7a_200000033628_200011445536 [0,2,0,0,0,0|0,0,2]=4 14721 B16R0.61 CCCCCC#CCSCCCC(=O)OCC 62a_100009816472_100009991533 [0,2,0,0,0,0|0,0,1]=3 14722 B16R0.61 CCCCCC#CCSCCCC(=O)OCC 62a_100009991533_100009816472 [0,2,0,0,0,0|0,0,1]=3 14723 B16R0.61 CCCCCC#CCSCCNC(=O)OCC 62a_100009816472_200011445536 [0,2,0,0,0,0|0,0,2]=4 14724 B16R0.61 CCCCCC/C=C/COCCC(=O)NCC 7a_200016276170_100000737597 [0,2,0,0,0,0|1,0,1]=4 14725 B16R0.61 CCCCCC/C=C/COCCC(=O)OCC 34a_200016276170_100000765890 [0,2,0,0,0,0|0,0,1]=3 14726 B16R0.61 CCCCCC/C=C/COCCC(=O)OCC 7a_200016276170_100011206558 [0,2,0,0,0,0|0,0,1]=3 14727 B16R0.61 CCCCCCC#CCCOCC(=O)CCC 7a_200000033163_100000747444 [0,2,0,0,0,0|1,0,1]=4 14728 B16R0.61 CCCCCCC#CCCOCC(=O)NCC 34a_200000033163_100000183381 [0,2,0,0,0,0|1,0,1]=4 14729 B16R0.61 CCCCCCC#CCCOCC(=O)NCC 7a_200000033163_100000183381 [0,2,0,0,0,0|1,0,1]=4 14730 B16R0.61 CCCCCCC#CCCOCC(=O)OCC 34a_200000033163_100000188475 [0,2,0,0,0,0|0,0,1]=3 14731 B16R0.61 CCCCCCC#CCCOCC(=O)OCC 7a_200000033163_100000188475 [0,2,0,0,0,0|0,0,1]=3 14732 B16R0.61 CCCCCCC#CCOCCC(=O)NCC 7a_200000037284_100000737597 [0,2,0,0,0,0|1,0,1]=4 14733 B16R0.61 CCCCCCC#CCOCCC(=O)OCC 34a_200000037284_100000765890 [0,2,0,0,0,0|0,0,1]=3 14734 B16R0.61 CCCCCCC#CCOCCC(=O)OCC 7a_200000037284_100011206558 [0,2,0,0,0,0|0,0,1]=3 14735 B16R0.61 CCCCCCCC#CCOCC(=O)CCC 7a_200000061759_100000747444 [0,2,0,0,0,0|1,0,1]=4 14736 B16R0.61 CCCCCCCC#CCOCC(=O)NCC 34a_200000061759_100000183381 [0,2,0,0,0,0|1,0,1]=4 14737 B16R0.61 CCCCCCCC#CCOCC(=O)NCC 7a_200000061759_100000183381 [0,2,0,0,0,0|1,0,1]=4 14738 B16R0.61 CCCCCCCC#CCOCC(=O)OCC 34a_200000061759_100000188475 [0,2,0,0,0,0|0,0,1]=3 14739 B16R0.61 CCCCCCCC#CCOCC(=O)OCC 7a_200000061759_100000188475 [0,2,0,0,0,0|0,0,1]=3 14740 B16R0.61 CCCCCCCCCC=NNC(=O)CCC 4a_100000189770_100000210895 [0,2,0,0,0,0|1,0,1]=4 14741 B16R0.61 CCCCCCCCCCC=CC(=O)NCC 11a_100015525214_100015291182 [0,2,0,0,0,0|1,0,0]=3 14742 B16R0.61 CCCCCCCCCCC=CC(=O)NCC 240690a_100015525214_100015291182 [0,2,0,0,0,0|1,0,0]=3 14743 B16R0.61 CCCCCCCCCCC=CC(=O)NNC 22a_100016993582_100015291182 [0,2,0,0,0,0|2,0,0]=4 14744 B16R0.61 CCCCCCCCCCCCC(=O)CCO 1458a_100011215791_100000211926 [0,2,0,0,0,0|2,0,0]=4 14745 B16R0.61 CCCCCCCCCCCCC(=O)CCO 1458a_100011216618_100000759014 [0,2,0,0,0,0|2,0,0]=4 14746 B16R0.61 CCCCCCCCCCCCC(=O)COC 1458a_100000210968_100000759014 [0,2,0,0,0,0|2,0,0]=4 14747 B16R0.61 CCCCCCCCCCCCC(=O)NCC 11a_100015525214_100011215791 [0,2,0,0,0,0|1,0,0]=3 14748 B16R0.61 CCCCCCCCCCCCC(=O)NCC 240690a_100015525214_100011215791 [0,2,0,0,0,0|1,0,0]=3 14749 B16R0.61 CCCCCCCCCCCCC(=O)NNC 22a_100016993582_100011215791 [0,2,0,0,0,0|2,0,0]=4 14750 B16R0.61 CCCCCCCCCCCNC(=O)CCC 11a_200011215754_100000211992 [0,2,0,0,0,0|1,0,0]=3 14751 B16R0.61 CCCCCCCCCCCNC(=O)CCC 1626a_200011215754_100000211992 [0,2,0,0,0,0|1,0,0]=3 14752 B16R0.61 CCCCCCCCCCCNC(=O)CCC 240690a_200011215754_100000211992 [0,2,0,0,0,0|1,0,0]=3 14753 B16R0.61 CCCCCCCCCCCNC(=O)CCC 527a_200011215754_100000211992 [0,2,0,0,0,0|1,0,0]=3 14754 B16R0.61 CCCCCCCCCCCNC(=O)CCO 240690a_200011215754_100011216618 [0,2,0,0,0,0|2,0,0]=4 14755 B16R0.61 CCCCCCCCCCCNC(=O)COC 11a_200011215754_100000210968 [0,2,0,0,0,0|2,0,0]=4 14756 B16R0.61 CCCCCCCCCCCNC(=O)COC 1626a_200011215754_100000210968 [0,2,0,0,0,0|2,0,0]=4 14757 B16R0.61 CCCCCCCCCCCNC(=O)COC 240690a_200011215754_100000210968 [0,2,0,0,0,0|2,0,0]=4 14758 B16R0.61 CCCCCCCCCCCNC(=O)COC 527a_200011215754_100000210968 [0,2,0,0,0,0|2,0,0]=4 14759 B16R0.61 CCCCCCCCCCCNC(=O)CSC 11a_200011215754_100000184570 [0,2,0,0,0,0|2,0,0]=4 14760 B16R0.61 CCCCCCCCCCCNC(=O)CSC 1626a_200011215754_100000184570 [0,2,0,0,0,0|2,0,0]=4 14761 B16R0.61 CCCCCCCCCCCNC(=O)CSC 240690a_200011215754_100000184570 [0,2,0,0,0,0|2,0,0]=4 14762 B16R0.61 CCCCCCCCCCCNC(=O)CSC 527a_200011215754_100000184570 [0,2,0,0,0,0|2,0,0]=4 14763 B16R0.61 CCCCCCCCCCCNC(=O)NCC 2708a_100015525214_200011215754 [0,2,0,0,0,0|1,0,0]=3 14764 B16R0.61 CCCCCCCCCCCNC(=O)NCC 2708a_200011215754_100015525214 [0,2,0,0,0,0|1,0,0]=3 14765 B16R0.61 CCCCCCCCCCCNC(=O)NCC 273464a_100015525214_200011215754 [0,2,0,0,0,0|1,0,0]=3 14766 B16R0.61 CCCCCCCCCCCNC(=O)NCC 273464a_200011215754_100015525214 [0,2,0,0,0,0|1,0,0]=3 14767 B16R0.61 CCCCCCCCCCCNC(=O)NCC 512a_100015525214_200011215754 [0,2,0,0,0,0|1,0,0]=3 14768 B16R0.61 CCCCCCCCCCCNC(=O)NCC 512a_200011215754_100015525214 [0,2,0,0,0,0|1,0,0]=3 14769 B16R0.61 CCCCCCCCCCCNC(=O)NNC 273464a_200011215754_100016993582 [0,2,0,0,0,0|2,0,0]=4 14770 B16R0.61 CCCCCCCCCCCNC(=O)NNC 512a_100016993582_200011215754 [0,2,0,0,0,0|2,0,0]=4 14771 B16R0.61 CCCCCCCCCCCNC(=O)NNC 512a_200011215754_100016993582 [0,2,0,0,0,0|2,0,0]=4 14772 B16R0.61 CCCCCCCCCCNCC(=O)CCC 2230a_100000684558_100000747444 [0,2,0,0,0,0|1,0,0]=3 14773 B16R0.61 CCCCCCCCCCNCC(=O)NCC 2230a_100000684558_100000183381 [0,2,0,0,0,0|1,0,0]=3 14774 B16R0.61 CCCCCCCCCCNCC(=O)NCC 2230a_100016988866_100000210320 [0,2,0,0,0,0|1,0,0]=3 14775 B16R0.61 CCCCCCCCCCNCC(=O)NCC 34a_100000684558_100000183381 [0,2,0,0,0,0|1,0,0]=3 14776 B16R0.61 CCCCCCCCCCNCC(=O)NCO 2230a_100000684558_100000185155 [0,2,0,0,0,0|2,0,0]=4 14777 B16R0.61 CCCCCCCCCCNCC(=O)NCO 34a_100000684558_100000185155 [0,2,0,0,0,0|2,0,0]=4 14778 B16R0.61 CCCCCCCCCCNCC(=O)OCC 2230a_100000684558_100000188475 [0,2,0,0,0,0|0,0,0]=2 14779 B16R0.61 CCCCCCCCCCNCC(=O)OCC 34a_100000684558_100000188475 [0,2,0,0,0,0|0,0,0]=2 14780 B16R0.61 CCCCCCCCCCOCC(=O)CCC 7a_100000210711_100000747444 [0,2,0,0,0,0|1,0,0]=3 14781 B16R0.61 CCCCCCCCCCOCC(=O)NCC 34a_100000210711_100000183381 [0,2,0,0,0,0|1,0,0]=3 14782 B16R0.61 CCCCCCCCCCOCC(=O)NCC 7a_100000210711_100000183381 [0,2,0,0,0,0|1,0,0]=3 14783 B16R0.61 CCCCCCCCCCOCC(=O)NCO 34a_100000210711_100000185155 [0,2,0,0,0,0|2,0,0]=4 14784 B16R0.61 CCCCCCCCCCOCC(=O)NCO 7a_100000210711_100000185155 [0,2,0,0,0,0|2,0,0]=4 14785 B16R0.61 CCCCCCCCCCOCC(=O)OCC 34a_100000210711_100000188475 [0,2,0,0,0,0|0,0,0]=2 14786 B16R0.61 CCCCCCCCCCOCC(=O)OCC 7a_100000210711_100000188475 [0,2,0,0,0,0|0,0,0]=2 14787 B16R0.61 CCCCCCCCCCSCC(=O)NCC 62a_100000183381_100000210320 [0,2,0,0,0,0|1,0,0]=3 14788 B16R0.61 CCCCCCCCCCSCC(=O)NCO 62a_100000185155_100000210320 [0,2,0,0,0,0|2,0,0]=4 14789 B16R0.61 CCCCCCCCCCSCC(=O)OCC 62a_100000188475_100000210320 [0,2,0,0,0,0|0,0,0]=2 14790 B16R0.61 CCCCCCCCCNCCC(=O)NCC 2230a_100000212291_100000737597 [0,2,0,0,0,0|1,0,0]=3 14791 B16R0.61 CCCCCCCCCNCCC(=O)NCC 34a_100025743525_100011214924 [0,2,0,0,0,0|1,0,0]=3 14792 B16R0.61 CCCCCCCCCNCCC(=O)OCC 2230a_100000212291_100011206558 [0,2,0,0,0,0|0,0,0]=2 14793 B16R0.61 CCCCCCCCCNCCC(=O)OCC 34a_100000212291_100000765890 [0,2,0,0,0,0|0,0,0]=2 14794 B16R0.61 CCCCCCCCCNCOC(=O)CCC 2230a_100000212291_100000034017 [0,2,0,0,0,0|1,0,0]=3 14795 B16R0.61 CCCCCCCCCNCOC(=O)CCC 34a_100000212291_100000034017 [0,2,0,0,0,0|1,0,0]=3 14796 B16R0.61 CCCCCCCCCOCCC(=O)NCC 7a_100000210712_100000737597 [0,2,0,0,0,0|1,0,0]=3 14797 B16R0.61 CCCCCCCCCOCCC(=O)OCC 34a_100000210712_100000765890 [0,2,0,0,0,0|0,0,0]=2 14798 B16R0.61 CCCCCCCCCOCCC(=O)OCC 7a_100000210712_100011206558 [0,2,0,0,0,0|0,0,0]=2 14799 B16R0.61 CCCCCCCCCOCOC(=O)CCC 34a_100000210712_100000034017 [0,2,0,0,0,0|1,0,0]=3 14800 B16R0.61 CCCCCCCCCSCCC(=O)NCC 62a_100000737597_100000210670 [0,2,0,0,0,0|1,0,0]=3 14801 B16R0.61 CCCCCCCCCSCCC(=O)OCC 62a_100000765890_100000210670 [0,2,0,0,0,0|0,0,0]=2 14802 B16R0.61 CCCCCCCCNC/C=C/C(=O)OCC 2230a_100000229939_100016267167 [0,2,0,0,0,0|0,0,1]=3 14803 B16R0.61 CCCCCCCCNC/C=C/C(=O)OCC 34a_100000229939_100016267167 [0,2,0,0,0,0|0,0,1]=3 14804 B16R0.61 CCCCCCCCNCCCC(=O)OCC 2230a_100000229939_100009991533 [0,2,0,0,0,0|0,0,0]=2 14805 B16R0.61 CCCCCCCCNCCCC(=O)OCC 34a_100000229939_100009991533 [0,2,0,0,0,0|0,0,0]=2 14806 B16R0.61 CCCCCCCCOC/C=C/C(=O)OCC 34a_100000210232_100016267167 [0,2,0,0,0,0|0,0,1]=3 14807 B16R0.61 CCCCCCCCOC/C=C/C(=O)OCC 7a_100000210232_100016267167 [0,2,0,0,0,0|0,0,1]=3 14808 B16R0.61 CCCCCCCCOCCCC(=O)OCC 34a_100000210232_100009991533 [0,2,0,0,0,0|0,0,0]=2 14809 B16R0.61 CCCCCCCCOCCCC(=O)OCC 7a_100000210232_100011215271 [0,2,0,0,0,0|0,0,0]=2 14810 B16R0.61 CCCCCCCCOCCCC(=O)OCC 7a_100012001163_100000210759 [0,2,0,0,0,0|0,0,0]=2 14811 B16R0.61 CCCCCCCCOCCNC(=O)OCC 34a_100000158857_100000210759 [0,2,0,0,0,0|0,0,0]=2 14812 B16R0.61 CCCCCCCCOCCNC(=O)OCC 7a_100000210232_200011445536 [0,2,0,0,0,0|0,0,0]=2 14813 B16R0.61 CCCCCCCCSC/C=C/C(=O)OCC 62a_100000210759_100016267167 [0,2,0,0,0,0|0,0,1]=3 14814 B16R0.61 CCCCCCCCSC/C=C/C(=O)OCC 62a_100016267167_100000210317 [0,2,0,0,0,0|0,0,1]=3 14815 B16R0.61 CCCCCCCCSCCCC(=O)OCC 62a_100000210759_100009991533 [0,2,0,0,0,0|0,0,0]=2 14816 B16R0.61 CCCCCCCCSCCCC(=O)OCC 62a_100009991533_100000210317 [0,2,0,0,0,0|0,0,0]=2 14817 B16R0.61 CCCCCCCCSCCNC(=O)OCC 62a_100000210759_200011445536 [0,2,0,0,0,0|0,0,0]=2 14818 B16R0.61 CCCCCCCNCCCCC(=O)OCC 2230a_100000229938_100000750268 [0,2,0,0,0,0|0,0,0]=2 14819 B16R0.61 CCCCCCCNCCOCC(=O)OCC 2230a_100000229938_100000088970 [0,2,0,0,0,0|0,0,0]=2 14820 B16R0.61 CCCCCCCOCCCCC(=O)OCC 34a_100000210272_100000750268 [0,2,0,0,0,0|0,0,0]=2 14821 B16R0.61 CCCCCCCOCCCCC(=O)OCC 7a_100000210272_100000750268 [0,2,0,0,0,0|0,0,0]=2 14822 B16R0.61 CCCCCCCOCCOCC(=O)OCC 34a_100000210272_100000088970 [0,2,0,0,0,0|0,0,0]=2 14823 B16R0.61 CCCCCCCOCCOCC(=O)OCC 7a_100000210272_100000088970 [0,2,0,0,0,0|0,0,0]=2 14824 B16R0.61 CCCCCCCOCCSCC(=O)OCC 7a_200000230590_100000210614 [0,2,0,0,0,0|0,0,0]=2 14825 B16R0.61 CCCCCCCSCC=NNC(=O)OCC 62a_100000210614_100015372823 [0,2,0,0,0,0|1,0,1]=4 14826 B16R0.61 CCCCCCCSCCCCC(=O)OCC 62a_100000210614_100000750268 [0,2,0,0,0,0|0,0,0]=2 14827 B16R0.61 CCCCCCCSCCCCC(=O)OCC 62a_100000750268_100000210316 [0,2,0,0,0,0|0,0,0]=2 14828 B16R0.61 CCCCCCCSCCOCC(=O)OCC 62a_100000088970_100000210316 [0,2,0,0,0,0|0,0,0]=2 14829 B16R0.61 CCCCCCCSCCOCC(=O)OCC 62a_100000210614_100000088970 [0,2,0,0,0,0|0,0,0]=2 14830 B16R0.61 CCCCCCNCCCCCC(=O)OCC 2230a_100000210581_100000755133 [0,2,0,0,0,0|0,0,0]=2 14831 B16R0.61 CCCCCCNCCCOCC(=O)OCC 2230a_100000210581_100009893628 [0,2,0,0,0,0|0,0,0]=2 14832 B16R0.61 CCCCCCOCCCCCC(=O)OCC 34a_100000210259_100000755133 [0,2,0,0,0,0|0,0,0]=2 14833 B16R0.61 CCCCCCOCCCCCC(=O)OCC 7a_100000210259_100000755133 [0,2,0,0,0,0|0,0,0]=2 14834 B16R0.61 CCCCCCOCCCCCC(=O)OCC 7a_100011214988_100000210314 [0,2,0,0,0,0|0,0,0]=2 14835 B16R0.61 CCCCCCOCCCOCC(=O)OCC 34a_100000210259_100009893628 [0,2,0,0,0,0|0,0,0]=2 14836 B16R0.61 CCCCCCOCCCOCC(=O)OCC 7a_100000210259_100009893628 [0,2,0,0,0,0|0,0,0]=2 14837 B16R0.61 CCCCCCOCCOCCC(=O)NCC 7a_100000691444_100000737597 [0,2,0,0,0,0|1,0,0]=3 14838 B16R0.61 CCCCCCOCCOCCC(=O)OCC 34a_100000691444_100000765890 [0,2,0,0,0,0|0,0,0]=2 14839 B16R0.61 CCCCCCOCCOCCC(=O)OCC 7a_100000691444_100011206558 [0,2,0,0,0,0|0,0,0]=2 14840 B16R0.61 CCCCCCOCCOCOC(=O)CCC 34a_100000691444_100000034017 [0,2,0,0,0,0|2,0,0]=4 14841 B16R0.61 CCCCCCSCCCCCC(=O)OCC 62a_100000210314_100000755133 [0,2,0,0,0,0|0,0,0]=2 14842 B16R0.61 CCCCCCSCCCCCC(=O)OCC 62a_100000755133_100000210757 [0,2,0,0,0,0|0,0,0]=2 14843 B16R0.61 CCCCCCSCCCOCC(=O)OCC 62a_100000210314_100009893628 [0,2,0,0,0,0|0,0,0]=2 14844 B16R0.61 CCCCCCSCCCOCC(=O)OCC 62a_100009893628_100000210757 [0,2,0,0,0,0|0,0,0]=2 14845 B16R0.61 CCCCCNCCCCCCC(=O)OCC 2230a_100000209983_100009814379 [0,2,0,0,0,0|0,0,0]=2 14846 B16R0.61 CCCCCNCCOC/C=C/C(=O)OCC 34a_100000224656_100016267167 [0,2,0,0,0,0|0,0,2]=4 14847 B16R0.61 CCCCCNCCOCCCC(=O)OCC 34a_100000224656_100009991533 [0,2,0,0,0,0|0,0,0]=2 14848 B16R0.61 CCCCCNN=CCCCCC(=O)OCC 4a_100000694160_100012182868 [0,2,0,0,0,0|0,0,1]=3 14849 B16R0.61 CCCCCOCCCCCCC(=O)OCC 34a_100000210253_100009814379 [0,2,0,0,0,0|0,0,0]=2 14850 B16R0.61 CCCCCOCCCCCCC(=O)OCC 7a_100000210253_100009814379 [0,2,0,0,0,0|0,0,0]=2 14851 B16R0.61 CCCCCOCCOC/C=C/C(=O)OCC 34a_100011215259_100016267167 [0,2,0,0,0,0|0,0,2]=4 14852 B16R0.61 CCCCCOCCOC/C=C/C(=O)OCC 7a_100011215259_100016267167 [0,2,0,0,0,0|0,0,2]=4 14853 B16R0.61 CCCCCOCCOCCCC(=O)OCC 34a_100011215259_100009991533 [0,2,0,0,0,0|0,0,0]=2 14854 B16R0.61 CCCCCOCCOCCCC(=O)OCC 7a_100011215259_100011215271 [0,2,0,0,0,0|0,0,0]=2 14855 B16R0.61 CCCCCOCCOCCNC(=O)OCC 7a_100011215259_200011445536 [0,2,0,0,0,0|1,0,0]=3 14856 B16R0.61 CCCCCSCCCCCCC(=O)OCC 62a_100000210326_100009814379 [0,2,0,0,0,0|0,0,0]=2 14857 B16R0.61 CCCCNCCCCCCCC(=O)OCC 2230a_100000102301_100009991516 [0,2,0,0,0,0|0,0,0]=2 14858 B16R0.61 CCCCNCCCCCCCC(=O)OCC 7a_106832991798_100009991516 [0,2,0,0,0,0|0,0,0]=2 14859 B16R0.61 CCCCNCCCCOCCC(=O)OCC 34a_200011216965_100000765890 [0,2,0,0,0,0|0,0,0]=2 14860 B16R0.61 CCCCNCCCCOCOC(=O)CCC 34a_200011216965_100000034017 [0,2,0,0,0,0|2,0,0]=4 14861 B16R0.61 CCCCNN=CCCCCCC(=O)OCC 4a_100025702795_100000085164 [0,2,0,0,0,0|0,0,1]=3 14862 B16R0.61 CCCCOCCCCCCCC(=O)OCC 34a_100000210227_100009991516 [0,2,0,0,0,0|0,0,0]=2 14863 B16R0.61 CCCCOCCCCCCCC(=O)OCC 7a_100000210227_100009991516 [0,2,0,0,0,0|0,0,0]=2 14864 B16R0.61 CCCCOCCCCOCCC(=O)NCC 7a_200000760531_100000737597 [0,2,0,0,0,0|1,0,0]=3 14865 B16R0.61 CCCCOCCCCOCCC(=O)OCC 34a_200000760531_100000765890 [0,2,0,0,0,0|0,0,0]=2 14866 B16R0.61 CCCCOCCCCOCCC(=O)OCC 7a_200000760531_100011206558 [0,2,0,0,0,0|0,0,0]=2 14867 B16R0.61 CCCCOCCCCOCOC(=O)CCC 34a_200000760531_100000034017 [0,2,0,0,0,0|2,0,0]=4 14868 B16R0.61 CCCCOCCCNC/C=C/C(=O)OCC 2230a_200000211371_100016267167 [0,2,0,0,0,0|0,0,2]=4 14869 B16R0.61 CCCCOCCCNC/C=C/C(=O)OCC 34a_200000211371_100016267167 [0,2,0,0,0,0|0,0,2]=4 14870 B16R0.61 CCCCOCCCNCCCC(=O)OCC 2230a_200000211371_100009991533 [0,2,0,0,0,0|0,0,0]=2 14871 B16R0.61 CCCCOCCCNCCCC(=O)OCC 34a_200000211371_100009991533 [0,2,0,0,0,0|0,0,0]=2 14872 B16R0.61 CCCCOCCCOC/C=C/C(=O)OCC 34a_200011215613_100016267167 [0,2,0,0,0,0|0,0,2]=4 14873 B16R0.61 CCCCOCCCOC/C=C/C(=O)OCC 7a_200011215613_100016267167 [0,2,0,0,0,0|0,0,2]=4 14874 B16R0.61 CCCCOCCCOCCCC(=O)OCC 34a_200011215613_100009991533 [0,2,0,0,0,0|0,0,0]=2 14875 B16R0.61 CCCCOCCCOCCCC(=O)OCC 7a_200011215613_100011215271 [0,2,0,0,0,0|0,0,0]=2 14876 B16R0.61 CCCCOCCCOCCNC(=O)OCC 7a_200011215613_200011445536 [0,2,0,0,0,0|1,0,0]=3 14877 B16R0.61 CCCCOCCOCCCCC(=O)OCC 34a_100000210238_100000750268 [0,2,0,0,0,0|0,0,0]=2 14878 B16R0.61 CCCCOCCOCCCCC(=O)OCC 7a_100000210238_100000750268 [0,2,0,0,0,0|0,0,0]=2 14879 B16R0.61 CCCCOCCOCCOCC(=O)CCC 7a_100011215186_100000747444 [0,2,0,0,0,0|2,0,0]=4 14880 B16R0.61 CCCCOCCOCCOCC(=O)NCC 34a_100011215186_100000183381 [0,2,0,0,0,0|2,0,0]=4 14881 B16R0.61 CCCCOCCOCCOCC(=O)NCC 7a_100011215186_100000183381 [0,2,0,0,0,0|2,0,0]=4 14882 B16R0.61 CCCCOCCOCCOCC(=O)OCC 34a_100000210238_100000088970 [0,2,0,0,0,0|1,0,0]=3 14883 B16R0.61 CCCCOCCOCCOCC(=O)OCC 34a_100011215186_100000188475 [0,2,0,0,0,0|1,0,0]=3 14884 B16R0.61 CCCCOCCOCCOCC(=O)OCC 7a_100000210238_100000088970 [0,2,0,0,0,0|1,0,0]=3 14885 B16R0.61 CCCCOCCOCCOCC(=O)OCC 7a_100011215186_100000188475 [0,2,0,0,0,0|1,0,0]=3 14886 B16R0.61 CCCCOCCOCCSCC(=O)OCC 7a_200000230590_100000743108 [0,2,0,0,0,0|1,0,0]=3 14887 B16R0.61 CCCCOCCSCCCCC(=O)OCC 62a_100000743108_100000750268 [0,2,0,0,0,0|0,0,0]=2 14888 B16R0.61 CCCCOCCSCCCCC(=O)OCC 62a_100000750268_100000743108 [0,2,0,0,0,0|0,0,0]=2 14889 B16R0.61 CCCCOCCSCCOCC(=O)OCC 62a_100000088970_100000743108 [0,2,0,0,0,0|1,0,0]=3 14890 B16R0.61 CCCCOCCSCCOCC(=O)OCC 62a_100000743108_100000088970 [0,2,0,0,0,0|1,0,0]=3 14891 B16R0.61 CCCCOCSCCCCCC(=O)OCC 62a_100000755133_100011995733 [0,2,0,0,0,0|0,0,0]=2 14892 B16R0.61 CCCCOCSCCCCCC(=O)OCC 62a_100011995733_100000755133 [0,2,0,0,0,0|0,0,0]=2 14893 B16R0.61 CCCCOCSCCCOCC(=O)OCC 62a_100009893628_100011995733 [0,2,0,0,0,0|1,0,0]=3 14894 B16R0.61 CCCCOCSCCCOCC(=O)OCC 62a_100011995733_100009893628 [0,2,0,0,0,0|1,0,0]=3 14895 B16R0.61 CCCCSCCCCCCCC(=O)OCC 62a_100000210211_100009991516 [0,2,0,0,0,0|0,0,0]=2 14896 B16R0.61 CCCCSCCNCCCCC(=O)OCC 2230a_100025743550_100000750268 [0,2,0,0,0,0|0,0,0]=2 14897 B16R0.61 CCCCSCCNCCOCC(=O)OCC 2230a_100025743550_100000088970 [0,2,0,0,0,0|1,0,0]=3 14898 B16R0.61 CCCCSCCOCCCCC(=O)OCC 34a_200000230436_100000750268 [0,2,0,0,0,0|0,0,0]=2 14899 B16R0.61 CCCCSCCOCCCCC(=O)OCC 7a_200000230436_100000750268 [0,2,0,0,0,0|0,0,0]=2 14900 B16R0.61 CCCCSCCOCCOCC(=O)OCC 34a_200000230436_100000088970 [0,2,0,0,0,0|1,0,0]=3 14901 B16R0.61 CCCCSCCOCCOCC(=O)OCC 7a_200000230436_100000088970 [0,2,0,0,0,0|1,0,0]=3 14902 B16R0.61 CCCOCCCCCCCCC(=O)OCC 34a_100000210258_100010175975 [0,2,0,0,0,0|0,0,0]=2 14903 B16R0.61 CCCOCCCNCCCCC(=O)OCC 2230a_100011217757_100000750268 [0,2,0,0,0,0|0,0,0]=2 14904 B16R0.61 CCCOCCCNCCCCC(=O)OCC 34a_100011217757_100000750268 [0,2,0,0,0,0|0,0,0]=2 14905 B16R0.61 CCCOCCCNCCOCC(=O)OCC 2230a_100011217757_100000088970 [0,2,0,0,0,0|1,0,0]=3 14906 B16R0.61 CCCOCCCNCCOCC(=O)OCC 34a_100011217757_100000088970 [0,2,0,0,0,0|1,0,0]=3 14907 B16R0.61 CCCOCCNCCCCCC(=O)OCC 2230a_100161115042_100000755133 [0,2,0,0,0,0|0,0,0]=2 14908 B16R0.61 CCCOCCNCCCCCC(=O)OCC 34a_100161115042_100000755133 [0,2,0,0,0,0|0,0,0]=2 14909 B16R0.61 CCCOCCNCCCOCC(=O)OCC 2230a_100161115042_100009893628 [0,2,0,0,0,0|1,0,0]=3 14910 B16R0.61 CCCOCCNCCCOCC(=O)OCC 34a_100161115042_100009893628 [0,2,0,0,0,0|1,0,0]=3 14911 B16R0.61 CCCOCCOCCCCCC(=O)OCC 34a_100000752267_100000755133 [0,2,0,0,0,0|0,0,0]=2 14912 B16R0.61 CCCOCCOCCCCCC(=O)OCC 7a_100000752267_100000755133 [0,2,0,0,0,0|0,0,0]=2 14913 B16R0.61 CCCOCCOCCCCCC(=O)OCC 7a_100011214988_100011215938 [0,2,0,0,0,0|0,0,0]=2 14914 B16R0.61 CCCOCCOCCCOCC(=O)OCC 34a_100000752267_100009893628 [0,2,0,0,0,0|1,0,0]=3 14915 B16R0.61 CCCOCCOCCCOCC(=O)OCC 7a_100000752267_100009893628 [0,2,0,0,0,0|1,0,0]=3 14916 B16R0.61 CCCOCCOCCNCCC(=O)NCC 2230a_200011904461_100000737597 [0,2,0,0,0,0|2,0,0]=4 14917 B16R0.61 CCCOCCOCCNCCC(=O)OCC 2230a_200011904461_100011206558 [0,2,0,0,0,0|1,0,0]=3 14918 B16R0.61 CCCOCCOCCNCCC(=O)OCC 34a_200011904461_100000765890 [0,2,0,0,0,0|1,0,0]=3 14919 B16R0.61 CCCOCCOCCOCCC(=O)OCC 34a_100010737887_100000210303 [0,2,0,0,0,0|1,0,0]=3 14920 B16R0.61 CCCOCCOCCOCCC(=O)OCC 7a_100010737887_100000210303 [0,2,0,0,0,0|1,0,0]=3 14921 B16R0.61 CCCOCCSCCCCCC(=O)OCC 62a_100000755133_100011215938 [0,2,0,0,0,0|0,0,0]=2 14922 B16R0.61 CCCOCCSCCCCCC(=O)OCC 62a_100011215938_100000755133 [0,2,0,0,0,0|0,0,0]=2 14923 B16R0.61 CCCOCCSCCCOCC(=O)OCC 62a_100009893628_100011215938 [0,2,0,0,0,0|1,0,0]=3 14924 B16R0.61 CCCOCCSCCCOCC(=O)OCC 62a_100011215938_100009893628 [0,2,0,0,0,0|1,0,0]=3 14925 B16R0.61 CCCSCCCCCCCCC(=O)OCC 62a_100000210303_100010175975 [0,2,0,0,0,0|0,0,0]=2 14926 B16R0.61 CCCSCCNCCCCCC(=O)OCC 2230a_100020603323_100000755133 [0,2,0,0,0,0|0,0,0]=2 14927 B16R0.61 CCCSCCNCCCOCC(=O)OCC 2230a_100020603323_100009893628 [0,2,0,0,0,0|1,0,0]=3 14928 B16R0.61 CCCSCCOCCCCCC(=O)OCC 34a_200000230433_100000755133 [0,2,0,0,0,0|0,0,0]=2 14929 B16R0.61 CCCSCCOCCCCCC(=O)OCC 7a_200000230433_100000755133 [0,2,0,0,0,0|0,0,0]=2 14930 B16R0.61 CCCSCCOCCCOCC(=O)OCC 34a_200000230433_100009893628 [0,2,0,0,0,0|1,0,0]=3 14931 B16R0.61 CCCSCCOCCCOCC(=O)OCC 7a_200000230433_100009893628 [0,2,0,0,0,0|1,0,0]=3 14932 B16R0.61 CCNC(=O)CCCCCCCCCCCO 240690a_100015525214_100000037981 [0,2,0,0,0,0|1,0,0]=3 14933 B16R0.61 CCNC(=O)CCNCCCCCCCCO 2230a_102515433106_100000737597 [0,2,0,0,0,0|1,0,0]=3 14934 B16R0.61 CCNC(=O)CCNCCCCCCCCO 34a_100025743525_100000033203 [0,2,0,0,0,0|1,0,0]=3 14935 B16R0.61 CCNC(=O)CCOCCCCCCCCBr 7a_100009813846_100000737597 [0,2,0,0,0,0|1,0,0]=3 14936 B16R0.61 CCNC(=O)CCOCCCCCCCCCl 7a_100000033203_100000737597 [0,2,0,0,0,0|1,0,0]=3 14937 B16R0.61 CCNC(=O)CCOCCCOCCCOC 7a_200011215475_100000737597 [0,2,0,0,0,0|2,0,0]=4 14938 B16R0.61 CCNC(=O)CCSCCCCCCCCO 62a_100000033203_100000737597 [0,2,0,0,0,0|1,0,0]=3 14939 B16R0.61 CCNC(=O)CCSCCCCCCCCO 62a_100000737597_100000033203 [0,2,0,0,0,0|1,0,0]=3 14940 B16R0.61 CCNC(=O)CNCCCCCCCCCO 2230a_100000078944_100000183381 [0,2,0,0,0,0|1,0,0]=3 14941 B16R0.61 CCNC(=O)CNCCCCCCCCCO 2230a_100016988866_100009813782 [0,2,0,0,0,0|1,0,0]=3 14942 B16R0.61 CCNC(=O)CNCCCCCCCCCO 34a_100000078944_100000183381 [0,2,0,0,0,0|1,0,0]=3 14943 B16R0.61 CCNC(=O)COCCCCCCCCCBr 34a_100009813782_100000183381 [0,2,0,0,0,0|1,0,0]=3 14944 B16R0.61 CCNC(=O)COCCCCCCCCCBr 7a_100009813782_100000183381 [0,2,0,0,0,0|1,0,0]=3 14945 B16R0.61 CCNC(=O)COCCCCCCCCCCl 34a_100009868337_100000183381 [0,2,0,0,0,0|1,0,0]=3 14946 B16R0.61 CCNC(=O)COCCCCCCCCCCl 7a_100009868337_100000183381 [0,2,0,0,0,0|1,0,0]=3 14947 B16R0.61 CCNC(=O)COCCCCCCCCCN 34a_100000078944_100000183381 [0,2,0,0,0,0|1,0,0]=3 14948 B16R0.61 CCNC(=O)CSCCCCCCCCCO 62a_100000183381_100009813782 [0,2,0,0,0,0|1,0,0]=3 14949 B16R0.61 CCNC(=O)CSCCCCCCCCCO 62a_100009813782_100000183381 [0,2,0,0,0,0|1,0,0]=3 14950 B16R0.61 CCNC(=O)NCCCCCCCCCCO 2708a_100000066964_100015525214 [0,2,0,0,0,0|1,0,0]=3 14951 B16R0.61 CCNC(=O)NCCCCCCCCCCO 2708a_100015525214_100000066964 [0,2,0,0,0,0|1,0,0]=3 14952 B16R0.61 CCNC(=O)NCCCCCCCCCCO 273464a_100000066964_100015525214 [0,2,0,0,0,0|1,0,0]=3 14953 B16R0.61 CCNC(=O)NCCCCCCCCCCO 273464a_100015525214_100000066964 [0,2,0,0,0,0|1,0,0]=3 14954 B16R0.61 CCNC(=O)NCCCCCCCCCCO 512a_100000066964_100015525214 [0,2,0,0,0,0|1,0,0]=3 14955 B16R0.61 CCNC(=O)NCCCCCCCCCCO 512a_100015525214_100000066964 [0,2,0,0,0,0|1,0,0]=3 14956 B16R0.61 CCNCCCCCCCCCC(=O)OCC 2230a_100015525214_100009828014 [0,2,0,0,0,0|0,0,0]=2 14957 B16R0.61 CCNN=CCCCCCCCC(=O)OCC 4a_100000756455_100102623289 [0,2,0,0,0,0|0,0,1]=3 14958 B16R0.61 CCOC(=O)/C=C/CNCCCCCCCO 2230a_100011996573_100016267167 [0,2,0,0,0,0|0,0,2]=4 14959 B16R0.61 CCOC(=O)/C=C/CNCCCCCCCO 34a_100011996573_100016267167 [0,2,0,0,0,0|0,0,2]=4 14960 B16R0.61 CCOC(=O)/C=C/COCCCCCCCBr 34a_100000760002_100016267167 [0,2,0,0,0,0|0,0,2]=4 14961 B16R0.61 CCOC(=O)/C=C/COCCCCCCCBr 7a_100000760002_100016267167 [0,2,0,0,0,0|0,0,2]=4 14962 B16R0.61 CCOC(=O)/C=C/COCCCCCCCN 34a_100011996573_100016267167 [0,2,0,0,0,0|0,0,2]=4 14963 B16R0.61 CCOC(=O)/C=C/COCCCCCCOC 34a_200012092642_100016267167 [0,2,0,0,0,0|0,0,2]=4 14964 B16R0.61 CCOC(=O)/C=C/COCCCCCCOC 7a_200012092642_100016267167 [0,2,0,0,0,0|0,0,2]=4 14965 B16R0.61 CCOC(=O)/C=C/CSCCCCCCCO 62a_100000760002_100016267167 [0,2,0,0,0,0|0,0,2]=4 14966 B16R0.61 CCOC(=O)/C=C/CSCCCCCCCO 62a_100016267167_100000760002 [0,2,0,0,0,0|0,0,2]=4 14967 B16R0.61 CCOC(=O)/C=C/CSCCCCCCOC 62a_100011998445_100016267167 [0,2,0,0,0,0|0,0,2]=4 14968 B16R0.61 CCOC(=O)/C=C/CSCCCCCCOC 62a_100016267167_100011998445 [0,2,0,0,0,0|0,0,2]=4 14969 B16R0.61 CCOC(=O)CCCCCCCCCCNC 2230a_106832991635_100009827693 [0,2,0,0,0,0|0,0,0]=2 14970 B16R0.61 CCOC(=O)CCCCCCCCCCNC 34a_100102657272_100009827693 [0,2,0,0,0,0|0,0,0]=2 14971 B16R0.61 CCOC(=O)CCCCCCCCCCNC 7a_106832991635_100009827693 [0,2,0,0,0,0|0,0,0]=2 14972 B16R0.61 CCOC(=O)CCCCCCCCCCOC 34a_100138415774_100009827693 [0,2,0,0,0,0|0,0,0]=2 14973 B16R0.61 CCOC(=O)CCCCCCCCCCSC 62a_200000210301_100009827693 [0,2,0,0,0,0|0,0,0]=2 14974 B16R0.61 CCOC(=O)CCCCCCCCCCS[13CH3] 62a_200025704644_100009827693 [0,2,0,0,0,0|0,0,0]=2 14975 B16R0.61 CCOC(=O)CCCCCCCCCSCC 62a_100000210202_100009828014 [0,2,0,0,0,0|0,0,0]=2 14976 B16R0.61 CCOC(=O)CCCCCCCCCSCF 62a_100015361967_100009828014 [0,2,0,0,0,0|0,0,0]=2 14977 B16R0.61 CCOC(=O)CCCCCCCCNCCF 34a_100000724931_100010175975 [0,2,0,0,0,0|0,0,0]=2 14978 B16R0.61 CCOC(=O)CCCCCCCCNCCO 2230a_100016997473_100010175975 [0,2,0,0,0,0|0,0,0]=2 14979 B16R0.61 CCOC(=O)CCCCCCCCNCCO 34a_100016990907_100010175975 [0,2,0,0,0,0|0,0,0]=2 14980 B16R0.61 CCOC(=O)CCCCCCCCOCCBr 34a_100000211926_100010175975 [0,2,0,0,0,0|0,0,0]=2 14981 B16R0.61 CCOC(=O)CCCCCCCCOCCN 34a_100000210304_100010175975 [0,2,0,0,0,0|0,0,0]=2 14982 B16R0.61 CCOC(=O)CCCCCCCCSCC#N 62a_100011215382_100010175975 [0,2,0,0,0,0|0,0,1]=3 14983 B16R0.61 CCOC(=O)CCCCCCCCSCC=O 62a_200015260668_100010175975 [0,2,0,0,0,0|0,0,1]=3 14984 B16R0.61 CCOC(=O)CCCCCCCCSCCF 62a_100011217306_100010175975 [0,2,0,0,0,0|0,0,0]=2 14985 B16R0.61 CCOC(=O)CCCCCCCCSCCO 62a_100000211926_100010175975 [0,2,0,0,0,0|0,0,0]=2 14986 B16R0.61 CCOC(=O)CCCCCCCCSCOC 62a_100000766300_100010175975 [0,2,0,0,0,0|0,0,0]=2 14987 B16R0.61 CCOC(=O)CCCCCCCCSCSC 62a_100011218213_100010175975 [0,2,0,0,0,0|0,0,0]=2 14988 B16R0.61 CCOC(=O)CCCCCCCNCCCF 2230a_100015189416_100009991516 [0,2,0,0,0,0|0,0,0]=2 14989 B16R0.61 CCOC(=O)CCCCCCCNCCCF 34a_100015189416_100009991516 [0,2,0,0,0,0|0,0,0]=2 14990 B16R0.61 CCOC(=O)CCCCCCCNCCOC 2230a_100000209980_100009991516 [0,2,0,0,0,0|0,0,0]=2 14991 B16R0.61 CCOC(=O)CCCCCCCNCCSC 2230a_100020590264_100009991516 [0,2,0,0,0,0|0,0,0]=2 14992 B16R0.61 CCOC(=O)CCCCCCCOCCCBr 34a_100011217188_100009991516 [0,2,0,0,0,0|0,0,0]=2 14993 B16R0.61 CCOC(=O)CCCCCCCOCCCCl 34a_100000230001_100009991516 [0,2,0,0,0,0|0,0,0]=2 14994 B16R0.61 CCOC(=O)CCCCCCCOCCCF 34a_100000759539_100009991516 [0,2,0,0,0,0|0,0,0]=2 14995 B16R0.61 CCOC(=O)CCCCCCCOCCCN 34a_100000182051_100009991516 [0,2,0,0,0,0|0,0,0]=2 14996 B16R0.61 CCOC(=O)CCCCCCCOCCOC 34a_100000210237_100009991516 [0,2,0,0,0,0|0,0,0]=2 14997 B16R0.61 CCOC(=O)CCCCCCCOCCON 34a_100000700252_100009991516 [0,2,0,0,0,0|1,0,0]=3 14998 B16R0.61 CCOC(=O)CCCCCCCOCCSC 34a_100000230434_100009991516 [0,2,0,0,0,0|0,0,0]=2 14999 B16R0.61 CCOC(=O)CCCCCCCOCCSC 7a_100000230434_100009991516 [0,2,0,0,0,0|0,0,0]=2 15000 B16R0.61 CCOC(=O)CCCCCCCSCCC#N 62a_100011215226_100009991516 [0,2,0,0,0,0|0,0,1]=3 15001 B16R0.61 CCOC(=O)CCCCCCCSCCCF 62a_100011934791_100009991516 [0,2,0,0,0,0|0,0,0]=2 15002 B16R0.61 CCOC(=O)CCCCCCCSCCCO 62a_100011215043_100009991516 [0,2,0,0,0,0|0,0,0]=2 15003 B16R0.61 CCOC(=O)CCCCCCCSCCOC 62a_100000233755_100009991516 [0,2,0,0,0,0|0,0,0]=2 15004 B16R0.61 CCOC(=O)CCCCCCCSCCSC 62a_100000212216_100009991516 [0,2,0,0,0,0|0,0,0]=2 15005 B16R0.61 CCOC(=O)CCCCCCCSCSC#N 62a_100000211825_100009991516 [0,2,0,0,0,0|1,0,1]=4 15006 B16R0.61 CCOC(=O)CCCCCCNCCCCO 2230a_100000750430_100009814379 [0,2,0,0,0,0|0,0,0]=2 15007 B16R0.61 CCOC(=O)CCCCCCNCCCCO 34a_100000750430_100009814379 [0,2,0,0,0,0|0,0,0]=2 15008 B16R0.61 CCOC(=O)CCCCCCNCCCOC 34a_100150723488_100009814379 [0,2,0,0,0,0|0,0,0]=2 15009 B16R0.61 CCOC(=O)CCCCCCNCCCSC 2230a_100000749238_100009814379 [0,2,0,0,0,0|0,0,0]=2 15010 B16R0.61 CCOC(=O)CCCCCCNCCSCC 2230a_100000106463_100009814379 [0,2,0,0,0,0|0,0,0]=2 15011 B16R0.61 CCOC(=O)CCCCCCOCC#CCCl 34a_200000047223_100009814379 [0,2,0,0,0,0|0,0,2]=4 15012 B16R0.61 CCOC(=O)CCCCCCOCCCCBr 34a_100011216708_100009814379 [0,2,0,0,0,0|0,0,0]=2 15013 B16R0.61 CCOC(=O)CCCCCCOCCCCCl 34a_100000210776_100009814379 [0,2,0,0,0,0|0,0,0]=2 15014 B16R0.61 CCOC(=O)CCCCCCOCCCCCl 7a_100000210776_100009814379 [0,2,0,0,0,0|0,0,0]=2 15015 B16R0.61 CCOC(=O)CCCCCCOCCCCF 34a_100011995726_100009814379 [0,2,0,0,0,0|0,0,0]=2 15016 B16R0.61 CCOC(=O)CCCCCCOCCCCF 7a_100011995726_100009814379 [0,2,0,0,0,0|0,0,0]=2 15017 B16R0.61 CCOC(=O)CCCCCCOCCCCI 34a_200012148704_100009814379 [0,2,0,0,0,0|0,0,0]=2 15018 B16R0.61 CCOC(=O)CCCCCCOCCCCN 34a_100000750430_100009814379 [0,2,0,0,0,0|0,0,0]=2 15019 B16R0.61 CCOC(=O)CCCCCCOCCCNC 34a_100000213112_100009814379 [0,2,0,0,0,0|0,0,0]=2 15020 B16R0.61 CCOC(=O)CCCCCCOCCCOC 34a_100000740835_100009814379 [0,2,0,0,0,0|0,0,0]=2 15021 B16R0.61 CCOC(=O)CCCCCCOCCCSC 34a_100000690336_100009814379 [0,2,0,0,0,0|0,0,0]=2 15022 B16R0.61 CCOC(=O)CCCCCCOCCCSC 7a_100000690336_100009814379 [0,2,0,0,0,0|0,0,0]=2 15023 B16R0.61 CCOC(=O)CCCCCCOCCSCC 34a_100000212035_100009814379 [0,2,0,0,0,0|0,0,0]=2 15024 B16R0.61 CCOC(=O)CCCCCCOCCSCC 7a_100000212035_100009814379 [0,2,0,0,0,0|0,0,0]=2 15025 B16R0.61 CCOC(=O)CCCCCCSCC#CCO 62a_200000047223_100009814379 [0,2,0,0,0,0|0,0,2]=4 15026 B16R0.61 CCOC(=O)CCCCCCSCCCC#N 62a_100000687738_100009814379 [0,2,0,0,0,0|0,0,1]=3 15027 B16R0.61 CCOC(=O)CCCCCCSCCCC=O 62a_200011292268_100009814379 [0,2,0,0,0,0|0,0,1]=3 15028 B16R0.61 CCOC(=O)CCCCCCSCCCCF 62a_100000729493_100009814379 [0,2,0,0,0,0|0,0,0]=2 15029 B16R0.61 CCOC(=O)CCCCCCSCCCCO 62a_100000210776_100009814379 [0,2,0,0,0,0|0,0,0]=2 15030 B16R0.61 CCOC(=O)CCCCCCSCCCOC 62a_100000709357_100009814379 [0,2,0,0,0,0|0,0,0]=2 15031 B16R0.61 CCOC(=O)CCCCCCSCCSC#N 62a_100000034367_100009814379 [0,2,0,0,0,0|1,0,1]=4 15032 B16R0.61 CCOC(=O)CCCCCCSCCSCC 62a_100000757381_100009814379 [0,2,0,0,0,0|0,0,0]=2 15033 B16R0.61 CCOC(=O)CCCCCNCCCCCO 2230a_100000762737_100000755133 [0,2,0,0,0,0|0,0,0]=2 15034 B16R0.61 CCOC(=O)CCCCCNCCCCCO 34a_100000762737_100000755133 [0,2,0,0,0,0|0,0,0]=2 15035 B16R0.61 CCOC(=O)CCCCCNCCCN=[N+]=[N-] 2230a_100000744732_100000755133 [0,2,0,0,0,0|2,0,0]=4 15036 B16R0.61 CCOC(=O)CCCCCNCCOCCO 2230a_100000211614_100000755133 [0,2,0,0,0,0|1,0,0]=3 15037 B16R0.61 CCOC(=O)CCCCCNCCOCCO 34a_100000211614_100000755133 [0,2,0,0,0,0|1,0,0]=3 15038 B16R0.61 CCOC(=O)CCCCCNCCSCCO 2230a_100011219999_100000755133 [0,2,0,0,0,0|1,0,0]=3 15039 B16R0.61 CCOC(=O)CCCCCOCCCCC#N 7a_100011214988_100000211819 [0,2,0,0,0,0|0,0,1]=3 15040 B16R0.61 CCOC(=O)CCCCCOCCCCC=O 7a_100011214988_100000139335 [0,2,0,0,0,0|0,0,1]=3 15041 B16R0.61 CCOC(=O)CCCCCOCCCCCBr 34a_100000746331_100000755133 [0,2,0,0,0,0|0,0,0]=2 15042 B16R0.61 CCOC(=O)CCCCCOCCCCCBr 7a_100000746331_100000755133 [0,2,0,0,0,0|0,0,0]=2 15043 B16R0.61 CCOC(=O)CCCCCOCCCCCCl 34a_100000746330_100000755133 [0,2,0,0,0,0|0,0,0]=2 15044 B16R0.61 CCOC(=O)CCCCCOCCCCCCl 7a_100000746330_100000755133 [0,2,0,0,0,0|0,0,0]=2 15045 B16R0.61 CCOC(=O)CCCCCOCCCCCF 7a_100011214988_100000729378 [0,2,0,0,0,0|0,0,0]=2 15046 B16R0.61 CCOC(=O)CCCCCOCCCCCI 34a_200012148887_100000755133 [0,2,0,0,0,0|0,0,0]=2 15047 B16R0.61 CCOC(=O)CCCCCOCCCCCI 7a_200012148887_100000755133 [0,2,0,0,0,0|0,0,0]=2 15048 B16R0.61 CCOC(=O)CCCCCOCCCCCN 34a_100000762737_100000755133 [0,2,0,0,0,0|0,0,0]=2 15049 B16R0.61 CCOC(=O)CCCCCOCCCCCO 7a_100011214988_100000746330 [0,2,0,0,0,0|0,0,0]=2 15050 B16R0.61 CCOC(=O)CCCCCOCCCCOC 34a_100000740925_100000755133 [0,2,0,0,0,0|0,0,0]=2 15051 B16R0.61 CCOC(=O)CCCCCOCCCCOC 7a_100011214988_100000730899 [0,2,0,0,0,0|0,0,0]=2 15052 B16R0.61 CCOC(=O)CCCCCOCCCCSC 34a_100011217163_100000755133 [0,2,0,0,0,0|0,0,0]=2 15053 B16R0.61 CCOC(=O)CCCCCOCCCCSC 7a_100011217163_100000755133 [0,2,0,0,0,0|0,0,0]=2 15054 B16R0.61 CCOC(=O)CCCCCOCCCSCC 34a_100011216438_100000755133 [0,2,0,0,0,0|0,0,0]=2 15055 B16R0.61 CCOC(=O)CCCCCOCCCSCC 7a_100011216438_100000755133 [0,2,0,0,0,0|0,0,0]=2 15056 B16R0.61 CCOC(=O)CCCCCOCCOCC#N 7a_100011214988_200000047693 [0,2,0,0,0,0|1,0,1]=4 15057 B16R0.61 CCOC(=O)CCCCCOCCOCCBr 34a_100000692535_100000755133 [0,2,0,0,0,0|1,0,0]=3 15058 B16R0.61 CCOC(=O)CCCCCOCCOCCBr 7a_100000692535_100000755133 [0,2,0,0,0,0|1,0,0]=3 15059 B16R0.61 CCOC(=O)CCCCCOCCOCCCl 34a_100011215305_100000755133 [0,2,0,0,0,0|1,0,0]=3 15060 B16R0.61 CCOC(=O)CCCCCOCCOCCCl 7a_100011215305_100000755133 [0,2,0,0,0,0|1,0,0]=3 15061 B16R0.61 CCOC(=O)CCCCCOCCOCCF 34a_200015357709_100000755133 [0,2,0,0,0,0|1,0,0]=3 15062 B16R0.61 CCOC(=O)CCCCCOCCOCCF 7a_200015357709_100000755133 [0,2,0,0,0,0|1,0,0]=3 15063 B16R0.61 CCOC(=O)CCCCCOCCOCCI 34a_100012149058_100000755133 [0,2,0,0,0,0|1,0,0]=3 15064 B16R0.61 CCOC(=O)CCCCCOCCOCCI 7a_100012149058_100000755133 [0,2,0,0,0,0|1,0,0]=3 15065 B16R0.61 CCOC(=O)CCCCCOCCOCCN 34a_100000211614_100000755133 [0,2,0,0,0,0|1,0,0]=3 15066 B16R0.61 CCOC(=O)CCCCCOCCOCCO 7a_100011214988_100011215305 [0,2,0,0,0,0|1,0,0]=3 15067 B16R0.61 CCOC(=O)CCCCCSCCCCC#N 62a_100000755133_100000211819 [0,2,0,0,0,0|0,0,1]=3 15068 B16R0.61 CCOC(=O)CCCCCSCCCCC#N 62a_100011219923_100000755133 [0,2,0,0,0,0|0,0,1]=3 15069 B16R0.61 CCOC(=O)CCCCCSCCCCC=O 62a_100000139335_100000755133 [0,2,0,0,0,0|0,0,1]=3 15070 B16R0.61 CCOC(=O)CCCCCSCCCCC=O 62a_100000755133_100000139335 [0,2,0,0,0,0|0,0,1]=3 15071 B16R0.61 CCOC(=O)CCCCCSCCCCCF 62a_100000729378_100000755133 [0,2,0,0,0,0|0,0,0]=2 15072 B16R0.61 CCOC(=O)CCCCCSCCCCCF 62a_100000755133_100000729378 [0,2,0,0,0,0|0,0,0]=2 15073 B16R0.61 CCOC(=O)CCCCCSCCCCCO 62a_100000746330_100000755133 [0,2,0,0,0,0|0,0,0]=2 15074 B16R0.61 CCOC(=O)CCCCCSCCCCCO 62a_100000755133_100000746330 [0,2,0,0,0,0|0,0,0]=2 15075 B16R0.61 CCOC(=O)CCCCCSCCCCOC 62a_100000730899_100000755133 [0,2,0,0,0,0|0,0,0]=2 15076 B16R0.61 CCOC(=O)CCCCCSCCCCOC 62a_100000755133_100000730899 [0,2,0,0,0,0|0,0,0]=2 15077 B16R0.61 CCOC(=O)CCCCCSCCOCC#N 62a_100000755133_200000047693 [0,2,0,0,0,0|1,0,1]=4 15078 B16R0.61 CCOC(=O)CCCCCSCCOCC#N 62a_200000047693_100000755133 [0,2,0,0,0,0|1,0,1]=4 15079 B16R0.61 CCOC(=O)CCCCCSCCOCCO 62a_100000755133_100011215305 [0,2,0,0,0,0|1,0,0]=3 15080 B16R0.61 CCOC(=O)CCCCCSCCOCCO 62a_100011215305_100000755133 [0,2,0,0,0,0|1,0,0]=3 15081 B16R0.61 CCOC(=O)CCCCCSCOCCOC 62a_100000231047_100000755133 [0,2,0,0,0,0|1,0,0]=3 15082 B16R0.61 CCOC(=O)CCCCCSCOCCOC 62a_100000755133_100000231047 [0,2,0,0,0,0|1,0,0]=3 15083 B16R0.61 CCOC(=O)CCCCNCCCCCCO 2230a_100000686447_100000750268 [0,2,0,0,0,0|0,0,0]=2 15084 B16R0.61 CCOC(=O)CCCCNCCCCCCO 34a_100000686447_100000750268 [0,2,0,0,0,0|0,0,0]=2 15085 B16R0.61 CCOC(=O)CCCCNCCCCCOC 2230a_100000747528_100000750268 [0,2,0,0,0,0|0,0,0]=2 15086 B16R0.61 CCOC(=O)CCCCNCCCCCOC 34a_100000747528_100000750268 [0,2,0,0,0,0|0,0,0]=2 15087 B16R0.61 CCOC(=O)CCCCNCCCCN=[N+]=[N-] 2230a_100000101370_100000750268 [0,2,0,0,0,0|2,0,0]=4 15088 B16R0.61 CCOC(=O)CCCCNCCOCCOC 2230a_100000745349_100000750268 [0,2,0,0,0,0|1,0,0]=3 15089 B16R0.61 CCOC(=O)CCCCNCCOCCOC 34a_100000745349_100000750268 [0,2,0,0,0,0|1,0,0]=3 15090 B16R0.61 CCOC(=O)CCCCOCCCCCCBr 34a_100011215345_100000750268 [0,2,0,0,0,0|0,0,0]=2 15091 B16R0.61 CCOC(=O)CCCCOCCCCCCBr 7a_100011215345_100000750268 [0,2,0,0,0,0|0,0,0]=2 15092 B16R0.61 CCOC(=O)CCCCOCCCCCCCl 34a_100000766143_100000750268 [0,2,0,0,0,0|0,0,0]=2 15093 B16R0.61 CCOC(=O)CCCCOCCCCCCCl 7a_100000766143_100000750268 [0,2,0,0,0,0|0,0,0]=2 15094 B16R0.61 CCOC(=O)CCCCOCCCCCCF 34a_100000732779_100000750268 [0,2,0,0,0,0|0,0,0]=2 15095 B16R0.61 CCOC(=O)CCCCOCCCCCCF 7a_100000732779_100000750268 [0,2,0,0,0,0|0,0,0]=2 15096 B16R0.61 CCOC(=O)CCCCOCCCCCCN 34a_100000686447_100000750268 [0,2,0,0,0,0|0,0,0]=2 15097 B16R0.61 CCOC(=O)CCCCOCCCCCNC 34a_100000722520_100000750268 [0,2,0,0,0,0|0,0,0]=2 15098 B16R0.61 CCOC(=O)CCCCOCCOCCNC 34a_100000228057_100000750268 [0,2,0,0,0,0|1,0,0]=3 15099 B16R0.61 CCOC(=O)CCCCOCCOCCOC 34a_100011215163_100000750268 [0,2,0,0,0,0|1,0,0]=3 15100 B16R0.61 CCOC(=O)CCCCOCCOCCOC 7a_100011215163_100000750268 [0,2,0,0,0,0|1,0,0]=3 15101 B16R0.61 CCOC(=O)CCCCSCCCCCC#N 62a_100000750268_100009813376 [0,2,0,0,0,0|0,0,1]=3 15102 B16R0.61 CCOC(=O)CCCCSCCCCCC#N 62a_100009813376_100000750268 [0,2,0,0,0,0|0,0,1]=3 15103 B16R0.61 CCOC(=O)CCCCSCCCCCC=O 62a_100000139337_100000750268 [0,2,0,0,0,0|0,0,1]=3 15104 B16R0.61 CCOC(=O)CCCCSCCCCCC=O 62a_100000750268_100000139337 [0,2,0,0,0,0|0,0,1]=3 15105 B16R0.61 CCOC(=O)CCCCSCCCCCCF 62a_100000750268_100015922095 [0,2,0,0,0,0|0,0,0]=2 15106 B16R0.61 CCOC(=O)CCCCSCCCCCCF 62a_100015922095_100000750268 [0,2,0,0,0,0|0,0,0]=2 15107 B16R0.61 CCOC(=O)CCCCSCCCCCCO 62a_100000750268_100000766143 [0,2,0,0,0,0|0,0,0]=2 15108 B16R0.61 CCOC(=O)CCCCSCCCCCCO 62a_100000766143_100000750268 [0,2,0,0,0,0|0,0,0]=2 15109 B16R0.61 CCOC(=O)CCCCSCCOCCOC 62a_100000695917_100000750268 [0,2,0,0,0,0|1,0,0]=3 15110 B16R0.61 CCOC(=O)CCCCSCCOCCOC 62a_100000750268_100000695917 [0,2,0,0,0,0|1,0,0]=3 15111 B16R0.61 CCOC(=O)CCCNCCCCCCCO 2230a_100011996573_100009991533 [0,2,0,0,0,0|0,0,0]=2 15112 B16R0.61 CCOC(=O)CCCNCCCCCCCO 34a_100011996573_100009991533 [0,2,0,0,0,0|0,0,0]=2 15113 B16R0.61 CCOC(=O)CCCNCCCOCCCO 2230a_100011310245_100009991533 [0,2,0,0,0,0|1,0,0]=3 15114 B16R0.61 CCOC(=O)CCCNCCCOCCCO 34a_100011310245_100009991533 [0,2,0,0,0,0|1,0,0]=3 15115 B16R0.61 CCOC(=O)CCCNCCCOCCOC 2230a_100000206027_100009991533 [0,2,0,0,0,0|1,0,0]=3 15116 B16R0.61 CCOC(=O)CCCNCCCOCCOC 34a_100000206027_100009991533 [0,2,0,0,0,0|1,0,0]=3 15117 B16R0.61 CCOC(=O)CCCOCCCCCCC#N 7a_100012001163_100009813337 [0,2,0,0,0,0|0,0,1]=3 15118 B16R0.61 CCOC(=O)CCCOCCCCCCCBr 34a_100000760002_100009991533 [0,2,0,0,0,0|0,0,0]=2 15119 B16R0.61 CCOC(=O)CCCOCCCCCCCBr 7a_100000760002_100011215271 [0,2,0,0,0,0|0,0,0]=2 15120 B16R0.61 CCOC(=O)CCCOCCCCCCCN 34a_100011996573_100009991533 [0,2,0,0,0,0|0,0,0]=2 15121 B16R0.61 CCOC(=O)CCCOCCCCCCCO 7a_100012001163_100000760002 [0,2,0,0,0,0|0,0,0]=2 15122 B16R0.61 CCOC(=O)CCCOCCCCCCOC 34a_200012092642_100009991533 [0,2,0,0,0,0|0,0,0]=2 15123 B16R0.61 CCOC(=O)CCCOCCCCCCOC 7a_100012001163_100011998445 [0,2,0,0,0,0|0,0,0]=2 15124 B16R0.61 CCOC(=O)CCCOCCCCCCOC 7a_200012092642_100011215271 [0,2,0,0,0,0|0,0,0]=2 15125 B16R0.61 CCOC(=O)CCCOCCCOCCCN 34a_100011310245_100009991533 [0,2,0,0,0,0|1,0,0]=3 15126 B16R0.61 CCOC(=O)CCCOCCCOCCOC 7a_100012001163_100011216529 [0,2,0,0,0,0|1,0,0]=3 15127 B16R0.61 CCOC(=O)CCCSCCCCCCC#N 62a_100009813337_100009991533 [0,2,0,0,0,0|0,0,1]=3 15128 B16R0.61 CCOC(=O)CCCSCCCCCCC#N 62a_100009991533_100009813337 [0,2,0,0,0,0|0,0,1]=3 15129 B16R0.61 CCOC(=O)CCCSCCCCCCCO 62a_100000760002_100009991533 [0,2,0,0,0,0|0,0,0]=2 15130 B16R0.61 CCOC(=O)CCCSCCCCCCCO 62a_100009991533_100000760002 [0,2,0,0,0,0|0,0,0]=2 15131 B16R0.61 CCOC(=O)CCCSCCCCCCOC 62a_100009991533_100011998445 [0,2,0,0,0,0|0,0,0]=2 15132 B16R0.61 CCOC(=O)CCCSCCCCCCOC 62a_100011998445_100009991533 [0,2,0,0,0,0|0,0,0]=2 15133 B16R0.61 CCOC(=O)CCCSCCCOCCOC 62a_100009991533_100011216529 [0,2,0,0,0,0|1,0,0]=3 15134 B16R0.61 CCOC(=O)CCCSCCCOCCOC 62a_100011216529_100009991533 [0,2,0,0,0,0|1,0,0]=3 15135 B16R0.61 CCOC(=O)CCNCCCCCCCCO 2230a_102515433106_100011206558 [0,2,0,0,0,0|0,0,0]=2 15136 B16R0.61 CCOC(=O)CCNCCCCCCCCO 34a_102515433106_100000765890 [0,2,0,0,0,0|0,0,0]=2 15137 B16R0.61 CCOC(=O)CCNCCCCCCN=[N+]=[N-] 2230a_200000049180_100011206558 [0,2,0,0,0,0|2,0,0]=4 15138 B16R0.61 CCOC(=O)CCNCCOCCOCCO 2230a_100011998139_100011206558 [0,2,0,0,0,0|2,0,0]=4 15139 B16R0.61 CCOC(=O)CCNCCOCCOCCO 34a_100011998139_100000765890 [0,2,0,0,0,0|2,0,0]=4 15140 B16R0.61 CCOC(=O)CCOCCCCCCCCBr 34a_100009813846_100000765890 [0,2,0,0,0,0|0,0,0]=2 15141 B16R0.61 CCOC(=O)CCOCCCCCCCCBr 7a_100009813846_100011206558 [0,2,0,0,0,0|0,0,0]=2 15142 B16R0.61 CCOC(=O)CCOCCCCCCCCCl 34a_100000033203_100000765890 [0,2,0,0,0,0|0,0,0]=2 15143 B16R0.61 CCOC(=O)CCOCCCCCCCCCl 7a_100000033203_100011206558 [0,2,0,0,0,0|0,0,0]=2 15144 B16R0.61 CCOC(=O)CCOCCCCCCCCN 34a_102515433106_100000765890 [0,2,0,0,0,0|0,0,0]=2 15145 B16R0.61 CCOC(=O)CCOCCCCCNCCN 34a_103619048469_100000765890 [0,2,0,0,0,0|1,0,0]=3 15146 B16R0.61 CCOC(=O)CCOCCCOCCCOC 34a_200011215475_100000765890 [0,2,0,0,0,0|1,0,0]=3 15147 B16R0.61 CCOC(=O)CCOCCCOCCCOC 7a_200011215475_100011206558 [0,2,0,0,0,0|1,0,0]=3 15148 B16R0.61 CCOC(=O)CCOCCOCCOCCBr 34a_100010132937_100000765890 [0,2,0,0,0,0|2,0,0]=4 15149 B16R0.61 CCOC(=O)CCOCCOCCOCCBr 7a_100010132937_100011206558 [0,2,0,0,0,0|2,0,0]=4 15150 B16R0.61 CCOC(=O)CCOCCOCCOCCCl 34a_100000032323_100000765890 [0,2,0,0,0,0|2,0,0]=4 15151 B16R0.61 CCOC(=O)CCOCCOCCOCCCl 7a_100000032323_100011206558 [0,2,0,0,0,0|2,0,0]=4 15152 B16R0.61 CCOC(=O)CCOCCOCCOCCF 34a_100010737887_100011217306 [0,2,0,0,0,0|2,0,0]=4 15153 B16R0.61 CCOC(=O)CCOCCOCCOCCF 7a_100010737887_100011217306 [0,2,0,0,0,0|2,0,0]=4 15154 B16R0.61 CCOC(=O)CCOCCOCCOCCN 34a_100011998139_100000765890 [0,2,0,0,0,0|2,0,0]=4 15155 B16R0.61 CCOC(=O)CCOCCOCCOCCO 34a_100010737887_100000211926 [0,2,0,0,0,0|2,0,0]=4 15156 B16R0.61 CCOC(=O)CCOCCOCCOCCO 7a_100010737887_100000211926 [0,2,0,0,0,0|2,0,0]=4 15157 B16R0.61 CCOC(=O)CCOCCOCCOCSC 34a_100010737887_100011218213 [0,2,0,0,0,0|2,0,0]=4 15158 B16R0.61 CCOC(=O)CCSCCCCCCCCO 62a_100000033203_100000765890 [0,2,0,0,0,0|0,0,0]=2 15159 B16R0.61 CCOC(=O)CCSCCCCCCCCO 62a_100000765890_100000033203 [0,2,0,0,0,0|0,0,0]=2 15160 B16R0.61 CCOC(=O)CCSCCOCCOCCO 62a_100000032323_100000765890 [0,2,0,0,0,0|2,0,0]=4 15161 B16R0.61 CCOC(=O)CCSCCOCCOCCO 62a_100000765890_100000032323 [0,2,0,0,0,0|2,0,0]=4 15162 B16R0.61 CCOC(=O)CNCCCCCCCCCO 2230a_100000078944_100000188475 [0,2,0,0,0,0|0,0,0]=2 15163 B16R0.61 CCOC(=O)CNCCCCCCCCCO 34a_100000078944_100000188475 [0,2,0,0,0,0|0,0,0]=2 15164 B16R0.61 CCOC(=O)CNCCCOCCOCCO 2230a_100011996194_100000188475 [0,2,0,0,0,0|2,0,0]=4 15165 B16R0.61 CCOC(=O)CNCCCOCCOCCO 34a_100011996194_100000188475 [0,2,0,0,0,0|2,0,0]=4 15166 B16R0.61 CCOC(=O)CNCCOCCOCCOC 2230a_100012028300_100000188475 [0,2,0,0,0,0|2,0,0]=4 15167 B16R0.61 CCOC(=O)CNCCOCCOCCOC 34a_100012028300_100000188475 [0,2,0,0,0,0|2,0,0]=4 15168 B16R0.61 CCOC(=O)COCCCCCCCCCBr 34a_100009813782_100000188475 [0,2,0,0,0,0|0,0,0]=2 15169 B16R0.61 CCOC(=O)COCCCCCCCCCBr 7a_100009813782_100000188475 [0,2,0,0,0,0|0,0,0]=2 15170 B16R0.61 CCOC(=O)COCCCCCCCCCCl 34a_100009868337_100000188475 [0,2,0,0,0,0|0,0,0]=2 15171 B16R0.61 CCOC(=O)COCCCCCCCCCCl 7a_100009868337_100000188475 [0,2,0,0,0,0|0,0,0]=2 15172 B16R0.61 CCOC(=O)COCCCCCCCCCN 34a_100000078944_100000188475 [0,2,0,0,0,0|0,0,0]=2 15173 B16R0.61 CCOC(=O)COCCCNCCCCCO 2230a_100000762737_100009893628 [0,2,0,0,0,0|1,0,0]=3 15174 B16R0.61 CCOC(=O)COCCCNCCCCCO 34a_100000762737_100009893628 [0,2,0,0,0,0|1,0,0]=3 15175 B16R0.61 CCOC(=O)COCCCNCCOCCO 2230a_100000211614_100009893628 [0,2,0,0,0,0|2,0,0]=4 15176 B16R0.61 CCOC(=O)COCCCNCCOCCO 34a_100000211614_100009893628 [0,2,0,0,0,0|2,0,0]=4 15177 B16R0.61 CCOC(=O)COCCCNCCSCCO 2230a_100011219999_100009893628 [0,2,0,0,0,0|2,0,0]=4 15178 B16R0.61 CCOC(=O)COCCCOCCCCCBr 34a_100000746331_100009893628 [0,2,0,0,0,0|1,0,0]=3 15179 B16R0.61 CCOC(=O)COCCCOCCCCCBr 7a_100000746331_100009893628 [0,2,0,0,0,0|1,0,0]=3 15180 B16R0.61 CCOC(=O)COCCCOCCCCCCl 34a_100000746330_100009893628 [0,2,0,0,0,0|1,0,0]=3 15181 B16R0.61 CCOC(=O)COCCCOCCCCCCl 7a_100000746330_100009893628 [0,2,0,0,0,0|1,0,0]=3 15182 B16R0.61 CCOC(=O)COCCCOCCCCCI 34a_200012148887_100009893628 [0,2,0,0,0,0|1,0,0]=3 15183 B16R0.61 CCOC(=O)COCCCOCCCCCI 7a_200012148887_100009893628 [0,2,0,0,0,0|1,0,0]=3 15184 B16R0.61 CCOC(=O)COCCCOCCCCCN 34a_100000762737_100009893628 [0,2,0,0,0,0|1,0,0]=3 15185 B16R0.61 CCOC(=O)COCCCOCCCCOC 34a_100000740925_100009893628 [0,2,0,0,0,0|1,0,0]=3 15186 B16R0.61 CCOC(=O)COCCCOCCCCSC 34a_100011217163_100009893628 [0,2,0,0,0,0|1,0,0]=3 15187 B16R0.61 CCOC(=O)COCCCOCCCCSC 7a_100011217163_100009893628 [0,2,0,0,0,0|1,0,0]=3 15188 B16R0.61 CCOC(=O)COCCCOCCCSCC 34a_100011216438_100009893628 [0,2,0,0,0,0|1,0,0]=3 15189 B16R0.61 CCOC(=O)COCCCOCCCSCC 7a_100011216438_100009893628 [0,2,0,0,0,0|1,0,0]=3 15190 B16R0.61 CCOC(=O)COCCCOCCOCCBr 34a_100000692535_100009893628 [0,2,0,0,0,0|2,0,0]=4 15191 B16R0.61 CCOC(=O)COCCCOCCOCCBr 7a_100000692535_100009893628 [0,2,0,0,0,0|2,0,0]=4 15192 B16R0.61 CCOC(=O)COCCCOCCOCCCl 34a_100011215305_100009893628 [0,2,0,0,0,0|2,0,0]=4 15193 B16R0.61 CCOC(=O)COCCCOCCOCCCl 7a_100011215305_100009893628 [0,2,0,0,0,0|2,0,0]=4 15194 B16R0.61 CCOC(=O)COCCCOCCOCCF 34a_200015357709_100009893628 [0,2,0,0,0,0|2,0,0]=4 15195 B16R0.61 CCOC(=O)COCCCOCCOCCF 7a_200015357709_100009893628 [0,2,0,0,0,0|2,0,0]=4 15196 B16R0.61 CCOC(=O)COCCCOCCOCCI 34a_100012149058_100009893628 [0,2,0,0,0,0|2,0,0]=4 15197 B16R0.61 CCOC(=O)COCCCOCCOCCI 7a_100012149058_100009893628 [0,2,0,0,0,0|2,0,0]=4 15198 B16R0.61 CCOC(=O)COCCCOCCOCCN 34a_100000211614_100009893628 [0,2,0,0,0,0|2,0,0]=4 15199 B16R0.61 CCOC(=O)COCCCSCCCCC#N 62a_100009893628_100000211819 [0,2,0,0,0,0|1,0,1]=4 15200 B16R0.61 CCOC(=O)COCCCSCCCCC#N 62a_100011219923_100009893628 [0,2,0,0,0,0|1,0,1]=4 15201 B16R0.61 CCOC(=O)COCCCSCCCCC=O 62a_100000139335_100009893628 [0,2,0,0,0,0|1,0,1]=4 15202 B16R0.61 CCOC(=O)COCCCSCCCCC=O 62a_100009893628_100000139335 [0,2,0,0,0,0|1,0,1]=4 15203 B16R0.61 CCOC(=O)COCCCSCCCCCF 62a_100000729378_100009893628 [0,2,0,0,0,0|1,0,0]=3 15204 B16R0.61 CCOC(=O)COCCCSCCCCCF 62a_100009893628_100000729378 [0,2,0,0,0,0|1,0,0]=3 15205 B16R0.61 CCOC(=O)COCCCSCCCCCO 62a_100000746330_100009893628 [0,2,0,0,0,0|1,0,0]=3 15206 B16R0.61 CCOC(=O)COCCCSCCCCCO 62a_100009893628_100000746330 [0,2,0,0,0,0|1,0,0]=3 15207 B16R0.61 CCOC(=O)COCCCSCCCCOC 62a_100000730899_100009893628 [0,2,0,0,0,0|1,0,0]=3 15208 B16R0.61 CCOC(=O)COCCCSCCCCOC 62a_100009893628_100000730899 [0,2,0,0,0,0|1,0,0]=3 15209 B16R0.61 CCOC(=O)COCCCSCCOCCO 62a_100009893628_100011215305 [0,2,0,0,0,0|2,0,0]=4 15210 B16R0.61 CCOC(=O)COCCCSCCOCCO 62a_100011215305_100009893628 [0,2,0,0,0,0|2,0,0]=4 15211 B16R0.61 CCOC(=O)COCCCSCOCCOC 62a_100000231047_100009893628 [0,2,0,0,0,0|2,0,0]=4 15212 B16R0.61 CCOC(=O)COCCCSCOCCOC 62a_100009893628_100000231047 [0,2,0,0,0,0|2,0,0]=4 15213 B16R0.61 CCOC(=O)COCCNCCCCCCO 2230a_100000686447_100000088970 [0,2,0,0,0,0|1,0,0]=3 15214 B16R0.61 CCOC(=O)COCCNCCCCCCO 34a_100000686447_100000088970 [0,2,0,0,0,0|1,0,0]=3 15215 B16R0.61 CCOC(=O)COCCNCCCCCOC 2230a_100000747528_100000088970 [0,2,0,0,0,0|1,0,0]=3 15216 B16R0.61 CCOC(=O)COCCNCCCCCOC 34a_100000747528_100000088970 [0,2,0,0,0,0|1,0,0]=3 15217 B16R0.61 CCOC(=O)COCCNCCOCCOC 2230a_100000745349_100000088970 [0,2,0,0,0,0|2,0,0]=4 15218 B16R0.61 CCOC(=O)COCCNCCOCCOC 34a_100000745349_100000088970 [0,2,0,0,0,0|2,0,0]=4 15219 B16R0.61 CCOC(=O)COCCOCCCCCCBr 34a_100011215345_100000088970 [0,2,0,0,0,0|1,0,0]=3 15220 B16R0.61 CCOC(=O)COCCOCCCCCCBr 7a_100011215345_100000088970 [0,2,0,0,0,0|1,0,0]=3 15221 B16R0.61 CCOC(=O)COCCOCCCCCCCl 34a_100000766143_100000088970 [0,2,0,0,0,0|1,0,0]=3 15222 B16R0.61 CCOC(=O)COCCOCCCCCCCl 7a_100000766143_100000088970 [0,2,0,0,0,0|1,0,0]=3 15223 B16R0.61 CCOC(=O)COCCOCCCCCCF 34a_100000732779_100000088970 [0,2,0,0,0,0|1,0,0]=3 15224 B16R0.61 CCOC(=O)COCCOCCCCCCF 7a_100000732779_100000088970 [0,2,0,0,0,0|1,0,0]=3 15225 B16R0.61 CCOC(=O)COCCOCCCCCCN 34a_100000686447_100000088970 [0,2,0,0,0,0|1,0,0]=3 15226 B16R0.61 CCOC(=O)COCCOCCCCCNC 34a_100000722520_100000088970 [0,2,0,0,0,0|1,0,0]=3 15227 B16R0.61 CCOC(=O)COCCOCCOCCCN 34a_100011996194_100000188475 [0,2,0,0,0,0|2,0,0]=4 15228 B16R0.61 CCOC(=O)COCCOCCOCCNC 34a_100000228057_100000088970 [0,2,0,0,0,0|2,0,0]=4 15229 B16R0.61 CCOC(=O)COCCOCCOCCNC 34a_200014138305_100000188475 [0,2,0,0,0,0|2,0,0]=4 15230 B16R0.61 CCOC(=O)COCCOCCOCCOC 34a_100000688194_100000188475 [0,2,0,0,0,0|2,0,0]=4 15231 B16R0.61 CCOC(=O)COCCOCCOCCOC 34a_100011215163_100000088970 [0,2,0,0,0,0|2,0,0]=4 15232 B16R0.61 CCOC(=O)COCCOCCOCCOC 7a_100000688194_100000188475 [0,2,0,0,0,0|2,0,0]=4 15233 B16R0.61 CCOC(=O)COCCOCCOCCOC 7a_100011215163_100000088970 [0,2,0,0,0,0|2,0,0]=4 15234 B16R0.61 CCOC(=O)COCCSCCCCCC#N 62a_100000088970_100009813376 [0,2,0,0,0,0|1,0,1]=4 15235 B16R0.61 CCOC(=O)COCCSCCCCCC#N 62a_100009813376_100000088970 [0,2,0,0,0,0|1,0,1]=4 15236 B16R0.61 CCOC(=O)COCCSCCCCCC=O 62a_100000088970_100000139337 [0,2,0,0,0,0|1,0,1]=4 15237 B16R0.61 CCOC(=O)COCCSCCCCCC=O 62a_100000139337_100000088970 [0,2,0,0,0,0|1,0,1]=4 15238 B16R0.61 CCOC(=O)COCCSCCCCCCF 62a_100000088970_100015922095 [0,2,0,0,0,0|1,0,0]=3 15239 B16R0.61 CCOC(=O)COCCSCCCCCCF 62a_100015922095_100000088970 [0,2,0,0,0,0|1,0,0]=3 15240 B16R0.61 CCOC(=O)COCCSCCCCCCO 62a_100000088970_100000766143 [0,2,0,0,0,0|1,0,0]=3 15241 B16R0.61 CCOC(=O)COCCSCCCCCCO 62a_100000766143_100000088970 [0,2,0,0,0,0|1,0,0]=3 15242 B16R0.61 CCOC(=O)COCCSCCOCCOC 62a_100000088970_100000695917 [0,2,0,0,0,0|2,0,0]=4 15243 B16R0.61 CCOC(=O)COCCSCCOCCOC 62a_100000695917_100000088970 [0,2,0,0,0,0|2,0,0]=4 15244 B16R0.61 CCOC(=O)CSCCCCCCCCCO 62a_100000188475_100009813782 [0,2,0,0,0,0|0,0,0]=2 15245 B16R0.61 CCOC(=O)CSCCCCCCCCCO 62a_100009813782_100000188475 [0,2,0,0,0,0|0,0,0]=2 15246 B16R0.61 CCOC(=O)CSCCOCCCCCC#N 7a_200000230590_100009813376 [0,2,0,0,0,0|1,0,1]=4 15247 B16R0.61 CCOC(=O)CSCCOCCCCCC=O 7a_200000230590_100000139337 [0,2,0,0,0,0|1,0,1]=4 15248 B16R0.61 CCOC(=O)CSCCOCCCCCCF 7a_200000230590_100015922095 [0,2,0,0,0,0|1,0,0]=3 15249 B16R0.61 CCOC(=O)CSCCOCCCCCCO 7a_200000230590_100000766143 [0,2,0,0,0,0|1,0,0]=3 15250 B16R0.61 CCOC(=O)CSCCOCCOCCOC 62a_100000188475_100013367474 [0,2,0,0,0,0|2,0,0]=4 15251 B16R0.61 CCOC(=O)CSCCOCCOCCOC 62a_100013367474_100000188475 [0,2,0,0,0,0|2,0,0]=4 15252 B16R0.61 CCOC(=O)CSCCOCCOCCOC 7a_200000230590_100000695917 [0,2,0,0,0,0|2,0,0]=4 15253 B16R0.61 CCOC(=O)NCCOCCCCCCCBr 7a_100000760002_200011445536 [0,2,0,0,0,0|1,0,0]=3 15254 B16R0.61 CCOC(=O)NCCOCCCCCCCO 34a_100000158857_100000760002 [0,2,0,0,0,0|1,0,0]=3 15255 B16R0.61 CCOC(=O)NCCOCCCCCCOC 34a_100000158857_100011998445 [0,2,0,0,0,0|1,0,0]=3 15256 B16R0.61 CCOC(=O)NCCOCCCCCCOC 7a_200012092642_200011445536 [0,2,0,0,0,0|1,0,0]=3 15257 B16R0.61 CCOC(=O)NCCOCCCOCCOC 34a_100000158857_100011216529 [0,2,0,0,0,0|2,0,0]=4 15258 B16R0.61 CCOC(=O)NCCSCCCCCCC#N 62a_100009813337_200011445536 [0,2,0,0,0,0|1,0,1]=4 15259 B16R0.61 CCOC(=O)NCCSCCCCCCCO 62a_100000760002_200011445536 [0,2,0,0,0,0|1,0,0]=3 15260 B16R0.61 CCOC(=O)NCCSCCCCCCOC 62a_100011998445_200011445536 [0,2,0,0,0,0|1,0,0]=3 15261 B16R0.61 CCOC(=O)NCCSCCCOCCOC 62a_100011216529_200011445536 [0,2,0,0,0,0|2,0,0]=4 15262 B16R0.61 CCOC(=O)OCSCCCCCCCCO 62a_100000033203_100000075025 [0,2,0,0,0,0|1,0,0]=3 15263 B16R0.61 CCOCCCCCCCCCC(=O)OCC 34a_100121572206_100009828014 [0,2,0,0,0,0|0,0,0]=2 15264 B16R0.61 CCOCCCNCCCCCC(=O)OCC 2230a_100000210961_100000755133 [0,2,0,0,0,0|0,0,0]=2 15265 B16R0.61 CCOCCCNCCCCCC(=O)OCC 34a_100000210961_100000755133 [0,2,0,0,0,0|0,0,0]=2 15266 B16R0.61 CCOCCCNCCCOCC(=O)OCC 2230a_100000210961_100009893628 [0,2,0,0,0,0|1,0,0]=3 15267 B16R0.61 CCOCCCNCCCOCC(=O)OCC 34a_100000210961_100009893628 [0,2,0,0,0,0|1,0,0]=3 15268 B16R0.61 CCOCCCOCCCCCC(=O)OCC 34a_100000757476_100000755133 [0,2,0,0,0,0|0,0,0]=2 15269 B16R0.61 CCOCCCOCCCCCC(=O)OCC 7a_100000757476_100000755133 [0,2,0,0,0,0|0,0,0]=2 15270 B16R0.61 CCOCCCOCCCCCC(=O)OCC 7a_100011214988_100012232248 [0,2,0,0,0,0|0,0,0]=2 15271 B16R0.61 CCOCCCOCCCOCC(=O)OCC 34a_100000757476_100009893628 [0,2,0,0,0,0|1,0,0]=3 15272 B16R0.61 CCOCCCOCCCOCC(=O)OCC 7a_100000757476_100009893628 [0,2,0,0,0,0|1,0,0]=3 15273 B16R0.61 CCOCCCSCCCCCC(=O)OCC 62a_100000755133_100012232248 [0,2,0,0,0,0|0,0,0]=2 15274 B16R0.61 CCOCCCSCCCCCC(=O)OCC 62a_100012232248_100000755133 [0,2,0,0,0,0|0,0,0]=2 15275 B16R0.61 CCOCCCSCCCOCC(=O)OCC 62a_100009893628_100012232248 [0,2,0,0,0,0|1,0,0]=3 15276 B16R0.61 CCOCCCSCCCOCC(=O)OCC 62a_100012232248_100009893628 [0,2,0,0,0,0|1,0,0]=3 15277 B16R0.61 CCOCCNCCCCCCC(=O)OCC 2230a_102516460346_100009814379 [0,2,0,0,0,0|0,0,0]=2 15278 B16R0.61 CCOCCNCCCCCCC(=O)OCC 34a_102516460346_100009814379 [0,2,0,0,0,0|0,0,0]=2 15279 B16R0.61 CCOCCNN=CCCCCC(=O)OCC 4a_100000732670_100012182868 [0,2,0,0,0,0|1,0,1]=4 15280 B16R0.61 CCOCCOCCCCCCC(=O)OCC 34a_100000210136_100009814379 [0,2,0,0,0,0|0,0,0]=2 15281 B16R0.61 CCOCCOCCCCCCC(=O)OCC 7a_100000210136_100009814379 [0,2,0,0,0,0|0,0,0]=2 15282 B16R0.61 CCOCCOCCNCCCC(=O)OCC 2230a_100102712874_100009991533 [0,2,0,0,0,0|1,0,0]=3 15283 B16R0.61 CCOCCOCCNCCCC(=O)OCC 34a_100102712874_100009991533 [0,2,0,0,0,0|1,0,0]=3 15284 B16R0.61 CCOCCOCCOCCCC(=O)OCC 34a_100000210240_100009991533 [0,2,0,0,0,0|1,0,0]=3 15285 B16R0.61 CCOCCOCCOCCCC(=O)OCC 7a_100000210240_100011215271 [0,2,0,0,0,0|1,0,0]=3 15286 B16R0.61 CCOCCOCCOCCCC(=O)OCC 7a_100012001163_100011211534 [0,2,0,0,0,0|1,0,0]=3 15287 B16R0.61 CCOCCOCCOCCNC(=O)OCC 34a_100000158857_100011211534 [0,2,0,0,0,0|2,0,0]=4 15288 B16R0.61 CCOCCOCCOCCNC(=O)OCC 7a_100000210240_200011445536 [0,2,0,0,0,0|2,0,0]=4 15289 B16R0.61 CCOCCOCCSCCCC(=O)OCC 62a_100009991533_100011211534 [0,2,0,0,0,0|1,0,0]=3 15290 B16R0.61 CCOCCOCCSCCCC(=O)OCC 62a_100011211534_100009991533 [0,2,0,0,0,0|1,0,0]=3 15291 B16R0.61 CCOCCOCCSCCNC(=O)OCC 62a_100011211534_200011445536 [0,2,0,0,0,0|2,0,0]=4 15292 B16R0.61 CCOCCSCCCCCCC(=O)OCC 62a_100000210147_100009814379 [0,2,0,0,0,0|0,0,0]=2 15293 B16R0.61 CCOCSCCCCCCCC(=O)OCC 62a_100000739092_100009991516 [0,2,0,0,0,0|0,0,0]=2 15294 B16R0.61 CNNC(=O)CCCCCCCCCCCO 22a_100016993582_100000037981 [0,2,0,0,0,0|2,0,0]=4 15295 B16R0.61 CNNC(=O)NCCCCCCCCCCO 273464a_100000066964_100016993582 [0,2,0,0,0,0|2,0,0]=4 15296 B16R0.61 CNNC(=O)NCCCCCCCCCCO 512a_100000066964_100016993582 [0,2,0,0,0,0|2,0,0]=4 15297 B16R0.61 CNNC(=O)NCCCCCCCCCCO 512a_100016993582_100000066964 [0,2,0,0,0,0|2,0,0]=4 15298 B16R0.61 COCC(=O)CCCCCCCCCCCO 1458a_100000210968_100009812471 [0,2,0,0,0,0|2,0,0]=4 15299 B16R0.61 COCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000210968 [0,2,0,0,0,0|2,0,0]=4 15300 B16R0.61 CSCC(=O)CCCCCCCCCCCO 1458a_100000184570_100009812471 [0,2,0,0,0,0|2,0,0]=4 15301 B16R0.61 CSCC(=O)NCCCCCCCCCCO 240690a_100000066964_100000184570 [0,2,0,0,0,0|2,0,0]=4 15302 B16R0.61 NCCCCCCCCCOCC(=O)NCO 34a_100000078944_100000185155 [0,2,0,0,0,0|2,0,0]=4 15303 B16R0.61 O=C(CCO)CCCCCCCCCCCO 1458a_100011216618_100009812471 [0,2,0,0,0,0|2,0,0]=4 15304 B16R0.61 O=C(CCO)NCCCCCCCCCCO 240690a_100000066964_100011216618 [0,2,0,0,0,0|2,0,0]=4 15305 B16R0.61 O=C(CNCCCCCCCCCO)NCO 2230a_100000078944_100000185155 [0,2,0,0,0,0|2,0,0]=4 15306 B16R0.61 O=C(CNCCCCCCCCCO)NCO 34a_100000078944_100000185155 [0,2,0,0,0,0|2,0,0]=4 15307 B16R0.61 O=C(COCCCCCCCCCBr)NCO 34a_100009813782_100000185155 [0,2,0,0,0,0|2,0,0]=4 15308 B16R0.61 O=C(COCCCCCCCCCBr)NCO 7a_100009813782_100000185155 [0,2,0,0,0,0|2,0,0]=4 15309 B16R0.61 O=C(COCCCCCCCCCCl)NCO 34a_100009868337_100000185155 [0,2,0,0,0,0|2,0,0]=4 15310 B16R0.61 O=C(COCCCCCCCCCCl)NCO 7a_100009868337_100000185155 [0,2,0,0,0,0|2,0,0]=4 15311 B16R0.61 O=C(CSCCCCCCCCCO)NCO 62a_100000185155_100009813782 [0,2,0,0,0,0|2,0,0]=4 15312 B16R0.61 O=C(CSCCCCCCCCCO)NCO 62a_100009813782_100000185155 [0,2,0,0,0,0|2,0,0]=4 15313 B16R0.97 C#CCC(=O)CCCCCCCC(=O)OCC 1458a_100011220946_100009991516 [0,2,0,0,0,0|0,0,2]=4 15314 B16R0.97 C#CCC(C)OCCCCCCC(=O)OCC 34a_100000685586_100009814379 [0,2,0,0,0,0|0,0,2]=4 15315 B16R0.97 C#CCC(C)OCCCCCCC(=O)OCC 7a_100000685586_100009814379 [0,2,0,0,0,0|0,0,2]=4 15316 B16R0.97 C#CCN(C)CCCCCCCC(=O)OCC 2230a_100000225692_100009991516 [0,2,0,0,0,0|0,0,2]=4 15317 B16R0.97 C#CCN(C)CCCCCCCC(=O)OCC 34a_100000225692_100009991516 [0,2,0,0,0,0|0,0,2]=4 15318 B16R0.97 C/C=C/C(C)OCCCCCCC(=O)OCC 34a_200102604097_100009814379 [0,2,0,0,0,0|0,0,2]=4 15319 B16R0.97 C=CCC(=O)CCCCCCCC(=O)OCC 1458a_100000210193_100009991516 [0,2,0,0,0,0|0,0,2]=4 15320 B16R0.97 C=CCC(C)COCCCCCC(=O)OCC 34a_100009832082_100000755133 [0,2,0,0,0,0|0,0,2]=4 15321 B16R0.97 C=CCC(C)COCCCCCC(=O)OCC 7a_100009832082_100000755133 [0,2,0,0,0,0|0,0,2]=4 15322 B16R0.97 C=CCN(C)CCCCCCCC(=O)OCC 2230a_100000225617_100009991516 [0,2,0,0,0,0|0,0,2]=4 15323 B16R0.97 C=CCN(C)CCCCCCCC(=O)OCC 269982a_100000225617_100009991516 [0,2,0,0,0,0|0,0,2]=4 15324 B16R0.97 C=CC[C@@H](C)OCCCCCCC(=O)OCC 34a_100000731007_100009814379 [0,2,0,0,0,0|0,0,2]=4 15325 B16R0.97 C=CC[C@@H](C)OCCCCCCC(=O)OCC 7a_100000731007_100009814379 [0,2,0,0,0,0|0,0,2]=4 15326 B16R0.97 C=CC[C@@H](N)COCCCCCC(=O)OCC 34a_100020615467_100000755133 [0,2,0,0,0,0|0,0,2]=4 15327 B16R0.97 CC#CC(=O)CCCCCCCC(=O)OCC 1458a_100000763181_100009991516 [0,2,0,0,0,0|0,0,2]=4 15328 B16R0.97 CC#CC(C)OCCCCCCC(=O)OCC 34a_100011216543_100009814379 [0,2,0,0,0,0|0,0,2]=4 15329 B16R0.97 CC=CC(=O)CCCCCCCC(=O)OCC 1458a_100000210699_100009991516 [0,2,0,0,0,0|0,0,2]=4 15330 B16R0.97 CCCC(=O)CCCCCCCC(=O)OCC 1458a_100000211992_100009991516 [0,2,0,0,0,0|0,0,0]=2 15331 B16R0.97 CCCC(=O)COCCCCCC(=O)OCC 7a_100011214988_100000747444 [0,2,0,0,0,0|0,0,1]=3 15332 B16R0.97 CCCC(=O)CSCCCCCC(=O)OCC 62a_100000747444_100000755133 [0,2,0,0,0,0|0,0,1]=3 15333 B16R0.97 CCCC(=O)CSCCCCCC(=O)OCC 62a_100000755133_100000747444 [0,2,0,0,0,0|0,0,1]=3 15334 B16R0.97 CCCC(=O)CSCCCOCC(=O)OCC 62a_100000747444_100009893628 [0,2,0,0,0,0|1,0,1]=4 15335 B16R0.97 CCCC(=O)CSCCCOCC(=O)OCC 62a_100009893628_100000747444 [0,2,0,0,0,0|1,0,1]=4 15336 B16R0.97 CCCC(=O)NCCCCCCC(=O)OCC 188690a_100000741137_100000211992 [0,2,0,0,0,0|0,0,1]=3 15337 B16R0.97 CCCC(=O)OCSCCCCC(=O)OCC 62a_100000750268_100000034017 [0,2,0,0,0,0|1,0,1]=4 15338 B16R0.97 CCCC(C)CCCOC/C=C/C(=O)OCC 34a_100011713154_100016267167 [0,2,0,0,0,0|0,0,2]=4 15339 B16R0.97 CCCC(C)CCCOC/C=C/C(=O)OCC 7a_100011713154_100016267167 [0,2,0,0,0,0|0,0,2]=4 15340 B16R0.97 CCCC(C)CCCOCCCC(=O)OCC 34a_100011713154_100009991533 [0,2,0,0,0,0|0,0,0]=2 15341 B16R0.97 CCCC(C)CCCOCCCC(=O)OCC 7a_100011713154_100011215271 [0,2,0,0,0,0|0,0,0]=2 15342 B16R0.97 CCCC(C)CCCOCCNC(=O)OCC 7a_100011713154_200011445536 [0,2,0,0,0,0|1,0,0]=3 15343 B16R0.97 CCCC(C)CCOCCCCC(=O)OCC 34a_100011217855_100000750268 [0,2,0,0,0,0|0,0,0]=2 15344 B16R0.97 CCCC(C)CCOCCCCC(=O)OCC 7a_100011217855_100000750268 [0,2,0,0,0,0|0,0,0]=2 15345 B16R0.97 CCCC(C)CCOCCOCC(=O)OCC 34a_100011217855_100000088970 [0,2,0,0,0,0|1,0,0]=3 15346 B16R0.97 CCCC(C)CCOCCOCC(=O)OCC 7a_100011217855_100000088970 [0,2,0,0,0,0|1,0,0]=3 15347 B16R0.97 CCCC(C)COCCCCCC(=O)OCC 34a_100000688023_100000755133 [0,2,0,0,0,0|0,0,0]=2 15348 B16R0.97 CCCC(C)COCCCCCC(=O)OCC 7a_100000688023_100000755133 [0,2,0,0,0,0|0,0,0]=2 15349 B16R0.97 CCCC(C)COCCCCCC(=O)OCC 7a_100011214988_100011216630 [0,2,0,0,0,0|0,0,0]=2 15350 B16R0.97 CCCC(C)COCCCOCC(=O)OCC 34a_100000688023_100009893628 [0,2,0,0,0,0|1,0,0]=3 15351 B16R0.97 CCCC(C)COCCCOCC(=O)OCC 7a_100000688023_100009893628 [0,2,0,0,0,0|1,0,0]=3 15352 B16R0.97 CCCC(C)CSCCCCCC(=O)OCC 62a_100000755133_100011216630 [0,2,0,0,0,0|0,0,0]=2 15353 B16R0.97 CCCC(C)CSCCCCCC(=O)OCC 62a_100011216630_100000755133 [0,2,0,0,0,0|0,0,0]=2 15354 B16R0.97 CCCC(C)CSCCCOCC(=O)OCC 62a_100009893628_100011216630 [0,2,0,0,0,0|1,0,0]=3 15355 B16R0.97 CCCC(C)CSCCCOCC(=O)OCC 62a_100011216630_100009893628 [0,2,0,0,0,0|1,0,0]=3 15356 B16R0.97 CCCC(C)NCCCCCCC(=O)OCC 2230a_100000741246_100009814379 [0,2,0,0,0,0|0,0,0]=2 15357 B16R0.97 CCCC(C)OCCCCCCC(=O)OCC 34a_100000764384_100009814379 [0,2,0,0,0,0|0,0,0]=2 15358 B16R0.97 CCCC(C)OCCCCCCC(=O)OCC 7a_100000764384_100009814379 [0,2,0,0,0,0|0,0,0]=2 15359 B16R0.97 CCCC(C)SCCCCCCC(=O)OCC 62a_100000766640_100009814379 [0,2,0,0,0,0|0,0,0]=2 15360 B16R0.97 CCCN(C)CCCCCCCC(=O)OCC 2230a_100000747261_100009991516 [0,2,0,0,0,0|0,0,0]=2 15361 B16R0.97 CCCN(C)CCCCCCCC(=O)OCC 269982a_100000747261_100009991516 [0,2,0,0,0,0|0,0,0]=2 15362 B16R0.97 CCC[C@H](N)CCOCCCCC(=O)OCC 34a_100015193777_100000750268 [0,2,0,0,0,0|0,0,0]=2 15363 B16R0.97 CCC[C@H](N)CCOCCOCC(=O)OCC 34a_100015193777_100000088970 [0,2,0,0,0,0|1,0,0]=3 15364 B16R0.97 CCC[C@H](N)COCCCCCC(=O)OCC 34a_100000732646_100000755133 [0,2,0,0,0,0|0,0,0]=2 15365 B16R0.97 CCC[C@H](N)COCCCOCC(=O)OCC 34a_100000732646_100009893628 [0,2,0,0,0,0|1,0,0]=3 15366 B16R0.97 CCNC(=O)CCNCCCCC(=O)OCC 34a_100025743525_100000750268 [0,2,0,0,0,0|1,0,1]=4 15367 B16R0.97 CCNC(=O)CCSCCCCC(=O)OCC 62a_100000737597_100000750268 [0,2,0,0,0,0|1,0,1]=4 15368 B16R0.97 CCNC(=O)CCSCCCCC(=O)OCC 62a_100000750268_100000737597 [0,2,0,0,0,0|1,0,1]=4 15369 B16R0.97 CCNC(=O)CNCCCCCC(=O)OCC 2230a_100016988866_100000755133 [0,2,0,0,0,0|1,0,1]=4 15370 B16R0.97 CCNC(=O)COCCCCCC(=O)OCC 7a_100011214988_100000183381 [0,2,0,0,0,0|1,0,1]=4 15371 B16R0.97 CCNC(=O)CSCCCCCC(=O)OCC 62a_100000183381_100000755133 [0,2,0,0,0,0|1,0,1]=4 15372 B16R0.97 CCNC(=O)CSCCCCCC(=O)OCC 62a_100000755133_100000183381 [0,2,0,0,0,0|1,0,1]=4 15373 B16R0.97 CCOC(=O)CCCCCCCC(=O)CC#N 1458a_100051588842_100009991516 [0,2,0,0,0,0|0,0,2]=4 15374 B16R0.97 CCOC(=O)CCCCCCCC(=O)CCO 1458a_100011216618_100009991516 [0,2,0,0,0,0|0,0,1]=3 15375 B16R0.97 CCOC(=O)CCCCCCCC(=O)COC 1458a_100000210968_100009991516 [0,2,0,0,0,0|0,0,1]=3 15376 B16R0.97 CCOC(=O)CCCCCCCC(=O)CSC 1458a_100000184570_100009991516 [0,2,0,0,0,0|0,0,1]=3 15377 B16R0.97 CCOC(=O)CCCCCCCN(C)CC#N 2230a_100000748184_100009991516 [0,2,0,0,0,0|1,0,1]=4 15378 B16R0.97 CCOC(=O)CCCCCCCN(C)CCO 2230a_100000210263_100009991516 [0,2,0,0,0,0|1,0,0]=3 15379 B16R0.97 CCOC(=O)CCCCCCCN(C)CCO 269982a_100000210263_100009991516 [0,2,0,0,0,0|1,0,0]=3 15380 B16R0.97 CCOC(=O)CCCCCCNC(=O)COC 188690a_100000741137_100000210968 [0,2,0,0,0,0|1,0,1]=4 15381 B16R0.97 CCOC(=O)CCCCCCNC(=O)CSC 188690a_100000741137_100000184570 [0,2,0,0,0,0|1,0,1]=4 15382 B16R0.97 CCOC(=O)CCCCCCN[C@@H](C)CC#N 2230a_100016994482_100009814379 [0,2,0,0,0,0|1,0,1]=4 15383 B16R0.97 CCOC(=O)CCCCCCN[C@H](C)CCO 2230a_100000706166_100009814379 [0,2,0,0,0,0|1,0,0]=3 15384 B16R0.97 CCOC(=O)CCCCCCN[C@H](C)CCO 34a_100000706166_100009814379 [0,2,0,0,0,0|1,0,0]=3 15385 B16R0.97 CCOC(=O)CCCCCCN[C@H](C)COC 2230a_100000764878_100009814379 [0,2,0,0,0,0|1,0,0]=3 15386 B16R0.97 CCOC(=O)CCCCCCOC(C)CCBr 34a_100012276601_100009814379 [0,2,0,0,0,0|1,0,0]=3 15387 B16R0.97 CCOC(=O)CCCCCCO[C@H](C)COC 34a_100011934205_100009814379 [0,2,0,0,0,0|1,0,0]=3 15388 B16R0.97 CCOC(=O)CCCCCCSC(C)CC#N 62a_100009813641_100009814379 [0,2,0,0,0,0|1,0,1]=4 15389 B16R0.97 CCOC(=O)CCCCCCSC(C)CCO 62a_100009893172_100009814379 [0,2,0,0,0,0|1,0,0]=3 15390 B16R0.97 CCOC(=O)CCCCCCSC(C)COC 62a_100000765312_100009814379 [0,2,0,0,0,0|1,0,0]=3 15391 B16R0.97 CCOC(=O)CCCCCNCC(O)COC 2230a_100000756049_100000755133 [0,2,0,0,0,0|1,0,0]=3 15392 B16R0.97 CCOC(=O)CCCCCNCC(O)COC 34a_100000756049_100000755133 [0,2,0,0,0,0|1,0,0]=3 15393 B16R0.97 CCOC(=O)CCCCCOCC(=O)OCC 7a_100011214988_100000188475 [0,2,0,0,0,0|1,0,1]=4 15394 B16R0.97 CCOC(=O)CCCCCOCC(C)CCN 34a_106354213184_100000755133 [0,2,0,0,0,0|1,0,0]=3 15395 B16R0.97 CCOC(=O)CCCCCOCC(N)COC 34a_100000724102_100000755133 [0,2,0,0,0,0|1,0,0]=3 15396 B16R0.97 CCOC(=O)CCCCCOCC(O)COC 7a_100011214988_100011215053 [0,2,0,0,0,0|1,0,0]=3 15397 B16R0.97 CCOC(=O)CCCCCOC[C@@H](O)CC#N 7a_100011214988_100000001066 [0,2,0,0,0,0|1,0,1]=4 15398 B16R0.97 CCOC(=O)CCCCCSCC(=O)OCC 62a_100000188475_100000755133 [0,2,0,0,0,0|1,0,1]=4 15399 B16R0.97 CCOC(=O)CCCCCSCC(=O)OCC 62a_100000755133_100000188475 [0,2,0,0,0,0|1,0,1]=4 15400 B16R0.97 CCOC(=O)CCCCCSCC(O)COC 62a_100000755133_100011215053 [0,2,0,0,0,0|1,0,0]=3 15401 B16R0.97 CCOC(=O)CCCCCSCC(O)COC 62a_100011215053_100000755133 [0,2,0,0,0,0|1,0,0]=3 15402 B16R0.97 CCOC(=O)CCCCCSC[C@@H](O)CC#N 62a_100000001066_100000755133 [0,2,0,0,0,0|1,0,1]=4 15403 B16R0.97 CCOC(=O)CCCCCSC[C@@H](O)CC#N 62a_100000755133_100000001066 [0,2,0,0,0,0|1,0,1]=4 15404 B16R0.97 CCOC(=O)CCCCSCCC(=O)OCC 62a_100000750268_100000765890 [0,2,0,0,0,0|1,0,1]=4 15405 B16R0.97 CCOC(=O)CCCCSCCC(=O)OCC 62a_100000765890_100000750268 [0,2,0,0,0,0|1,0,1]=4 15406 B16R0.97 CCOC(=O)CCCOCCCC(=O)OCC 7a_100012001163_100011215271 [0,2,0,0,0,0|1,0,1]=4 15407 B16R0.97 CCOC(=O)CCCSCCCC(=O)OCC 62a_100009991533_100009991533 [0,2,0,0,0,0|1,0,1]=4 15408 B16R0.97 CCOC(=O)COCCCNCC(O)COC 2230a_100000756049_100009893628 [0,2,0,0,0,0|2,0,0]=4 15409 B16R0.97 CCOC(=O)COCCCNCC(O)COC 34a_100000756049_100009893628 [0,2,0,0,0,0|2,0,0]=4 15410 B16R0.97 CCOC(=O)COCCCOCC(C)CCN 34a_106354213184_100009893628 [0,2,0,0,0,0|2,0,0]=4 15411 B16R0.97 CCOC(=O)COCCCOCC(N)COC 34a_100000724102_100009893628 [0,2,0,0,0,0|2,0,0]=4 15412 B16R0.97 CCOC(=O)COCCCSCC(O)COC 62a_100009893628_100011215053 [0,2,0,0,0,0|2,0,0]=4 15413 B16R0.97 CCOC(=O)COCCCSCC(O)COC 62a_100011215053_100009893628 [0,2,0,0,0,0|2,0,0]=4 15414 B16R0.154 C#CCCCCCCCC(=O)CC(=O)OCC 1458a_100000087357_100000188475 [0,2,0,0,0,0|0,0,2]=4 15415 B16R0.154 C#CCCCCCCCC(=O)CC(=O)OCC 1458a_100000243816_100153394163 [0,2,0,0,0,0|0,0,2]=4 15416 B16R0.154 C#CCCCCCCCN(C)CC(=O)OCC 2230a_100000220588_100153394163 [0,2,0,0,0,0|0,0,2]=4 15417 B16R0.154 C#CCCCCCCOC(C)CC(=O)OCC 7a_100011217361_100009817359 [0,2,0,0,0,0|0,0,2]=4 15418 B16R0.154 C#CCCCCCCO[C@H](C)CC(=O)OCC 7a_100009816390_100012276617 [0,2,0,0,0,0|0,0,2]=4 15419 B16R0.154 C#CCCCCCCSC(C)CC(=O)OCC 62a_100009817359_100012276617 [0,2,0,0,0,0|0,0,2]=4 15420 B16R0.154 C#CCCCCCCSC(C)CC(=O)OCC 62a_100012276617_100009817359 [0,2,0,0,0,0|0,0,2]=4 15421 B16R0.154 C#CCCCCCOC[C@@H](O)CC(=O)OCC 34a_100000766912_100000688340 [0,2,0,0,0,0|0,0,2]=4 15422 B16R0.154 C#CCCCCCOC[C@@H](O)CC(=O)OCC 7a_100000766912_100000688340 [0,2,0,0,0,0|0,0,2]=4 15423 B16R0.154 C#CCCCCCSC[C@@H](O)CC(=O)OCC 62a_100000688340_100012094781 [0,2,0,0,0,0|0,0,2]=4 15424 B16R0.154 C#CCCCCCSC[C@@H](O)CC(=O)OCC 62a_100012094781_100000688340 [0,2,0,0,0,0|0,0,2]=4 15425 B16R0.154 C=CCCCCCCCC(=O)CC(=O)OCC 1458a_100000243816_100012355270 [0,2,0,0,0,0|0,0,2]=4 15426 B16R0.154 C=CCCCCCCCC(=O)CC(=O)OCC 1458a_100011216160_100000188475 [0,2,0,0,0,0|0,0,2]=4 15427 B16R0.154 C=CCCCCCCCN(C)CC(=O)OCC 2230a_100000220588_100012355270 [0,2,0,0,0,0|0,0,2]=4 15428 B16R0.154 C=CCCCCCCOC(C)CC(=O)OCC 7a_200011216477_100009817359 [0,2,0,0,0,0|0,0,2]=4 15429 B16R0.154 C=CCCCCCCO[C@H](C)CC(=O)OCC 7a_100009816390_100011215473 [0,2,0,0,0,0|0,0,2]=4 15430 B16R0.154 C=CCCCCCCSC(C)CC(=O)OCC 62a_100009817359_100011215473 [0,2,0,0,0,0|0,0,2]=4 15431 B16R0.154 C=CCCCCCCSC(C)CC(=O)OCC 62a_100011215473_100009817359 [0,2,0,0,0,0|0,0,2]=4 15432 B16R0.154 C=CCCCCCOC[C@@H](O)CC(=O)OCC 34a_100011216702_100000688340 [0,2,0,0,0,0|0,0,2]=4 15433 B16R0.154 C=CCCCCCOC[C@@H](O)CC(=O)OCC 7a_100011216702_100000688340 [0,2,0,0,0,0|0,0,2]=4 15434 B16R0.154 C=CCCCCCSC[C@@H](O)CC(=O)OCC 62a_100000688340_100000700193 [0,2,0,0,0,0|0,0,2]=4 15435 B16R0.154 C=CCCCCCSC[C@@H](O)CC(=O)OCC 62a_100000700193_100000688340 [0,2,0,0,0,0|0,0,2]=4 15436 B16R0.154 C=COC(=O)CC(=O)CCCCCCCCC 1458a_100000210558_100000036128 [0,2,0,0,0,0|0,0,2]=4 15437 B16R0.154 C=COC(=O)CN(C)CCCCCCCCC 2230a_100000232482_100000036128 [0,2,0,0,0,0|0,0,2]=4 15438 B16R0.154 C=COC(=O)CN(C)CCCCCCCCC 269982a_100000232482_100000036128 [0,2,0,0,0,0|0,0,2]=4 15439 B16R0.154 CC/C=C/CCCOC[C@@H](O)CC(=O)OCC 34a_100016287902_100000688340 [0,2,0,0,0,0|0,0,2]=4 15440 B16R0.154 CC/C=C/CCCOC[C@@H](O)CC(=O)OCC 7a_100016287902_100000688340 [0,2,0,0,0,0|0,0,2]=4 15441 B16R0.154 CC/C=C\CCCCOC(C)CC(=O)OCC 7a_100016287862_100009817359 [0,2,0,0,0,0|0,0,2]=4 15442 B16R0.154 CCCC#CCCOC[C@@H](O)CC(=O)OCC 34a_100000042726_100000688340 [0,2,0,0,0,0|0,0,2]=4 15443 B16R0.154 CCCC#CCCOC[C@@H](O)CC(=O)OCC 7a_100000042726_100000688340 [0,2,0,0,0,0|0,0,2]=4 15444 B16R0.154 CCCC/C=C/COC[C@@H](O)CC(=O)OCC 34a_200016272032_100000688340 [0,2,0,0,0,0|0,0,2]=4 15445 B16R0.154 CCCC/C=C/COC[C@@H](O)CC(=O)OCC 7a_200016272032_100000688340 [0,2,0,0,0,0|0,0,2]=4 15446 B16R0.154 CCCC/C=C\CCOC(C)CC(=O)OCC 7a_200016286491_100009817359 [0,2,0,0,0,0|0,0,2]=4 15447 B16R0.154 CCCCC#CCCCC(=O)CC(=O)OCC 1458a_100000243816_200000047210 [0,2,0,0,0,0|0,0,2]=4 15448 B16R0.154 CCCCC#CCCCN(C)CC(=O)OCC 2230a_100000220588_200000047210 [0,2,0,0,0,0|0,0,2]=4 15449 B16R0.154 CCCCC#CCCOC(C)CC(=O)OCC 7a_100000037610_100009817359 [0,2,0,0,0,0|0,0,2]=4 15450 B16R0.154 CCCCC#CCOC[C@@H](O)CC(=O)OCC 34a_200000034558_100000688340 [0,2,0,0,0,0|0,0,2]=4 15451 B16R0.154 CCCCC#CCOC[C@@H](O)CC(=O)OCC 7a_200000034558_100000688340 [0,2,0,0,0,0|0,0,2]=4 15452 B16R0.154 CCCCC/C=C/CCC(=O)CC(=O)OCC 1458a_200015255902_100000188475 [0,2,0,0,0,0|0,0,2]=4 15453 B16R0.154 CCCCC/C=C/COC(C)CC(=O)OCC 7a_100016258190_100009817359 [0,2,0,0,0,0|0,0,2]=4 15454 B16R0.154 CCCCCC#CCOC(C)CC(=O)OCC 7a_200000033628_100009817359 [0,2,0,0,0,0|0,0,2]=4 15455 B16R0.154 CCCCCC#CCO[C@H](C)CC(=O)OCC 7a_100009816390_100009816472 [0,2,0,0,0,0|0,0,2]=4 15456 B16R0.154 CCCCCC#CCSC(C)CC(=O)OCC 62a_100009816472_100009817359 [0,2,0,0,0,0|0,0,2]=4 15457 B16R0.154 CCCCCC#CCSC(C)CC(=O)OCC 62a_100009817359_100009816472 [0,2,0,0,0,0|0,0,2]=4 15458 B16R0.154 CCCCCC/C=C/CC(=O)CC(=O)OCC 1458a_100020681715_100000188475 [0,2,0,0,0,0|0,0,2]=4 15459 B16R0.154 CCCCCCCC=CC(=O)CC(=O)OCC 1458a_200015332781_100000188475 [0,2,0,0,0,0|0,0,2]=4 15460 B16R0.154 CCCCCCCCCC(=O)CC(=O)CCC 1458a_100000210558_100000747444 [0,2,0,0,0,0|1,0,0]=3 15461 B16R0.154 CCCCCCCCCC(=O)CC(=O)NCC 1458a_100000210558_100000183381 [0,2,0,0,0,0|1,0,0]=3 15462 B16R0.154 CCCCCCCCCC(=O)CC(=O)NCO 1458a_100000210558_100000185155 [0,2,0,0,0,0|2,0,0]=4 15463 B16R0.154 CCCCCCCCCC(=O)CC(=O)OCC 1458a_100000210558_100000188475 [0,2,0,0,0,0|0,0,0]=2 15464 B16R0.154 CCCCCCCCCC(=O)CC(=O)OCC 1458a_100000243816_100000210670 [0,2,0,0,0,0|0,0,0]=2 15465 B16R0.154 CCCCCCCCCC(=O)CS(=O)CCC 1458a_100011387404_100000210670 [0,2,0,0,0,0|2,0,0]=4 15466 B16R0.154 CCCCCCCCCC(O)CC(=O)NCC 240690a_100015525214_200012339438 [0,2,0,0,0,0|1,0,0]=3 15467 B16R0.154 CCCCCCCCCC(O)CC(=O)NNC 22a_100016993582_200012339438 [0,2,0,0,0,0|2,0,0]=4 15468 B16R0.154 CCCCCCCCCN(C)CC(=O)CCC 2230a_100000232482_100000747444 [0,2,0,0,0,0|1,0,0]=3 15469 B16R0.154 CCCCCCCCCN(C)CC(=O)CCC 269982a_100000232482_100000747444 [0,2,0,0,0,0|1,0,0]=3 15470 B16R0.154 CCCCCCCCCN(C)CC(=O)NCC 2230a_100000232482_100000183381 [0,2,0,0,0,0|1,0,0]=3 15471 B16R0.154 CCCCCCCCCN(C)CC(=O)NCC 2230a_100000741943_100011214924 [0,2,0,0,0,0|1,0,0]=3 15472 B16R0.154 CCCCCCCCCN(C)CC(=O)NCC 269982a_100000232482_100000183381 [0,2,0,0,0,0|1,0,0]=3 15473 B16R0.154 CCCCCCCCCN(C)CC(=O)NCC 269982a_100000741943_100000210670 [0,2,0,0,0,0|1,0,0]=3 15474 B16R0.154 CCCCCCCCCN(C)CC(=O)NCO 2230a_100000232482_100000185155 [0,2,0,0,0,0|2,0,0]=4 15475 B16R0.154 CCCCCCCCCN(C)CC(=O)NCO 269982a_100000232482_100000185155 [0,2,0,0,0,0|2,0,0]=4 15476 B16R0.154 CCCCCCCCCN(C)CC(=O)OCC 2230a_100000220588_100011214924 [0,2,0,0,0,0|0,0,0]=2 15477 B16R0.154 CCCCCCCCCN(C)CC(=O)OCC 2230a_100000232482_100000188475 [0,2,0,0,0,0|0,0,0]=2 15478 B16R0.154 CCCCCCCCCN(C)CC(=O)OCC 269982a_100000232482_100000188475 [0,2,0,0,0,0|0,0,0]=2 15479 B16R0.154 CCCCCCCCNC(=O)CC(=O)OCC 240690a_100000229939_100000243816 [0,2,0,0,0,0|0,0,1]=3 15480 B16R0.154 CCCCCCCCNC(C)CC(=O)OCC 2230a_100000229939_100009817359 [0,2,0,0,0,0|0,0,0]=2 15481 B16R0.154 CCCCCCCCOC(C)CC(=O)OCC 7a_100000210232_100009817359 [0,2,0,0,0,0|0,0,0]=2 15482 B16R0.154 CCCCCCCCO[C@H](C)CC(=O)OCC 7a_100009816390_100000210759 [0,2,0,0,0,0|0,0,0]=2 15483 B16R0.154 CCCCCCCCSC(C)CC(=O)OCC 62a_100000210759_100009817359 [0,2,0,0,0,0|0,0,0]=2 15484 B16R0.154 CCCCCCCCSC(C)CC(=O)OCC 62a_100009817359_100000210317 [0,2,0,0,0,0|0,0,0]=2 15485 B16R0.154 CCCCCCCCSC(C)OC(=O)OCC 62a_100000036008_100000210317 [0,2,0,0,0,0|1,0,0]=3 15486 B16R0.154 CCCCCCCCSC(C)OC(=O)OCC 62a_100000210759_100000036008 [0,2,0,0,0,0|1,0,0]=3 15487 B16R0.154 CCCCCCCNCC(=CC(=O)OCC)C 2230a_100000229938_100135422193 [0,2,0,0,0,0|0,0,2]=4 15488 B16R0.154 CCCCCCCOCC(=CC(=O)OCC)C 34a_100000210272_100135422193 [0,2,0,0,0,0|0,0,2]=4 15489 B16R0.154 CCCCCCCOCC(=CC(=O)OCC)C 7a_100000210272_100135422193 [0,2,0,0,0,0|0,0,2]=4 15490 B16R0.154 CCCCCCCOCC(=O)NC(=O)OCC 7a_100000210272_100000010344 [0,2,0,0,0,0|1,0,1]=4 15491 B16R0.154 CCCCCCCOC[C@@H](O)CC(=O)OCC 34a_100000210272_100000688340 [0,2,0,0,0,0|0,0,0]=2 15492 B16R0.154 CCCCCCCOC[C@@H](O)CC(=O)OCC 7a_100000210272_100000688340 [0,2,0,0,0,0|0,0,0]=2 15493 B16R0.154 CCCCCCCSCC(=CC(=O)OCC)C 62a_100000210614_100135422193 [0,2,0,0,0,0|0,0,2]=4 15494 B16R0.154 CCCCCCCSCC(=CC(=O)OCC)C 62a_100135422193_100000210316 [0,2,0,0,0,0|0,0,2]=4 15495 B16R0.154 CCCCCCCSCC(=O)CC(=O)OCC 62a_100000210311_100000210316 [0,2,0,0,0,0|0,0,1]=3 15496 B16R0.154 CCCCCCCSCC(=O)CC(=O)OCC 62a_100000210614_100000210311 [0,2,0,0,0,0|0,0,1]=3 15497 B16R0.154 CCCCCCCSCC(=O)NC(=O)OCC 62a_100000210614_100000010344 [0,2,0,0,0,0|1,0,1]=4 15498 B16R0.154 CCCCCCCSC[C@@H](O)CC(=O)OCC 62a_100000210614_100000688340 [0,2,0,0,0,0|0,0,0]=2 15499 B16R0.154 CCCCCCCSC[C@@H](O)CC(=O)OCC 62a_100000688340_100000210316 [0,2,0,0,0,0|0,0,0]=2 15500 B16R0.154 CCCCCOCCOC(C)CC(=O)OCC 7a_100011215259_100009817359 [0,2,0,0,0,0|1,0,0]=3 15501 B16R0.154 CCCCOCCCNC(=O)CC(=O)OCC 240690a_200000211371_100000243816 [0,2,0,0,0,0|1,0,1]=4 15502 B16R0.154 CCCCOCCCNC(C)CC(=O)OCC 2230a_200000211371_100009817359 [0,2,0,0,0,0|1,0,0]=3 15503 B16R0.154 CCCCOCCCOC(C)CC(=O)OCC 7a_200011215613_100009817359 [0,2,0,0,0,0|1,0,0]=3 15504 B16R0.154 CCCCOCCOCC(=O)CC(=O)OCC 1458a_100011216887_100000188475 [0,2,0,0,0,0|1,0,1]=4 15505 B16R0.154 CCCCOCCOC[C@@H](O)CC(=O)OCC 34a_100000210238_100000688340 [0,2,0,0,0,0|1,0,0]=3 15506 B16R0.154 CCCCOCCOC[C@@H](O)CC(=O)OCC 7a_100000210238_100000688340 [0,2,0,0,0,0|1,0,0]=3 15507 B16R0.154 CCCCOCCSCC(=O)CC(=O)OCC 62a_100000210311_100000743108 [0,2,0,0,0,0|1,0,1]=4 15508 B16R0.154 CCCCOCCSCC(=O)CC(=O)OCC 62a_100000743108_100000210311 [0,2,0,0,0,0|1,0,1]=4 15509 B16R0.154 CCCCOCCSC[C@@H](O)CC(=O)OCC 62a_100000688340_100000743108 [0,2,0,0,0,0|1,0,0]=3 15510 B16R0.154 CCCCOCCSC[C@@H](O)CC(=O)OCC 62a_100000743108_100000688340 [0,2,0,0,0,0|1,0,0]=3 15511 B16R0.154 CCCCSCCOC[C@@H](O)CC(=O)OCC 34a_200000230436_100000688340 [0,2,0,0,0,0|1,0,0]=3 15512 B16R0.154 CCCCSCCOC[C@@H](O)CC(=O)OCC 7a_200000230436_100000688340 [0,2,0,0,0,0|1,0,0]=3 15513 B16R0.154 CCCOCCCNC[C@@H](O)CC(=O)OCC 34a_100011217757_100000688340 [0,2,0,0,0,0|1,0,0]=3 15514 B16R0.154 CCNC(=O)CN(C)CCCCCCCCO 2230a_100000741943_100000033203 [0,2,0,0,0,0|2,0,0]=4 15515 B16R0.154 CCNC(=O)CN(C)CCCCCCCCO 269982a_100000741943_100000033203 [0,2,0,0,0,0|2,0,0]=4 15516 B16R0.154 CCOC(=O)CC(=O)CCCCCCCCO 1458a_100000243816_100000033203 [0,2,0,0,0,0|0,0,1]=3 15517 B16R0.154 CCOC(=O)CC(=O)CSCCCCCCF 62a_100000210311_100015922095 [0,2,0,0,0,0|1,0,1]=4 15518 B16R0.154 CCOC(=O)CC(=O)CSCCCCCCF 62a_100015922095_100000210311 [0,2,0,0,0,0|1,0,1]=4 15519 B16R0.154 CCOC(=O)CC(=O)CSCCCCCCO 62a_100000210311_100000766143 [0,2,0,0,0,0|1,0,1]=4 15520 B16R0.154 CCOC(=O)CC(=O)CSCCCCCCO 62a_100000766143_100000210311 [0,2,0,0,0,0|1,0,1]=4 15521 B16R0.154 CCOC(=O)CC(=O)NCCCCCCCO 240690a_100011996573_100000243816 [0,2,0,0,0,0|1,0,1]=4 15522 B16R0.154 CCOC(=O)CC(C)NCCCCCCCO 2230a_100011996573_100009817359 [0,2,0,0,0,0|1,0,0]=3 15523 B16R0.154 CCOC(=O)CC(C)NCCCOCCCO 2230a_100011310245_100009817359 [0,2,0,0,0,0|2,0,0]=4 15524 B16R0.154 CCOC(=O)CC(C)NCCCOCCOC 2230a_100000206027_100009817359 [0,2,0,0,0,0|2,0,0]=4 15525 B16R0.154 CCOC(=O)CC(C)OCCCCCCCBr 7a_100000760002_100009817359 [0,2,0,0,0,0|1,0,0]=3 15526 B16R0.154 CCOC(=O)CC(C)OCCCCCCOC 7a_200012092642_100009817359 [0,2,0,0,0,0|1,0,0]=3 15527 B16R0.154 CCOC(=O)CC(C)SCCCCCCC#N 62a_100009813337_100009817359 [0,2,0,0,0,0|1,0,1]=4 15528 B16R0.154 CCOC(=O)CC(C)SCCCCCCC#N 62a_100009817359_100009813337 [0,2,0,0,0,0|1,0,1]=4 15529 B16R0.154 CCOC(=O)CC(C)SCCCCCCCO 62a_100000760002_100009817359 [0,2,0,0,0,0|1,0,0]=3 15530 B16R0.154 CCOC(=O)CC(C)SCCCCCCCO 62a_100009817359_100000760002 [0,2,0,0,0,0|1,0,0]=3 15531 B16R0.154 CCOC(=O)CC(C)SCCCCCCOC 62a_100009817359_100011998445 [0,2,0,0,0,0|1,0,0]=3 15532 B16R0.154 CCOC(=O)CC(C)SCCCCCCOC 62a_100011998445_100009817359 [0,2,0,0,0,0|1,0,0]=3 15533 B16R0.154 CCOC(=O)CC(C)SCCCOCCOC 62a_100009817359_100011216529 [0,2,0,0,0,0|2,0,0]=4 15534 B16R0.154 CCOC(=O)CC(C)SCCCOCCOC 62a_100011216529_100009817359 [0,2,0,0,0,0|2,0,0]=4 15535 B16R0.154 CCOC(=O)CN(C)CCCCCCCCO 2230a_100000220588_100000033203 [0,2,0,0,0,0|1,0,0]=3 15536 B16R0.154 CCOC(=O)C[C@@H](C)OCCCCCCC#N 7a_100009816390_100009813337 [0,2,0,0,0,0|1,0,1]=4 15537 B16R0.154 CCOC(=O)C[C@@H](C)OCCCCCCCO 7a_100009816390_100000760002 [0,2,0,0,0,0|1,0,0]=3 15538 B16R0.154 CCOC(=O)C[C@@H](C)OCCCCCCOC 7a_100009816390_100011998445 [0,2,0,0,0,0|1,0,0]=3 15539 B16R0.154 CCOC(=O)C[C@@H](C)OCCCOCCOC 7a_100009816390_100011216529 [0,2,0,0,0,0|2,0,0]=4 15540 B16R0.154 CCOC(=O)C[C@H](O)CNCCCCCCO 34a_100000686447_100000688340 [0,2,0,0,0,0|1,0,0]=3 15541 B16R0.154 CCOC(=O)C[C@H](O)CNCCCCCOC 34a_100000747528_100000688340 [0,2,0,0,0,0|1,0,0]=3 15542 B16R0.154 CCOC(=O)C[C@H](O)CNCCOCCOC 34a_100000745349_100000688340 [0,2,0,0,0,0|2,0,0]=4 15543 B16R0.154 CCOC(=O)C[C@H](O)COCCCCCCBr 34a_100011215345_100000688340 [0,2,0,0,0,0|1,0,0]=3 15544 B16R0.154 CCOC(=O)C[C@H](O)COCCCCCCBr 7a_100011215345_100000688340 [0,2,0,0,0,0|1,0,0]=3 15545 B16R0.154 CCOC(=O)C[C@H](O)COCCCCCCCl 34a_100000766143_100000688340 [0,2,0,0,0,0|1,0,0]=3 15546 B16R0.154 CCOC(=O)C[C@H](O)COCCCCCCCl 7a_100000766143_100000688340 [0,2,0,0,0,0|1,0,0]=3 15547 B16R0.154 CCOC(=O)C[C@H](O)COCCCCCCF 34a_100000732779_100000688340 [0,2,0,0,0,0|1,0,0]=3 15548 B16R0.154 CCOC(=O)C[C@H](O)COCCCCCCF 7a_100000732779_100000688340 [0,2,0,0,0,0|1,0,0]=3 15549 B16R0.154 CCOC(=O)C[C@H](O)COCCCCCCN 34a_100000686447_100000688340 [0,2,0,0,0,0|1,0,0]=3 15550 B16R0.154 CCOC(=O)C[C@H](O)COCCCCCNC 34a_100000722520_100000688340 [0,2,0,0,0,0|1,0,0]=3 15551 B16R0.154 CCOC(=O)C[C@H](O)COCCOCCNC 34a_100000228057_100000688340 [0,2,0,0,0,0|2,0,0]=4 15552 B16R0.154 CCOC(=O)C[C@H](O)COCCOCCOC 34a_100011215163_100000688340 [0,2,0,0,0,0|2,0,0]=4 15553 B16R0.154 CCOC(=O)C[C@H](O)COCCOCCOC 7a_100011215163_100000688340 [0,2,0,0,0,0|2,0,0]=4 15554 B16R0.154 CCOC(=O)C[C@H](O)CSCCCCCC#N 62a_100000688340_100009813376 [0,2,0,0,0,0|1,0,1]=4 15555 B16R0.154 CCOC(=O)C[C@H](O)CSCCCCCC#N 62a_100009813376_100000688340 [0,2,0,0,0,0|1,0,1]=4 15556 B16R0.154 CCOC(=O)C[C@H](O)CSCCCCCC=O 62a_100000139337_100000688340 [0,2,0,0,0,0|1,0,1]=4 15557 B16R0.154 CCOC(=O)C[C@H](O)CSCCCCCC=O 62a_100000688340_100000139337 [0,2,0,0,0,0|1,0,1]=4 15558 B16R0.154 CCOC(=O)C[C@H](O)CSCCCCCCF 62a_100000688340_100015922095 [0,2,0,0,0,0|1,0,0]=3 15559 B16R0.154 CCOC(=O)C[C@H](O)CSCCCCCCF 62a_100015922095_100000688340 [0,2,0,0,0,0|1,0,0]=3 15560 B16R0.154 CCOC(=O)C[C@H](O)CSCCCCCCO 62a_100000688340_100000766143 [0,2,0,0,0,0|1,0,0]=3 15561 B16R0.154 CCOC(=O)C[C@H](O)CSCCCCCCO 62a_100000766143_100000688340 [0,2,0,0,0,0|1,0,0]=3 15562 B16R0.154 CCOC(=O)C[C@H](O)CSCCOCCOC 62a_100000688340_100000695917 [0,2,0,0,0,0|2,0,0]=4 15563 B16R0.154 CCOC(=O)C[C@H](O)CSCCOCCOC 62a_100000695917_100000688340 [0,2,0,0,0,0|2,0,0]=4 15564 B16R0.154 CCOC(=O)OC(C)SCCCCCCCO 62a_100000036008_100000760002 [0,2,0,0,0,0|2,0,0]=4 15565 B16R0.154 CCOC(=O)OC(C)SCCCCCCCO 62a_100000760002_100000036008 [0,2,0,0,0,0|2,0,0]=4 15566 B16R0.154 CCOC(=O)OC(C)SCCCCCCOC 62a_100000036008_100011998445 [0,2,0,0,0,0|2,0,0]=4 15567 B16R0.154 CCOC(=O)OC(C)SCCCCCCOC 62a_100011998445_100000036008 [0,2,0,0,0,0|2,0,0]=4 15568 B16R0.154 CCOCCOCCNC(C)CC(=O)OCC 2230a_100102712874_100009817359 [0,2,0,0,0,0|2,0,0]=4 15569 B16R0.154 CCOCCOCCOC(C)CC(=O)OCC 7a_100000210240_100009817359 [0,2,0,0,0,0|2,0,0]=4 15570 B16R0.154 CCOCCOCCO[C@H](C)CC(=O)OCC 7a_100009816390_100011211534 [0,2,0,0,0,0|2,0,0]=4 15571 B16R0.154 CCOCCOCCSC(C)CC(=O)OCC 62a_100009817359_100011211534 [0,2,0,0,0,0|2,0,0]=4 15572 B16R0.154 CCOCCOCCSC(C)CC(=O)OCC 62a_100011211534_100009817359 [0,2,0,0,0,0|2,0,0]=4 15573 B16R0.195 C#CCCC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100000753159 [0,2,0,0,0,0|0,0,2]=4 15574 B16R0.195 C#CCCC(=O)CCCCCCC(=O)OCC 1458a_100000692101_100009814379 [0,2,0,0,0,0|0,0,2]=4 15575 B16R0.195 C/C=C/CC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100102629194 [0,2,0,0,0,0|0,0,2]=4 15576 B16R0.195 C=CCCC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100000754431 [0,2,0,0,0,0|0,0,2]=4 15577 B16R0.195 C=CCCC(=O)CCCCCCC(=O)OCC 1458a_100000749702_100009814379 [0,2,0,0,0,0|0,0,2]=4 15578 B16R0.195 C=CCCC(C)OCCCCCC(=O)OCC 34a_100000765329_100000755133 [0,2,0,0,0,0|0,0,2]=4 15579 B16R0.195 C=CCCC(C)OCCCCCC(=O)OCC 7a_100000765329_100000755133 [0,2,0,0,0,0|0,0,2]=4 15580 B16R0.195 C=CCCN(C)CCCCCCC(=O)OCC 2230a_100020639649_100009814379 [0,2,0,0,0,0|0,0,2]=4 15581 B16R0.195 C=CCCN(C)CCCCCCC(=O)OCC 269982a_100020639649_100009814379 [0,2,0,0,0,0|0,0,2]=4 15582 B16R0.195 C=COC(=O)COCCCCC(C)CCCC 34a_200011021034_100000036128 [0,2,0,0,0,0|0,0,2]=4 15583 B16R0.195 CC#CCC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100000748600 [0,2,0,0,0,0|0,0,2]=4 15584 B16R0.195 CC=CCC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100000070051 [0,2,0,0,0,0|0,0,2]=4 15585 B16R0.195 CC=CCC(=O)CCCCCCC(=O)OCC 1458a_100121576822_100009814379 [0,2,0,0,0,0|0,0,2]=4 15586 B16R0.195 CCC#CC(=O)CCCCCCC(=O)OCC 1458a_100011827653_100009814379 [0,2,0,0,0,0|0,0,2]=4 15587 B16R0.195 CCC#CC(C)OCCCCCC(=O)OCC 34a_100000033903_100000755133 [0,2,0,0,0,0|0,0,2]=4 15588 B16R0.195 CCC#CC(C)OCCCCCC(=O)OCC 7a_100000033903_100000755133 [0,2,0,0,0,0|0,0,2]=4 15589 B16R0.195 CCC=CC(=O)CCCCCCC(=O)OCC 1458a_100000212282_100009814379 [0,2,0,0,0,0|0,0,2]=4 15590 B16R0.195 CCCCC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100000210211 [0,2,0,0,0,0|0,0,0]=2 15591 B16R0.195 CCCCC(=O)CCCCCCC(=O)OCC 1458a_100000210183_100009814379 [0,2,0,0,0,0|0,0,0]=2 15592 B16R0.195 CCCCC(=O)NCCCCCC(=O)OCC 188690a_100000062434_100000210183 [0,2,0,0,0,0|0,0,1]=3 15593 B16R0.195 CCCCC(C)CCCCOCC(=O)CCC 7a_200011021034_100000747444 [0,2,0,0,0,0|1,0,0]=3 15594 B16R0.195 CCCCC(C)CCCCOCC(=O)NCC 34a_200011021034_100000183381 [0,2,0,0,0,0|1,0,0]=3 15595 B16R0.195 CCCCC(C)CCCCOCC(=O)NCC 7a_200011021034_100000183381 [0,2,0,0,0,0|1,0,0]=3 15596 B16R0.195 CCCCC(C)CCCCOCC(=O)NCO 34a_200011021034_100000185155 [0,2,0,0,0,0|2,0,0]=4 15597 B16R0.195 CCCCC(C)CCCCOCC(=O)NCO 7a_200011021034_100000185155 [0,2,0,0,0,0|2,0,0]=4 15598 B16R0.195 CCCCC(C)CCCCOCC(=O)OCC 34a_200011021034_100000188475 [0,2,0,0,0,0|0,0,0]=2 15599 B16R0.195 CCCCC(C)CCCCOCC(=O)OCC 7a_200011021034_100000188475 [0,2,0,0,0,0|0,0,0]=2 15600 B16R0.195 CCCCC(C)COCCCCC(=O)OCC 34a_100011995851_100000750268 [0,2,0,0,0,0|0,0,0]=2 15601 B16R0.195 CCCCC(C)COCCCCC(=O)OCC 7a_100011995851_100000750268 [0,2,0,0,0,0|0,0,0]=2 15602 B16R0.195 CCCCC(C)COCCOCC(=O)OCC 34a_100011995851_100000088970 [0,2,0,0,0,0|1,0,0]=3 15603 B16R0.195 CCCCC(C)COCCOCC(=O)OCC 7a_100011995851_100000088970 [0,2,0,0,0,0|1,0,0]=3 15604 B16R0.195 CCCCC(C)NCCCCCC(=O)OCC 2230a_100000126638_100000755133 [0,2,0,0,0,0|0,0,0]=2 15605 B16R0.195 CCCCC(C)NCCCOCC(=O)OCC 2230a_100000126638_100009893628 [0,2,0,0,0,0|1,0,0]=3 15606 B16R0.195 CCCCC(C)OCCCCCC(=O)OCC 34a_100000687866_100000755133 [0,2,0,0,0,0|0,0,0]=2 15607 B16R0.195 CCCCC(C)OCCCCCC(=O)OCC 7a_100000687866_100000755133 [0,2,0,0,0,0|0,0,0]=2 15608 B16R0.195 CCCCC(C)OCCCCCC(=O)OCC 7a_100011214988_200011215066 [0,2,0,0,0,0|0,0,0]=2 15609 B16R0.195 CCCCC(C)OCCCOCC(=O)OCC 34a_100000687866_100009893628 [0,2,0,0,0,0|1,0,0]=3 15610 B16R0.195 CCCCC(C)OCCCOCC(=O)OCC 7a_100000687866_100009893628 [0,2,0,0,0,0|1,0,0]=3 15611 B16R0.195 CCCCC(C)SCCCCCC(=O)OCC 62a_100000755133_200011215066 [0,2,0,0,0,0|0,0,0]=2 15612 B16R0.195 CCCCC(C)SCCCCCC(=O)OCC 62a_200011215066_100000755133 [0,2,0,0,0,0|0,0,0]=2 15613 B16R0.195 CCCCC(C)SCCCOCC(=O)OCC 62a_100009893628_200011215066 [0,2,0,0,0,0|1,0,0]=3 15614 B16R0.195 CCCCC(C)SCCCOCC(=O)OCC 62a_200011215066_100009893628 [0,2,0,0,0,0|1,0,0]=3 15615 B16R0.195 CCCCN(C)CCCCCCC(=O)OCC 2230a_100000207549_100009814379 [0,2,0,0,0,0|0,0,0]=2 15616 B16R0.195 CCCCN(C)CCCCCCC(=O)OCC 269982a_100000207549_100009814379 [0,2,0,0,0,0|0,0,0]=2 15617 B16R0.195 CCCC[C@H](N)COCCCCC(=O)OCC 34a_100011934283_100000750268 [0,2,0,0,0,0|0,0,0]=2 15618 B16R0.195 CCCC[C@H](N)COCCOCC(=O)OCC 34a_100011934283_100000088970 [0,2,0,0,0,0|1,0,0]=3 15619 B16R0.195 CCCNC(=O)CCCCCCC(=O)OCC 11a_100020643023_100000031895 [0,2,0,0,0,0|0,0,1]=3 15620 B16R0.195 CCCNC(=O)CCCCCCC(=O)OCC 1626a_100020643023_100000031895 [0,2,0,0,0,0|0,0,1]=3 15621 B16R0.195 CCCNC(=O)CCCCCCC(=O)OCC 240690a_100020643023_100000031895 [0,2,0,0,0,0|0,0,1]=3 15622 B16R0.195 CCCNC(=O)CCCCCCC(=O)OCC 527a_100020643023_100000031895 [0,2,0,0,0,0|0,0,1]=3 15623 B16R0.195 CCCNC(=O)CCCOCCC(C)CCC 7a_100011217855_100011194427 [0,2,0,0,0,0|2,0,0]=4 15624 B16R0.195 CCCNC(=O)CCCSCCC(=O)OCC 62a_100000765890_100011194427 [0,2,0,0,0,0|1,0,1]=4 15625 B16R0.195 CCCNC(=O)CCCSCCC(=O)OCC 62a_100011194427_100000765890 [0,2,0,0,0,0|1,0,1]=4 15626 B16R0.195 CCCNC(=O)CNCCCCC(=O)OCC 2230a_100000174927_100000750268 [0,2,0,0,0,0|1,0,1]=4 15627 B16R0.195 CCCNC(=O)CSCCCCC(=O)OCC 62a_100000183358_100000750268 [0,2,0,0,0,0|1,0,1]=4 15628 B16R0.195 CCCNC(=O)CSCCCCC(=O)OCC 62a_100000750268_100000183358 [0,2,0,0,0,0|1,0,1]=4 15629 B16R0.195 CCCOC(=O)CSCCCCC(=O)OCC 62a_100000750268_200011215008 [0,2,0,0,0,0|1,0,1]=4 15630 B16R0.195 CCCOC(=O)CSCCCCC(=O)OCC 62a_200011215008_100000750268 [0,2,0,0,0,0|1,0,1]=4 15631 B16R0.195 CCCOC(=O)OCOCCCC(C)CCC 34a_100011713154_200000139673 [0,2,0,0,0,0|2,0,0]=4 15632 B16R0.195 CCCOC(=O)OCOCCCC(C)CCC 7a_100011713154_200000139673 [0,2,0,0,0,0|2,0,0]=4 15633 B16R0.195 CCCOC(C)CNCCCCC(=O)OCC 2230a_100015185124_100000750268 [0,2,0,0,0,0|1,0,0]=3 15634 B16R0.195 CCCOC(C)CNCCCCC(=O)OCC 34a_100015185124_100000750268 [0,2,0,0,0,0|1,0,0]=3 15635 B16R0.195 CCCOC(C)CNCCOCC(=O)OCC 2230a_100015185124_100000088970 [0,2,0,0,0,0|2,0,0]=4 15636 B16R0.195 CCCOC(C)CNCCOCC(=O)OCC 34a_100015185124_100000088970 [0,2,0,0,0,0|2,0,0]=4 15637 B16R0.195 CCOC(=O)CCCCCCC(=O)CCC#N 1458a_100000031895_100011215226 [0,2,0,0,0,0|0,0,2]=4 15638 B16R0.195 CCOC(=O)CCCCCCC(=O)CCC#N 1458a_100011934036_100009814379 [0,2,0,0,0,0|0,0,2]=4 15639 B16R0.195 CCOC(=O)CCCCCCC(=O)CCCF 1458a_100000031895_100011934791 [0,2,0,0,0,0|0,0,1]=3 15640 B16R0.195 CCOC(=O)CCCCCCC(=O)CCCO 1458a_100000031895_100011215043 [0,2,0,0,0,0|0,0,1]=3 15641 B16R0.195 CCOC(=O)CCCCCCC(=O)CCOC 1458a_100000031895_100000233755 [0,2,0,0,0,0|0,0,1]=3 15642 B16R0.195 CCOC(=O)CCCCCCC(=O)CCOC 1458a_100000749529_100009814379 [0,2,0,0,0,0|0,0,1]=3 15643 B16R0.195 CCOC(=O)CCCCCCC(=O)CCSC 1458a_100000031895_100000751147 [0,2,0,0,0,0|0,0,1]=3 15644 B16R0.195 CCOC(=O)CCCCCCC(=O)CCSC 1458a_100000174002_100009814379 [0,2,0,0,0,0|0,0,1]=3 15645 B16R0.195 CCOC(=O)CCCCCCC(=O)CSCC 1458a_100000230394_100009814379 [0,2,0,0,0,0|0,0,1]=3 15646 B16R0.195 CCOC(=O)CCCCCCC(=O)NCCF 11a_100000724931_100000031895 [0,2,0,0,0,0|1,0,1]=4 15647 B16R0.195 CCOC(=O)CCCCCCC(=O)NCCF 1626a_100000724931_100000031895 [0,2,0,0,0,0|1,0,1]=4 15648 B16R0.195 CCOC(=O)CCCCCCC(=O)NCCF 240690a_100000724931_100000031895 [0,2,0,0,0,0|1,0,1]=4 15649 B16R0.195 CCOC(=O)CCCCCCC(=O)NCCF 527a_100000724931_100000031895 [0,2,0,0,0,0|1,0,1]=4 15650 B16R0.195 CCOC(=O)CCCCCCC(=O)NCCO 240690a_100000210304_100000031895 [0,2,0,0,0,0|1,0,1]=4 15651 B16R0.195 CCOC(=O)CCCCCCC(=O)NCCO 527a_100000210304_100000031895 [0,2,0,0,0,0|1,0,1]=4 15652 B16R0.195 CCOC(=O)CCCCCCN(C)CCC#N 2230a_100000184479_100009814379 [0,2,0,0,0,0|1,0,1]=4 15653 B16R0.195 CCOC(=O)CCCCCCN(C)CCCO 2230a_100000213112_100009814379 [0,2,0,0,0,0|1,0,0]=3 15654 B16R0.195 CCOC(=O)CCCCCCN(C)CCCO 269982a_100000213112_100009814379 [0,2,0,0,0,0|1,0,0]=3 15655 B16R0.195 CCOC(=O)CCCCCCN(C)CCOC 2230a_100000743101_100009814379 [0,2,0,0,0,0|1,0,0]=3 15656 B16R0.195 CCOC(=O)CCCCCCN(C)CCOC 269982a_100000743101_100009814379 [0,2,0,0,0,0|1,0,0]=3 15657 B16R0.195 CCOC(=O)CCCCCCN(C)CCSC 2230a_100000686725_100009814379 [0,2,0,0,0,0|1,0,0]=3 15658 B16R0.195 CCOC(=O)CCCCCCN(C)CCSC 269982a_100000686725_100009814379 [0,2,0,0,0,0|1,0,0]=3 15659 B16R0.195 CCOC(=O)CCCCCNC(=O)CCOC 188690a_100000062434_100000749529 [0,2,0,0,0,0|1,0,1]=4 15660 B16R0.195 CCOC(=O)CCCCCNC(=O)CCSC 188690a_100000062434_100000174002 [0,2,0,0,0,0|1,0,1]=4 15661 B16R0.195 CCOC(=O)CCCCCNC(=O)CSCC 188690a_100000062434_100000230394 [0,2,0,0,0,0|1,0,1]=4 15662 B16R0.195 CCOC(=O)CCCCCOC(C)CCCCl 34a_200000718107_100000755133 [0,2,0,0,0,0|1,0,0]=3 15663 B16R0.195 CCOC(=O)CCCCCOC(C)CCCCl 7a_200000718107_100000755133 [0,2,0,0,0,0|1,0,0]=3 15664 B16R0.195 CCOC(=O)CCCCNC[C@H](C)CCCO 2230a_100160569302_100000750268 [0,2,0,0,0,0|1,0,0]=3 15665 B16R0.195 CCOC(=O)CCCCNC[C@H](C)CCCO 34a_100160569302_100000750268 [0,2,0,0,0,0|1,0,0]=3 15666 B16R0.195 CCOC(=O)CCCCOC[C@@H](C)OCOC 34a_100016172286_100000750268 [0,2,0,0,0,0|2,0,0]=4 15667 B16R0.195 CCOC(=O)CCCCOC[C@@H](C)OCOC 7a_100016172286_100000750268 [0,2,0,0,0,0|2,0,0]=4 15668 B16R0.195 CCOC(=O)CCCCOC[C@@H](N)CCSC 34a_100011827619_100000750268 [0,2,0,0,0,0|1,0,0]=3 15669 B16R0.195 CCOC(=O)COCCCOC(C)CCCCl 34a_200000718107_100009893628 [0,2,0,0,0,0|2,0,0]=4 15670 B16R0.195 CCOC(=O)COCCCOC(C)CCCCl 7a_200000718107_100009893628 [0,2,0,0,0,0|2,0,0]=4 15671 B16R0.195 CCOC(=O)COCCNC[C@H](C)CCCO 2230a_100160569302_100000088970 [0,2,0,0,0,0|2,0,0]=4 15672 B16R0.195 CCOC(=O)COCCNC[C@H](C)CCCO 34a_100160569302_100000088970 [0,2,0,0,0,0|2,0,0]=4 15673 B16R0.195 CCOC(=O)COCCOC[C@@H](N)CCSC 34a_100011827619_100000088970 [0,2,0,0,0,0|2,0,0]=4 15674 B16R0.195 CCOCC(=O)CCCCCCC(=O)OCC 1458a_100000211967_100009814379 [0,2,0,0,0,0|0,0,1]=3 15675 B16R0.195 CCOCC(=O)NCCCCCC(=O)OCC 188690a_100000062434_100000211967 [0,2,0,0,0,0|1,0,1]=4 15676 B16R0.195 CCOCC(C)OCCCCCC(=O)OCC 34a_100000718985_100000755133 [0,2,0,0,0,0|1,0,0]=3 15677 B16R0.195 CCOCC(C)OCCCCCC(=O)OCC 7a_100000718985_100000755133 [0,2,0,0,0,0|1,0,0]=3 15678 B16R0.195 CCOCC(C)OCCCOCC(=O)OCC 34a_100000718985_100009893628 [0,2,0,0,0,0|2,0,0]=4 15679 B16R0.195 CCOCC(C)OCCCOCC(=O)OCC 7a_100000718985_100009893628 [0,2,0,0,0,0|2,0,0]=4 15680 B16R0.195 CCOCC(O)CNCCCCC(=O)OCC 2230a_102515437182_100000750268 [0,2,0,0,0,0|1,0,0]=3 15681 B16R0.195 CCOCC(O)CNCCCCC(=O)OCC 34a_102515437182_100000750268 [0,2,0,0,0,0|1,0,0]=3 15682 B16R0.195 CCOCC(O)CNCCOCC(=O)OCC 2230a_102515437182_100000088970 [0,2,0,0,0,0|2,0,0]=4 15683 B16R0.195 CCOCC(O)CNCCOCC(=O)OCC 34a_102515437182_100000088970 [0,2,0,0,0,0|2,0,0]=4 15684 B16R0.220 CCCCCCCCCNCC(CC)OCC 2230a_100015183923_100011214924 [0,2,0,0,0,0|1,0,1]=4 15685 B16R0.220 CCCCCCCCCNCC(CC)OCC 34a_100015183923_100011214924 [0,2,0,0,0,0|1,0,1]=4 15686 B16R0.661 C#CCCC(=O)CCCCCCCCCCC 1458a_100000210736_100000753159 [0,2,0,0,0,0|1,0,1]=4 15687 B16R0.661 C#CCCC(=O)CCCCCCCCCCC 1458a_100000692101_100011215454 [0,2,0,0,0,0|1,0,1]=4 15688 B16R0.661 C#CCCC(=O)CCCCCCCCCCO 1458a_100000692101_100009813290 [0,2,0,0,0,0|1,0,1]=4 15689 B16R0.661 C#CCCC(=O)CCOCCCCCCCC 34a_100011064465_100000210759 [0,2,0,0,0,0|1,0,1]=4 15690 B16R0.661 C#CCCC(=O)CCOCCCCCCCC 7a_100011064465_100000210759 [0,2,0,0,0,0|1,0,1]=4 15691 B16R0.661 C#CCCC(=O)NCCCCCCCCCC 11a_100000684558_100000692101 [0,2,0,0,0,0|1,0,1]=4 15692 B16R0.661 C#CCCC(=O)NCCCCCCCCCC 1626a_100000684558_100000692101 [0,2,0,0,0,0|1,0,1]=4 15693 B16R0.661 C#CCCC(=O)NCCCCCCCCCC 240690a_100000684558_100000692101 [0,2,0,0,0,0|1,0,1]=4 15694 B16R0.661 C#CCCC(=O)NCCCCCCCCCC 527a_100000684558_100000692101 [0,2,0,0,0,0|1,0,1]=4 15695 B16R0.661 C#CCCCCCCCOCC(=O)OCCC 34a_100000054614_200011215008 [0,2,0,0,0,0|0,0,2]=4 15696 B16R0.661 C#CCCCCCCCOCC(=O)OCCC 7a_100000054614_200011215008 [0,2,0,0,0,0|0,0,2]=4 15697 B16R0.661 C#CCCCCCCCSCC(=O)OCCC 62a_100153394163_200011215008 [0,2,0,0,0,0|0,0,2]=4 15698 B16R0.661 C#CCCCCCCCSCC(=O)OCCC 62a_200011215008_100153394163 [0,2,0,0,0,0|0,0,2]=4 15699 B16R0.661 C#CCNC(=O)CCCCCCCCCCC 11a_100000212058_100000210736 [0,2,0,0,0,0|1,0,1]=4 15700 B16R0.661 C#CCNC(=O)CCCCCCCCCCC 1626a_100000212058_100000210736 [0,2,0,0,0,0|1,0,1]=4 15701 B16R0.661 C#CCNC(=O)CCCCCCCCCCC 240690a_100000212058_100000210736 [0,2,0,0,0,0|1,0,1]=4 15702 B16R0.661 C#CCNC(=O)CCCCCCCCCCO 240690a_100000212058_200000016029 [0,2,0,0,0,0|1,0,1]=4 15703 B16R0.661 C#CCNC(=O)CNCCCCCCCCC 2230a_100000747989_100011214924 [0,2,0,0,0,0|1,0,1]=4 15704 B16R0.661 C#CCNC(=O)CNCCCCCCCCC 34a_100000747989_100011214924 [0,2,0,0,0,0|1,0,1]=4 15705 B16R0.661 C#CCNC(=O)NCCCCCCCCCC 2708a_100000212058_100000684558 [0,2,0,0,0,0|1,0,1]=4 15706 B16R0.661 C#CCNC(=O)NCCCCCCCCCC 2708a_100000684558_100000212058 [0,2,0,0,0,0|1,0,1]=4 15707 B16R0.661 C#CCNC(=O)NCCCCCCCCCC 273464a_100000212058_100000684558 [0,2,0,0,0,0|1,0,1]=4 15708 B16R0.661 C#CCNC(=O)NCCCCCCCCCC 273464a_100000684558_100000212058 [0,2,0,0,0,0|1,0,1]=4 15709 B16R0.661 C#CCNC(=O)NCCCCCCCCCC 512a_100000212058_100000684558 [0,2,0,0,0,0|1,0,1]=4 15710 B16R0.661 C#CCNC(=O)NCCCCCCCCCC 512a_100000684558_100000212058 [0,2,0,0,0,0|1,0,1]=4 15711 B16R0.661 C=C(CNCCCCCCCCC)OCOC 34a_100000212291_100000042856 [0,2,0,0,0,0|1,0,0]=3 15712 B16R0.661 C=C(CNCCCCCCCCO)OCOC 34a_102515433106_100000042856 [0,2,0,0,0,0|2,0,0]=4 15713 B16R0.661 C=C(COCCCCCCCCBr)OCOC 34a_100009813846_100000042856 [0,2,0,0,0,0|2,0,0]=4 15714 B16R0.661 C=C(COCCCCCCCCC)OCOC 34a_100000210712_100000042856 [0,2,0,0,0,0|1,0,0]=3 15715 B16R0.661 C=C(COCCCCCCCCCl)OCOC 34a_100000033203_100000042856 [0,2,0,0,0,0|2,0,0]=4 15716 B16R0.661 C=C(COCCCCCCCCN)OCOC 34a_102515433106_100000042856 [0,2,0,0,0,0|2,0,0]=4 15717 B16R0.661 C=C(COCCCCNCCCC)OCOC 34a_200011216965_100000042856 [0,2,0,0,0,0|2,0,0]=4 15718 B16R0.661 C=C(COCCCCOCCCC)OCOC 34a_200000760531_100000042856 [0,2,0,0,0,0|2,0,0]=4 15719 B16R0.661 C=C(COCCOCCCCCC)OCOC 34a_100000691444_100000042856 [0,2,0,0,0,0|2,0,0]=4 15720 B16R0.661 C=C(CSCCCCCCCCC)OCOC 62a_100000042856_100000210670 [0,2,0,0,0,0|1,0,0]=3 15721 B16R0.661 C=C(CSCCCCCCCCO)OCOC 62a_100000033203_100000042856 [0,2,0,0,0,0|2,0,0]=4 15722 B16R0.661 C=C(CSCCCCCCCCO)OCOC 62a_100000042856_100000033203 [0,2,0,0,0,0|2,0,0]=4 15723 B16R0.661 C=CCCC(=O)CCCCCCCCCCO 1458a_100000749702_100009813290 [0,2,0,0,0,0|1,0,1]=4 15724 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 11a_100000684558_100000749702 [0,2,0,0,0,0|1,0,1]=4 15725 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 1626a_100000684558_100000749702 [0,2,0,0,0,0|1,0,1]=4 15726 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 240690a_100000684558_100000749702 [0,2,0,0,0,0|1,0,1]=4 15727 B16R0.661 C=CCCC(=O)NCCCCCCCCCC 527a_100000684558_100000749702 [0,2,0,0,0,0|1,0,1]=4 15728 B16R0.661 C=CCCCCCCCCCC(=O)C#CCC 1458a_100011827653_100009814027 [0,2,0,0,0,0|1,0,1]=4 15729 B16R0.661 C=CCCCCCCCCCC(=O)CCOC 1458a_100000749529_100009814027 [0,2,0,0,0,0|1,0,1]=4 15730 B16R0.661 C=CCCCCCCCCCC(=O)COCC 1458a_100000211967_100009814027 [0,2,0,0,0,0|0,0,1]=3 15731 B16R0.661 C=CCCCCCCCOCC(=O)OCCC 34a_100000730831_200011215008 [0,2,0,0,0,0|0,0,2]=4 15732 B16R0.661 C=CCCCCCCCOCC(=O)OCCC 7a_100000730831_200011215008 [0,2,0,0,0,0|0,0,2]=4 15733 B16R0.661 C=CCCCCCCCSCC(=O)OCCC 62a_100012355270_200011215008 [0,2,0,0,0,0|0,0,2]=4 15734 B16R0.661 C=CCCCCCCCSCC(=O)OCCC 62a_200011215008_100012355270 [0,2,0,0,0,0|0,0,2]=4 15735 B16R0.661 C=CCNC(=O)CCCCCCCCCCC 1626a_100020586998_100000210736 [0,2,0,0,0,0|1,0,1]=4 15736 B16R0.661 C=CCNC(=O)CCCCCCCCCCC 240690a_100020586998_100000210736 [0,2,0,0,0,0|1,0,1]=4 15737 B16R0.661 C=CCNC(=O)CCCCCCCCCCO 240690a_100020586998_200000016029 [0,2,0,0,0,0|1,0,1]=4 15738 B16R0.661 C=CCNC(=O)CCNCCCCCCCC 2230a_100000229939_100011222895 [0,2,0,0,0,0|1,0,1]=4 15739 B16R0.661 C=CCNC(=O)CCOCCCCCCCC 7a_100000210232_100011222895 [0,2,0,0,0,0|1,0,1]=4 15740 B16R0.661 C=CCNC(=O)CCSCCCCCCCC 62a_100000210759_100011222895 [0,2,0,0,0,0|1,0,1]=4 15741 B16R0.661 C=CCNC(=O)CCSCCCCCCCC 62a_100011222895_100000210317 [0,2,0,0,0,0|1,0,1]=4 15742 B16R0.661 C=CCNC(=O)CNCCCCCCCCC 2230a_100000212291_100000183597 [0,2,0,0,0,0|1,0,1]=4 15743 B16R0.661 C=CCNC(=O)COCCCCCCCCC 7a_100000210712_100000183597 [0,2,0,0,0,0|1,0,1]=4 15744 B16R0.661 C=CCNC(=O)CSCCCCCCCCC 62a_100000183597_100000210670 [0,2,0,0,0,0|1,0,1]=4 15745 B16R0.661 C=CCNC(=O)NCCCCCCCCCC 2708a_100000684558_100020586998 [0,2,0,0,0,0|1,0,1]=4 15746 B16R0.661 C=CCNC(=O)NCCCCCCCCCC 273464a_100000684558_100020586998 [0,2,0,0,0,0|1,0,1]=4 15747 B16R0.661 C=CCNC(=O)NCCCCCCCCCC 273464a_100020586998_100000684558 [0,2,0,0,0,0|1,0,1]=4 15748 B16R0.661 C=CCNC(=O)NCCCCCCCCCC 512a_100000684558_100020586998 [0,2,0,0,0,0|1,0,1]=4 15749 B16R0.661 C=CCNC(=O)NCCCCCCCCCC 512a_100020586998_100000684558 [0,2,0,0,0,0|1,0,1]=4 15750 B16R0.661 C=CCOC(=O)CNCCCCCCCCC 2230a_100000212291_100000033060 [0,2,0,0,0,0|0,0,1]=3 15751 B16R0.661 C=CCOC(=O)CNCCCCCCCCC 34a_100000212291_100000033060 [0,2,0,0,0,0|0,0,1]=3 15752 B16R0.661 C=CCOC(=O)CNCCCCCCCCO 2230a_102515433106_100000033060 [0,2,0,0,0,0|1,0,1]=4 15753 B16R0.661 C=CCOC(=O)CNCCCCCCCCO 34a_102515433106_100000033060 [0,2,0,0,0,0|1,0,1]=4 15754 B16R0.661 C=CCOC(=O)COCCCCCCCCBr 34a_100009813846_100000033060 [0,2,0,0,0,0|1,0,1]=4 15755 B16R0.661 C=CCOC(=O)COCCCCCCCCBr 7a_100009813846_100000033060 [0,2,0,0,0,0|1,0,1]=4 15756 B16R0.661 C=CCOC(=O)COCCCCCCCCC 34a_100000210712_100000033060 [0,2,0,0,0,0|0,0,1]=3 15757 B16R0.661 C=CCOC(=O)COCCCCCCCCC 7a_100000210712_100000033060 [0,2,0,0,0,0|0,0,1]=3 15758 B16R0.661 C=CCOC(=O)COCCCCCCCCCl 34a_100000033203_100000033060 [0,2,0,0,0,0|1,0,1]=4 15759 B16R0.661 C=CCOC(=O)COCCCCCCCCCl 7a_100000033203_100000033060 [0,2,0,0,0,0|1,0,1]=4 15760 B16R0.661 C=CCOC(=O)COCCCCCCCCN 34a_102515433106_100000033060 [0,2,0,0,0,0|1,0,1]=4 15761 B16R0.661 C=CCOC(=O)COCCCCNCCCC 34a_200011216965_100000033060 [0,2,0,0,0,0|1,0,1]=4 15762 B16R0.661 C=CCOC(=O)COCCCCOCCCC 34a_200000760531_100000033060 [0,2,0,0,0,0|1,0,1]=4 15763 B16R0.661 C=CCOC(=O)COCCCCOCCCC 7a_200000760531_100000033060 [0,2,0,0,0,0|1,0,1]=4 15764 B16R0.661 C=CCOC(=O)COCCOCCCCCC 34a_100000691444_100000033060 [0,2,0,0,0,0|1,0,1]=4 15765 B16R0.661 C=CCOC(=O)COCCOCCCCCC 7a_100000691444_100000033060 [0,2,0,0,0,0|1,0,1]=4 15766 B16R0.661 C=CCOC(=O)CSCCCCCCCCC 62a_100000033060_100000210670 [0,2,0,0,0,0|0,0,1]=3 15767 B16R0.661 C=CCOC(=O)CSCCCCCCCCO 62a_100000033060_100000033203 [0,2,0,0,0,0|1,0,1]=4 15768 B16R0.661 C=CCOC(=O)CSCCCCCCCCO 62a_100000033203_100000033060 [0,2,0,0,0,0|1,0,1]=4 15769 B16R0.661 CC#CCC(=O)CCCCCCCCCCC 1458a_100000210736_100000748600 [0,2,0,0,0,0|1,0,1]=4 15770 B16R0.661 CC/C=C\CCCCCOCC(=O)OCCC 34a_100016268722_200011215008 [0,2,0,0,0,0|0,0,2]=4 15771 B16R0.661 CC/C=C\CCCCCOCC(=O)OCCC 7a_100016268722_200011215008 [0,2,0,0,0,0|0,0,2]=4 15772 B16R0.661 CC=CCC(=O)CCCCCCCCCCO 1458a_100121576822_100009813290 [0,2,0,0,0,0|1,0,1]=4 15773 B16R0.661 CC=CCC(=O)NCCCCCCCCCC 11a_100000684558_100121576822 [0,2,0,0,0,0|1,0,1]=4 15774 B16R0.661 CC=CCC(=O)NCCCCCCCCCC 1626a_100000684558_100121576822 [0,2,0,0,0,0|1,0,1]=4 15775 B16R0.661 CC=CCC(=O)NCCCCCCCCCC 240690a_100000684558_100121576822 [0,2,0,0,0,0|1,0,1]=4 15776 B16R0.661 CC=CCC(=O)NCCCCCCCCCC 527a_100000684558_100121576822 [0,2,0,0,0,0|1,0,1]=4 15777 B16R0.661 CC=NNC(=O)CCCCCCCCCCC 4a_200011219152_200000210099 [0,2,0,0,0,0|1,0,1]=4 15778 B16R0.661 CCC#CC(=O)CCCCCCCCCCC 1458a_100011827653_100011215454 [0,2,0,0,0,0|1,0,0]=3 15779 B16R0.661 CCC#CC(=O)CCCCCCCCCCO 1458a_100011827653_100009813290 [0,2,0,0,0,0|1,0,0]=3 15780 B16R0.661 CCC=CC(=O)CCCCCCCCCCO 1458a_100000212282_100009813290 [0,2,0,0,0,0|1,0,0]=3 15781 B16R0.661 CCC=CC(=O)NCCCCCCCCCC 11a_100000684558_100000212282 [0,2,0,0,0,0|1,0,0]=3 15782 B16R0.661 CCC=CC(=O)NCCCCCCCCCC 1626a_100000684558_100000212282 [0,2,0,0,0,0|1,0,0]=3 15783 B16R0.661 CCC=CC(=O)NCCCCCCCCCC 240690a_100000684558_100000212282 [0,2,0,0,0,0|1,0,0]=3 15784 B16R0.661 CCC=CC(=O)NCCCCCCCCCO 240690a_100000078944_100000212282 [0,2,0,0,0,0|2,0,0]=4 15785 B16R0.661 CCCCC#CCCCSCC(=O)OCCC 62a_200000047210_200011215008 [0,2,0,0,0,0|0,0,2]=4 15786 B16R0.661 CCCCC#CCCCSCC(=O)OCCC 62a_200011215008_200000047210 [0,2,0,0,0,0|0,0,2]=4 15787 B16R0.661 CCCCC(=O)CCCCCCCCCCO 1458a_100000210183_100009813290 [0,2,0,0,0,0|1,0,0]=3 15788 B16R0.661 CCCCC(=O)NCCCCCCCCCO 240690a_100000078944_100000210183 [0,2,0,0,0,0|2,0,0]=4 15789 B16R0.661 CCCCC/C=C\CCOCC(=O)OCCC 34a_100016277358_200011215008 [0,2,0,0,0,0|0,0,2]=4 15790 B16R0.661 CCCCC/C=C\CCOCC(=O)OCCC 7a_100016277358_200011215008 [0,2,0,0,0,0|0,0,2]=4 15791 B16R0.661 CCCCCC#CCCOCC(=O)OCCC 34a_200000042877_200011215008 [0,2,0,0,0,0|0,0,2]=4 15792 B16R0.661 CCCCCC#CCCOCC(=O)OCCC 7a_200000042877_200011215008 [0,2,0,0,0,0|0,0,2]=4 15793 B16R0.661 CCCCCC/C=C/COCC(=O)OCCC 34a_200016276170_200011215008 [0,2,0,0,0,0|0,0,2]=4 15794 B16R0.661 CCCCCC/C=C/COCC(=O)OCCC 7a_200016276170_200011215008 [0,2,0,0,0,0|0,0,2]=4 15795 B16R0.661 CCCCCCC#CCOCC(=O)OCCC 34a_200000037284_200011215008 [0,2,0,0,0,0|0,0,2]=4 15796 B16R0.661 CCCCCCC#CCOCC(=O)OCCC 7a_200000037284_200011215008 [0,2,0,0,0,0|0,0,2]=4 15797 B16R0.661 CCCCCCCCC=NNC(=O)COCC 4a_100000216846_100011218696 [0,2,0,0,0,0|1,0,1]=4 15798 B16R0.661 CCCCCCCCCC=CC(=O)CCCO 1458a_200015352897_100011215043 [0,2,0,0,0,0|1,0,1]=4 15799 B16R0.661 CCCCCCCCCC=CC(=O)CCOC 1458a_200015352897_100000233755 [0,2,0,0,0,0|1,0,1]=4 15800 B16R0.661 CCCCCCCCCC=CC(=O)NCCC 11a_100020643023_200015352897 [0,2,0,0,0,0|1,0,1]=4 15801 B16R0.661 CCCCCCCCCC=CC(=O)NCCC 1626a_100020643023_200015352897 [0,2,0,0,0,0|1,0,1]=4 15802 B16R0.661 CCCCCCCCCC=CC(=O)NCCC 240690a_100020643023_200015352897 [0,2,0,0,0,0|1,0,1]=4 15803 B16R0.661 CCCCCCCCCC=CC(=O)NCCF 11a_100000724931_200015352897 [0,2,0,0,0,0|1,0,1]=4 15804 B16R0.661 CCCCCCCCCC=CC(=O)NCCF 1626a_100000724931_200015352897 [0,2,0,0,0,0|1,0,1]=4 15805 B16R0.661 CCCCCCCCCC=CC(=O)NCCF 240690a_100000724931_200015352897 [0,2,0,0,0,0|1,0,1]=4 15806 B16R0.661 CCCCCCCCCC=CC(=O)NCCO 240690a_100000210304_200015352897 [0,2,0,0,0,0|1,0,1]=4 15807 B16R0.661 CCCCCCCCCC=CC(=O)NNCC 22a_100000756455_200015352897 [0,2,0,0,0,0|1,0,1]=4 15808 B16R0.661 CCCCCCCCCCCC(=NNCC)C 4a_100000756455_100011216755 [0,2,0,0,0,0|2,0,0]=4 15809 B16R0.661 CCCCCCCCCCCC(=O)C#CCO 1458a_100000049017_100011215454 [0,2,0,0,0,0|1,0,1]=4 15810 B16R0.661 CCCCCCCCCCCC(=O)C=COC 1458a_100016268678_100011215454 [0,2,0,0,0,0|1,0,1]=4 15811 B16R0.661 CCCCCCCCCCCC(=O)CCC#N 1458a_100000210736_100011215226 [0,2,0,0,0,0|1,0,1]=4 15812 B16R0.661 CCCCCCCCCCCC(=O)CCC#N 1458a_100011934036_100011215454 [0,2,0,0,0,0|1,0,1]=4 15813 B16R0.661 CCCCCCCCCCCC(=O)CCCO 1458a_100000210736_100011215043 [0,2,0,0,0,0|1,0,0]=3 15814 B16R0.661 CCCCCCCCCCCC(=O)CCOC 1458a_100000210736_100000233755 [0,2,0,0,0,0|1,0,0]=3 15815 B16R0.661 CCCCCCCCCCCC(=O)CCOC 1458a_100000749529_100011215454 [0,2,0,0,0,0|1,0,0]=3 15816 B16R0.661 CCCCCCCCCCCC(=O)COCC 1458a_100000211967_100011215454 [0,2,0,0,0,0|0,0,0]=2 15817 B16R0.661 CCCCCCCCCCCC(=O)NCC#N 1626a_100000734998_100000210736 [0,2,0,0,0,0|1,0,1]=4 15818 B16R0.661 CCCCCCCCCCCC(=O)NCCC 11a_100020643023_100000210736 [0,2,0,0,0,0|1,0,0]=3 15819 B16R0.661 CCCCCCCCCCCC(=O)NCCC 1626a_100020643023_100000210736 [0,2,0,0,0,0|1,0,0]=3 15820 B16R0.661 CCCCCCCCCCCC(=O)NCCC 240690a_100020643023_100000210736 [0,2,0,0,0,0|1,0,0]=3 15821 B16R0.661 CCCCCCCCCCCC(=O)NCCF 11a_100000724931_100000210736 [0,2,0,0,0,0|1,0,0]=3 15822 B16R0.661 CCCCCCCCCCCC(=O)NCCF 1626a_100000724931_100000210736 [0,2,0,0,0,0|1,0,0]=3 15823 B16R0.661 CCCCCCCCCCCC(=O)NCCF 240690a_100000724931_100000210736 [0,2,0,0,0,0|1,0,0]=3 15824 B16R0.661 CCCCCCCCCCCC(=O)NCCO 240690a_100000210304_100000210736 [0,2,0,0,0,0|1,0,0]=3 15825 B16R0.661 CCCCCCCCCCCC(=O)NNCC 22a_100000756455_100000210736 [0,2,0,0,0,0|1,0,0]=3 15826 B16R0.661 CCCCCCCCCCCC(=O)OCNC 2230a_106832991635_100020644155 [0,2,0,0,0,0|0,0,0]=2 15827 B16R0.661 CCCCCCCCCCCC(=O)OCNC 34a_100102657272_100020644155 [0,2,0,0,0,0|0,0,0]=2 15828 B16R0.661 CCCCCCCCCCCC(=O)OCNC 7a_106832991635_100020644155 [0,2,0,0,0,0|0,0,0]=2 15829 B16R0.661 CCCCCCCCCCCC(=O)OCOC 34a_100138415774_100020644155 [0,2,0,0,0,0|0,0,0]=2 15830 B16R0.661 CCCCCCCCCCCC(=O)OCSC 62a_200000210301_100020644155 [0,2,0,0,0,0|0,0,0]=2 15831 B16R0.661 CCCCCCCCCCCC(=O)OCS[13CH3] 62a_200025704644_100020644155 [0,2,0,0,0,0|0,0,0]=2 15832 B16R0.661 CCCCCCCCCCCC(C)OCCO 34a_100011217895_100000211926 [0,2,0,0,0,0|1,0,1]=4 15833 B16R0.661 CCCCCCCCCCCC(C)OCCO 7a_100011217895_100000211926 [0,2,0,0,0,0|1,0,1]=4 15834 B16R0.661 CCCCCCCCCCNC(=O)C=COC 1626a_100000684558_100016268678 [0,2,0,0,0,0|1,0,1]=4 15835 B16R0.661 CCCCCCCCCCNC(=O)C=COC 240690a_100000684558_100016268678 [0,2,0,0,0,0|1,0,1]=4 15836 B16R0.661 CCCCCCCCCCNC(=O)CCC#N 11a_100000684558_100011934036 [0,2,0,0,0,0|1,0,1]=4 15837 B16R0.661 CCCCCCCCCCNC(=O)CCC#N 1626a_100000684558_100011934036 [0,2,0,0,0,0|1,0,1]=4 15838 B16R0.661 CCCCCCCCCCNC(=O)CCC#N 240690a_100000684558_100011934036 [0,2,0,0,0,0|1,0,1]=4 15839 B16R0.661 CCCCCCCCCCNC(=O)CCC#N 527a_100000684558_100011934036 [0,2,0,0,0,0|1,0,1]=4 15840 B16R0.661 CCCCCCCCCCNC(=O)CCCC 11a_100000684558_100000210183 [0,2,0,0,0,0|1,0,0]=3 15841 B16R0.661 CCCCCCCCCCNC(=O)CCCC 1626a_100000684558_100000210183 [0,2,0,0,0,0|1,0,0]=3 15842 B16R0.661 CCCCCCCCCCNC(=O)CCCC 240690a_100000684558_100000210183 [0,2,0,0,0,0|1,0,0]=3 15843 B16R0.661 CCCCCCCCCCNC(=O)CCCC 527a_100000684558_100000210183 [0,2,0,0,0,0|1,0,0]=3 15844 B16R0.661 CCCCCCCCCCNC(=O)CCOC 11a_100000684558_100000749529 [0,2,0,0,0,0|1,0,0]=3 15845 B16R0.661 CCCCCCCCCCNC(=O)CCOC 1626a_100000684558_100000749529 [0,2,0,0,0,0|1,0,0]=3 15846 B16R0.661 CCCCCCCCCCNC(=O)CCOC 240690a_100000684558_100000749529 [0,2,0,0,0,0|1,0,0]=3 15847 B16R0.661 CCCCCCCCCCNC(=O)CCOC 527a_100000684558_100000749529 [0,2,0,0,0,0|1,0,0]=3 15848 B16R0.661 CCCCCCCCCCNC(=O)CCSC 11a_100000684558_100000174002 [0,2,0,0,0,0|1,0,0]=3 15849 B16R0.661 CCCCCCCCCCNC(=O)CCSC 1626a_100000684558_100000174002 [0,2,0,0,0,0|1,0,0]=3 15850 B16R0.661 CCCCCCCCCCNC(=O)CCSC 240690a_100000684558_100000174002 [0,2,0,0,0,0|1,0,0]=3 15851 B16R0.661 CCCCCCCCCCNC(=O)CCSC 527a_100000684558_100000174002 [0,2,0,0,0,0|1,0,0]=3 15852 B16R0.661 CCCCCCCCCCNC(=O)COCC 11a_100000684558_100000211967 [0,2,0,0,0,0|0,0,0]=2 15853 B16R0.661 CCCCCCCCCCNC(=O)COCC 1626a_100000684558_100000211967 [0,2,0,0,0,0|0,0,0]=2 15854 B16R0.661 CCCCCCCCCCNC(=O)COCC 240690a_100000684558_100000211967 [0,2,0,0,0,0|0,0,0]=2 15855 B16R0.661 CCCCCCCCCCNC(=O)COCC 527a_100000684558_100000211967 [0,2,0,0,0,0|0,0,0]=2 15856 B16R0.661 CCCCCCCCCCNC(=O)CSCC 11a_100000684558_100000230394 [0,2,0,0,0,0|0,1,0]=3 15857 B16R0.661 CCCCCCCCCCNC(=O)CSCC 1626a_100000684558_100000230394 [0,2,0,0,0,0|0,1,0]=3 15858 B16R0.661 CCCCCCCCCCNC(=O)CSCC 240690a_100000684558_100000230394 [0,2,0,0,0,0|0,1,0]=3 15859 B16R0.661 CCCCCCCCCCNC(=O)CSCC 527a_100000684558_100000230394 [0,2,0,0,0,0|0,1,0]=3 15860 B16R0.661 CCCCCCCCCCNC(=O)NCC#N 2708a_100000734998_100000684558 [0,2,0,0,0,0|1,0,1]=4 15861 B16R0.661 CCCCCCCCCCNC(=O)NCC#N 273464a_100000684558_100000734998 [0,2,0,0,0,0|1,0,1]=4 15862 B16R0.661 CCCCCCCCCCNC(=O)NCC#N 273464a_100000734998_100000684558 [0,2,0,0,0,0|1,0,1]=4 15863 B16R0.661 CCCCCCCCCCNC(=O)NCC#N 512a_100000684558_100000734998 [0,2,0,0,0,0|1,0,1]=4 15864 B16R0.661 CCCCCCCCCCNC(=O)NCC#N 512a_100000734998_100000684558 [0,2,0,0,0,0|1,0,1]=4 15865 B16R0.661 CCCCCCCCCCNC(=O)NCCC 2708a_100000684558_100020643023 [0,2,0,0,0,0|1,0,0]=3 15866 B16R0.661 CCCCCCCCCCNC(=O)NCCC 2708a_100020643023_100000684558 [0,2,0,0,0,0|1,0,0]=3 15867 B16R0.661 CCCCCCCCCCNC(=O)NCCC 273464a_100000684558_100020643023 [0,2,0,0,0,0|1,0,0]=3 15868 B16R0.661 CCCCCCCCCCNC(=O)NCCC 273464a_100020643023_100000684558 [0,2,0,0,0,0|1,0,0]=3 15869 B16R0.661 CCCCCCCCCCNC(=O)NCCC 512a_100000684558_100020643023 [0,2,0,0,0,0|1,0,0]=3 15870 B16R0.661 CCCCCCCCCCNC(=O)NCCC 512a_100020643023_100000684558 [0,2,0,0,0,0|1,0,0]=3 15871 B16R0.661 CCCCCCCCCCNC(=O)NCCF 2708a_100000684558_100000724931 [0,2,0,0,0,0|1,0,0]=3 15872 B16R0.661 CCCCCCCCCCNC(=O)NCCF 273464a_100000684558_100000724931 [0,2,0,0,0,0|1,0,0]=3 15873 B16R0.661 CCCCCCCCCCNC(=O)NCCF 273464a_100000724931_100000684558 [0,2,0,0,0,0|1,0,0]=3 15874 B16R0.661 CCCCCCCCCCNC(=O)NCCF 512a_100000684558_100000724931 [0,2,0,0,0,0|1,0,0]=3 15875 B16R0.661 CCCCCCCCCCNC(=O)NCCO 2708a_100000684558_100000210304 [0,2,0,0,0,0|1,0,0]=3 15876 B16R0.661 CCCCCCCCCCNC(=O)NCCO 273464a_100000210304_100000684558 [0,2,0,0,0,0|1,0,0]=3 15877 B16R0.661 CCCCCCCCCCNC(=O)NCCO 273464a_100000684558_100000210304 [0,2,0,0,0,0|1,0,0]=3 15878 B16R0.661 CCCCCCCCCCNC(=O)NCCO 512a_100000684558_100000210304 [0,2,0,0,0,0|1,0,0]=3 15879 B16R0.661 CCCCCCCCCCNC(=O)NNCC 273464a_100000684558_100000756455 [0,2,0,0,0,0|1,0,0]=3 15880 B16R0.661 CCCCCCCCCCNC(=O)NNCC 512a_100000684558_100000756455 [0,2,0,0,0,0|1,0,0]=3 15881 B16R0.661 CCCCCCCCCCNC(=O)NNCC 512a_100000756455_100000684558 [0,2,0,0,0,0|1,0,0]=3 15882 B16R0.661 CCCCCCCCCCOC(=O)CNCC 2230a_100015525214_100000210668 [0,2,0,0,0,0|1,0,0]=3 15883 B16R0.661 CCCCCCCCCCOC(=O)COCC 34a_100121572206_100000210668 [0,2,0,0,0,0|0,0,0]=2 15884 B16R0.661 CCCCCCCCCCOC(=O)CSCC 62a_100000210202_100000680656 [0,2,0,0,0,0|0,1,0]=3 15885 B16R0.661 CCCCCCCCCCOC(=O)CSCC 62a_100000680656_100000210202 [0,2,0,0,0,0|0,1,0]=3 15886 B16R0.661 CCCCCCCCCCOC(=O)CSCF 62a_100000680656_100015361967 [0,2,0,0,0,0|1,1,0]=4 15887 B16R0.661 CCCCCCCCCCOC(=O)CSCF 62a_100015361967_100000680656 [0,2,0,0,0,0|1,1,0]=4 15888 B16R0.661 CCCCCCCCCCOC(C)COCC 34a_100000718985_100000210320 [0,2,0,0,0,0|1,0,1]=4 15889 B16R0.661 CCCCCCCCCCOC(C)COCC 7a_100000718985_100000210320 [0,2,0,0,0,0|1,0,1]=4 15890 B16R0.661 CCCCCCCCCNCC(=O)NCC#N 2230a_100000212291_100000736037 [0,2,0,0,0,0|1,0,1]=4 15891 B16R0.661 CCCCCCCCCNCC(=O)NCCC 2230a_100000174927_100011214924 [0,2,0,0,0,0|1,0,0]=3 15892 B16R0.661 CCCCCCCCCNCC(=O)NCCC 2230a_100000212291_100000183358 [0,2,0,0,0,0|1,0,0]=3 15893 B16R0.661 CCCCCCCCCNCC(=O)NCCC 34a_100000212291_100000183358 [0,2,0,0,0,0|1,0,0]=3 15894 B16R0.661 CCCCCCCCCNCC(=O)NCCF 2230a_100000725713_100011214924 [0,2,0,0,0,0|1,0,0]=3 15895 B16R0.661 CCCCCCCCCNCC(=O)OCCC 2230a_100000212291_200011215008 [0,2,0,0,0,0|0,0,0]=2 15896 B16R0.661 CCCCCCCCCNCC(=O)OCCC 34a_100000212291_200011215008 [0,2,0,0,0,0|0,0,0]=2 15897 B16R0.661 CCCCCCCCCNCC(C)OCCC 2230a_100015185124_100011214924 [0,2,0,0,0,0|1,0,1]=4 15898 B16R0.661 CCCCCCCCCNCC(C)OCCC 34a_100015185124_100011214924 [0,2,0,0,0,0|1,0,1]=4 15899 B16R0.661 CCCCCCCCCNCC(O)COCC 2230a_102515437182_100011214924 [0,2,0,0,0,0|0,0,2]=4 15900 B16R0.661 CCCCCCCCCNCC(O)COCC 34a_102515437182_100011214924 [0,2,0,0,0,0|0,0,2]=4 15901 B16R0.661 CCCCCCCCCOCC(=O)NCC#N 7a_100000210712_100000736037 [0,2,0,0,0,0|1,0,1]=4 15902 B16R0.661 CCCCCCCCCOCC(=O)NCCC 34a_100000210712_100000183358 [0,2,0,0,0,0|1,0,0]=3 15903 B16R0.661 CCCCCCCCCOCC(=O)NCCC 7a_100000210712_100000183358 [0,2,0,0,0,0|1,0,0]=3 15904 B16R0.661 CCCCCCCCCOCC(=O)OCCC 34a_100000210712_200011215008 [0,2,0,0,0,0|0,0,0]=2 15905 B16R0.661 CCCCCCCCCOCC(=O)OCCC 7a_100000210712_200011215008 [0,2,0,0,0,0|0,0,0]=2 15906 B16R0.661 CCCCCCCCCOC[C@@H](C)OCOC 34a_100016172286_100011214924 [0,2,0,0,0,0|1,0,1]=4 15907 B16R0.661 CCCCCCCCCOC[C@@H](C)OCOC 7a_100016172286_100000210328 [0,2,0,0,0,0|1,0,1]=4 15908 B16R0.661 CCCCCCCCCSCC(=O)NCC#N 62a_100000736037_100000210670 [0,2,0,0,0,0|1,0,1]=4 15909 B16R0.661 CCCCCCCCCSCC(=O)NCCC 62a_100000183358_100000210670 [0,2,0,0,0,0|1,0,0]=3 15910 B16R0.661 CCCCCCCCCSCC(=O)OCCC 62a_200011215008_100000210670 [0,2,0,0,0,0|0,0,0]=2 15911 B16R0.661 CCCCCCCCNCOC(=O)OCCC 34a_100000229939_200000139673 [0,2,0,0,0,0|1,0,0]=3 15912 B16R0.661 CCCCCCCCOCOC(=O)OCCC 34a_100000210232_200000139673 [0,2,0,0,0,0|1,0,0]=3 15913 B16R0.661 CCCCCCCCOCOC(=O)OCCC 7a_100000210232_200000139673 [0,2,0,0,0,0|1,0,0]=3 15914 B16R0.661 CCCCCCCCSCOC(=O)OCCC 62a_100000210759_200000139673 [0,2,0,0,0,0|1,0,0]=3 15915 B16R0.661 CCCCCCCNCCCC(=O)NCCC 2230a_100000229938_100011194427 [0,2,0,0,0,0|1,0,0]=3 15916 B16R0.661 CCCCCCCOCCCC(=O)NCCC 7a_100000210272_100011194427 [0,2,0,0,0,0|1,0,0]=3 15917 B16R0.661 CCCCCCCSCCCC(=O)NCCC 62a_100000210614_100011194427 [0,2,0,0,0,0|1,0,0]=3 15918 B16R0.661 CCCCCCCSCCCC(=O)NCCC 62a_100011194427_100000210316 [0,2,0,0,0,0|1,0,0]=3 15919 B16R0.661 CCCCCCOCCOCC(=O)NCCC 34a_100000691444_100000183358 [0,2,0,0,0,0|2,0,0]=4 15920 B16R0.661 CCCCCCOCCOCC(=O)NCCC 7a_100000691444_100000183358 [0,2,0,0,0,0|2,0,0]=4 15921 B16R0.661 CCCCCCOCCOCC(=O)OCCC 34a_100000691444_200011215008 [0,2,0,0,0,0|1,0,0]=3 15922 B16R0.661 CCCCCCOCCOCC(=O)OCCC 7a_100000691444_200011215008 [0,2,0,0,0,0|1,0,0]=3 15923 B16R0.661 CCCCCNCCOCOC(=O)OCCC 34a_100000224656_200000139673 [0,2,0,0,0,0|2,0,0]=4 15924 B16R0.661 CCCCCOCCOCOC(=O)OCCC 34a_100011215259_200000139673 [0,2,0,0,0,0|2,0,0]=4 15925 B16R0.661 CCCCCOCCOCOC(=O)OCCC 7a_100011215259_200000139673 [0,2,0,0,0,0|2,0,0]=4 15926 B16R0.661 CCCCNCCCCOCC(=O)NCCC 34a_200011216965_100000183358 [0,2,0,0,0,0|2,0,0]=4 15927 B16R0.661 CCCCNCCCCOCC(=O)OCCC 34a_200011216965_200011215008 [0,2,0,0,0,0|1,0,0]=3 15928 B16R0.661 CCCCOCCCCOCC(=O)NCCC 34a_200000760531_100000183358 [0,2,0,0,0,0|2,0,0]=4 15929 B16R0.661 CCCCOCCCCOCC(=O)NCCC 7a_200000760531_100000183358 [0,2,0,0,0,0|2,0,0]=4 15930 B16R0.661 CCCCOCCCCOCC(=O)OCCC 34a_200000760531_200011215008 [0,2,0,0,0,0|1,0,0]=3 15931 B16R0.661 CCCCOCCCCOCC(=O)OCCC 7a_200000760531_200011215008 [0,2,0,0,0,0|1,0,0]=3 15932 B16R0.661 CCCCOCCCNCOC(=O)OCCC 34a_200000211371_200000139673 [0,2,0,0,0,0|2,0,0]=4 15933 B16R0.661 CCCCOCCCOCOC(=O)OCCC 34a_200011215613_200000139673 [0,2,0,0,0,0|2,0,0]=4 15934 B16R0.661 CCCCOCCCOCOC(=O)OCCC 7a_200011215613_200000139673 [0,2,0,0,0,0|2,0,0]=4 15935 B16R0.661 CCCCOCCOCCCC(=O)NCCC 7a_100000210238_100011194427 [0,2,0,0,0,0|2,0,0]=4 15936 B16R0.661 CCCCOCCSCCCC(=O)NCCC 62a_100000743108_100011194427 [0,2,0,0,0,0|2,0,0]=4 15937 B16R0.661 CCCCOCCSCCCC(=O)NCCC 62a_100011194427_100000743108 [0,2,0,0,0,0|2,0,0]=4 15938 B16R0.661 CCCCSCCNCCCC(=O)NCCC 2230a_100025743550_100011194427 [0,2,0,0,0,0|2,0,0]=4 15939 B16R0.661 CCCCSCCOCCCC(=O)NCCC 7a_200000230436_100011194427 [0,2,0,0,0,0|2,0,0]=4 15940 B16R0.661 CCCNC(=O)CCCCCCCCCCO 240690a_100020643023_200000016029 [0,2,0,0,0,0|1,0,0]=3 15941 B16R0.661 CCCNC(=O)CCCNCCCCCCO 2230a_100000686447_100011194427 [0,2,0,0,0,0|2,0,0]=4 15942 B16R0.661 CCCNC(=O)CCCNCCCCCOC 2230a_100000747528_100011194427 [0,2,0,0,0,0|2,0,0]=4 15943 B16R0.661 CCCNC(=O)CCCNCCCOCCC 2230a_100011217757_100011194427 [0,2,0,0,0,0|2,0,0]=4 15944 B16R0.661 CCCNC(=O)CCCOCCCCCCBr 7a_100011215345_100011194427 [0,2,0,0,0,0|2,0,0]=4 15945 B16R0.661 CCCNC(=O)CCCOCCCCCCCl 7a_100000766143_100011194427 [0,2,0,0,0,0|2,0,0]=4 15946 B16R0.661 CCCNC(=O)CCCOCCCCCCF 7a_100000732779_100011194427 [0,2,0,0,0,0|2,0,0]=4 15947 B16R0.661 CCCNC(=O)CCCSCCCCCCF 62a_100011194427_100015922095 [0,2,0,0,0,0|2,0,0]=4 15948 B16R0.661 CCCNC(=O)CCCSCCCCCCF 62a_100015922095_100011194427 [0,2,0,0,0,0|2,0,0]=4 15949 B16R0.661 CCCNC(=O)CCCSCCCCCCO 62a_100000766143_100011194427 [0,2,0,0,0,0|2,0,0]=4 15950 B16R0.661 CCCNC(=O)CCCSCCCCCCO 62a_100011194427_100000766143 [0,2,0,0,0,0|2,0,0]=4 15951 B16R0.661 CCCNC(=O)CNCCCCCCCCO 2230a_100000174927_100000033203 [0,2,0,0,0,0|2,0,0]=4 15952 B16R0.661 CCCNC(=O)CNCCCCCCCCO 2230a_102515433106_100000183358 [0,2,0,0,0,0|2,0,0]=4 15953 B16R0.661 CCCNC(=O)CNCCCCCCCCO 34a_102515433106_100000183358 [0,2,0,0,0,0|2,0,0]=4 15954 B16R0.661 CCCNC(=O)COCCCCCCCCBr 34a_100009813846_100000183358 [0,2,0,0,0,0|2,0,0]=4 15955 B16R0.661 CCCNC(=O)COCCCCCCCCBr 7a_100009813846_100000183358 [0,2,0,0,0,0|2,0,0]=4 15956 B16R0.661 CCCNC(=O)COCCCCCCCCCl 34a_100000033203_100000183358 [0,2,0,0,0,0|2,0,0]=4 15957 B16R0.661 CCCNC(=O)COCCCCCCCCCl 7a_100000033203_100000183358 [0,2,0,0,0,0|2,0,0]=4 15958 B16R0.661 CCCNC(=O)COCCCCCCCCN 34a_102515433106_100000183358 [0,2,0,0,0,0|2,0,0]=4 15959 B16R0.661 CCCNC(=O)CSCCCCCCCCO 62a_100000033203_100000183358 [0,2,0,0,0,0|2,0,0]=4 15960 B16R0.661 CCCNC(=O)CSCCCCCCCCO 62a_100000183358_100000033203 [0,2,0,0,0,0|2,0,0]=4 15961 B16R0.661 CCCNC(=O)NCCCCCCCCCO 2708a_100000078944_100020643023 [0,2,0,0,0,0|2,0,0]=4 15962 B16R0.661 CCCNC(=O)NCCCCCCCCCO 2708a_100020643023_100000078944 [0,2,0,0,0,0|2,0,0]=4 15963 B16R0.661 CCCNC(=O)NCCCCCCCCCO 273464a_100000078944_100020643023 [0,2,0,0,0,0|2,0,0]=4 15964 B16R0.661 CCCNC(=O)NCCCCCCCCCO 273464a_100020643023_100000078944 [0,2,0,0,0,0|2,0,0]=4 15965 B16R0.661 CCCNC(=O)NCCCCCCCCCO 512a_100000078944_100020643023 [0,2,0,0,0,0|2,0,0]=4 15966 B16R0.661 CCCNC(=O)NCCCCCCCCCO 512a_100020643023_100000078944 [0,2,0,0,0,0|2,0,0]=4 15967 B16R0.661 CCCOC(=O)CNCCCCCCCCO 2230a_102515433106_200011215008 [0,2,0,0,0,0|1,0,0]=3 15968 B16R0.661 CCCOC(=O)CNCCCCCCCCO 34a_102515433106_200011215008 [0,2,0,0,0,0|1,0,0]=3 15969 B16R0.661 CCCOC(=O)COCCCCCCCCBr 34a_100009813846_200011215008 [0,2,0,0,0,0|1,0,0]=3 15970 B16R0.661 CCCOC(=O)COCCCCCCCCBr 7a_100009813846_200011215008 [0,2,0,0,0,0|1,0,0]=3 15971 B16R0.661 CCCOC(=O)COCCCCCCCCCl 34a_100000033203_200011215008 [0,2,0,0,0,0|1,0,0]=3 15972 B16R0.661 CCCOC(=O)COCCCCCCCCCl 7a_100000033203_200011215008 [0,2,0,0,0,0|1,0,0]=3 15973 B16R0.661 CCCOC(=O)COCCCCCCCCN 34a_102515433106_200011215008 [0,2,0,0,0,0|1,0,0]=3 15974 B16R0.661 CCCOC(=O)COCCCCCNCCN 34a_103619048469_200011215008 [0,2,0,0,0,0|2,0,0]=4 15975 B16R0.661 CCCOC(=O)COCCCOCCCOC 34a_200011215475_200011215008 [0,2,0,0,0,0|2,0,0]=4 15976 B16R0.661 CCCOC(=O)COCCCOCCCOC 7a_200011215475_200011215008 [0,2,0,0,0,0|2,0,0]=4 15977 B16R0.661 CCCOC(=O)CSCCCCCCCCO 62a_100000033203_200011215008 [0,2,0,0,0,0|1,0,0]=3 15978 B16R0.661 CCCOC(=O)CSCCCCCCCCO 62a_200011215008_100000033203 [0,2,0,0,0,0|1,0,0]=3 15979 B16R0.661 CCCOC(=O)OCNCCCCCCCO 34a_100011996573_200000139673 [0,2,0,0,0,0|2,0,0]=4 15980 B16R0.661 CCCOC(=O)OCOCCCCCCCBr 34a_100000760002_200000139673 [0,2,0,0,0,0|2,0,0]=4 15981 B16R0.661 CCCOC(=O)OCOCCCCCCCBr 7a_100000760002_200000139673 [0,2,0,0,0,0|2,0,0]=4 15982 B16R0.661 CCCOC(=O)OCOCCCCCCCN 34a_100011996573_200000139673 [0,2,0,0,0,0|2,0,0]=4 15983 B16R0.661 CCCOC(=O)OCOCCCCCCOC 34a_200012092642_200000139673 [0,2,0,0,0,0|2,0,0]=4 15984 B16R0.661 CCCOC(=O)OCOCCCCCCOC 7a_200012092642_200000139673 [0,2,0,0,0,0|2,0,0]=4 15985 B16R0.661 CCCOC(=O)OCSCCCCCCCO 62a_100000760002_200000139673 [0,2,0,0,0,0|2,0,0]=4 15986 B16R0.661 CCCOC(=O)OCSCCCCCCOC 62a_100011998445_200000139673 [0,2,0,0,0,0|2,0,0]=4 15987 B16R0.661 CCCOCCOCCNCC(=O)OCCC 2230a_200011904461_200011215008 [0,2,0,0,0,0|2,0,0]=4 15988 B16R0.661 CCCOCCOCCNCC(=O)OCCC 34a_200011904461_200011215008 [0,2,0,0,0,0|2,0,0]=4 15989 B16R0.661 CCNNC(=O)CCCCCCCCCCO 22a_100000756455_200000016029 [0,2,0,0,0,0|1,0,0]=3 15990 B16R0.661 CCNNC(=O)NCCCCCCCCCO 273464a_100000078944_100000756455 [0,2,0,0,0,0|2,0,0]=4 15991 B16R0.661 CCNNC(=O)NCCCCCCCCCO 512a_100000078944_100000756455 [0,2,0,0,0,0|2,0,0]=4 15992 B16R0.661 CCNNC(=O)NCCCCCCCCCO 512a_100000756455_100000078944 [0,2,0,0,0,0|2,0,0]=4 15993 B16R0.661 CCOCC(=O)CCCCCCCCCCO 1458a_100000211967_100009813290 [0,2,0,0,0,0|0,0,0]=2 15994 B16R0.661 CCOCC(=O)NCCCCCCCCCO 240690a_100000078944_100000211967 [0,2,0,0,0,0|1,0,0]=3 15995 B16R0.661 CCSCC(=O)CCCCCCCCCCO 1458a_100000230394_100009813290 [0,2,0,0,0,0|0,1,0]=3 15996 B16R0.661 CCSCC(=O)NCCCCCCCCCO 240690a_100000078944_100000230394 [0,2,0,0,0,0|1,1,0]=4 15997 B16R0.661 COC=CC(=O)CCCCCCCCCCO 1458a_100016268678_100009813290 [0,2,0,0,0,0|1,0,1]=4 15998 B16R0.661 COCCC(=O)CCCCCCCCCCO 1458a_100000749529_100009813290 [0,2,0,0,0,0|1,0,0]=3 15999 B16R0.661 COCCC(=O)NCCCCCCCCCO 240690a_100000078944_100000749529 [0,2,0,0,0,0|2,0,0]=4 16000 B16R0.661 CSCCC(=O)CCCCCCCCCCO 1458a_100000174002_100009813290 [0,2,0,0,0,0|1,0,0]=3 16001 B16R0.661 CSCCC(=O)NCCCCCCCCCO 240690a_100000078944_100000174002 [0,2,0,0,0,0|2,0,0]=4 16002 B16R0.661 N#CCCC(=O)CCCCCCCCCCO 1458a_100011934036_100009813290 [0,2,0,0,0,0|1,0,1]=4 16003 B16R0.661 O=C(C#CCO)CCCCCCCCCCO 1458a_100000049017_100009813290 [0,2,0,0,0,0|1,0,1]=4 16004 B16R0.661 O=C(CCCCCCCCCCO)NCCF 240690a_100000724931_200000016029 [0,2,0,0,0,0|1,0,0]=3 16005 B16R0.661 O=C(CCCCCCCCCCO)NCCO 240690a_100000210304_200000016029 [0,2,0,0,0,0|1,0,0]=3 16006 B16R0.661 O=C(CNCCCCCCCCO)NCCF 2230a_100000725713_100000033203 [0,2,0,0,0,0|2,0,0]=4 16007 B16R0.661 O=C(NCCF)NCCCCCCCCCO 2708a_100000078944_100000724931 [0,2,0,0,0,0|2,0,0]=4 16008 B16R0.661 O=C(NCCF)NCCCCCCCCCO 273464a_100000078944_100000724931 [0,2,0,0,0,0|2,0,0]=4 16009 B16R0.661 O=C(NCCF)NCCCCCCCCCO 273464a_100000724931_100000078944 [0,2,0,0,0,0|2,0,0]=4 16010 B16R0.661 O=C(NCCF)NCCCCCCCCCO 512a_100000078944_100000724931 [0,2,0,0,0,0|2,0,0]=4 16011 B16R0.661 O=C(NCCO)NCCCCCCCCCO 2708a_100000078944_100000210304 [0,2,0,0,0,0|2,0,0]=4 16012 B16R0.661 O=C(NCCO)NCCCCCCCCCO 273464a_100000078944_100000210304 [0,2,0,0,0,0|2,0,0]=4 16013 B16R0.661 O=C(NCCO)NCCCCCCCCCO 273464a_100000210304_100000078944 [0,2,0,0,0,0|2,0,0]=4 16014 B16R0.661 O=C(NCCO)NCCCCCCCCCO 512a_100000078944_100000210304 [0,2,0,0,0,0|2,0,0]=4 16015 B16R0.5308 CCCCCCCCCCNS(=O)(=O)CCC 270084a_100000684558_100000211391 [0,2,0,0,0,0|2,0,0]=4 16016 B16R0.5308 CCCCCCCCCCNS(=O)(=O)CCC 274078a_100000684558_100000211391 [0,2,0,0,0,0|2,0,0]=4 16017 B16R0.5308 CCCCCCCCCCNS(=O)(=O)CCC 40a_100000684558_100000054278 [0,2,0,0,0,0|2,0,0]=4 16018 B16R0.5308 CCCCCCCNCCC[Si](C)(C)OCC 2230a_100000229938_100000070546 [0,2,0,0,0,0|1,1,0]=4 16019 B16R0.5308 CCCCCCCOCCC[Si](C)(C)OCC 34a_100000210272_100000070546 [0,2,0,0,0,0|1,1,0]=4 16020 B16R0.5308 CCCCCCCOCCC[Si](C)(C)OCC 7a_100000210272_100000070546 [0,2,0,0,0,0|1,1,0]=4 16021 B16R0.329 CCOC(=O)C[C@H](O)COCCCC(C)CC 7a_100011216074_100000688340 [0,2,0,0,0,0|1,0,0]=3 16022 B16R0.329 CCOC(=O)C[C@H](O)COCCC[C@@H](C)CN 34a_100160569302_100000688340 [0,2,0,0,0,0|2,0,0]=4 16023 B16R0.329 CCOC(=O)C[C@H](O)CSCCCN(C)CC 62a_100000688340_100015186262 [0,2,0,0,0,0|2,0,0]=4 16024 B16R0.1821 CCCCCCCCC(=O)C(C)C(=O)NCC 1458a_100000210188_100000230173 [0,2,0,0,0,0|1,0,1]=4 16025 B16R0.1821 CCCCCCCCC(=O)C(C)C(=O)OCC 1458a_100000210188_100011216346 [0,2,0,0,0,0|0,0,1]=3 16026 B16R0.1821 CCCCCCCCC(=O)C(C)C(=O)OCC 1458a_100132301724_100000210759 [0,2,0,0,0,0|0,0,1]=3 16027 B16R0.1821 CCCCCCCCC(=O)C(F)C(=O)OCC 1458a_100000210188_100000760018 [0,2,0,0,0,0|0,0,1]=3 16028 B16R0.1821 CCCCCCCCN(C)C(=O)C(=O)OCC 11a_100000207567_100014798877 [0,2,0,0,0,0|1,0,1]=4 16029 B16R0.1821 CCCCCCCCN(C)C(=O)C(=O)OCC 1626a_100000207567_100014798877 [0,2,0,0,0,0|1,0,1]=4 16030 B16R0.1821 CCCCCCCCN(C)C(=O)C(=O)OCC 240690a_100000207567_100014798877 [0,2,0,0,0,0|1,0,1]=4 16031 B16R0.1821 CCCCCCCCN(C)C(C)C(=O)NCC 2230a_100000207567_100000230173 [0,2,0,0,0,0|2,0,0]=4 16032 B16R0.1821 CCCCCCCCN(C)C(C)C(=O)NCC 269982a_100000207567_100000230173 [0,2,0,0,0,0|2,0,0]=4 16033 B16R0.1821 CCCCCCCCN(C)C(C)C(=O)OCC 2230a_100000207567_100011215307 [0,2,0,0,0,0|1,0,0]=3 16034 B16R0.1821 CCCCCCCCN(C)C(C)C(=O)OCC 269982a_100000207567_100011216346 [0,2,0,0,0,0|1,0,0]=3 16035 B16R0.1821 CCCCCCCCN(C)C(F)C(=O)OCC 2230a_100000207567_100000760018 [0,2,0,0,0,0|1,0,0]=3 16036 B16R0.1821 CCCCCCCCN(C)C(F)C(=O)OCC 269982a_100000207567_100000760018 [0,2,0,0,0,0|1,0,0]=3 16037 B16R0.1821 CCCCCCCNC(=O)C(C)C(=O)OCC 11a_100000229938_100132301724 [0,2,0,0,0,0|1,0,1]=4 16038 B16R0.1821 CCCCCCCNC(=O)C(C)C(=O)OCC 1626a_100000229938_100132301724 [0,2,0,0,0,0|1,0,1]=4 16039 B16R0.1821 CCCCCCCNC(=O)C(C)C(=O)OCC 240690a_100000229938_100132301724 [0,2,0,0,0,0|1,0,1]=4 16040 B16R0.1821 CCCCCCCNC(=O)C(C)C(=O)OCC 527a_100000229938_100132301724 [0,2,0,0,0,0|1,0,1]=4 16041 B16R0.1821 CCCCCCCNC(C)C(=O)C(=O)OCC 2230a_100000229938_100010256902 [0,2,0,0,0,0|1,0,1]=4 16042 B16R0.1821 CCCCCCCSC(C)C(=O)C(=O)OCC 62a_100000210614_100010256902 [0,2,0,0,0,0|1,0,1]=4 16043 B16R0.1821 CCCCCCCSC(C)C(=O)C(=O)OCC 62a_100010256902_100000210316 [0,2,0,0,0,0|1,0,1]=4 16044 B16R0.1821 CCOC(=O)C(C)C(=O)CCCCCCCO 1458a_100011219782_100011216346 [0,2,0,0,0,0|1,0,1]=4 16045 B16R0.1821 CCOC(=O)C(C)C(=O)CCCCCCCO 1458a_100132301724_100000760002 [0,2,0,0,0,0|1,0,1]=4 16046 B16R0.1821 CCOC(=O)C(C)C(=O)CCCCCCOC 1458a_100132301724_100011998445 [0,2,0,0,0,0|1,0,1]=4 16047 B16R0.1821 CCOC(=O)C(F)C(=O)CCCCCCCO 1458a_100011219782_100000760018 [0,2,0,0,0,0|1,0,1]=4 16048 B16R0.3207 C=C(CC(=O)CCCCCCCC)OCOC 1458a_100000210188_100000042856 [0,2,0,0,0,0|1,0,1]=4 16049 B16R0.3207 C=C(CN(C)CCCCCCCC)OCOC 269982a_100000207567_100000042856 [0,2,0,0,0,0|2,0,0]=4 16050 B16R0.3207 C=CCOC(=O)CC(=O)CCCCCCCC 1458a_100000210188_100000033060 [0,2,0,0,0,0|0,0,2]=4 16051 B16R0.3207 C=CCOC(=O)CN(C)CCCCCCCC 2230a_100000207567_100000033060 [0,2,0,0,0,0|1,0,1]=4 16052 B16R0.3207 C=CCOC(=O)CN(C)CCCCCCCC 269982a_100000207567_100000033060 [0,2,0,0,0,0|1,0,1]=4 16053 B16R0.3207 CCCCCCCCC(=O)CC(=O)NCCC 1458a_100000210188_100000183358 [0,2,0,0,0,0|1,0,1]=4 16054 B16R0.3207 CCCCCCCCC(=O)CC(=O)OCCC 1458a_100000210188_200011215008 [0,2,0,0,0,0|0,0,1]=3 16055 B16R0.3207 CCCCCCCCN(C)CC(=O)NCCC 2230a_100000207567_100000183358 [0,2,0,0,0,0|2,0,0]=4 16056 B16R0.3207 CCCCCCCCN(C)CC(=O)NCCC 2230a_100000684209_100000210759 [0,2,0,0,0,0|2,0,0]=4 16057 B16R0.3207 CCCCCCCCN(C)CC(=O)NCCC 269982a_100000207567_100000183358 [0,2,0,0,0,0|2,0,0]=4 16058 B16R0.3207 CCCCCCCCN(C)CC(=O)NCCC 269982a_100000684209_100000210759 [0,2,0,0,0,0|2,0,0]=4 16059 B16R0.3207 CCCCCCCCN(C)CC(=O)OCCC 2230a_100000207567_200011215008 [0,2,0,0,0,0|1,0,0]=3 16060 B16R0.3207 CCCCCCCCN(C)CC(=O)OCCC 269982a_100000207567_200011215008 [0,2,0,0,0,0|1,0,0]=3 16061 B16R0.3207 CCCOC(=O)CC(=O)CCCCCCCO 1458a_100011219782_200011215008 [0,2,0,0,0,0|1,0,1]=4 16062 B16R0.6403 CCCCCCCCN(CC)CC(=O)OCC 2230a_100000220607_100000210759 [0,2,0,0,0,0|1,0,0]=3 16063 B16R0.6403 CCCCCCCCN(CC)CC(=O)OCC 269982a_100000220607_100000210759 [0,2,0,0,0,0|1,0,0]=3 16064 B16R0.6403 CCCCCCCO[C@H](CCl)CC(=O)OCC 7a_100000688340_100000210614 [0,2,0,0,0,0|1,0,0]=3 16065 B16R0.6403 CCCCOCCO[C@H](CCl)CC(=O)OCC 7a_100000688340_100000743108 [0,2,0,0,0,0|2,0,0]=4 16066 B16R0.6403 CCOC(=O)CN(CC)CCCCCCCO 2230a_100000220607_100000760002 [0,2,0,0,0,0|2,0,0]=4 16067 B16R0.6403 CCOC(=O)CN(CC)CCCCCCCO 269982a_100000220607_100000760002 [0,2,0,0,0,0|2,0,0]=4 16068 B16R0.6403 CCOC(=O)CN(CC)CCCCCCOC 2230a_100000220607_100011998445 [0,2,0,0,0,0|2,0,0]=4 16069 B16R0.6403 CCOC(=O)CN(CC)CCCCCCOC 269982a_100000220607_100011998445 [0,2,0,0,0,0|2,0,0]=4 16070 B16R0.6403 CCOC(=O)C[C@@H](CCl)OCCCCCCF 7a_100000688340_100015922095 [0,2,0,0,0,0|2,0,0]=4 16071 B16R0.6403 CCOC(=O)C[C@@H](CCl)OCCCCCCO 7a_100000688340_100000766143 [0,2,0,0,0,0|2,0,0]=4 16072 B16R0.15371 CCCCCCCNS(=O)(=O)CC(=O)OCC 270084a_100000229938_100000738689 [0,2,0,0,0,0|2,0,0]=4 16073 B16R0.15371 CCCCCCCNS(=O)(=O)CC(=O)OCC 274078a_100000229938_100000738689 [0,2,0,0,0,0|2,0,0]=4 16074 B16R0.15371 CCCCCCCOC(C)(C)CC(=O)OCC 7a_100000765344_100000210614 [0,2,0,0,0,0|1,0,0]=3 16075 B16R0.15371 CCCCOCCOC(C)(C)CC(=O)OCC 7a_100000765344_100000743108 [0,2,0,0,0,0|2,0,0]=4 16076 B16R0.15371 CCOC(=O)CC(C)(C)OCCCCCCF 7a_100000765344_100015922095 [0,2,0,0,0,0|2,0,0]=4 16077 B16R0.15371 CCOC(=O)CC(C)(C)OCCCCCCO 7a_100000765344_100000766143 [0,2,0,0,0,0|2,0,0]=4 16078 B16R0.7 C=CCOC(=O)COCCCCCC(C)CC 7a_200000035636_100000033060 [0,2,0,0,0,0|1,0,1]=4 16079 B16R0.7 CCCNC(=O)CCCOCCCC(C)CC 7a_100011216074_100011194427 [0,2,0,0,0,0|2,0,0]=4 16080 B16R0.7 CCCNC(=O)COCCCCCC(C)CC 7a_200000035636_100000183358 [0,2,0,0,0,0|2,0,0]=4 16081 B16R0.7 CCCOC(=O)COCCCCCC(C)CC 7a_200000035636_200011215008 [0,2,0,0,0,0|1,0,0]=3 16082 B16R0.7 CCOCC(=O)CCCCCCCC(=O)OC 1458a_100000211967_100010004213 [0,2,0,0,0,0|1,0,1]=4 16083 B16R0.251 CCNC(=O)C(C)OCCCCCC(C)CC 7a_200000035636_100000230173 [0,2,0,0,0,0|2,0,0]=4 16084 B16R0.251 CCOC(=O)C(=O)CCCCCNC(C)CC 2230a_100000209981_100000068741 [0,2,0,0,0,0|1,0,1]=4 16085 B16R0.251 CCOC(=O)C(=O)CCCCCSC(C)CC 62a_100000758301_100000068741 [0,2,0,0,0,0|1,0,1]=4 16086 B16R0.251 CCOC(=O)C(C)OCCCCCC(C)CC 7a_200000035636_100011216346 [0,2,0,0,0,0|1,0,0]=3 16087 B16R0.251 CCOC(=O)C(F)OCCCCCC(C)CC 7a_200000035636_100000040065 [0,2,0,0,0,0|1,0,0]=3 16088 B16R0.2482 CCOC(=O)CCCCCCNC(C)(C)CC 2230a_100000211385_100009814379 [0,2,0,0,0,0|1,0,0]=3 16089 B16R0.2482 CCOC(=O)CCCCCCNC(C)(C)CO 2230a_100000210608_100009814379 [0,2,0,0,0,0|2,0,0]=4 16090 B16R0.2482 CCOC(=O)CCCCCCOC(C)(C)CC 7a_100000210230_100009814379 [0,2,0,0,0,0|1,0,0]=3 16091 B16R0.2482 CCOC(=O)CCCCCCOC(C)(C)CCl 7a_100000764493_100009814379 [0,2,0,0,0,0|2,0,0]=4 16092 B16R0.2482 CCOC(=O)CCCCCCSC(C)(C)CC 62a_100000032637_100009814379 [0,2,0,0,0,0|1,0,0]=3 16093 B16R0.2482 CCOC(=O)CCCCCCSC(F)(F)CO 62a_100011217949_100009814379 [0,2,0,0,0,0|2,0,0]=4 16094 B16R0.2482 CCOC(=O)CCCCCNCC(C)(C)CO 2230a_100020635058_100000755133 [0,2,0,0,0,0|2,0,0]=4 16095 B16R0.2482 CCOC(=O)CCCCCNCC(C)(C)OC 2230a_100000763424_100000755133 [0,2,0,0,0,0|2,0,0]=4 16096 B16R0.2482 CCOC(=O)CCCCCOCC(C)(C)CC 7a_100000765029_100000755133 [0,2,0,0,0,0|1,0,0]=3 16097 B16R0.2482 CCOC(=O)CCCCCOCC(C)(C)CCl 7a_100011217199_100000755133 [0,2,0,0,0,0|2,0,0]=4 16098 B16R0.2482 CCOC(=O)CCCCCOCC(C)(C)CO 7a_100011214988_100009813988 [0,2,0,0,0,0|2,0,0]=4 16099 B16R0.2482 CCOC(=O)CCCCCOCC(F)(F)CN 34a_100000703232_100000755133 [0,2,0,0,0,0|2,0,0]=4 16100 B16R0.2482 CCOC(=O)CCCCCSCC(C)(C)CO 62a_100000755133_100009813988 [0,2,0,0,0,0|2,0,0]=4 16101 B16R0.2482 CCOC(=O)CCCCCSCC(C)(C)CO 62a_100009813988_100000755133 [0,2,0,0,0,0|2,0,0]=4 16102 B16R0.2482 CCOC(=O)CCCCCSCC(C)(C)OC 62a_100000701081_100000755133 [0,2,0,0,0,0|2,0,0]=4 16103 B16R0.2482 CCOC(=O)CCCCCSCC(C)(C)OC 62a_100000755133_100000701081 [0,2,0,0,0,0|2,0,0]=4 16104 B16R0.2482 CCOC(=O)CCCCNCCS(=O)(=O)CC 2230a_100000751051_100000750268 [0,2,0,0,0,0|2,0,0]=4 16105 B16R0.2482 CCOC(=O)CCCCNCCS(=O)(=O)CC 34a_100000751051_100000750268 [0,2,0,0,0,0|2,0,0]=4 16106 B16R0.2482 CCOC(=O)CCCCOCCC(C)(C)OC 7a_100000699976_100000750268 [0,2,0,0,0,0|2,0,0]=4 16107 B16R0.2482 CCOC(=O)CCCCOCCS(=O)(=O)CC 34a_200011216379_100000750268 [0,2,0,0,0,0|2,0,0]=4 16108 B16R0.2482 CCOC(=O)CCCCOCCS(=O)(=O)CC 7a_200011216379_100000750268 [0,2,0,0,0,0|2,0,0]=4 16109 B16R0.2482 CCOC(=O)CCCCSCCS(=O)(=O)CC 62a_100000750268_100000756660 [0,2,0,0,0,0|2,0,0]=4 16110 B16R0.2482 CCOC(=O)CCCCSCCS(=O)(=O)CC 62a_100000756660_100000750268 [0,2,0,0,0,0|2,0,0]=4 16111 B16R0.2482 CCOC(=O)CCCNCCCC(C)(C)CO 2230a_100000039164_100009991533 [0,2,0,0,0,0|2,0,0]=4 16112 B16R0.2482 CCOC(=O)COCCCOCC(C)(C)CC 7a_100000765029_100009893628 [0,2,0,0,0,0|2,0,0]=4 16113 B16R0.2709 C#CC(CC)OCCCCCCC(=O)OCC 34a_100000758843_100009814379 [0,2,0,0,0,0|1,0,0]=3 16114 B16R0.2709 C#CC(CC)OCCCCCCC(=O)OCC 7a_100000758843_100009814379 [0,2,0,0,0,0|1,0,0]=3 16115 B16R0.2709 C=CC(CC)OCCCCCCC(=O)OCC 34a_100000766422_100009814379 [0,2,0,0,0,0|1,0,0]=3 16116 B16R0.2709 C=CC(CC)OCCCCCCC(=O)OCC 7a_100000766422_100009814379 [0,2,0,0,0,0|1,0,0]=3 16117 B16R0.2709 C=C[C@@H](CO)NCCCCCCC(=O)OCC 2230a_100016989147_100009814379 [0,2,0,0,0,0|2,0,0]=4 16118 B16R0.2709 C=C[C@@H](CO)NCCCCCCC(=O)OCC 34a_100016989147_100009814379 [0,2,0,0,0,0|2,0,0]=4 16119 B16R0.2709 CCOC(=O)CCCCCCCN(CC)CC 2230a_100000724800_100009991516 [0,2,0,0,0,0|1,0,0]=3 16120 B16R0.2709 CCOC(=O)CCCCCCCN(CC)CC 269956a_100000042499_100009991516 [0,2,0,0,0,0|1,0,0]=3 16121 B16R0.2709 CCOC(=O)CCCCCCCN(CC)CC 269982a_100000724800_100009991516 [0,2,0,0,0,0|1,0,0]=3 16122 B16R0.2709 CCOC(=O)CCCCCCNC(CC)CC 2230a_100000199018_100009814379 [0,2,0,0,0,0|1,0,0]=3 16123 B16R0.2709 CCOC(=O)CCCCCCNC(CO)CO 2230a_100000759517_100009814379 [0,2,0,0,0,0|2,0,0]=4 16124 B16R0.2709 CCOC(=O)CCCCCCN[C@@H](CC)CO 2230a_100000709445_100009814379 [0,2,0,0,0,0|1,0,0]=3 16125 B16R0.2709 CCOC(=O)CCCCCCOC(CC)CC 7a_100000688536_100009814379 [0,2,0,0,0,0|1,0,0]=3 16126 B16R0.2709 CCOC(=O)CCCCCCOC(CCl)CCl 7a_100000737055_100009814379 [0,2,0,0,0,0|2,0,0]=4 16127 B16R0.2709 CCOC(=O)CCCCCCOC(CF)CF 34a_100000032261_100009814379 [0,2,0,0,0,0|2,0,0]=4 16128 B16R0.2709 CCOC(=O)CCCCCCOC(CF)CF 7a_100000032261_100009814379 [0,2,0,0,0,0|2,0,0]=4 16129 B16R0.2709 CCOC(=O)CCCCCCOC(CN)CN 34a_100000031598_100009814379 [0,2,0,0,0,0|2,0,0]=4 16130 B16R0.2709 CCOC(=O)CCCCCCO[C@@H](CF)CCl 34a_100015614560_100009814379 [0,2,0,0,0,0|2,0,0]=4 16131 B16R0.2709 CCOC(=O)CCCCCCO[C@@H](CF)CCl 7a_100015614560_100009814379 [0,2,0,0,0,0|2,0,0]=4 16132 B16R0.2709 CCOC(=O)CCCCCCSC(CC)CC 62a_100000210505_100009814379 [0,2,0,0,0,0|1,0,0]=3 16133 B16R0.2709 CCOC(=O)CCCCCNCC(CC)CC 2230a_100102946423_100000755133 [0,2,0,0,0,0|1,0,0]=3 16134 B16R0.2709 CCOC(=O)CCCCCOCC(CC)CC 7a_100000703878_100000755133 [0,2,0,0,0,0|1,0,0]=3 16135 B16R0.2709 CCOC(=O)CCCCCOCC(CC)CC 7a_100011214988_100011215472 [0,2,0,0,0,0|1,0,0]=3 16136 B16R0.2709 CCOC(=O)CCCCCOCC(CC)OC 34a_100011934954_100000755133 [0,2,0,0,0,0|1,0,0]=3 16137 B16R0.2709 CCOC(=O)CCCCCOCC(CC)OC 7a_100011934954_100000755133 [0,2,0,0,0,0|1,0,0]=3 16138 B16R0.2709 CCOC(=O)CCCCCOCC(OC)OC 34a_100011216393_100000755133 [0,2,0,0,0,0|2,0,0]=4 16139 B16R0.2709 CCOC(=O)CCCCCOCC(OC)OC 7a_100011214988_100000751394 [0,2,0,0,0,0|2,0,0]=4 16140 B16R0.2709 CCOC(=O)CCCCCOCN(CC)CC 7a_200015374951_100000755133 [0,2,0,0,0,0|2,0,0]=4 16141 B16R0.2709 CCOC(=O)CCCCCSCC(CC)CC 62a_100000755133_100011215472 [0,2,0,0,0,0|1,0,0]=3 16142 B16R0.2709 CCOC(=O)CCCCCSCC(CC)CC 62a_100011215472_100000755133 [0,2,0,0,0,0|1,0,0]=3 16143 B16R0.2709 CCOC(=O)CCCCCSCC(OC)OC 62a_100000751394_100000755133 [0,2,0,0,0,0|2,0,0]=4 16144 B16R0.2709 CCOC(=O)CCCCCSCC(OC)OC 62a_100000755133_100000751394 [0,2,0,0,0,0|2,0,0]=4 16145 B16R0.2709 CCOC(=O)CCCCNCCN(CC)CC 2230a_100015382049_100000750268 [0,2,0,0,0,0|2,0,0]=4 16146 B16R0.2709 CCOC(=O)CCCCOCCN(CC)CC 7a_100016990331_100000750268 [0,2,0,0,0,0|2,0,0]=4 16147 B16R0.2709 CCOC(=O)CCCCSCCC(OC)OC 62a_100000139399_100000750268 [0,2,0,0,0,0|2,0,0]=4 16148 B16R0.2709 CCOC(=O)CCCCSCCC(OC)OC 62a_100000750268_100000139399 [0,2,0,0,0,0|2,0,0]=4 16149 B16R0.2709 CCOC(=O)CCCCSCCN(CC)CC 62a_100000750268_100000700428 [0,2,0,0,0,0|2,0,0]=4 16150 B16R0.2709 CCOC(=O)CCCOCCCC(OC)OC 7a_100012001163_100000069011 [0,2,0,0,0,0|2,0,0]=4 16151 B16R0.2709 CCOC(=O)CCCOCCCN(CC)CC 7a_100000212844_100011215271 [0,2,0,0,0,0|2,0,0]=4 16152 B16R0.2709 CCOC(=O)CCCOCCCN(CC)CC 7a_100012001163_100000709985 [0,2,0,0,0,0|2,0,0]=4 16153 B16R0.2709 CCOC(=O)CCCSCCCC(OC)OC 62a_100000069011_100009991533 [0,2,0,0,0,0|2,0,0]=4 16154 B16R0.2709 CCOC(=O)CCCSCCCC(OC)OC 62a_100009991533_100000069011 [0,2,0,0,0,0|2,0,0]=4 16155 B16R0.2709 CCOC(=O)CCCSCCCN(CC)CC 62a_100009991533_100000709985 [0,2,0,0,0,0|2,0,0]=4 16156 B16R0.2709 CCOC(=O)CCNCCCCN(CC)CC 2230a_100000743895_100011206558 [0,2,0,0,0,0|2,0,0]=4 16157 B16R0.2709 CCOC(=O)CCOCCCCN(CC)CC 7a_100011305530_100011206558 [0,2,0,0,0,0|2,0,0]=4 16158 B16R0.2709 CCOC(=O)CCOCCCCN(CC)N=O 34a_200000035056_100000765890 [0,2,0,0,0,0|2,0,0]=4 16159 B16R0.2709 CCOC(=O)CNCCCCCN(CC)CC 2230a_100011491781_100000188475 [0,2,0,0,0,0|2,0,0]=4 16160 B16R0.2709 CCOC(=O)COCCCCCN(CC)CC 7a_200011629222_100000188475 [0,2,0,0,0,0|2,0,0]=4 16161 B16R0.2709 CCOC(=O)COCCCNCC(CC)CC 2230a_100102946423_100009893628 [0,2,0,0,0,0|2,0,0]=4 16162 B16R0.2709 CCOC(=O)COCCCOCC(CC)CC 7a_100000703878_100009893628 [0,2,0,0,0,0|2,0,0]=4 16163 B16R0.2709 CCOC(=O)COCCCOCC(CC)OC 34a_100011934954_100009893628 [0,2,0,0,0,0|2,0,0]=4 16164 B16R0.2709 CCOC(=O)COCCCOCC(CC)OC 7a_100011934954_100009893628 [0,2,0,0,0,0|2,0,0]=4 16165 B16R0.2709 CCOC(=O)COCCCSCC(CC)CC 62a_100009893628_100011215472 [0,2,0,0,0,0|2,0,0]=4 16166 B16R0.2709 CCOC(=O)COCCCSCC(CC)CC 62a_100011215472_100009893628 [0,2,0,0,0,0|2,0,0]=4 16167 B16R0.2011 CCCC(C)(C)COCCCCC(=O)OCC 7a_100011995695_100000750268 [0,2,0,0,0,0|1,0,0]=3 16168 B16R0.2011 CCCC(C)(C)COCCOCC(=O)OCC 7a_100011995695_100000088970 [0,2,0,0,0,0|2,0,0]=4 16169 B16R0.2011 CCCC(C)(C)OCCCCCC(=O)OCC 7a_100000748436_100000755133 [0,2,0,0,0,0|1,0,0]=3 16170 B16R0.2011 CCCC(C)(C)OCCCOCC(=O)OCC 7a_100000748436_100009893628 [0,2,0,0,0,0|2,0,0]=4 16171 B16R0.2011 CCNC(C)(C)COCCCCC(=O)OCC 7a_100000747347_100000750268 [0,2,0,0,0,0|2,0,0]=4 16172 B16R0.2011 CCOC(=O)CCCCCNC(C)(C)COC 2230a_100000752728_100000755133 [0,2,0,0,0,0|2,0,0]=4 16173 B16R0.2011 CCOC(=O)CCCCCNC(C)(C)CSC 2230a_100000759623_100000755133 [0,2,0,0,0,0|2,0,0]=4 16174 B16R0.2011 CCOC(=O)CCCCCNC(C)(C)CSC 7a_100000759623_100000755133 [0,2,0,0,0,0|2,0,0]=4 16175 B16R0.2011 CCOC(=O)CCCCCOC(C)(C)CCBr 7a_100000702414_100000755133 [0,2,0,0,0,0|2,0,0]=4 16176 B16R0.2011 CCOC(=O)CCCCNCC(C)(C)COC 2230a_100000734190_100000750268 [0,2,0,0,0,0|2,0,0]=4 16177 B16R0.3233 C#CC(CCC)OCCCCCC(=O)OCC 34a_200011217317_100000755133 [0,2,0,0,0,0|1,0,0]=3 16178 B16R0.3233 C#CC(CCC)OCCCCCC(=O)OCC 7a_200011217317_100000755133 [0,2,0,0,0,0|1,0,0]=3 16179 B16R0.3233 C#CC(CCC)OCCCOCC(=O)OCC 34a_200011217317_100009893628 [0,2,0,0,0,0|2,0,0]=4 16180 B16R0.3233 C#CC(CCC)OCCCOCC(=O)OCC 7a_200011217317_100009893628 [0,2,0,0,0,0|2,0,0]=4 16181 B16R0.3233 C=CC(CCC)OCCCCCC(=O)OCC 34a_100011216692_100000755133 [0,2,0,0,0,0|1,0,0]=3 16182 B16R0.3233 C=CC(CCC)OCCCCCC(=O)OCC 7a_100011216692_100000755133 [0,2,0,0,0,0|1,0,0]=3 16183 B16R0.3233 C=CC(CCC)OCCCOCC(=O)OCC 34a_100011216692_100009893628 [0,2,0,0,0,0|2,0,0]=4 16184 B16R0.3233 C=CC(CCC)OCCCOCC(=O)OCC 7a_100011216692_100009893628 [0,2,0,0,0,0|2,0,0]=4 16185 B16R0.3233 CCCC(C#N)OCCCCCC(=O)OCC 34a_100000686963_100000755133 [0,2,0,0,0,0|1,0,0]=3 16186 B16R0.3233 CCCC(C#N)OCCCCCC(=O)OCC 7a_100000686963_100000755133 [0,2,0,0,0,0|1,0,0]=3 16187 B16R0.3233 CCCC(C#N)OCCCOCC(=O)OCC 34a_100000686963_100009893628 [0,2,0,0,0,0|2,0,0]=4 16188 B16R0.3233 CCCC(C#N)OCCCOCC(=O)OCC 7a_100000686963_100009893628 [0,2,0,0,0,0|2,0,0]=4 16189 B16R0.3233 CCCC(CC)NCCCCCC(=O)OCC 2230a_100000747048_100000755133 [0,2,0,0,0,0|1,0,0]=3 16190 B16R0.3233 CCCC(CC)NCCCOCC(=O)OCC 2230a_100000747048_100009893628 [0,2,0,0,0,0|2,0,0]=4 16191 B16R0.3233 CCCC(CC)OCCCCCC(=O)OCC 34a_100000687864_100000755133 [0,2,0,0,0,0|1,0,0]=3 16192 B16R0.3233 CCCC(CC)OCCCCCC(=O)OCC 7a_100000687864_100000755133 [0,2,0,0,0,0|1,0,0]=3 16193 B16R0.3233 CCCC(CC)OCCCCCC(=O)OCC 7a_100011214988_100011219200 [0,2,0,0,0,0|1,0,0]=3 16194 B16R0.3233 CCCC(CC)OCCCOCC(=O)OCC 34a_100000687864_100009893628 [0,2,0,0,0,0|2,0,0]=4 16195 B16R0.3233 CCCC(CC)OCCCOCC(=O)OCC 7a_100000687864_100009893628 [0,2,0,0,0,0|2,0,0]=4 16196 B16R0.3233 CCCC(CC)SCCCCCC(=O)OCC 62a_100000755133_100011219200 [0,2,0,0,0,0|1,0,0]=3 16197 B16R0.3233 CCCC(CC)SCCCCCC(=O)OCC 62a_100011219200_100000755133 [0,2,0,0,0,0|1,0,0]=3 16198 B16R0.3233 CCCC(CC)SCCCOCC(=O)OCC 62a_100009893628_100011219200 [0,2,0,0,0,0|2,0,0]=4 16199 B16R0.3233 CCCC(CC)SCCCOCC(=O)OCC 62a_100011219200_100009893628 [0,2,0,0,0,0|2,0,0]=4 16200 B16R0.3233 CCCC(CCOCCCC(=O)OCC)SC 34a_100000032865_100009991533 [0,2,0,0,0,0|1,0,0]=3 16201 B16R0.3233 CCCC(CCOCCCC(=O)OCC)SC 7a_100000032865_100011215271 [0,2,0,0,0,0|1,0,0]=3 16202 B16R0.3233 CCCC(CCOCCNC(=O)OCC)SC 7a_100000032865_200011445536 [0,2,0,0,0,0|2,0,0]=4 16203 B16R0.3233 CCCN(CC)CCCCCCC(=O)OCC 2230a_100000226822_100009814379 [0,2,0,0,0,0|1,0,0]=3 16204 B16R0.3233 CCCN(CC)CCCCCCC(=O)OCC 269982a_100000226822_100009814379 [0,2,0,0,0,0|1,0,0]=3 16205 B16R0.3233 CCC[C@@H](CO)NCCCCCC(=O)OCC 2230a_100000732646_100000755133 [0,2,0,0,0,0|1,0,0]=3 16206 B16R0.3233 CCC[C@@H](CO)NCCCCCC(=O)OCC 34a_100000732646_100000755133 [0,2,0,0,0,0|1,0,0]=3 16207 B16R0.3233 CCC[C@@H](CO)NCCCOCC(=O)OCC 2230a_100000732646_100009893628 [0,2,0,0,0,0|2,0,0]=4 16208 B16R0.3233 CCC[C@@H](CO)NCCCOCC(=O)OCC 34a_100000732646_100009893628 [0,2,0,0,0,0|2,0,0]=4 16209 B16R0.3233 CCOC(=O)CCCCCCN(CC)CCO 2230a_100000210973_100009814379 [0,2,0,0,0,0|2,0,0]=4 16210 B16R0.3233 CCOC(=O)CCCCCCN(CC)CCO 269982a_100000210973_100009814379 [0,2,0,0,0,0|2,0,0]=4 16211 B16R0.3233 CCOC(=O)CCCCCNC(CC)COC 2230a_100000757820_100000755133 [0,2,0,0,0,0|2,0,0]=4 16212 B16R0.3233 CCOC(=O)CCCCCNC(CO)COC 2230a_100000724102_100000755133 [0,2,0,0,0,0|2,0,0]=4 16213 B16R0.3233 CCOC(=O)CCCCCNC(CO)COC 34a_100000724102_100000755133 [0,2,0,0,0,0|2,0,0]=4 16214 B16R0.3233 CCOC(=O)CCCCCOC(CC)COC 7a_200011214946_100000755133 [0,2,0,0,0,0|2,0,0]=4 16215 B16R0.3233 CCOC(=O)CCCCCOC(CCl)COC 34a_100011215053_100000755133 [0,2,0,0,0,0|2,0,0]=4 16216 B16R0.3233 CCOC(=O)CCCCCOC(CN)COC 34a_100000756049_100000755133 [0,2,0,0,0,0|2,0,0]=4 16217 B16R0.3233 CCOC(=O)CCCCNCC(CC)OCC 2230a_100015183923_100000750268 [0,2,0,0,0,0|2,0,0]=4 16218 B16R0.3233 CCOC(=O)CCCCNCC(CC)OCC 34a_100015183923_100000750268 [0,2,0,0,0,0|2,0,0]=4 16219 B16R0.8580 CCCCCCCCCCS(=O)(=O)NCCC 270084a_100020643023_200011217601 [0,2,0,0,0,0|2,0,0]=4 16220 B16R0.8580 CCCCCCCCCCS(=O)(=O)NCCC 274078a_100020643023_200011217601 [0,2,0,0,0,0|2,0,0]=4 16221 B16R0.8580 CCCCCCCCCCS(=O)(=O)NCCF 270084a_100000724931_200011217601 [0,2,0,0,0,0|2,0,0]=4 16222 B16R0.8580 CCCCCCCCCCS(=O)(=O)NCCF 274078a_100000724931_200011217601 [0,2,0,0,0,0|2,0,0]=4 16223 B16R0.8580 CCCCCCCCCCS(=O)(=O)NCCO 270084a_100000210304_200011217601 [0,2,0,0,0,0|2,0,0]=4 16224 B16R0.8580 CCCCCCCCCCS(=O)(=O)NCCO 274078a_100000210304_200011217601 [0,2,0,0,0,0|2,0,0]=4 16225 B16R0.68 C#CCCCC(=O)CCCCCCCCCC 1458a_100000210375_100000731252 [0,2,0,0,0,0|1,0,0]=3 16226 B16R0.68 C#CCCCC(=O)CCCCCCCCCC 1458a_100000690238_100000210319 [0,2,0,0,0,0|1,0,0]=3 16227 B16R0.68 C#CCCCC(=O)CCCCCCCCCF 1458a_200009909015_100000731252 [0,2,0,0,0,0|2,0,0]=4 16228 B16R0.68 C#CCCCC(=O)CCCCCCCCCO 1458a_100000690238_100009813782 [0,2,0,0,0,0|2,0,0]=4 16229 B16R0.68 C#CCCCC(=O)COCCCCCCCC 1458a_100000759886_100000731252 [0,2,0,0,0,0|2,0,0]=4 16230 B16R0.68 C#CCCCC(=O)NCCCCCCCCC 11a_100000212291_100000690238 [0,2,0,0,0,0|2,0,0]=4 16231 B16R0.68 C#CCCCC(=O)NCCCCCCCCC 1626a_100000212291_100000690238 [0,2,0,0,0,0|2,0,0]=4 16232 B16R0.68 C#CCCCC(=O)NCCCCCCCCC 240690a_100000212291_100000690238 [0,2,0,0,0,0|2,0,0]=4 16233 B16R0.68 C#CCCCC(=O)NCCCCCCCCC 527a_100000212291_100000690238 [0,2,0,0,0,0|2,0,0]=4 16234 B16R0.68 C#CCCCCCCCCC(=O)CCOCC 1458a_100000029693_100011215890 [0,2,0,0,0,0|0,0,2]=4 16235 B16R0.68 C#CCCNC(=O)CCCCCCCCCC 11a_100000755551_100000210375 [0,2,0,0,0,0|1,0,0]=3 16236 B16R0.68 C#CCCNC(=O)CCCCCCCCCC 1626a_100000755551_100000210375 [0,2,0,0,0,0|1,0,0]=3 16237 B16R0.68 C#CCCNC(=O)CCCCCCCCCC 240690a_100000755551_100000210375 [0,2,0,0,0,0|1,0,0]=3 16238 B16R0.68 C#CCCNC(=O)CCCCCCCCCF 11a_100000755551_200009909015 [0,2,0,0,0,0|2,0,0]=4 16239 B16R0.68 C#CCCNC(=O)CCCCCCCCCF 240690a_100000755551_200009909015 [0,2,0,0,0,0|2,0,0]=4 16240 B16R0.68 C#CCCNC(=O)CCCCCCCCCF 527a_100000755551_200009909015 [0,2,0,0,0,0|2,0,0]=4 16241 B16R0.68 C#CCCNC(=O)CCCCCCCCCO 240690a_100000755551_100000032657 [0,2,0,0,0,0|2,0,0]=4 16242 B16R0.68 C#CCCNC(=O)COCCCCCCCC 11a_100000755551_100000759886 [0,2,0,0,0,0|2,0,0]=4 16243 B16R0.68 C#CCCNC(=O)COCCCCCCCC 1626a_100000755551_100000759886 [0,2,0,0,0,0|2,0,0]=4 16244 B16R0.68 C#CCCNC(=O)COCCCCCCCC 240690a_100000755551_100000759886 [0,2,0,0,0,0|2,0,0]=4 16245 B16R0.68 C#CCCNC(=O)COCCCCCCCC 527a_100000755551_100000759886 [0,2,0,0,0,0|2,0,0]=4 16246 B16R0.68 C#CCCNC(=O)NCCCCCCCCC 2708a_100000212291_100000755551 [0,2,0,0,0,0|2,0,0]=4 16247 B16R0.68 C#CCCNC(=O)NCCCCCCCCC 2708a_100000755551_100000212291 [0,2,0,0,0,0|2,0,0]=4 16248 B16R0.68 C#CCCNC(=O)NCCCCCCCCC 273464a_100000212291_100000755551 [0,2,0,0,0,0|2,0,0]=4 16249 B16R0.68 C#CCCNC(=O)NCCCCCCCCC 273464a_100000755551_100000212291 [0,2,0,0,0,0|2,0,0]=4 16250 B16R0.68 C#CCCNC(=O)NCCCCCCCCC 512a_100000212291_100000755551 [0,2,0,0,0,0|2,0,0]=4 16251 B16R0.68 C#CCCNC(=O)NCCCCCCCCC 512a_100000755551_100000212291 [0,2,0,0,0,0|2,0,0]=4 16252 B16R0.68 C#CCCOC(C)CCCCCCCCCC 34a_100011215000_100000688953 [0,2,0,0,0,0|1,0,1]=4 16253 B16R0.68 C#CCCOC(C)CCCCCCCCCC 7a_100011215000_100000688953 [0,2,0,0,0,0|1,0,1]=4 16254 B16R0.68 C#CCOCC(=O)CCCCCCCCCC 1458a_100011251226_100000210319 [0,2,0,0,0,0|0,0,1]=3 16255 B16R0.68 C#CCOCC(=O)CCCCCCCCCO 1458a_100011251226_100009813782 [0,2,0,0,0,0|1,0,1]=4 16256 B16R0.68 C#CCOCC(=O)NCCCCCCCCC 11a_100000212291_100011251226 [0,2,0,0,0,0|1,0,1]=4 16257 B16R0.68 C#CCOCC(=O)NCCCCCCCCC 1626a_100000212291_100011251226 [0,2,0,0,0,0|1,0,1]=4 16258 B16R0.68 C#CCOCC(=O)NCCCCCCCCC 527a_100000212291_100011251226 [0,2,0,0,0,0|1,0,1]=4 16259 B16R0.68 C=CCCCC(=O)CCCCCCCCCO 1458a_100000766728_100009813782 [0,2,0,0,0,0|2,0,0]=4 16260 B16R0.68 C=CCCCC(=O)COCCCCCCCC 1458a_100000759886_100000757094 [0,2,0,0,0,0|2,0,0]=4 16261 B16R0.68 C=CCCCC(=O)NCCCCCCCCC 11a_100000212291_100000766728 [0,2,0,0,0,0|2,0,0]=4 16262 B16R0.68 C=CCCCC(=O)NCCCCCCCCC 1626a_100000212291_100000766728 [0,2,0,0,0,0|2,0,0]=4 16263 B16R0.68 C=CCCCC(=O)NCCCCCCCCC 240690a_100000212291_100000766728 [0,2,0,0,0,0|2,0,0]=4 16264 B16R0.68 C=CCCCC(=O)NCCCCCCCCC 527a_100000212291_100000766728 [0,2,0,0,0,0|2,0,0]=4 16265 B16R0.68 C=CCCCCCCCCC(=O)C=COCC 1458a_100016266692_100011933949 [0,2,0,0,0,0|0,0,2]=4 16266 B16R0.68 C=CCCCCCCCCC(=O)CCOCC 1458a_100000211349_100011215890 [0,2,0,0,0,0|0,0,2]=4 16267 B16R0.68 C=CCCCCCCCCC(=O)CCOCC 1458a_100000749530_100011933949 [0,2,0,0,0,0|0,0,2]=4 16268 B16R0.68 C=CCCCCCCCCC(=O)COCCC 1458a_100000745993_100011933949 [0,2,0,0,0,0|0,0,2]=4 16269 B16R0.68 C=CCCCCCCCCC(=O)COCCO 1458a_100000708028_100011933949 [0,2,0,0,0,0|0,0,2]=4 16270 B16R0.68 C=CCCNC(=O)CCCCCCCCCC 11a_100015191253_100000210375 [0,2,0,0,0,0|1,0,0]=3 16271 B16R0.68 C=CCCNC(=O)CCCCCCCCCC 1626a_100015191253_100000210375 [0,2,0,0,0,0|1,0,0]=3 16272 B16R0.68 C=CCCNC(=O)CCCCCCCCCC 240690a_100015191253_100000210375 [0,2,0,0,0,0|1,0,0]=3 16273 B16R0.68 C=CCCNC(=O)CCCCCCCCCF 11a_100015191253_200009909015 [0,2,0,0,0,0|2,0,0]=4 16274 B16R0.68 C=CCCNC(=O)CCCCCCCCCF 240690a_100015191253_200009909015 [0,2,0,0,0,0|2,0,0]=4 16275 B16R0.68 C=CCCNC(=O)CCCCCCCCCF 527a_100015191253_200009909015 [0,2,0,0,0,0|2,0,0]=4 16276 B16R0.68 C=CCCNC(=O)CCCCCCCCCO 240690a_100015191253_100000032657 [0,2,0,0,0,0|2,0,0]=4 16277 B16R0.68 C=CCCNC(=O)COCCCCCCCC 11a_100015191253_100000759886 [0,2,0,0,0,0|2,0,0]=4 16278 B16R0.68 C=CCCNC(=O)COCCCCCCCC 1626a_100015191253_100000759886 [0,2,0,0,0,0|2,0,0]=4 16279 B16R0.68 C=CCCNC(=O)COCCCCCCCC 240690a_100015191253_100000759886 [0,2,0,0,0,0|2,0,0]=4 16280 B16R0.68 C=CCCNC(=O)COCCCCCCCC 527a_100015191253_100000759886 [0,2,0,0,0,0|2,0,0]=4 16281 B16R0.68 C=CCCNC(=O)NCCCCCCCCC 2708a_100000212291_100015191253 [0,2,0,0,0,0|2,0,0]=4 16282 B16R0.68 C=CCCNC(=O)NCCCCCCCCC 2708a_100015191253_100000212291 [0,2,0,0,0,0|2,0,0]=4 16283 B16R0.68 C=CCCNC(=O)NCCCCCCCCC 273464a_100000212291_100015191253 [0,2,0,0,0,0|2,0,0]=4 16284 B16R0.68 C=CCCNC(=O)NCCCCCCCCC 273464a_100015191253_100000212291 [0,2,0,0,0,0|2,0,0]=4 16285 B16R0.68 C=CCCNC(=O)NCCCCCCCCC 512a_100000212291_100015191253 [0,2,0,0,0,0|2,0,0]=4 16286 B16R0.68 C=CCCNC(=O)NCCCCCCCCC 512a_100015191253_100000212291 [0,2,0,0,0,0|2,0,0]=4 16287 B16R0.68 C=CCNNC(=O)CCCCCCCCCC 22a_100020588587_100000210375 [0,2,0,0,0,0|1,0,1]=4 16288 B16R0.68 C=COCCC(=O)CCCCCCCCCC 1458a_100000210375_100000039644 [0,2,0,0,0,0|0,0,2]=4 16289 B16R0.68 CC#CCCCCCCCC(=O)CCOCC 1458a_100000066323_100011215890 [0,2,0,0,0,0|0,0,2]=4 16290 B16R0.68 CC#CCNC(=O)CCCCCCCCCC 11a_100000685387_100000210375 [0,2,0,0,0,0|1,0,0]=3 16291 B16R0.68 CC#CCNC(=O)CCCCCCCCCC 1626a_100000685387_100000210375 [0,2,0,0,0,0|1,0,0]=3 16292 B16R0.68 CC#CCNC(=O)CCCCCCCCCF 11a_100000685387_200009909015 [0,2,0,0,0,0|2,0,0]=4 16293 B16R0.68 CC#CCNC(=O)CCCCCCCCCF 527a_100000685387_200009909015 [0,2,0,0,0,0|2,0,0]=4 16294 B16R0.68 CC#CCNC(=O)COCCCCCCCC 11a_100000685387_100000759886 [0,2,0,0,0,0|2,0,0]=4 16295 B16R0.68 CC#CCNC(=O)COCCCCCCCC 1626a_100000685387_100000759886 [0,2,0,0,0,0|2,0,0]=4 16296 B16R0.68 CC#CCNC(=O)COCCCCCCCC 527a_100000685387_100000759886 [0,2,0,0,0,0|2,0,0]=4 16297 B16R0.68 CC#CCNC(=O)NCCCCCCCCC 2708a_100000212291_100000685387 [0,2,0,0,0,0|2,0,0]=4 16298 B16R0.68 CC#CCNC(=O)NCCCCCCCCC 273464a_100000212291_100000685387 [0,2,0,0,0,0|2,0,0]=4 16299 B16R0.68 CC#CCNC(=O)NCCCCCCCCC 273464a_100000685387_100000212291 [0,2,0,0,0,0|2,0,0]=4 16300 B16R0.68 CC#CCNC(=O)NCCCCCCCCC 512a_100000212291_100000685387 [0,2,0,0,0,0|2,0,0]=4 16301 B16R0.68 CC#CCNC(=O)NCCCCCCCCC 512a_100000685387_100000212291 [0,2,0,0,0,0|2,0,0]=4 16302 B16R0.68 CC#CCOC(C)CCCCCCCCCC 34a_100011215000_100000748600 [0,2,0,0,0,0|1,0,1]=4 16303 B16R0.68 CC#CCOC(C)CCCCCCCCCC 7a_100011215000_100000748600 [0,2,0,0,0,0|1,0,1]=4 16304 B16R0.68 CC/C=C/CC(=O)CCCCCCCCCO 1458a_100016274230_100009813782 [0,2,0,0,0,0|2,0,0]=4 16305 B16R0.68 CC/C=C/CC(=O)NCCCCCCCCC 11a_100000212291_100016274230 [0,2,0,0,0,0|2,0,0]=4 16306 B16R0.68 CC/C=C/CC(=O)NCCCCCCCCC 1626a_100000212291_100016274230 [0,2,0,0,0,0|2,0,0]=4 16307 B16R0.68 CC/C=C/CC(=O)NCCCCCCCCC 240690a_100000212291_100016274230 [0,2,0,0,0,0|2,0,0]=4 16308 B16R0.68 CC/C=C/CC(=O)NCCCCCCCCC 527a_100000212291_100016274230 [0,2,0,0,0,0|2,0,0]=4 16309 B16R0.68 CC/C=C\CC(=O)COCCCCCCCC 1458a_100000759886_100103147603 [0,2,0,0,0,0|2,0,0]=4 16310 B16R0.68 CCC#CCC(=O)CCCCCCCCCC 1458a_100000210375_100009813939 [0,2,0,0,0,0|1,0,0]=3 16311 B16R0.68 CCC#CCC(=O)CCCCCCCCCF 1458a_200009909015_100009813939 [0,2,0,0,0,0|2,0,0]=4 16312 B16R0.68 CCC#CCC(=O)COCCCCCCCC 1458a_100000759886_100009813939 [0,2,0,0,0,0|2,0,0]=4 16313 B16R0.68 CCC#CCCCCCCC(=O)C=COCC 1458a_100016266692_200000036426 [0,2,0,0,0,0|0,0,2]=4 16314 B16R0.68 CCC#CCCCCCCC(=O)CCOCC 1458a_100000749530_200000036426 [0,2,0,0,0,0|0,0,2]=4 16315 B16R0.68 CCC#CCCCCCCC(=O)COCCC 1458a_100000745993_200000036426 [0,2,0,0,0,0|0,0,2]=4 16316 B16R0.68 CCC#CCCCCCCC(=O)COCCO 1458a_100000708028_200000036426 [0,2,0,0,0,0|0,0,2]=4 16317 B16R0.68 CCCC#CC(=O)CCCCCCCCCC 1458a_200011218047_100000210319 [0,2,0,0,0,0|1,0,0]=3 16318 B16R0.68 CCCC#CC(=O)CCCCCCCCCO 1458a_200011218047_100009813782 [0,2,0,0,0,0|2,0,0]=4 16319 B16R0.68 CCCC#CC(=O)NCCCCCCCCC 240690a_100000212291_200011218047 [0,2,0,0,0,0|2,0,0]=4 16320 B16R0.68 CCCC=CC(=O)CCCCCCCCCO 1458a_100000212230_100009813782 [0,2,0,0,0,0|2,0,0]=4 16321 B16R0.68 CCCC=CC(=O)NCCCCCCCCC 11a_100000212291_100000212230 [0,2,0,0,0,0|2,0,0]=4 16322 B16R0.68 CCCC=CC(=O)NCCCCCCCCC 1626a_100000212291_100000212230 [0,2,0,0,0,0|2,0,0]=4 16323 B16R0.68 CCCC=CC(=O)NCCCCCCCCC 240690a_100000212291_100000212230 [0,2,0,0,0,0|2,0,0]=4 16324 B16R0.68 CCCCCC(=O)CCCCCCCCCO 1458a_100000212188_100009813782 [0,2,0,0,0,0|2,0,0]=4 16325 B16R0.68 CCCCCCCCC=CC(=O)CCOCC 1458a_100015345288_100011215890 [0,2,0,0,0,0|0,0,2]=4 16326 B16R0.68 CCCCCCCCCCC(=NNCCC)C 4a_100000740057_200011219864 [0,2,0,0,0,0|2,0,0]=4 16327 B16R0.68 CCCCCCCCCCC(=NNCCO)C 4a_100000210001_200011219864 [0,2,0,0,0,0|2,0,0]=4 16328 B16R0.68 CCCCCCCCCCC(=O)C=CCOC 1458a_100016285016_100000210319 [0,2,0,0,0,0|1,0,0]=3 16329 B16R0.68 CCCCCCCCCCC(=O)C=COCC 1458a_100016266692_100000210319 [0,2,0,0,0,0|0,0,0]=2 16330 B16R0.68 CCCCCCCCCCC(=O)CC#CCO 1458a_100000210375_200000047223 [0,2,0,0,0,0|1,0,1]=4 16331 B16R0.68 CCCCCCCCCCC(=O)CCCC#N 1458a_100000075515_100000210319 [0,2,0,0,0,0|1,0,0]=3 16332 B16R0.68 CCCCCCCCCCC(=O)CCCC#N 1458a_100000210375_100000211468 [0,2,0,0,0,0|1,0,0]=3 16333 B16R0.68 CCCCCCCCCCC(=O)CCCCO 1458a_100000210375_100000210776 [0,2,0,0,0,0|1,0,0]=3 16334 B16R0.68 CCCCCCCCCCC(=O)CCCCO 1458a_100000695505_100000210319 [0,2,0,0,0,0|1,0,0]=3 16335 B16R0.68 CCCCCCCCCCC(=O)CCCOC 1458a_100000210375_100000740836 [0,2,0,0,0,0|1,0,0]=3 16336 B16R0.68 CCCCCCCCCCC(=O)CCCOC 1458a_100000741012_100000210319 [0,2,0,0,0,0|1,0,0]=3 16337 B16R0.68 CCCCCCCCCCC(=O)CCN=[N+]=[N-] 1458a_100000688302_100000210319 [0,2,0,0,0,0|2,0,0]=4 16338 B16R0.68 CCCCCCCCCCC(=O)CCOCC 1458a_100000210375_100011215890 [0,2,0,0,0,0|0,0,0]=2 16339 B16R0.68 CCCCCCCCCCC(=O)CCOCC 1458a_100000749530_100000210319 [0,2,0,0,0,0|0,0,0]=2 16340 B16R0.68 CCCCCCCCCCC(=O)COCCC 1458a_100000745993_100000210319 [0,2,0,0,0,0|0,0,0]=2 16341 B16R0.68 CCCCCCCCCCC(=O)COCCO 1458a_100000708028_100000210319 [0,2,0,0,0,0|0,0,0]=2 16342 B16R0.68 CCCCCCCCCCC(=O)CSCC#N 1458a_100000150266_100000210319 [0,2,0,0,0,0|0,1,1]=4 16343 B16R0.68 CCCCCCCCCCC(=O)NCCC#N 11a_100000720768_100000210375 [0,2,0,0,0,0|1,0,0]=3 16344 B16R0.68 CCCCCCCCCCC(=O)NCCC#N 1626a_100000720768_100000210375 [0,2,0,0,0,0|1,0,0]=3 16345 B16R0.68 CCCCCCCCCCC(=O)NCCC#N 240690a_100000720768_100000210375 [0,2,0,0,0,0|1,0,0]=3 16346 B16R0.68 CCCCCCCCCCC(=O)NCCCC 11a_100000102301_100000210375 [0,2,0,0,0,0|1,0,0]=3 16347 B16R0.68 CCCCCCCCCCC(=O)NCCCC 1626a_100000102301_100000210375 [0,2,0,0,0,0|1,0,0]=3 16348 B16R0.68 CCCCCCCCCCC(=O)NCCCC 240690a_100000102301_100000210375 [0,2,0,0,0,0|1,0,0]=3 16349 B16R0.68 CCCCCCCCCCC(=O)NCCCF 11a_100015189416_100000210375 [0,2,0,0,0,0|1,0,0]=3 16350 B16R0.68 CCCCCCCCCCC(=O)NCCCF 1626a_100015189416_100000210375 [0,2,0,0,0,0|1,0,0]=3 16351 B16R0.68 CCCCCCCCCCC(=O)NCCCF 240690a_100015189416_100000210375 [0,2,0,0,0,0|1,0,0]=3 16352 B16R0.68 CCCCCCCCCCC(=O)NCCCO 240690a_100000182051_100000210375 [0,2,0,0,0,0|1,0,0]=3 16353 B16R0.68 CCCCCCCCCCC(=O)NCCOC 1626a_100000209980_100000210375 [0,2,0,0,0,0|1,0,0]=3 16354 B16R0.68 CCCCCCCCCCC(=O)NCCOC 240690a_100000209980_100000210375 [0,2,0,0,0,0|1,0,0]=3 16355 B16R0.68 CCCCCCCCCCC(=O)NCCSC 11a_100020590264_100000210375 [0,2,0,0,0,0|1,0,0]=3 16356 B16R0.68 CCCCCCCCCCC(=O)NCCSC 1626a_100020590264_100000210375 [0,2,0,0,0,0|1,0,0]=3 16357 B16R0.68 CCCCCCCCCCC(=O)NCCSC 240690a_100020590264_100000210375 [0,2,0,0,0,0|1,0,0]=3 16358 B16R0.68 CCCCCCCCCCC(=O)NNCCC 22a_100000740057_100000210375 [0,2,0,0,0,0|1,0,0]=3 16359 B16R0.68 CCCCCCCCCCC(=O)NNCCO 22a_100000210001_100000210375 [0,2,0,0,0,0|1,0,0]=3 16360 B16R0.68 CCCCCCCCCCC(C)OCCC#N 7a_100011215000_100000184422 [0,2,0,0,0,0|1,0,1]=4 16361 B16R0.68 CCCCCCCCCCC(C)OCCCO 34a_100011215000_100000230001 [0,2,0,0,0,0|1,0,1]=4 16362 B16R0.68 CCCCCCCCCCC(C)OCCCO 7a_100011215000_100011215043 [0,2,0,0,0,0|1,0,1]=4 16363 B16R0.68 CCCCCCCCCCC(C)OCCOC 34a_100011215000_100011201679 [0,2,0,0,0,0|1,0,1]=4 16364 B16R0.68 CCCCCCCCCCC(C)OCCOC 7a_100011215000_100000233755 [0,2,0,0,0,0|1,0,1]=4 16365 B16R0.68 CCCCCCCCCCN(C)CCOCC 2230a_100000207566_100011215890 [0,2,0,0,0,0|2,0,0]=4 16366 B16R0.68 CCCCCCCCCCN(C)CCOCC 269982a_100000207566_100011215890 [0,2,0,0,0,0|2,0,0]=4 16367 B16R0.68 CCCCCCCCCNC(=O)C=CCOC 11a_100000212291_100016285016 [0,2,0,0,0,0|2,0,0]=4 16368 B16R0.68 CCCCCCCCCNC(=O)C=CCOC 1626a_100000212291_100016285016 [0,2,0,0,0,0|2,0,0]=4 16369 B16R0.68 CCCCCCCCCNC(=O)C=CCOC 240690a_100000212291_100016285016 [0,2,0,0,0,0|2,0,0]=4 16370 B16R0.68 CCCCCCCCCNC(=O)C=COCC 11a_100000212291_100016266692 [0,2,0,0,0,0|1,0,0]=3 16371 B16R0.68 CCCCCCCCCNC(=O)C=COCC 1626a_100000212291_100016266692 [0,2,0,0,0,0|1,0,0]=3 16372 B16R0.68 CCCCCCCCCNC(=O)C=COCC 240690a_100000212291_100016266692 [0,2,0,0,0,0|1,0,0]=3 16373 B16R0.68 CCCCCCCCCNC(=O)CCCC#N 11a_100000212291_100000075515 [0,2,0,0,0,0|2,0,0]=4 16374 B16R0.68 CCCCCCCCCNC(=O)CCCC#N 1626a_100000212291_100000075515 [0,2,0,0,0,0|2,0,0]=4 16375 B16R0.68 CCCCCCCCCNC(=O)CCCC#N 240690a_100000212291_100000075515 [0,2,0,0,0,0|2,0,0]=4 16376 B16R0.68 CCCCCCCCCNC(=O)CCCC#N 527a_100000212291_100000075515 [0,2,0,0,0,0|2,0,0]=4 16377 B16R0.68 CCCCCCCCCNC(=O)CCCCC 11a_100000212291_100000212188 [0,2,0,0,0,0|2,0,0]=4 16378 B16R0.68 CCCCCCCCCNC(=O)CCCCC 1626a_100000212291_100000212188 [0,2,0,0,0,0|2,0,0]=4 16379 B16R0.68 CCCCCCCCCNC(=O)CCCCC 240690a_100000212291_100000212188 [0,2,0,0,0,0|2,0,0]=4 16380 B16R0.68 CCCCCCCCCNC(=O)CCCCC 527a_100000212291_100000212188 [0,2,0,0,0,0|2,0,0]=4 16381 B16R0.68 CCCCCCCCCNC(=O)CCCCO 1626a_100000212291_100000695505 [0,2,0,0,0,0|2,0,0]=4 16382 B16R0.68 CCCCCCCCCNC(=O)CCCOC 11a_100000212291_100000741012 [0,2,0,0,0,0|2,0,0]=4 16383 B16R0.68 CCCCCCCCCNC(=O)CCCOC 1626a_100000212291_100000741012 [0,2,0,0,0,0|2,0,0]=4 16384 B16R0.68 CCCCCCCCCNC(=O)CCCOC 240690a_100000212291_100000741012 [0,2,0,0,0,0|2,0,0]=4 16385 B16R0.68 CCCCCCCCCNC(=O)CCCOC 527a_100000212291_100000741012 [0,2,0,0,0,0|2,0,0]=4 16386 B16R0.68 CCCCCCCCCNC(=O)CCCSC 11a_100000212291_100000173376 [0,2,0,0,0,0|2,0,0]=4 16387 B16R0.68 CCCCCCCCCNC(=O)CCCSC 1626a_100000212291_100000173376 [0,2,0,0,0,0|2,0,0]=4 16388 B16R0.68 CCCCCCCCCNC(=O)CCCSC 240690a_100000212291_100000173376 [0,2,0,0,0,0|2,0,0]=4 16389 B16R0.68 CCCCCCCCCNC(=O)CCCSC 527a_100000212291_100000173376 [0,2,0,0,0,0|2,0,0]=4 16390 B16R0.68 CCCCCCCCCNC(=O)CCOCC 11a_100000212291_100000749530 [0,2,0,0,0,0|1,0,0]=3 16391 B16R0.68 CCCCCCCCCNC(=O)CCOCC 1626a_100000212291_100000749530 [0,2,0,0,0,0|1,0,0]=3 16392 B16R0.68 CCCCCCCCCNC(=O)CCOCC 240690a_100000212291_100000749530 [0,2,0,0,0,0|1,0,0]=3 16393 B16R0.68 CCCCCCCCCNC(=O)CCOCC 527a_100000212291_100000749530 [0,2,0,0,0,0|1,0,0]=3 16394 B16R0.68 CCCCCCCCCNC(=O)CCSCC 11a_100000212291_100000230768 [0,2,0,0,0,0|1,1,0]=4 16395 B16R0.68 CCCCCCCCCNC(=O)CCSCC 1626a_100000212291_100000230768 [0,2,0,0,0,0|1,1,0]=4 16396 B16R0.68 CCCCCCCCCNC(=O)CCSCC 240690a_100000212291_100000230768 [0,2,0,0,0,0|1,1,0]=4 16397 B16R0.68 CCCCCCCCCNC(=O)CCSCC 527a_100000212291_100000230768 [0,2,0,0,0,0|1,1,0]=4 16398 B16R0.68 CCCCCCCCCNC(=O)COCCC 11a_100000212291_100000745993 [0,2,0,0,0,0|1,0,0]=3 16399 B16R0.68 CCCCCCCCCNC(=O)COCCC 1626a_100000212291_100000745993 [0,2,0,0,0,0|1,0,0]=3 16400 B16R0.68 CCCCCCCCCNC(=O)COCCC 240690a_100000212291_100000745993 [0,2,0,0,0,0|1,0,0]=3 16401 B16R0.68 CCCCCCCCCNC(=O)COCCC 527a_100000212291_100000745993 [0,2,0,0,0,0|1,0,0]=3 16402 B16R0.68 CCCCCCCCCNC(=O)COCCO 1626a_100000212291_100000708028 [0,2,0,0,0,0|1,0,0]=3 16403 B16R0.68 CCCCCCCCCNC(=O)COCCO 240690a_100000212291_100000708028 [0,2,0,0,0,0|1,0,0]=3 16404 B16R0.68 CCCCCCCCCNC(=O)CSCCC 11a_100000212291_100000217233 [0,2,0,0,0,0|1,1,0]=4 16405 B16R0.68 CCCCCCCCCNC(=O)CSCCC 1626a_100000212291_100000217233 [0,2,0,0,0,0|1,1,0]=4 16406 B16R0.68 CCCCCCCCCNC(=O)CSCCC 240690a_100000212291_100000217233 [0,2,0,0,0,0|1,1,0]=4 16407 B16R0.68 CCCCCCCCCNC(=O)CSCCC 527a_100000212291_100000217233 [0,2,0,0,0,0|1,1,0]=4 16408 B16R0.68 CCCCCCCCCNC(=O)NCCC#N 2708a_100000212291_100000720768 [0,2,0,0,0,0|2,0,0]=4 16409 B16R0.68 CCCCCCCCCNC(=O)NCCC#N 2708a_100000720768_100000212291 [0,2,0,0,0,0|2,0,0]=4 16410 B16R0.68 CCCCCCCCCNC(=O)NCCC#N 273464a_100000212291_100000720768 [0,2,0,0,0,0|2,0,0]=4 16411 B16R0.68 CCCCCCCCCNC(=O)NCCC#N 273464a_100000720768_100000212291 [0,2,0,0,0,0|2,0,0]=4 16412 B16R0.68 CCCCCCCCCNC(=O)NCCC#N 512a_100000212291_100000720768 [0,2,0,0,0,0|2,0,0]=4 16413 B16R0.68 CCCCCCCCCNC(=O)NCCC#N 512a_100000720768_100000212291 [0,2,0,0,0,0|2,0,0]=4 16414 B16R0.68 CCCCCCCCCNC(=O)NCCCC 2708a_100000102301_100000212291 [0,2,0,0,0,0|2,0,0]=4 16415 B16R0.68 CCCCCCCCCNC(=O)NCCCC 2708a_100000212291_100000102301 [0,2,0,0,0,0|2,0,0]=4 16416 B16R0.68 CCCCCCCCCNC(=O)NCCCC 273464a_100000102301_100000212291 [0,2,0,0,0,0|2,0,0]=4 16417 B16R0.68 CCCCCCCCCNC(=O)NCCCC 273464a_100000212291_100000102301 [0,2,0,0,0,0|2,0,0]=4 16418 B16R0.68 CCCCCCCCCNC(=O)NCCCC 512a_100000102301_100000212291 [0,2,0,0,0,0|2,0,0]=4 16419 B16R0.68 CCCCCCCCCNC(=O)NCCCC 512a_100000212291_100000102301 [0,2,0,0,0,0|2,0,0]=4 16420 B16R0.68 CCCCCCCCCNC(=O)NCCCF 2708a_100000212291_100015189416 [0,2,0,0,0,0|2,0,0]=4 16421 B16R0.68 CCCCCCCCCNC(=O)NCCCF 2708a_100015189416_100000212291 [0,2,0,0,0,0|2,0,0]=4 16422 B16R0.68 CCCCCCCCCNC(=O)NCCCF 273464a_100000212291_100015189416 [0,2,0,0,0,0|2,0,0]=4 16423 B16R0.68 CCCCCCCCCNC(=O)NCCCF 273464a_100015189416_100000212291 [0,2,0,0,0,0|2,0,0]=4 16424 B16R0.68 CCCCCCCCCNC(=O)NCCCF 512a_100000212291_100015189416 [0,2,0,0,0,0|2,0,0]=4 16425 B16R0.68 CCCCCCCCCNC(=O)NCCCF 512a_100015189416_100000212291 [0,2,0,0,0,0|2,0,0]=4 16426 B16R0.68 CCCCCCCCCNC(=O)NCCCO 2708a_100000212291_100000182051 [0,2,0,0,0,0|2,0,0]=4 16427 B16R0.68 CCCCCCCCCNC(=O)NCCCO 273464a_100000182051_100000212291 [0,2,0,0,0,0|2,0,0]=4 16428 B16R0.68 CCCCCCCCCNC(=O)NCCCO 273464a_100000212291_100000182051 [0,2,0,0,0,0|2,0,0]=4 16429 B16R0.68 CCCCCCCCCNC(=O)NCCCO 512a_100000212291_100000182051 [0,2,0,0,0,0|2,0,0]=4 16430 B16R0.68 CCCCCCCCCNC(=O)NCCOC 2708a_100000212291_100000209980 [0,2,0,0,0,0|2,0,0]=4 16431 B16R0.68 CCCCCCCCCNC(=O)NCCOC 273464a_100000209980_100000212291 [0,2,0,0,0,0|2,0,0]=4 16432 B16R0.68 CCCCCCCCCNC(=O)NCCOC 273464a_100000212291_100000209980 [0,2,0,0,0,0|2,0,0]=4 16433 B16R0.68 CCCCCCCCCNC(=O)NCCSC 2708a_100000212291_100020590264 [0,2,0,0,0,0|2,0,0]=4 16434 B16R0.68 CCCCCCCCCNC(=O)NCCSC 2708a_100020590264_100000212291 [0,2,0,0,0,0|2,0,0]=4 16435 B16R0.68 CCCCCCCCCNC(=O)NCCSC 273464a_100000212291_100020590264 [0,2,0,0,0,0|2,0,0]=4 16436 B16R0.68 CCCCCCCCCNC(=O)NCCSC 273464a_100020590264_100000212291 [0,2,0,0,0,0|2,0,0]=4 16437 B16R0.68 CCCCCCCCCNC(=O)NCCSC 512a_100000212291_100020590264 [0,2,0,0,0,0|2,0,0]=4 16438 B16R0.68 CCCCCCCCCNC(=O)NCCSC 512a_100020590264_100000212291 [0,2,0,0,0,0|2,0,0]=4 16439 B16R0.68 CCCCCCCCCNC(=O)NNCCC 273464a_100000212291_100000740057 [0,2,0,0,0,0|2,0,0]=4 16440 B16R0.68 CCCCCCCCCNC(=O)NNCCC 512a_100000212291_100000740057 [0,2,0,0,0,0|2,0,0]=4 16441 B16R0.68 CCCCCCCCCNC(=O)NNCCC 512a_100000740057_100000212291 [0,2,0,0,0,0|2,0,0]=4 16442 B16R0.68 CCCCCCCCCNC(=O)NNCCO 273464a_100000212291_100000210001 [0,2,0,0,0,0|2,0,0]=4 16443 B16R0.68 CCCCCCCCCNC(=O)NNCCO 512a_100000212291_100000210001 [0,2,0,0,0,0|2,0,0]=4 16444 B16R0.68 CCCCCCCCNCC(=O)CCCCC 2230a_100000229939_200012276598 [0,2,0,0,0,0|2,0,0]=4 16445 B16R0.68 CCCCCCCCNCC(=O)CCCCC 34a_100000229939_200012276598 [0,2,0,0,0,0|2,0,0]=4 16446 B16R0.68 CCCCCCCCNCC(=O)NCCCC 2230a_100000229939_100000182744 [0,2,0,0,0,0|2,0,0]=4 16447 B16R0.68 CCCCCCCCNCC(=O)NCCCC 34a_100000229939_100000182744 [0,2,0,0,0,0|2,0,0]=4 16448 B16R0.68 CCCCCCCCNCC(=O)NCCOC 2230a_100000229939_100000183275 [0,2,0,0,0,0|2,0,0]=4 16449 B16R0.68 CCCCCCCCNCC(=O)NCCOC 2230a_100000754632_100000210759 [0,2,0,0,0,0|2,0,0]=4 16450 B16R0.68 CCCCCCCCNCC(=O)NCCOC 34a_100000229939_100000183275 [0,2,0,0,0,0|2,0,0]=4 16451 B16R0.68 CCCCCCCCNCC(=O)OCCCC 2230a_100000229939_100000211628 [0,2,0,0,0,0|1,0,0]=3 16452 B16R0.68 CCCCCCCCNCC(=O)OCCCC 34a_100000229939_100000211628 [0,2,0,0,0,0|1,0,0]=3 16453 B16R0.68 CCCCCCCCNCC(=O)OCCOC 2230a_100000229939_200000040189 [0,2,0,0,0,0|1,0,0]=3 16454 B16R0.68 CCCCCCCCNCC(=O)OCCOC 34a_100000229939_200000040189 [0,2,0,0,0,0|1,0,0]=3 16455 B16R0.68 CCCCCCCCOCC(=O)CCCC#N 1458a_100000759886_100000211468 [0,2,0,0,0,0|2,0,0]=4 16456 B16R0.68 CCCCCCCCOCC(=O)CCCCC 1458a_100000759886_100000210326 [0,2,0,0,0,0|2,0,0]=4 16457 B16R0.68 CCCCCCCCOCC(=O)CCCCC 34a_100000210232_200012276598 [0,2,0,0,0,0|2,0,0]=4 16458 B16R0.68 CCCCCCCCOCC(=O)CCCCC 7a_100000210232_200012276598 [0,2,0,0,0,0|2,0,0]=4 16459 B16R0.68 CCCCCCCCOCC(=O)CCCCF 1458a_100000759886_100000729493 [0,2,0,0,0,0|2,0,0]=4 16460 B16R0.68 CCCCCCCCOCC(=O)CCCCO 1458a_100000759886_100000210776 [0,2,0,0,0,0|2,0,0]=4 16461 B16R0.68 CCCCCCCCOCC(=O)CCCOC 1458a_100000759886_100000740836 [0,2,0,0,0,0|2,0,0]=4 16462 B16R0.68 CCCCCCCCOCC(=O)CCOCC 1458a_100000759886_100011215890 [0,2,0,0,0,0|1,0,0]=3 16463 B16R0.68 CCCCCCCCOCC(=O)CCSCC 1458a_100000759886_100000757381 [0,2,0,0,0,0|1,1,0]=4 16464 B16R0.68 CCCCCCCCOCC(=O)NCCC#N 11a_100000720768_100000759886 [0,2,0,0,0,0|2,0,0]=4 16465 B16R0.68 CCCCCCCCOCC(=O)NCCC#N 1626a_100000720768_100000759886 [0,2,0,0,0,0|2,0,0]=4 16466 B16R0.68 CCCCCCCCOCC(=O)NCCC#N 240690a_100000720768_100000759886 [0,2,0,0,0,0|2,0,0]=4 16467 B16R0.68 CCCCCCCCOCC(=O)NCCC#N 527a_100000720768_100000759886 [0,2,0,0,0,0|2,0,0]=4 16468 B16R0.68 CCCCCCCCOCC(=O)NCCCC 11a_100000102301_100000759886 [0,2,0,0,0,0|2,0,0]=4 16469 B16R0.68 CCCCCCCCOCC(=O)NCCCC 1626a_100000102301_100000759886 [0,2,0,0,0,0|2,0,0]=4 16470 B16R0.68 CCCCCCCCOCC(=O)NCCCC 240690a_100000102301_100000759886 [0,2,0,0,0,0|2,0,0]=4 16471 B16R0.68 CCCCCCCCOCC(=O)NCCCC 34a_100000210232_100000182744 [0,2,0,0,0,0|2,0,0]=4 16472 B16R0.68 CCCCCCCCOCC(=O)NCCCC 527a_100000102301_100000759886 [0,2,0,0,0,0|2,0,0]=4 16473 B16R0.68 CCCCCCCCOCC(=O)NCCCC 7a_100000210232_100000182744 [0,2,0,0,0,0|2,0,0]=4 16474 B16R0.68 CCCCCCCCOCC(=O)NCCCF 11a_100015189416_100000759886 [0,2,0,0,0,0|2,0,0]=4 16475 B16R0.68 CCCCCCCCOCC(=O)NCCCF 1626a_100015189416_100000759886 [0,2,0,0,0,0|2,0,0]=4 16476 B16R0.68 CCCCCCCCOCC(=O)NCCCF 240690a_100015189416_100000759886 [0,2,0,0,0,0|2,0,0]=4 16477 B16R0.68 CCCCCCCCOCC(=O)NCCCF 527a_100015189416_100000759886 [0,2,0,0,0,0|2,0,0]=4 16478 B16R0.68 CCCCCCCCOCC(=O)NCCCO 240690a_100000182051_100000759886 [0,2,0,0,0,0|2,0,0]=4 16479 B16R0.68 CCCCCCCCOCC(=O)NCCCO 527a_100000182051_100000759886 [0,2,0,0,0,0|2,0,0]=4 16480 B16R0.68 CCCCCCCCOCC(=O)NCCOC 1626a_100000209980_100000759886 [0,2,0,0,0,0|2,0,0]=4 16481 B16R0.68 CCCCCCCCOCC(=O)NCCOC 240690a_100000209980_100000759886 [0,2,0,0,0,0|2,0,0]=4 16482 B16R0.68 CCCCCCCCOCC(=O)NCCOC 34a_100000210232_100000183275 [0,2,0,0,0,0|2,0,0]=4 16483 B16R0.68 CCCCCCCCOCC(=O)NCCOC 527a_100000209980_100000759886 [0,2,0,0,0,0|2,0,0]=4 16484 B16R0.68 CCCCCCCCOCC(=O)NCCOC 7a_100000210232_100000183275 [0,2,0,0,0,0|2,0,0]=4 16485 B16R0.68 CCCCCCCCOCC(=O)NCCSC 11a_100020590264_100000759886 [0,2,0,0,0,0|2,0,0]=4 16486 B16R0.68 CCCCCCCCOCC(=O)NCCSC 1626a_100020590264_100000759886 [0,2,0,0,0,0|2,0,0]=4 16487 B16R0.68 CCCCCCCCOCC(=O)NCCSC 240690a_100020590264_100000759886 [0,2,0,0,0,0|2,0,0]=4 16488 B16R0.68 CCCCCCCCOCC(=O)NCCSC 527a_100020590264_100000759886 [0,2,0,0,0,0|2,0,0]=4 16489 B16R0.68 CCCCCCCCOCC(=O)NNCCC 22a_100000740057_100000759886 [0,2,0,0,0,0|2,0,0]=4 16490 B16R0.68 CCCCCCCCOCC(=O)NNCCO 22a_100000210001_100000759886 [0,2,0,0,0,0|2,0,0]=4 16491 B16R0.68 CCCCCCCCOCC(=O)OCCCC 34a_100000210232_100000211628 [0,2,0,0,0,0|1,0,0]=3 16492 B16R0.68 CCCCCCCCOCC(=O)OCCCC 7a_100000210232_100000211628 [0,2,0,0,0,0|1,0,0]=3 16493 B16R0.68 CCCCCCCCOCC(=O)OCCOC 34a_100000210232_200000040189 [0,2,0,0,0,0|1,0,0]=3 16494 B16R0.68 CCCCCCCCOCC(=O)OCCOC 7a_100000210232_200000040189 [0,2,0,0,0,0|1,0,0]=3 16495 B16R0.68 CCCCCCCCSCC(=O)NCCCC 62a_100000182744_100000210317 [0,2,0,0,0,0|2,0,0]=4 16496 B16R0.68 CCCCCCCCSCC(=O)NCCCC 62a_100000210759_100000182744 [0,2,0,0,0,0|2,0,0]=4 16497 B16R0.68 CCCCCCCCSCC(=O)NCCOC 62a_100000183275_100000210317 [0,2,0,0,0,0|2,0,0]=4 16498 B16R0.68 CCCCCCCCSCC(=O)NCCOC 62a_100000210759_100000183275 [0,2,0,0,0,0|2,0,0]=4 16499 B16R0.68 CCCCCCCCSCC(=O)OCCCC 62a_100000210759_100000211628 [0,2,0,0,0,0|1,0,0]=3 16500 B16R0.68 CCCCCCCCSCC(=O)OCCCC 62a_100000211628_100000210317 [0,2,0,0,0,0|1,0,0]=3 16501 B16R0.68 CCCCCCCCSCC(=O)OCCOC 62a_100000210759_200000040189 [0,2,0,0,0,0|1,0,0]=3 16502 B16R0.68 CCCCCCCCSCC(=O)OCCOC 62a_200000040189_100000210317 [0,2,0,0,0,0|1,0,0]=3 16503 B16R0.68 CCCCCNCCOCC(=O)OCCCC 34a_100000224656_100000211628 [0,2,0,0,0,0|2,0,0]=4 16504 B16R0.68 CCCCCNCCOCC(=O)OCCOC 34a_100000224656_200000040189 [0,2,0,0,0,0|2,0,0]=4 16505 B16R0.68 CCCCCOCCOCC(=O)OCCCC 34a_100011215259_100000211628 [0,2,0,0,0,0|2,0,0]=4 16506 B16R0.68 CCCCCOCCOCC(=O)OCCCC 7a_100011215259_100000211628 [0,2,0,0,0,0|2,0,0]=4 16507 B16R0.68 CCCCCOCCOCC(=O)OCCOC 34a_100011215259_200000040189 [0,2,0,0,0,0|2,0,0]=4 16508 B16R0.68 CCCCCOCCOCC(=O)OCCOC 7a_100011215259_200000040189 [0,2,0,0,0,0|2,0,0]=4 16509 B16R0.68 CCCCNC(=O)CCCCCCCCCF 11a_100000102301_200009909015 [0,2,0,0,0,0|2,0,0]=4 16510 B16R0.68 CCCCNC(=O)CCCCCCCCCF 240690a_100000102301_200009909015 [0,2,0,0,0,0|2,0,0]=4 16511 B16R0.68 CCCCNC(=O)CCCCCCCCCF 527a_100000102301_200009909015 [0,2,0,0,0,0|2,0,0]=4 16512 B16R0.68 CCCCNC(=O)CCCCCCCCCO 240690a_100000102301_100000032657 [0,2,0,0,0,0|2,0,0]=4 16513 B16R0.68 CCCCOC(=O)CNCCCCCCCO 2230a_100011996573_100000211628 [0,2,0,0,0,0|2,0,0]=4 16514 B16R0.68 CCCCOC(=O)CNCCCCCCCO 34a_100011996573_100000211628 [0,2,0,0,0,0|2,0,0]=4 16515 B16R0.68 CCCCOC(=O)COCCCCCCCBr 34a_100000760002_100000211628 [0,2,0,0,0,0|2,0,0]=4 16516 B16R0.68 CCCCOC(=O)COCCCCCCCBr 7a_100000760002_100000211628 [0,2,0,0,0,0|2,0,0]=4 16517 B16R0.68 CCCCOC(=O)COCCCCCCCN 34a_100011996573_100000211628 [0,2,0,0,0,0|2,0,0]=4 16518 B16R0.68 CCCCOC(=O)COCCCCCCOC 34a_200012092642_100000211628 [0,2,0,0,0,0|2,0,0]=4 16519 B16R0.68 CCCCOC(=O)COCCCCCCOC 7a_200012092642_100000211628 [0,2,0,0,0,0|2,0,0]=4 16520 B16R0.68 CCCCOC(=O)CSCCCCCCCO 62a_100000211628_100000760002 [0,2,0,0,0,0|2,0,0]=4 16521 B16R0.68 CCCCOC(=O)CSCCCCCCCO 62a_100000760002_100000211628 [0,2,0,0,0,0|2,0,0]=4 16522 B16R0.68 CCCCOC(=O)CSCCCCCCOC 62a_100000211628_100011998445 [0,2,0,0,0,0|2,0,0]=4 16523 B16R0.68 CCCCOC(=O)CSCCCCCCOC 62a_100011998445_100000211628 [0,2,0,0,0,0|2,0,0]=4 16524 B16R0.68 CCCCOCCCNCC(=O)OCCCC 2230a_200000211371_100000211628 [0,2,0,0,0,0|2,0,0]=4 16525 B16R0.68 CCCCOCCCNCC(=O)OCCCC 34a_200000211371_100000211628 [0,2,0,0,0,0|2,0,0]=4 16526 B16R0.68 CCCCOCCCNCC(=O)OCCOC 2230a_200000211371_200000040189 [0,2,0,0,0,0|2,0,0]=4 16527 B16R0.68 CCCCOCCCNCC(=O)OCCOC 34a_200000211371_200000040189 [0,2,0,0,0,0|2,0,0]=4 16528 B16R0.68 CCCCOCCCOCC(=O)OCCCC 34a_200011215613_100000211628 [0,2,0,0,0,0|2,0,0]=4 16529 B16R0.68 CCCCOCCCOCC(=O)OCCCC 7a_200011215613_100000211628 [0,2,0,0,0,0|2,0,0]=4 16530 B16R0.68 CCCCOCCCOCC(=O)OCCOC 34a_200011215613_200000040189 [0,2,0,0,0,0|2,0,0]=4 16531 B16R0.68 CCCCOCCCOCC(=O)OCCOC 7a_200011215613_200000040189 [0,2,0,0,0,0|2,0,0]=4 16532 B16R0.68 CCCNNC(=O)CCCCCCCCCF 22a_100000740057_200009909015 [0,2,0,0,0,0|2,0,0]=4 16533 B16R0.68 CCCNNC(=O)CCCCCCCCCO 22a_100000740057_100000032657 [0,2,0,0,0,0|2,0,0]=4 16534 B16R0.68 CCCOCC(=O)CCCCCCCCCO 1458a_100000745993_100009813782 [0,2,0,0,0,0|1,0,0]=3 16535 B16R0.68 CCCOCC(=O)NCCCCCCCCO 240690a_102515433106_100000745993 [0,2,0,0,0,0|2,0,0]=4 16536 B16R0.68 CCCSCC(=O)CCCCCCCCCO 1458a_100000217233_100009813782 [0,2,0,0,0,0|1,1,0]=4 16537 B16R0.68 CCOC=CC(=O)CCCCCCCCCO 1458a_100016266692_100009813782 [0,2,0,0,0,0|1,0,0]=3 16538 B16R0.68 CCOC=CC(=O)NCCCCCCCCO 240690a_102515433106_100016266692 [0,2,0,0,0,0|2,0,0]=4 16539 B16R0.68 CCOCCC(=O)CCCCCCCCCF 1458a_200009909015_100011215890 [0,2,0,0,0,0|1,0,0]=3 16540 B16R0.68 CCOCCC(=O)CCCCCCCCCO 1458a_100000749530_100009813782 [0,2,0,0,0,0|1,0,0]=3 16541 B16R0.68 CCOCCC(=O)NCCCCCCCCO 240690a_102515433106_100000749530 [0,2,0,0,0,0|2,0,0]=4 16542 B16R0.68 CCSCCC(=O)CCCCCCCCCF 1458a_200009909015_100000757381 [0,2,0,0,0,0|1,1,0]=4 16543 B16R0.68 CCSCCC(=O)CCCCCCCCCO 1458a_100000230768_100009813782 [0,2,0,0,0,0|1,1,0]=4 16544 B16R0.68 COCC=CC(=O)CCCCCCCCCO 1458a_100016285016_100009813782 [0,2,0,0,0,0|2,0,0]=4 16545 B16R0.68 COCCCC(=O)CCCCCCCCCF 1458a_200009909015_100000740836 [0,2,0,0,0,0|2,0,0]=4 16546 B16R0.68 COCCCC(=O)CCCCCCCCCO 1458a_100000741012_100009813782 [0,2,0,0,0,0|2,0,0]=4 16547 B16R0.68 COCCCCCCOCC(=O)OCCOC 34a_200012092642_200000040189 [0,2,0,0,0,0|2,0,0]=4 16548 B16R0.68 COCCCCCCOCC(=O)OCCOC 7a_200012092642_200000040189 [0,2,0,0,0,0|2,0,0]=4 16549 B16R0.68 COCCCCCCSCC(=O)OCCOC 62a_100011998445_200000040189 [0,2,0,0,0,0|2,0,0]=4 16550 B16R0.68 COCCCCCCSCC(=O)OCCOC 62a_200000040189_100011998445 [0,2,0,0,0,0|2,0,0]=4 16551 B16R0.68 COCCNC(=O)CCCCCCCCCF 240690a_100000209980_200009909015 [0,2,0,0,0,0|2,0,0]=4 16552 B16R0.68 COCCNC(=O)CCCCCCCCCF 527a_100000209980_200009909015 [0,2,0,0,0,0|2,0,0]=4 16553 B16R0.68 COCCNC(=O)CCCCCCCCCO 240690a_100000209980_100000032657 [0,2,0,0,0,0|2,0,0]=4 16554 B16R0.68 COCCOC(=O)CNCCCCCCCO 2230a_100011996573_200000040189 [0,2,0,0,0,0|2,0,0]=4 16555 B16R0.68 COCCOC(=O)CNCCCCCCCO 34a_100011996573_200000040189 [0,2,0,0,0,0|2,0,0]=4 16556 B16R0.68 COCCOC(=O)COCCCCCCCBr 34a_100000760002_200000040189 [0,2,0,0,0,0|2,0,0]=4 16557 B16R0.68 COCCOC(=O)COCCCCCCCBr 7a_100000760002_200000040189 [0,2,0,0,0,0|2,0,0]=4 16558 B16R0.68 COCCOC(=O)COCCCCCCCN 34a_100011996573_200000040189 [0,2,0,0,0,0|2,0,0]=4 16559 B16R0.68 COCCOC(=O)CSCCCCCCCO 62a_100000760002_200000040189 [0,2,0,0,0,0|2,0,0]=4 16560 B16R0.68 COCCOC(=O)CSCCCCCCCO 62a_200000040189_100000760002 [0,2,0,0,0,0|2,0,0]=4 16561 B16R0.68 CSCCCC(=O)CCCCCCCCCO 1458a_100000173376_100009813782 [0,2,0,0,0,0|2,0,0]=4 16562 B16R0.68 CSCCNC(=O)CCCCCCCCCF 11a_100020590264_200009909015 [0,2,0,0,0,0|2,0,0]=4 16563 B16R0.68 CSCCNC(=O)CCCCCCCCCF 240690a_100020590264_200009909015 [0,2,0,0,0,0|2,0,0]=4 16564 B16R0.68 CSCCNC(=O)CCCCCCCCCF 527a_100020590264_200009909015 [0,2,0,0,0,0|2,0,0]=4 16565 B16R0.68 CSCCNC(=O)CCCCCCCCCO 240690a_100020590264_100000032657 [0,2,0,0,0,0|2,0,0]=4 16566 B16R0.68 N#CCCCC(=O)CCCCCCCCCF 1458a_200009909015_100000211468 [0,2,0,0,0,0|2,0,0]=4 16567 B16R0.68 N#CCCCC(=O)CCCCCCCCCO 1458a_100000075515_100009813782 [0,2,0,0,0,0|2,0,0]=4 16568 B16R0.68 N#CCCNC(=O)CCCCCCCCCF 11a_100000720768_200009909015 [0,2,0,0,0,0|2,0,0]=4 16569 B16R0.68 N#CCCNC(=O)CCCCCCCCCF 240690a_100000720768_200009909015 [0,2,0,0,0,0|2,0,0]=4 16570 B16R0.68 N#CCCNC(=O)CCCCCCCCCF 527a_100000720768_200009909015 [0,2,0,0,0,0|2,0,0]=4 16571 B16R0.68 N#CCCNC(=O)CCCCCCCCCO 240690a_100000720768_100000032657 [0,2,0,0,0,0|2,0,0]=4 16572 B16R0.68 O=C(CCCCCCCCCF)NCCCF 11a_100015189416_200009909015 [0,2,0,0,0,0|2,0,0]=4 16573 B16R0.68 O=C(CCCCCCCCCF)NCCCF 240690a_100015189416_200009909015 [0,2,0,0,0,0|2,0,0]=4 16574 B16R0.68 O=C(CCCCCCCCCF)NCCCF 527a_100015189416_200009909015 [0,2,0,0,0,0|2,0,0]=4 16575 B16R0.68 O=C(CCCCCCCCCF)NCCCO 240690a_100000182051_200009909015 [0,2,0,0,0,0|2,0,0]=4 16576 B16R0.68 O=C(CCCCCCCCCF)NCCCO 527a_100000182051_200009909015 [0,2,0,0,0,0|2,0,0]=4 16577 B16R0.68 O=C(CCCCCCCCCF)NNCCO 22a_100000210001_200009909015 [0,2,0,0,0,0|2,0,0]=4 16578 B16R0.68 O=C(CCCCCCCCCO)COCCO 1458a_100000708028_100009813782 [0,2,0,0,0,0|1,0,0]=3 16579 B16R0.68 O=C(CCCCCCCCCO)NCCCF 240690a_100015189416_100000032657 [0,2,0,0,0,0|2,0,0]=4 16580 B16R0.68 O=C(CCCCCCCCCO)NCCCO 240690a_100000182051_100000032657 [0,2,0,0,0,0|2,0,0]=4 16581 B16R0.68 O=C(CCCCCCCCCO)NNCCO 22a_100000210001_100000032657 [0,2,0,0,0,0|2,0,0]=4 16582 B16R0.68 O=C(CCCCF)CCCCCCCCCF 1458a_200009909015_100000729493 [0,2,0,0,0,0|2,0,0]=4 16583 B16R0.68 O=C(CCCCO)CCCCCCCCCF 1458a_200009909015_100000210776 [0,2,0,0,0,0|2,0,0]=4 16584 B16R0.68 O=C(CCCCO)CCCCCCCCCO 1458a_100000695505_100009813782 [0,2,0,0,0,0|2,0,0]=4 16585 B16R0.68 O=C(COCCO)NCCCCCCCCO 240690a_102515433106_100000708028 [0,2,0,0,0,0|2,0,0]=4 16586 B16R0.3183 C=C(C)CCC(=O)CCCCCCCCCO 1458a_200000688413_100009813782 [0,2,0,0,0,0|2,0,0]=4 16587 B16R0.3183 C=C(C)CCC(=O)COCCCCCCCC 1458a_100000759886_100000730704 [0,2,0,0,0,0|2,0,0]=4 16588 B16R0.3183 C=C(C)CCC(=O)NCCCCCCCCC 11a_100000212291_200000688413 [0,2,0,0,0,0|2,0,0]=4 16589 B16R0.3183 C=C(C)CCC(=O)NCCCCCCCCC 1626a_100000212291_200000688413 [0,2,0,0,0,0|2,0,0]=4 16590 B16R0.3183 C=C(C)CCC(=O)NCCCCCCCCC 240690a_100000212291_200000688413 [0,2,0,0,0,0|2,0,0]=4 16591 B16R0.3183 C=C(C)CCC(=O)NCCCCCCCCC 527a_100000212291_200000688413 [0,2,0,0,0,0|2,0,0]=4 16592 B16R0.3183 C=C(C)CNC(=O)CCCCCCCCCC 11a_100000765925_100000210375 [0,2,0,0,0,0|1,0,0]=3 16593 B16R0.3183 C=C(C)CNC(=O)CCCCCCCCCC 1626a_100000765925_100000210375 [0,2,0,0,0,0|1,0,0]=3 16594 B16R0.3183 C=C(C)CNC(=O)CCCCCCCCCC 240690a_100000765925_100000210375 [0,2,0,0,0,0|1,0,0]=3 16595 B16R0.3183 C=C(C)CNC(=O)CCCCCCCCCF 11a_100000765925_200009909015 [0,2,0,0,0,0|2,0,0]=4 16596 B16R0.3183 C=C(C)CNC(=O)CCCCCCCCCF 240690a_100000765925_200009909015 [0,2,0,0,0,0|2,0,0]=4 16597 B16R0.3183 C=C(C)CNC(=O)CCCCCCCCCF 527a_100000765925_200009909015 [0,2,0,0,0,0|2,0,0]=4 16598 B16R0.3183 C=C(C)CNC(=O)CCCCCCCCCO 240690a_100000765925_100000032657 [0,2,0,0,0,0|2,0,0]=4 16599 B16R0.3183 C=C(C)CNC(=O)COCCCCCCCC 11a_100000765925_100000759886 [0,2,0,0,0,0|2,0,0]=4 16600 B16R0.3183 C=C(C)CNC(=O)COCCCCCCCC 1626a_100000765925_100000759886 [0,2,0,0,0,0|2,0,0]=4 16601 B16R0.3183 C=C(C)CNC(=O)COCCCCCCCC 240690a_100000765925_100000759886 [0,2,0,0,0,0|2,0,0]=4 16602 B16R0.3183 C=C(C)CNC(=O)COCCCCCCCC 527a_100000765925_100000759886 [0,2,0,0,0,0|2,0,0]=4 16603 B16R0.3183 C=C(C)CNC(=O)NCCCCCCCCC 2708a_100000212291_100000765925 [0,2,0,0,0,0|2,0,0]=4 16604 B16R0.3183 C=C(C)CNC(=O)NCCCCCCCCC 2708a_100000765925_100000212291 [0,2,0,0,0,0|2,0,0]=4 16605 B16R0.3183 C=C(C)CNC(=O)NCCCCCCCCC 273464a_100000212291_100000765925 [0,2,0,0,0,0|2,0,0]=4 16606 B16R0.3183 C=C(C)CNC(=O)NCCCCCCCCC 273464a_100000765925_100000212291 [0,2,0,0,0,0|2,0,0]=4 16607 B16R0.3183 C=C(C)CNC(=O)NCCCCCCCCC 512a_100000212291_100000765925 [0,2,0,0,0,0|2,0,0]=4 16608 B16R0.3183 C=C(C)CNC(=O)NCCCCCCCCC 512a_100000765925_100000212291 [0,2,0,0,0,0|2,0,0]=4 16609 B16R0.3183 C=CCCCCCCCCC(=O)COC(C)C 1458a_100000745533_100011933949 [0,2,0,0,0,0|0,0,2]=4 16610 B16R0.3183 CC(=O)OCC(=O)CCCCCCCCCO 1458a_100000183556_100009813782 [0,2,0,0,0,0|1,0,1]=4 16611 B16R0.3183 CC(C)C=CC(=O)CCCCCCCCCO 1458a_100016268746_100009813782 [0,2,0,0,0,0|2,0,0]=4 16612 B16R0.3183 CC(C)CCC(=O)CCCCCCCCCO 1458a_100000181311_100009813782 [0,2,0,0,0,0|2,0,0]=4 16613 B16R0.3183 CC(C)CNC(=O)CCCCCCCCCF 11a_100000210953_200009909015 [0,2,0,0,0,0|2,0,0]=4 16614 B16R0.3183 CC(C)CNC(=O)CCCCCCCCCF 240690a_100000210953_200009909015 [0,2,0,0,0,0|2,0,0]=4 16615 B16R0.3183 CC(C)CNC(=O)CCCCCCCCCF 527a_100000210953_200009909015 [0,2,0,0,0,0|2,0,0]=4 16616 B16R0.3183 CC(C)CNC(=O)CCCCCCCCCO 240690a_100000210953_100000032657 [0,2,0,0,0,0|2,0,0]=4 16617 B16R0.3183 CC(C)NNC(=O)CCCCCCCCCF 22a_100000741168_200009909015 [0,2,0,0,0,0|2,0,0]=4 16618 B16R0.3183 CC(C)NNC(=O)CCCCCCCCCO 22a_100000741168_100000032657 [0,2,0,0,0,0|2,0,0]=4 16619 B16R0.3183 CC(C)OCC(=O)CCCCCCCCCO 1458a_100000745533_100009813782 [0,2,0,0,0,0|1,0,0]=3 16620 B16R0.3183 CC(C)OCC(=O)NCCCCCCCCO 240690a_102515433106_100000745533 [0,2,0,0,0,0|2,0,0]=4 16621 B16R0.3183 CC(C)SCC(=O)CCCCCCCCCO 1458a_100000241585_100009813782 [0,2,0,0,0,0|1,1,0]=4 16622 B16R0.3183 CC(O)CCC(=O)CCCCCCCCCF 1458a_200009909015_100012276601 [0,2,0,0,0,0|2,0,0]=4 16623 B16R0.3183 CC(O)CNC(=O)CCCCCCCCCF 11a_100000210904_200009909015 [0,2,0,0,0,0|2,0,0]=4 16624 B16R0.3183 CC(O)CNC(=O)CCCCCCCCCF 240690a_100000210904_200009909015 [0,2,0,0,0,0|2,0,0]=4 16625 B16R0.3183 CC(O)CNC(=O)CCCCCCCCCF 527a_100000210904_200009909015 [0,2,0,0,0,0|2,0,0]=4 16626 B16R0.3183 CC(O)CNC(=O)CCCCCCCCCO 240690a_100000210904_100000032657 [0,2,0,0,0,0|2,0,0]=4 16627 B16R0.3183 CCC#CCCCCCCC(=O)COC(C)C 1458a_100000745533_200000036426 [0,2,0,0,0,0|0,0,2]=4 16628 B16R0.3183 CCCCCCCCCCC(=NNC(C)C)C 4a_100000741168_200011219864 [0,2,0,0,0,0|2,0,0]=4 16629 B16R0.3183 CCCCCCCCCCC(=O)CCC(=O)N 1458a_100011215257_100000210319 [0,2,0,0,0,0|1,0,1]=4 16630 B16R0.3183 CCCCCCCCCCC(=O)CCC(C)O 1458a_100000210375_100012276601 [0,2,0,0,0,0|1,0,0]=3 16631 B16R0.3183 CCCCCCCCCCC(=O)CC[N+](=O)[O-] 1458a_200000064761_100000210319 [0,2,0,0,0,0|2,0,0]=4 16632 B16R0.3183 CCCCCCCCCCC(=O)CC[S+](C)C 1458a_100009452791_100000210319 [0,2,0,0,0,0|1,0,0]=3 16633 B16R0.3183 CCCCCCCCCCC(=O)CNC(=O)C 1458a_100000194580_100000210319 [0,2,0,0,0,0|1,0,1]=4 16634 B16R0.3183 CCCCCCCCCCC(=O)COC(=O)C 1458a_100000183556_100000210319 [0,2,0,0,0,0|0,0,1]=3 16635 B16R0.3183 CCCCCCCCCCC(=O)COC(C)C 1458a_100000745533_100000210319 [0,2,0,0,0,0|0,0,0]=2 16636 B16R0.3183 CCCCCCCCCCC(=O)COC(F)F 1458a_200000719455_100000210319 [0,2,0,0,0,0|1,0,0]=3 16637 B16R0.3183 CCCCCCCCCCC(=O)CSC(=O)C 1458a_100000049016_100000210319 [0,2,0,0,0,0|0,1,1]=4 16638 B16R0.3183 CCCCCCCCCCC(=O)NCC(=O)N 11a_100000711301_100000210375 [0,2,0,0,0,0|1,0,1]=4 16639 B16R0.3183 CCCCCCCCCCC(=O)NCC(=O)N 240690a_100000711301_100000210375 [0,2,0,0,0,0|1,0,1]=4 16640 B16R0.3183 CCCCCCCCCCC(=O)NCC(C)C 11a_100000210953_100000210375 [0,2,0,0,0,0|1,0,0]=3 16641 B16R0.3183 CCCCCCCCCCC(=O)NCC(C)C 1626a_100000210953_100000210375 [0,2,0,0,0,0|1,0,0]=3 16642 B16R0.3183 CCCCCCCCCCC(=O)NCC(C)C 240690a_100000210953_100000210375 [0,2,0,0,0,0|1,0,0]=3 16643 B16R0.3183 CCCCCCCCCCC(=O)NCC(C)O 11a_100000210904_100000210375 [0,2,0,0,0,0|1,0,0]=3 16644 B16R0.3183 CCCCCCCCCCC(=O)NCC(C)O 240690a_100000210904_100000210375 [0,2,0,0,0,0|1,0,0]=3 16645 B16R0.3183 CCCCCCCCCCC(=O)NCC(F)F 11a_100000765723_100000210375 [0,2,0,0,0,0|1,0,0]=3 16646 B16R0.3183 CCCCCCCCCCC(=O)NCC(F)F 1626a_100000765723_100000210375 [0,2,0,0,0,0|1,0,0]=3 16647 B16R0.3183 CCCCCCCCCCC(=O)NCC(F)F 240690a_100000765723_100000210375 [0,2,0,0,0,0|1,0,0]=3 16648 B16R0.3183 CCCCCCCCCCC(=O)NNC(=O)C 22a_100000189765_100000210375 [0,2,0,0,0,0|1,0,1]=4 16649 B16R0.3183 CCCCCCCCCCC(=O)NNC(C)C 22a_100000741168_100000210375 [0,2,0,0,0,0|1,0,0]=3 16650 B16R0.3183 CCCCCCCCCCC(C)OCC(C)O 34a_100011215000_100011218427 [0,2,0,0,0,0|1,0,1]=4 16651 B16R0.3183 CCCCCCCCCCC(C)OCC(C)O 7a_100011215000_100011218427 [0,2,0,0,0,0|1,0,1]=4 16652 B16R0.3183 CCCCCCCCCCC(C)OC[C@@H](C)O 34a_100011215000_100009817552 [0,2,0,0,0,0|1,0,1]=4 16653 B16R0.3183 CCCCCCCCCCC(C)OC[C@@H](C)O 7a_100011215000_100009817552 [0,2,0,0,0,0|1,0,1]=4 16654 B16R0.3183 CCCCCCCCCCN(C)COC(C)C 2230a_100000207566_100000709892 [0,2,0,0,0,0|2,0,0]=4 16655 B16R0.3183 CCCCCCCCCCN(C)COC(C)C 269982a_100000207566_100000709892 [0,2,0,0,0,0|2,0,0]=4 16656 B16R0.3183 CCCCCCCCCNC(=O)C=CC(C)C 11a_100000212291_100016268746 [0,2,0,0,0,0|2,0,0]=4 16657 B16R0.3183 CCCCCCCCCNC(=O)C=CC(C)C 1626a_100000212291_100016268746 [0,2,0,0,0,0|2,0,0]=4 16658 B16R0.3183 CCCCCCCCCNC(=O)C=CC(C)C 240690a_100000212291_100016268746 [0,2,0,0,0,0|2,0,0]=4 16659 B16R0.3183 CCCCCCCCCNC(=O)CCC(C)C 11a_100000212291_100000181311 [0,2,0,0,0,0|2,0,0]=4 16660 B16R0.3183 CCCCCCCCCNC(=O)CCC(C)C 1626a_100000212291_100000181311 [0,2,0,0,0,0|2,0,0]=4 16661 B16R0.3183 CCCCCCCCCNC(=O)CCC(C)C 240690a_100000212291_100000181311 [0,2,0,0,0,0|2,0,0]=4 16662 B16R0.3183 CCCCCCCCCNC(=O)CCC(C)C 527a_100000212291_100000181311 [0,2,0,0,0,0|2,0,0]=4 16663 B16R0.3183 CCCCCCCCCNC(=O)CCC(C)O 1626a_100000212291_100000718519 [0,2,0,0,0,0|2,0,0]=4 16664 B16R0.3183 CCCCCCCCCNC(=O)CCN(C)C 11a_100000212291_100000689311 [0,2,0,0,0,0|2,0,0]=4 16665 B16R0.3183 CCCCCCCCCNC(=O)CCN(C)C 240690a_100000212291_100000689311 [0,2,0,0,0,0|2,0,0]=4 16666 B16R0.3183 CCCCCCCCCNC(=O)CCN(C)C 527a_100000212291_100000689311 [0,2,0,0,0,0|2,0,0]=4 16667 B16R0.3183 CCCCCCCCCNC(=O)CC[S+](C)C 11a_100000212291_100009452791 [0,2,0,0,0,0|2,0,0]=4 16668 B16R0.3183 CCCCCCCCCNC(=O)CC[S+](C)C 1626a_100000212291_100009452791 [0,2,0,0,0,0|2,0,0]=4 16669 B16R0.3183 CCCCCCCCCNC(=O)CC[S+](C)C 240690a_100000212291_100009452791 [0,2,0,0,0,0|2,0,0]=4 16670 B16R0.3183 CCCCCCCCCNC(=O)COC(=O)C 1626a_100000212291_100000183556 [0,2,0,0,0,0|1,0,1]=4 16671 B16R0.3183 CCCCCCCCCNC(=O)COC(=O)C 240690a_100000212291_100000183556 [0,2,0,0,0,0|1,0,1]=4 16672 B16R0.3183 CCCCCCCCCNC(=O)COC(=O)C 527a_100000212291_100000183556 [0,2,0,0,0,0|1,0,1]=4 16673 B16R0.3183 CCCCCCCCCNC(=O)COC(C)C 11a_100000212291_100000745533 [0,2,0,0,0,0|1,0,0]=3 16674 B16R0.3183 CCCCCCCCCNC(=O)COC(C)C 1626a_100000212291_100000745533 [0,2,0,0,0,0|1,0,0]=3 16675 B16R0.3183 CCCCCCCCCNC(=O)COC(C)C 240690a_100000212291_100000745533 [0,2,0,0,0,0|1,0,0]=3 16676 B16R0.3183 CCCCCCCCCNC(=O)COC(C)C 527a_100000212291_100000745533 [0,2,0,0,0,0|1,0,0]=3 16677 B16R0.3183 CCCCCCCCCNC(=O)COC(F)F 11a_100000212291_200000719455 [0,2,0,0,0,0|2,0,0]=4 16678 B16R0.3183 CCCCCCCCCNC(=O)COC(F)F 1626a_100000212291_200000719455 [0,2,0,0,0,0|2,0,0]=4 16679 B16R0.3183 CCCCCCCCCNC(=O)COC(F)F 240690a_100000212291_200000719455 [0,2,0,0,0,0|2,0,0]=4 16680 B16R0.3183 CCCCCCCCCNC(=O)COC(F)F 527a_100000212291_200000719455 [0,2,0,0,0,0|2,0,0]=4 16681 B16R0.3183 CCCCCCCCCNC(=O)CSC(C)C 11a_100000212291_100000241585 [0,2,0,0,0,0|1,1,0]=4 16682 B16R0.3183 CCCCCCCCCNC(=O)CSC(C)C 1626a_100000212291_100000241585 [0,2,0,0,0,0|1,1,0]=4 16683 B16R0.3183 CCCCCCCCCNC(=O)CSC(C)C 240690a_100000212291_100000241585 [0,2,0,0,0,0|1,1,0]=4 16684 B16R0.3183 CCCCCCCCCNC(=O)CSC(C)C 527a_100000212291_100000241585 [0,2,0,0,0,0|1,1,0]=4 16685 B16R0.3183 CCCCCCCCCNC(=O)NCC(C)C 2708a_100000210953_100000212291 [0,2,0,0,0,0|2,0,0]=4 16686 B16R0.3183 CCCCCCCCCNC(=O)NCC(C)C 2708a_100000212291_100000210953 [0,2,0,0,0,0|2,0,0]=4 16687 B16R0.3183 CCCCCCCCCNC(=O)NCC(C)C 273464a_100000210953_100000212291 [0,2,0,0,0,0|2,0,0]=4 16688 B16R0.3183 CCCCCCCCCNC(=O)NCC(C)C 273464a_100000212291_100000210953 [0,2,0,0,0,0|2,0,0]=4 16689 B16R0.3183 CCCCCCCCCNC(=O)NCC(C)C 512a_100000210953_100000212291 [0,2,0,0,0,0|2,0,0]=4 16690 B16R0.3183 CCCCCCCCCNC(=O)NCC(C)C 512a_100000212291_100000210953 [0,2,0,0,0,0|2,0,0]=4 16691 B16R0.3183 CCCCCCCCCNC(=O)NCC(C)O 2708a_100000212291_100000210904 [0,2,0,0,0,0|2,0,0]=4 16692 B16R0.3183 CCCCCCCCCNC(=O)NCC(C)O 273464a_100000210904_100000212291 [0,2,0,0,0,0|2,0,0]=4 16693 B16R0.3183 CCCCCCCCCNC(=O)NCC(C)O 273464a_100000212291_100000210904 [0,2,0,0,0,0|2,0,0]=4 16694 B16R0.3183 CCCCCCCCCNC(=O)NCC(C)O 512a_100000210904_100000212291 [0,2,0,0,0,0|2,0,0]=4 16695 B16R0.3183 CCCCCCCCCNC(=O)NCC(C)O 512a_100000212291_100000210904 [0,2,0,0,0,0|2,0,0]=4 16696 B16R0.3183 CCCCCCCCCNC(=O)NCC(F)F 2708a_100000212291_100000765723 [0,2,0,0,0,0|2,0,0]=4 16697 B16R0.3183 CCCCCCCCCNC(=O)NCC(F)F 273464a_100000212291_100000765723 [0,2,0,0,0,0|2,0,0]=4 16698 B16R0.3183 CCCCCCCCCNC(=O)NCC(F)F 273464a_100000765723_100000212291 [0,2,0,0,0,0|2,0,0]=4 16699 B16R0.3183 CCCCCCCCCNC(=O)NCC(F)F 512a_100000212291_100000765723 [0,2,0,0,0,0|2,0,0]=4 16700 B16R0.3183 CCCCCCCCCNC(=O)NCC(F)F 512a_100000765723_100000212291 [0,2,0,0,0,0|2,0,0]=4 16701 B16R0.3183 CCCCCCCCCNC(=O)NNC(C)C 273464a_100000212291_100000741168 [0,2,0,0,0,0|2,0,0]=4 16702 B16R0.3183 CCCCCCCCCNC(=O)NNC(C)C 512a_100000212291_100000741168 [0,2,0,0,0,0|2,0,0]=4 16703 B16R0.3183 CCCCCCCCCNC(=O)NNC(C)C 512a_100000741168_100000212291 [0,2,0,0,0,0|2,0,0]=4 16704 B16R0.3183 CCCCCCCCNCC(=O)COC(=O)C 34a_100000229939_100000036994 [0,2,0,0,0,0|1,0,1]=4 16705 B16R0.3183 CCCCCCCCNCC(=O)NCC(C)C 2230a_100000229939_100000183291 [0,2,0,0,0,0|2,0,0]=4 16706 B16R0.3183 CCCCCCCCNCC(=O)NCC(C)C 34a_100000229939_100000183291 [0,2,0,0,0,0|2,0,0]=4 16707 B16R0.3183 CCCCCCCCOCC(=O)CCC(C)C 1458a_100000759886_100000210312 [0,2,0,0,0,0|2,0,0]=4 16708 B16R0.3183 CCCCCCCCOCC(=O)CCC(C)O 1458a_100000759886_100012276601 [0,2,0,0,0,0|2,0,0]=4 16709 B16R0.3183 CCCCCCCCOCC(=O)COC(=O)C 34a_100000210232_100000036994 [0,2,0,0,0,0|1,0,1]=4 16710 B16R0.3183 CCCCCCCCOCC(=O)NCC(C)C 11a_100000210953_100000759886 [0,2,0,0,0,0|2,0,0]=4 16711 B16R0.3183 CCCCCCCCOCC(=O)NCC(C)C 1626a_100000210953_100000759886 [0,2,0,0,0,0|2,0,0]=4 16712 B16R0.3183 CCCCCCCCOCC(=O)NCC(C)C 240690a_100000210953_100000759886 [0,2,0,0,0,0|2,0,0]=4 16713 B16R0.3183 CCCCCCCCOCC(=O)NCC(C)C 34a_100000210232_100000183291 [0,2,0,0,0,0|2,0,0]=4 16714 B16R0.3183 CCCCCCCCOCC(=O)NCC(C)C 527a_100000210953_100000759886 [0,2,0,0,0,0|2,0,0]=4 16715 B16R0.3183 CCCCCCCCOCC(=O)NCC(C)C 7a_100000210232_100000183291 [0,2,0,0,0,0|2,0,0]=4 16716 B16R0.3183 CCCCCCCCOCC(=O)NCC(C)O 11a_100000210904_100000759886 [0,2,0,0,0,0|2,0,0]=4 16717 B16R0.3183 CCCCCCCCOCC(=O)NCC(C)O 240690a_100000210904_100000759886 [0,2,0,0,0,0|2,0,0]=4 16718 B16R0.3183 CCCCCCCCOCC(=O)NCC(C)O 527a_100000210904_100000759886 [0,2,0,0,0,0|2,0,0]=4 16719 B16R0.3183 CCCCCCCCOCC(=O)NCC(F)F 11a_100000765723_100000759886 [0,2,0,0,0,0|2,0,0]=4 16720 B16R0.3183 CCCCCCCCOCC(=O)NCC(F)F 1626a_100000765723_100000759886 [0,2,0,0,0,0|2,0,0]=4 16721 B16R0.3183 CCCCCCCCOCC(=O)NCC(F)F 240690a_100000765723_100000759886 [0,2,0,0,0,0|2,0,0]=4 16722 B16R0.3183 CCCCCCCCOCC(=O)NCC(F)F 527a_100000765723_100000759886 [0,2,0,0,0,0|2,0,0]=4 16723 B16R0.3183 CCCCCCCCOCC(=O)NNC(C)C 22a_100000741168_100000759886 [0,2,0,0,0,0|2,0,0]=4 16724 B16R0.3183 CCCCCCCCSCC(=O)COC(=O)C 62a_100000036994_100000210317 [0,2,0,0,0,0|1,0,1]=4 16725 B16R0.3183 CCCCCCCCSCC(=O)COC(=O)C 62a_100000210759_100000036994 [0,2,0,0,0,0|1,0,1]=4 16726 B16R0.3183 CCCCCCCCSCC(=O)NCC(C)C 62a_100000183291_100000210317 [0,2,0,0,0,0|2,0,0]=4 16727 B16R0.3183 CCCCCCCCSCC(=O)NCC(C)C 62a_100000210759_100000183291 [0,2,0,0,0,0|2,0,0]=4 16728 B16R0.3183 CCCCCCNCCCC(=O)NCC(C)C 2230a_100000210581_100011194448 [0,2,0,0,0,0|2,0,0]=4 16729 B16R0.3183 CCCCCCOCCCC(=O)NCC(C)C 34a_100000210259_100011194448 [0,2,0,0,0,0|2,0,0]=4 16730 B16R0.3183 CCCCCCOCCCC(=O)NCC(C)C 7a_100000210259_100011194448 [0,2,0,0,0,0|2,0,0]=4 16731 B16R0.3183 CCCCCCSCCCC(=O)NCC(C)C 62a_100000210314_100011194448 [0,2,0,0,0,0|2,0,0]=4 16732 B16R0.3183 CCCCCCSCCCC(=O)NCC(C)C 62a_100011194448_100000210757 [0,2,0,0,0,0|2,0,0]=4 16733 B16R0.3183 C[S+](C)CCC(=O)CCCCCCCCCO 1458a_100009452791_100009813782 [0,2,0,0,0,0|2,0,0]=4 16734 B16R0.3183 O=C(CCCCCCCCCF)NCC(F)F 11a_100000765723_200009909015 [0,2,0,0,0,0|2,0,0]=4 16735 B16R0.3183 O=C(CCCCCCCCCF)NCC(F)F 240690a_100000765723_200009909015 [0,2,0,0,0,0|2,0,0]=4 16736 B16R0.3183 O=C(CCCCCCCCCF)NCC(F)F 527a_100000765723_200009909015 [0,2,0,0,0,0|2,0,0]=4 16737 B16R0.3183 O=C(CCCCCCCCCO)COC(F)F 1458a_200000719455_100009813782 [0,2,0,0,0,0|2,0,0]=4 16738 B16R0.3183 O=C(CCCCCCCCCO)NCC(F)F 240690a_100000765723_100000032657 [0,2,0,0,0,0|2,0,0]=4 16739 B16R0.6607 CCC=CC(=O)N(C)CCCCCCCCC 11a_100000232482_100000212282 [0,2,0,0,0,0|2,0,0]=4 16740 B16R0.6607 CCC=CC(=O)N(C)CCCCCCCCC 1626a_100000232482_100000212282 [0,2,0,0,0,0|2,0,0]=4 16741 B16R0.6607 CCC=CC(=O)N(C)CCCCCCCCC 240690a_100000232482_100000212282 [0,2,0,0,0,0|2,0,0]=4 16742 B16R0.6607 CCCCCCCCCC(=O)C(=O)NCCC 1458a_200011297150_100000210670 [0,2,0,0,0,0|1,0,1]=4 16743 B16R0.6607 CCCCCCCCCN(C)C(=O)CCCC 11a_100000232482_100000210183 [0,2,0,0,0,0|2,0,0]=4 16744 B16R0.6607 CCCCCCCCCN(C)C(=O)CCCC 1626a_100000232482_100000210183 [0,2,0,0,0,0|2,0,0]=4 16745 B16R0.6607 CCCCCCCCCN(C)C(=O)CCCC 240690a_100000232482_100000210183 [0,2,0,0,0,0|2,0,0]=4 16746 B16R0.6607 CCCCCCCCCN(C)C(=O)CCCC 527a_100000232482_100000210183 [0,2,0,0,0,0|2,0,0]=4 16747 B16R0.6607 CCCCCCCCCN(C)C(=O)CCOC 11a_100000232482_100000749529 [0,2,0,0,0,0|2,0,0]=4 16748 B16R0.6607 CCCCCCCCCN(C)C(=O)CCOC 1626a_100000232482_100000749529 [0,2,0,0,0,0|2,0,0]=4 16749 B16R0.6607 CCCCCCCCCN(C)C(=O)CCOC 240690a_100000232482_100000749529 [0,2,0,0,0,0|2,0,0]=4 16750 B16R0.6607 CCCCCCCCCN(C)C(=O)CCOC 527a_100000232482_100000749529 [0,2,0,0,0,0|2,0,0]=4 16751 B16R0.6607 CCCCCCCCCN(C)C(=O)CCSC 11a_100000232482_100000174002 [0,2,0,0,0,0|2,0,0]=4 16752 B16R0.6607 CCCCCCCCCN(C)C(=O)CCSC 1626a_100000232482_100000174002 [0,2,0,0,0,0|2,0,0]=4 16753 B16R0.6607 CCCCCCCCCN(C)C(=O)CCSC 240690a_100000232482_100000174002 [0,2,0,0,0,0|2,0,0]=4 16754 B16R0.6607 CCCCCCCCCN(C)C(=O)CCSC 527a_100000232482_100000174002 [0,2,0,0,0,0|2,0,0]=4 16755 B16R0.6607 CCCCCCCCCN(C)C(=O)COCC 11a_100000232482_100000211967 [0,2,0,0,0,0|1,0,0]=3 16756 B16R0.6607 CCCCCCCCCN(C)C(=O)COCC 1626a_100000232482_100000211967 [0,2,0,0,0,0|1,0,0]=3 16757 B16R0.6607 CCCCCCCCCN(C)C(=O)COCC 240690a_100000232482_100000211967 [0,2,0,0,0,0|1,0,0]=3 16758 B16R0.6607 CCCCCCCCCN(C)C(=O)COCC 527a_100000232482_100000211967 [0,2,0,0,0,0|1,0,0]=3 16759 B16R0.6607 CCCCCCCCCN(C)C(=O)CSCC 11a_100000232482_100000230394 [0,2,0,0,0,0|1,1,0]=4 16760 B16R0.6607 CCCCCCCCCN(C)C(=O)CSCC 1626a_100000232482_100000230394 [0,2,0,0,0,0|1,1,0]=4 16761 B16R0.6607 CCCCCCCCCN(C)C(=O)CSCC 240690a_100000232482_100000230394 [0,2,0,0,0,0|1,1,0]=4 16762 B16R0.6607 CCCCCCCCCN(C)C(=O)CSCC 527a_100000232482_100000230394 [0,2,0,0,0,0|1,1,0]=4 16763 B16R0.6607 CCCCCCCCCN(C)C(=O)NCCC 2708a_100020643023_100000232482 [0,2,0,0,0,0|2,0,0]=4 16764 B16R0.6607 CCCCCCCCCN(C)C(=O)NCCC 273464a_100020643023_100000232482 [0,2,0,0,0,0|2,0,0]=4 16765 B16R0.6607 CCCCCCCCCN(C)C(=O)NCCF 273464a_100000724931_100000232482 [0,2,0,0,0,0|2,0,0]=4 16766 B16R0.6607 CCCCCCCCCN(C)C(=O)NCCO 273464a_100000210304_100000232482 [0,2,0,0,0,0|2,0,0]=4 16767 B16R0.6607 CCCCCCCCNC(C)C(=O)NCCC 2230a_100000229939_100000230305 [0,2,0,0,0,0|2,0,0]=4 16768 B16R0.6607 CCCCCCCCNC(C)C(=O)NCCC 2230a_100025744714_100000210759 [0,2,0,0,0,0|2,0,0]=4 16769 B16R0.6607 CCCCCCCCNC(C)C(=O)NCCC 34a_100000229939_100000230305 [0,2,0,0,0,0|2,0,0]=4 16770 B16R0.6607 CCCCCCCCNC(C)C(=O)NCCC 34a_100025744714_100000210759 [0,2,0,0,0,0|2,0,0]=4 16771 B16R0.6607 CCCCCCCCNC(C)C(=O)OCCC 2230a_100000229939_100000760410 [0,2,0,0,0,0|1,0,0]=3 16772 B16R0.6607 CCCCCCCCNC(C)C(=O)OCCC 34a_100000229939_100000760410 [0,2,0,0,0,0|1,0,0]=3 16773 B16R0.6607 CCCCCCCCOC(C)C(=O)NCCC 34a_100000210232_100000230305 [0,2,0,0,0,0|2,0,0]=4 16774 B16R0.6607 CCCCCCCCOC(C)C(=O)NCCC 7a_100000210232_100000230305 [0,2,0,0,0,0|2,0,0]=4 16775 B16R0.6607 CCCCCCCCOC(C)C(=O)OCCC 34a_100000037348_100000210759 [0,2,0,0,0,0|1,0,0]=3 16776 B16R0.6607 CCCCCCCCOC(C)C(=O)OCCC 34a_100000210232_100000760410 [0,2,0,0,0,0|1,0,0]=3 16777 B16R0.6607 CCCCCCCCOC(C)C(=O)OCCC 7a_100000037348_100000210759 [0,2,0,0,0,0|1,0,0]=3 16778 B16R0.6607 CCCCCCCCOC(C)C(=O)OCCC 7a_100000210232_100000760410 [0,2,0,0,0,0|1,0,0]=3 16779 B16R0.6607 CCCCCCCCSC(C)C(=O)NCCC 62a_100000210759_100000230305 [0,2,0,0,0,0|2,0,0]=4 16780 B16R0.6607 CCCCCCCCSC(C)C(=O)NCCC 62a_100000230305_100000210317 [0,2,0,0,0,0|2,0,0]=4 16781 B16R0.6607 CCCCCCCCSC(C)C(=O)OCCC 62a_100000210759_100000760410 [0,2,0,0,0,0|1,0,0]=3 16782 B16R0.6607 CCCCCCCCSC(C)C(=O)OCCC 62a_100000760410_100000210317 [0,2,0,0,0,0|1,0,0]=3 16783 B16R0.6607 CCCCCNCCOC(C)C(=O)OCCC 34a_100000224656_100000760410 [0,2,0,0,0,0|2,0,0]=4 16784 B16R0.6607 CCCCCOCCOC(C)C(=O)OCCC 34a_100011215259_100000760410 [0,2,0,0,0,0|2,0,0]=4 16785 B16R0.6607 CCCCCOCCOC(C)C(=O)OCCC 7a_100011215259_100000760410 [0,2,0,0,0,0|2,0,0]=4 16786 B16R0.6607 CCCCOCCCNC(C)C(=O)OCCC 2230a_200000211371_100000760410 [0,2,0,0,0,0|2,0,0]=4 16787 B16R0.6607 CCCCOCCCNC(C)C(=O)OCCC 34a_200000211371_100000760410 [0,2,0,0,0,0|2,0,0]=4 16788 B16R0.6607 CCCCOCCCOC(C)C(=O)OCCC 34a_200011215613_100000760410 [0,2,0,0,0,0|2,0,0]=4 16789 B16R0.6607 CCCCOCCCOC(C)C(=O)OCCC 7a_200011215613_100000760410 [0,2,0,0,0,0|2,0,0]=4 16790 B16R0.6607 CCCOC(=O)C(C)NCCCCCCCO 2230a_100011996573_100000760410 [0,2,0,0,0,0|2,0,0]=4 16791 B16R0.6607 CCCOC(=O)C(C)NCCCCCCCO 34a_100011996573_100000760410 [0,2,0,0,0,0|2,0,0]=4 16792 B16R0.6607 CCCOC(=O)C(C)OCCCCCCCBr 34a_100000760002_100000760410 [0,2,0,0,0,0|2,0,0]=4 16793 B16R0.6607 CCCOC(=O)C(C)OCCCCCCCBr 7a_100000760002_100000760410 [0,2,0,0,0,0|2,0,0]=4 16794 B16R0.6607 CCCOC(=O)C(C)OCCCCCCCN 34a_100011996573_100000760410 [0,2,0,0,0,0|2,0,0]=4 16795 B16R0.6607 CCCOC(=O)C(C)OCCCCCCCO 34a_100000037348_100000760002 [0,2,0,0,0,0|2,0,0]=4 16796 B16R0.6607 CCCOC(=O)C(C)OCCCCCCCO 7a_100000037348_100000760002 [0,2,0,0,0,0|2,0,0]=4 16797 B16R0.6607 CCCOC(=O)C(C)OCCCCCCOC 34a_100000037348_100011998445 [0,2,0,0,0,0|2,0,0]=4 16798 B16R0.6607 CCCOC(=O)C(C)OCCCCCCOC 34a_200012092642_100000760410 [0,2,0,0,0,0|2,0,0]=4 16799 B16R0.6607 CCCOC(=O)C(C)OCCCCCCOC 7a_100000037348_100011998445 [0,2,0,0,0,0|2,0,0]=4 16800 B16R0.6607 CCCOC(=O)C(C)OCCCCCCOC 7a_200012092642_100000760410 [0,2,0,0,0,0|2,0,0]=4 16801 B16R0.6607 CCCOC(=O)C(C)SCCCCCCCO 62a_100000760002_100000760410 [0,2,0,0,0,0|2,0,0]=4 16802 B16R0.6607 CCCOC(=O)C(C)SCCCCCCCO 62a_100000760410_100000760002 [0,2,0,0,0,0|2,0,0]=4 16803 B16R0.6607 CCCOC(=O)C(C)SCCCCCCOC 62a_100000760410_100011998445 [0,2,0,0,0,0|2,0,0]=4 16804 B16R0.6607 CCCOC(=O)C(C)SCCCCCCOC 62a_100011998445_100000760410 [0,2,0,0,0,0|2,0,0]=4 16805 B16R0.654 CCCCCCCCNC(CC)C(=O)OCC 2230a_100000229939_100000212269 [0,2,0,0,0,0|1,0,0]=3 16806 B16R0.654 CCCCCCCCNC(CC)C(=O)OCC 34a_100000229939_100000212269 [0,2,0,0,0,0|1,0,0]=3 16807 B16R0.654 CCCCCCCCNC(SC)C(=O)OCC 34a_100000229939_100009893047 [0,2,0,0,0,0|1,0,0]=3 16808 B16R0.654 CCCCCCCCOC(CC)C(=O)OCC 34a_100000210232_100000212269 [0,2,0,0,0,0|1,0,0]=3 16809 B16R0.654 CCCCCCCCOC(CC)C(=O)OCC 34a_100011216719_100000210759 [0,2,0,0,0,0|1,0,0]=3 16810 B16R0.654 CCCCCCCCOC(CC)C(=O)OCC 7a_100000210232_100000212269 [0,2,0,0,0,0|1,0,0]=3 16811 B16R0.654 CCCCCCCCOC(CC)C(=O)OCC 7a_100011216719_100000210759 [0,2,0,0,0,0|1,0,0]=3 16812 B16R0.654 CCCCCCCCOC(SC)C(=O)OCC 34a_100000210232_100009893047 [0,2,0,0,0,0|1,0,0]=3 16813 B16R0.654 CCCCCCCCSC(C=O)C(=O)OCC 62a_100000053139_100000210317 [0,2,0,0,0,0|1,0,0]=3 16814 B16R0.654 CCCCCCCCSC(C=O)C(=O)OCC 62a_100000210759_100000053139 [0,2,0,0,0,0|1,0,0]=3 16815 B16R0.654 CCCCCCCCSC(CC)C(=O)OCC 62a_100000210759_100000212269 [0,2,0,0,0,0|1,0,0]=3 16816 B16R0.654 CCCCCCCCSC(CC)C(=O)OCC 62a_100000212269_100000210317 [0,2,0,0,0,0|1,0,0]=3 16817 B16R0.654 CCCCCCCCSC(SC)C(=O)OCC 62a_100000210759_100009893047 [0,2,0,0,0,0|1,0,0]=3 16818 B16R0.654 CCCCCCCCSC(SC)C(=O)OCC 62a_100009893047_100000210317 [0,2,0,0,0,0|1,0,0]=3 16819 B16R0.654 CCCCCNCCOC(CC)C(=O)OCC 34a_100000224656_100000212269 [0,2,0,0,0,0|2,0,0]=4 16820 B16R0.654 CCCCCNCCOC(SC)C(=O)OCC 34a_100000224656_100009893047 [0,2,0,0,0,0|2,0,0]=4 16821 B16R0.654 CCCCCOCCOC(CC)C(=O)OCC 34a_100011215259_100000212269 [0,2,0,0,0,0|2,0,0]=4 16822 B16R0.654 CCCCCOCCOC(CC)C(=O)OCC 7a_100011215259_100000212269 [0,2,0,0,0,0|2,0,0]=4 16823 B16R0.654 CCCCCOCCOC(SC)C(=O)OCC 34a_100011215259_100009893047 [0,2,0,0,0,0|2,0,0]=4 16824 B16R0.654 CCCCOCCCNC(CC)C(=O)OCC 2230a_200000211371_100000212269 [0,2,0,0,0,0|2,0,0]=4 16825 B16R0.654 CCCCOCCCNC(CC)C(=O)OCC 34a_200000211371_100000212269 [0,2,0,0,0,0|2,0,0]=4 16826 B16R0.654 CCCCOCCCNC(SC)C(=O)OCC 34a_200000211371_100009893047 [0,2,0,0,0,0|2,0,0]=4 16827 B16R0.654 CCCCOCCCOC(CC)C(=O)OCC 34a_200011215613_100000212269 [0,2,0,0,0,0|2,0,0]=4 16828 B16R0.654 CCCCOCCCOC(CC)C(=O)OCC 7a_200011215613_100000212269 [0,2,0,0,0,0|2,0,0]=4 16829 B16R0.654 CCCCOCCCOC(SC)C(=O)OCC 34a_200011215613_100009893047 [0,2,0,0,0,0|2,0,0]=4 16830 B16R0.654 CCOC(=O)C(C=O)SCCCCCCCO 62a_100000053139_100000760002 [0,2,0,0,0,0|2,0,0]=4 16831 B16R0.654 CCOC(=O)C(C=O)SCCCCCCCO 62a_100000760002_100000053139 [0,2,0,0,0,0|2,0,0]=4 16832 B16R0.654 CCOC(=O)C(C=O)SCCCCCCOC 62a_100000053139_100011998445 [0,2,0,0,0,0|2,0,0]=4 16833 B16R0.654 CCOC(=O)C(C=O)SCCCCCCOC 62a_100011998445_100000053139 [0,2,0,0,0,0|2,0,0]=4 16834 B16R0.654 CCOC(=O)C(CC)NCCCCCCCO 2230a_100011996573_100000212269 [0,2,0,0,0,0|2,0,0]=4 16835 B16R0.654 CCOC(=O)C(CC)NCCCCCCCO 34a_100011996573_100000212269 [0,2,0,0,0,0|2,0,0]=4 16836 B16R0.654 CCOC(=O)C(CC)OCCCCCCCBr 34a_100000760002_100000212269 [0,2,0,0,0,0|2,0,0]=4 16837 B16R0.654 CCOC(=O)C(CC)OCCCCCCCBr 7a_100000760002_100000212269 [0,2,0,0,0,0|2,0,0]=4 16838 B16R0.654 CCOC(=O)C(CC)OCCCCCCCN 34a_100011996573_100000212269 [0,2,0,0,0,0|2,0,0]=4 16839 B16R0.654 CCOC(=O)C(CC)OCCCCCCCO 34a_100011216719_100000760002 [0,2,0,0,0,0|2,0,0]=4 16840 B16R0.654 CCOC(=O)C(CC)OCCCCCCCO 7a_100011216719_100000760002 [0,2,0,0,0,0|2,0,0]=4 16841 B16R0.654 CCOC(=O)C(CC)OCCCCCCOC 34a_100011216719_100011998445 [0,2,0,0,0,0|2,0,0]=4 16842 B16R0.654 CCOC(=O)C(CC)OCCCCCCOC 34a_200012092642_100000212269 [0,2,0,0,0,0|2,0,0]=4 16843 B16R0.654 CCOC(=O)C(CC)OCCCCCCOC 7a_100011216719_100011998445 [0,2,0,0,0,0|2,0,0]=4 16844 B16R0.654 CCOC(=O)C(CC)OCCCCCCOC 7a_200012092642_100000212269 [0,2,0,0,0,0|2,0,0]=4 16845 B16R0.654 CCOC(=O)C(CC)SCCCCCCCO 62a_100000212269_100000760002 [0,2,0,0,0,0|2,0,0]=4 16846 B16R0.654 CCOC(=O)C(CC)SCCCCCCCO 62a_100000760002_100000212269 [0,2,0,0,0,0|2,0,0]=4 16847 B16R0.654 CCOC(=O)C(CC)SCCCCCCOC 62a_100000212269_100011998445 [0,2,0,0,0,0|2,0,0]=4 16848 B16R0.654 CCOC(=O)C(CC)SCCCCCCOC 62a_100011998445_100000212269 [0,2,0,0,0,0|2,0,0]=4 16849 B16R0.654 CCOC(=O)C(NCCCCCCCO)SC 34a_100011996573_100009893047 [0,2,0,0,0,0|2,0,0]=4 16850 B16R0.654 CCOC(=O)C(OCCCCCCCBr)SC 34a_100000760002_100009893047 [0,2,0,0,0,0|2,0,0]=4 16851 B16R0.654 CCOC(=O)C(OCCCCCCCN)SC 34a_100011996573_100009893047 [0,2,0,0,0,0|2,0,0]=4 16852 B16R0.654 CCOC(=O)C(OCCCCCCOC)SC 34a_200012092642_100009893047 [0,2,0,0,0,0|2,0,0]=4 16853 B16R0.654 CCOC(=O)C(SC)SCCCCCCCO 62a_100000760002_100009893047 [0,2,0,0,0,0|2,0,0]=4 16854 B16R0.654 CCOC(=O)C(SC)SCCCCCCCO 62a_100009893047_100000760002 [0,2,0,0,0,0|2,0,0]=4 16855 B16R0.654 CCOC(=O)C(SC)SCCCCCCOC 62a_100009893047_100011998445 [0,2,0,0,0,0|2,0,0]=4 16856 B16R0.654 CCOC(=O)C(SC)SCCCCCCOC 62a_100011998445_100009893047 [0,2,0,0,0,0|2,0,0]=4 16857 B16R0.6514 CCCCCCCCNC(C)(C)C(=O)OCC 2230a_100000229939_100011216345 [0,2,0,0,0,0|1,0,0]=3 16858 B16R0.6514 CCCCCCCCNC(F)(F)C(=O)OCC 34a_100000229939_100000210910 [0,2,0,0,0,0|1,0,0]=3 16859 B16R0.6514 CCCCCCCCOC(C)(C)C(=O)OCC 34a_100000686869_100000210759 [0,2,0,0,0,0|1,0,0]=3 16860 B16R0.6514 CCCCCCCCOC(C)(C)C(=O)OCC 7a_100000210232_100011216345 [0,2,0,0,0,0|1,0,0]=3 16861 B16R0.6514 CCCCCCCCOC(C)(C)C(=O)OCC 7a_100000686869_100000210759 [0,2,0,0,0,0|1,0,0]=3 16862 B16R0.6514 CCCCCCCCOC(F)(F)C(=O)OCC 34a_100000210232_100000210910 [0,2,0,0,0,0|1,0,0]=3 16863 B16R0.6514 CCCCCCCCOC(F)(F)C(=O)OCC 7a_100000210232_100000210910 [0,2,0,0,0,0|1,0,0]=3 16864 B16R0.6514 CCCCCCCCSC(C)(C)C(=O)OCC 62a_100000210759_100011216345 [0,2,0,0,0,0|1,0,0]=3 16865 B16R0.6514 CCCCCCCCSC(C)(C)C(=O)OCC 62a_100011216345_100000210317 [0,2,0,0,0,0|1,0,0]=3 16866 B16R0.6514 CCCCCCCCSC(F)(F)C(=O)OCC 62a_100000210759_100000210910 [0,2,0,0,0,0|1,0,0]=3 16867 B16R0.6514 CCCCCCCCSC(F)(F)C(=O)OCC 62a_100000210910_100000210317 [0,2,0,0,0,0|1,0,0]=3 16868 B16R0.6514 CCCCCCCNCC(C)(C)C(=O)OCC 2230a_100000229938_100011219049 [0,2,0,0,0,0|1,0,0]=3 16869 B16R0.6514 CCCCCCCOCC(C)(C)C(=O)OCC 7a_100011765865_100000210614 [0,2,0,0,0,0|1,0,0]=3 16870 B16R0.6514 CCCCCCCOCC(F)(F)C(=O)OCC 34a_100000210272_100009817193 [0,2,0,0,0,0|1,0,0]=3 16871 B16R0.6514 CCCCCCCSCC(C)(C)C(=O)NCC 62a_100000210614_100011895991 [0,2,0,0,0,0|2,0,0]=4 16872 B16R0.6514 CCCCCCCSCC(C)(C)C(=O)NCC 62a_100011895991_100000210316 [0,2,0,0,0,0|2,0,0]=4 16873 B16R0.6514 CCCCCCCSCC(C)(C)C(=O)OCC 62a_100000210614_100011219049 [0,2,0,0,0,0|1,0,0]=3 16874 B16R0.6514 CCCCCCCSCC(C)(C)C(=O)OCC 62a_100011219049_100000210316 [0,2,0,0,0,0|1,0,0]=3 16875 B16R0.6514 CCCCCCCSCC(F)(F)C(=O)OCC 62a_100000210614_100009817193 [0,2,0,0,0,0|1,0,0]=3 16876 B16R0.6514 CCCCCCCSCC(F)(F)C(=O)OCC 62a_100009817193_100000210316 [0,2,0,0,0,0|1,0,0]=3 16877 B16R0.6514 CCCCCNCCOC(F)(F)C(=O)OCC 34a_100000224656_100000210910 [0,2,0,0,0,0|2,0,0]=4 16878 B16R0.6514 CCCCCOCCOC(C)(C)C(=O)OCC 7a_100011215259_100011216345 [0,2,0,0,0,0|2,0,0]=4 16879 B16R0.6514 CCCCCOCCOC(F)(F)C(=O)OCC 34a_100011215259_100000210910 [0,2,0,0,0,0|2,0,0]=4 16880 B16R0.6514 CCCCCOCCOC(F)(F)C(=O)OCC 7a_100011215259_100000210910 [0,2,0,0,0,0|2,0,0]=4 16881 B16R0.6514 CCCCNCCCCC(C)(C)C(=O)OCC 2230a_100000102301_100010737182 [0,2,0,0,0,0|1,0,0]=3 16882 B16R0.6514 CCCCNCCCCC(C)(C)C(=O)OCC 7a_106832991798_100010737182 [0,2,0,0,0,0|1,0,0]=3 16883 B16R0.6514 CCCCOCCCCC(C)(C)C(=O)OCC 34a_100000210227_100010737182 [0,2,0,0,0,0|1,0,0]=3 16884 B16R0.6514 CCCCOCCCCC(C)(C)C(=O)OCC 7a_100000210227_100010737182 [0,2,0,0,0,0|1,0,0]=3 16885 B16R0.6514 CCCCOCCCNC(C)(C)C(=O)OCC 2230a_200000211371_100011216345 [0,2,0,0,0,0|2,0,0]=4 16886 B16R0.6514 CCCCOCCCNC(F)(F)C(=O)OCC 34a_200000211371_100000210910 [0,2,0,0,0,0|2,0,0]=4 16887 B16R0.6514 CCCCOCCCOC(C)(C)C(=O)OCC 7a_200011215613_100011216345 [0,2,0,0,0,0|2,0,0]=4 16888 B16R0.6514 CCCCOCCCOC(F)(F)C(=O)OCC 34a_200011215613_100000210910 [0,2,0,0,0,0|2,0,0]=4 16889 B16R0.6514 CCCCOCCCOC(F)(F)C(=O)OCC 7a_200011215613_100000210910 [0,2,0,0,0,0|2,0,0]=4 16890 B16R0.6514 CCCCOCCOCC(C)(C)C(=O)OCC 7a_100011765865_100000743108 [0,2,0,0,0,0|2,0,0]=4 16891 B16R0.6514 CCCCOCCOCC(F)(F)C(=O)OCC 34a_100000210238_100009817193 [0,2,0,0,0,0|2,0,0]=4 16892 B16R0.6514 CCCCOCCSCC(C)(C)C(=O)OCC 62a_100000743108_100011219049 [0,2,0,0,0,0|2,0,0]=4 16893 B16R0.6514 CCCCOCCSCC(C)(C)C(=O)OCC 62a_100011219049_100000743108 [0,2,0,0,0,0|2,0,0]=4 16894 B16R0.6514 CCCCOCCSCC(F)(F)C(=O)OCC 62a_100000743108_100009817193 [0,2,0,0,0,0|2,0,0]=4 16895 B16R0.6514 CCCCOCCSCC(F)(F)C(=O)OCC 62a_100009817193_100000743108 [0,2,0,0,0,0|2,0,0]=4 16896 B16R0.6514 CCCCSCCCCC(C)(C)C(=O)OCC 62a_100000210211_100010737182 [0,2,0,0,0,0|1,0,0]=3 16897 B16R0.6514 CCCCSCCCCC(C)(C)C(=O)OCC 62a_100010737182_100000210210 [0,2,0,0,0,0|1,0,0]=3 16898 B16R0.6514 CCCCSCCNCC(C)(C)C(=O)OCC 2230a_100025743550_100011219049 [0,2,0,0,0,0|2,0,0]=4 16899 B16R0.6514 CCCCSCCOCC(F)(F)C(=O)OCC 34a_200000230436_100009817193 [0,2,0,0,0,0|2,0,0]=4 16900 B16R0.6514 CCCOCCCCCC(C)(C)C(=O)OCC 34a_100000210258_100010999646 [0,2,0,0,0,0|1,0,0]=3 16901 B16R0.6514 CCCOCCCNCC(C)(C)C(=O)OCC 2230a_100011217757_100011219049 [0,2,0,0,0,0|2,0,0]=4 16902 B16R0.6514 CCCOCCCNCC(F)(F)C(=O)OCC 34a_100011217757_100009817193 [0,2,0,0,0,0|2,0,0]=4 16903 B16R0.6514 CCCSCCCCCC(C)(C)C(=O)OCC 62a_100000210303_100010999646 [0,2,0,0,0,0|1,0,0]=3 16904 B16R0.6514 CCCSCCCCCC(C)(C)C(=O)OCC 62a_100010999646_100000210303 [0,2,0,0,0,0|1,0,0]=3 16905 B16R0.6514 CCOC(=O)C(C)(C)CCCCCNCCF 34a_100000724931_100010999646 [0,2,0,0,0,0|2,0,0]=4 16906 B16R0.6514 CCOC(=O)C(C)(C)CCCCCNCCO 2230a_100016997473_100010999646 [0,2,0,0,0,0|2,0,0]=4 16907 B16R0.6514 CCOC(=O)C(C)(C)CCCCCNCCO 34a_100016990907_100010999646 [0,2,0,0,0,0|2,0,0]=4 16908 B16R0.6514 CCOC(=O)C(C)(C)CCCCCOCCBr 34a_100000211926_100010999646 [0,2,0,0,0,0|2,0,0]=4 16909 B16R0.6514 CCOC(=O)C(C)(C)CCCCCOCCN 34a_100000210304_100010999646 [0,2,0,0,0,0|2,0,0]=4 16910 B16R0.6514 CCOC(=O)C(C)(C)CCCCCSCCF 62a_100010999646_100011217306 [0,2,0,0,0,0|2,0,0]=4 16911 B16R0.6514 CCOC(=O)C(C)(C)CCCCCSCCF 62a_100011217306_100010999646 [0,2,0,0,0,0|2,0,0]=4 16912 B16R0.6514 CCOC(=O)C(C)(C)CCCCCSCCO 62a_100000211926_100010999646 [0,2,0,0,0,0|2,0,0]=4 16913 B16R0.6514 CCOC(=O)C(C)(C)CCCCCSCCO 62a_100010999646_100000211926 [0,2,0,0,0,0|2,0,0]=4 16914 B16R0.6514 CCOC(=O)C(C)(C)CCCCCSCOC 62a_100000766300_100010999646 [0,2,0,0,0,0|2,0,0]=4 16915 B16R0.6514 CCOC(=O)C(C)(C)CCCCCSCOC 62a_100010999646_100000766300 [0,2,0,0,0,0|2,0,0]=4 16916 B16R0.6514 CCOC(=O)C(C)(C)CCCCCSCSC 62a_100010999646_100011218213 [0,2,0,0,0,0|2,0,0]=4 16917 B16R0.6514 CCOC(=O)C(C)(C)CCCCCSCSC 62a_100011218213_100010999646 [0,2,0,0,0,0|2,0,0]=4 16918 B16R0.6514 CCOC(=O)C(C)(C)CCCCNCCCF 2230a_100015189416_100010737182 [0,2,0,0,0,0|2,0,0]=4 16919 B16R0.6514 CCOC(=O)C(C)(C)CCCCNCCCF 34a_100015189416_100010737182 [0,2,0,0,0,0|2,0,0]=4 16920 B16R0.6514 CCOC(=O)C(C)(C)CCCCNCCOC 2230a_100000209980_100010737182 [0,2,0,0,0,0|2,0,0]=4 16921 B16R0.6514 CCOC(=O)C(C)(C)CCCCNCCSC 2230a_100020590264_100010737182 [0,2,0,0,0,0|2,0,0]=4 16922 B16R0.6514 CCOC(=O)C(C)(C)CCCCOCCCBr 34a_100011217188_100010737182 [0,2,0,0,0,0|2,0,0]=4 16923 B16R0.6514 CCOC(=O)C(C)(C)CCCCOCCCCl 34a_100000230001_100010737182 [0,2,0,0,0,0|2,0,0]=4 16924 B16R0.6514 CCOC(=O)C(C)(C)CCCCOCCCF 34a_100000759539_100010737182 [0,2,0,0,0,0|2,0,0]=4 16925 B16R0.6514 CCOC(=O)C(C)(C)CCCCOCCCN 34a_100000182051_100010737182 [0,2,0,0,0,0|2,0,0]=4 16926 B16R0.6514 CCOC(=O)C(C)(C)CCCCOCCOC 34a_100000210237_100010737182 [0,2,0,0,0,0|2,0,0]=4 16927 B16R0.6514 CCOC(=O)C(C)(C)CCCCOCCSC 34a_100000230434_100010737182 [0,2,0,0,0,0|2,0,0]=4 16928 B16R0.6514 CCOC(=O)C(C)(C)CCCCOCCSC 7a_100000230434_100010737182 [0,2,0,0,0,0|2,0,0]=4 16929 B16R0.6514 CCOC(=O)C(C)(C)CCCCSCCCF 62a_100010737182_100011934791 [0,2,0,0,0,0|2,0,0]=4 16930 B16R0.6514 CCOC(=O)C(C)(C)CCCCSCCCF 62a_100011934791_100010737182 [0,2,0,0,0,0|2,0,0]=4 16931 B16R0.6514 CCOC(=O)C(C)(C)CCCCSCCCO 62a_100010737182_100011215043 [0,2,0,0,0,0|2,0,0]=4 16932 B16R0.6514 CCOC(=O)C(C)(C)CCCCSCCCO 62a_100011215043_100010737182 [0,2,0,0,0,0|2,0,0]=4 16933 B16R0.6514 CCOC(=O)C(C)(C)CCCCSCCOC 62a_100000233755_100010737182 [0,2,0,0,0,0|2,0,0]=4 16934 B16R0.6514 CCOC(=O)C(C)(C)CCCCSCCOC 62a_100010737182_100000233755 [0,2,0,0,0,0|2,0,0]=4 16935 B16R0.6514 CCOC(=O)C(C)(C)CCCCSCCSC 62a_100000212216_100010737182 [0,2,0,0,0,0|2,0,0]=4 16936 B16R0.6514 CCOC(=O)C(C)(C)CCCCSCCSC 62a_100010737182_100000751147 [0,2,0,0,0,0|2,0,0]=4 16937 B16R0.6514 CCOC(=O)C(C)(C)CNCCCCCCO 2230a_100000686447_100011219049 [0,2,0,0,0,0|2,0,0]=4 16938 B16R0.6514 CCOC(=O)C(C)(C)CNCCCCCOC 2230a_100000747528_100011219049 [0,2,0,0,0,0|2,0,0]=4 16939 B16R0.6514 CCOC(=O)C(C)(C)COCCCCCCF 7a_100011765865_100015922095 [0,2,0,0,0,0|2,0,0]=4 16940 B16R0.6514 CCOC(=O)C(C)(C)COCCCCCCO 7a_100011765865_100000766143 [0,2,0,0,0,0|2,0,0]=4 16941 B16R0.6514 CCOC(=O)C(C)(C)CSCCCCCCF 62a_100011219049_100015922095 [0,2,0,0,0,0|2,0,0]=4 16942 B16R0.6514 CCOC(=O)C(C)(C)CSCCCCCCF 62a_100015922095_100011219049 [0,2,0,0,0,0|2,0,0]=4 16943 B16R0.6514 CCOC(=O)C(C)(C)CSCCCCCCO 62a_100000766143_100011219049 [0,2,0,0,0,0|2,0,0]=4 16944 B16R0.6514 CCOC(=O)C(C)(C)CSCCCCCCO 62a_100011219049_100000766143 [0,2,0,0,0,0|2,0,0]=4 16945 B16R0.6514 CCOC(=O)C(C)(C)NCCCCCCCO 2230a_100011996573_100011216345 [0,2,0,0,0,0|2,0,0]=4 16946 B16R0.6514 CCOC(=O)C(C)(C)OCCCCCCCBr 7a_100000760002_100011216345 [0,2,0,0,0,0|2,0,0]=4 16947 B16R0.6514 CCOC(=O)C(C)(C)OCCCCCCCO 34a_100000686869_100000760002 [0,2,0,0,0,0|2,0,0]=4 16948 B16R0.6514 CCOC(=O)C(C)(C)OCCCCCCCO 7a_100000686869_100000760002 [0,2,0,0,0,0|2,0,0]=4 16949 B16R0.6514 CCOC(=O)C(C)(C)OCCCCCCOC 34a_100000686869_100011998445 [0,2,0,0,0,0|2,0,0]=4 16950 B16R0.6514 CCOC(=O)C(C)(C)OCCCCCCOC 7a_100000686869_100011998445 [0,2,0,0,0,0|2,0,0]=4 16951 B16R0.6514 CCOC(=O)C(C)(C)OCCCCCCOC 7a_200012092642_100011216345 [0,2,0,0,0,0|2,0,0]=4 16952 B16R0.6514 CCOC(=O)C(C)(C)SCCCCCCCO 62a_100000760002_100011216345 [0,2,0,0,0,0|2,0,0]=4 16953 B16R0.6514 CCOC(=O)C(C)(C)SCCCCCCCO 62a_100011216345_100000760002 [0,2,0,0,0,0|2,0,0]=4 16954 B16R0.6514 CCOC(=O)C(C)(C)SCCCCCCOC 62a_100011216345_100011998445 [0,2,0,0,0,0|2,0,0]=4 16955 B16R0.6514 CCOC(=O)C(C)(C)SCCCCCCOC 62a_100011998445_100011216345 [0,2,0,0,0,0|2,0,0]=4 16956 B16R0.6514 CCOC(=O)C(F)(F)CNCCCCCCO 34a_100000686447_100009817193 [0,2,0,0,0,0|2,0,0]=4 16957 B16R0.6514 CCOC(=O)C(F)(F)CNCCCCCOC 34a_100000747528_100009817193 [0,2,0,0,0,0|2,0,0]=4 16958 B16R0.6514 CCOC(=O)C(F)(F)COCCCCCCBr 34a_100011215345_100009817193 [0,2,0,0,0,0|2,0,0]=4 16959 B16R0.6514 CCOC(=O)C(F)(F)COCCCCCCCl 34a_100000766143_100009817193 [0,2,0,0,0,0|2,0,0]=4 16960 B16R0.6514 CCOC(=O)C(F)(F)COCCCCCCF 34a_100000732779_100009817193 [0,2,0,0,0,0|2,0,0]=4 16961 B16R0.6514 CCOC(=O)C(F)(F)COCCCCCCN 34a_100000686447_100009817193 [0,2,0,0,0,0|2,0,0]=4 16962 B16R0.6514 CCOC(=O)C(F)(F)COCCCCCNC 34a_100000722520_100009817193 [0,2,0,0,0,0|2,0,0]=4 16963 B16R0.6514 CCOC(=O)C(F)(F)CSCCCCCCF 62a_100009817193_100015922095 [0,2,0,0,0,0|2,0,0]=4 16964 B16R0.6514 CCOC(=O)C(F)(F)CSCCCCCCF 62a_100015922095_100009817193 [0,2,0,0,0,0|2,0,0]=4 16965 B16R0.6514 CCOC(=O)C(F)(F)CSCCCCCCO 62a_100000766143_100009817193 [0,2,0,0,0,0|2,0,0]=4 16966 B16R0.6514 CCOC(=O)C(F)(F)CSCCCCCCO 62a_100009817193_100000766143 [0,2,0,0,0,0|2,0,0]=4 16967 B16R0.6514 CCOC(=O)C(F)(F)NCCCCCCCO 34a_100011996573_100000210910 [0,2,0,0,0,0|2,0,0]=4 16968 B16R0.6514 CCOC(=O)C(F)(F)OCCCCCCCBr 34a_100000760002_100000210910 [0,2,0,0,0,0|2,0,0]=4 16969 B16R0.6514 CCOC(=O)C(F)(F)OCCCCCCCBr 7a_100000760002_100000210910 [0,2,0,0,0,0|2,0,0]=4 16970 B16R0.6514 CCOC(=O)C(F)(F)OCCCCCCCN 34a_100011996573_100000210910 [0,2,0,0,0,0|2,0,0]=4 16971 B16R0.6514 CCOC(=O)C(F)(F)OCCCCCCOC 34a_200012092642_100000210910 [0,2,0,0,0,0|2,0,0]=4 16972 B16R0.6514 CCOC(=O)C(F)(F)OCCCCCCOC 7a_200012092642_100000210910 [0,2,0,0,0,0|2,0,0]=4 16973 B16R0.6514 CCOC(=O)C(F)(F)SCCCCCCCO 62a_100000210910_100000760002 [0,2,0,0,0,0|2,0,0]=4 16974 B16R0.6514 CCOC(=O)C(F)(F)SCCCCCCCO 62a_100000760002_100000210910 [0,2,0,0,0,0|2,0,0]=4 16975 B16R0.6514 CCOC(=O)C(F)(F)SCCCCCCOC 62a_100000210910_100011998445 [0,2,0,0,0,0|2,0,0]=4 16976 B16R0.6514 CCOC(=O)C(F)(F)SCCCCCCOC 62a_100011998445_100000210910 [0,2,0,0,0,0|2,0,0]=4 16977 B16R0.6514 CCOCSCCCCC(C)(C)C(=O)OCC 62a_100000739092_100010737182 [0,2,0,0,0,0|2,0,0]=4 16978 B16R0.6514 CCOCSCCCCC(C)(C)C(=O)OCC 62a_100010737182_100000739092 [0,2,0,0,0,0|2,0,0]=4 16979 B14R1.26 CCCCCCCN1CCNC(=O)C1 2230a_100000184651_100000210681 [1,0,0,1,0,0|2,0,0]=4 16980 B14R1.26 CCCCCCCN1CCOC(=O)C1 2230a_100000131268_100000210681 [1,0,0,1,0,0|1,0,0]=3 16981 B14R1.26 CCCCCCNC1CCNC(=O)C1 2230a_100016994916_100000210314 [1,0,0,1,0,0|2,0,0]=4 16982 B14R1.26 CCCCCCNC1CCNC(=O)C1 34a_100016994916_100000210314 [1,0,0,1,0,0|2,0,0]=4 16983 B14R1.26 CCCCCCOC1CCCC(=O)C1 34a_100012613340_100000210314 [1,0,0,1,0,0|2,0,0]=4 16984 B14R1.26 CCCCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000210314 [1,0,0,1,0,0|2,0,0]=4 16985 B14R1.26 CCCCCOCC1CCNC(=O)C1 34a_100009886756_100000718602 [1,0,0,1,0,0|2,0,0]=4 16986 B14R1.26 CCCCOCCN1CCOC(=O)C1 2230a_100000131268_100000743108 [1,0,0,1,0,0|2,0,0]=4 16987 B14R1.26 O=C1CN(CCO1)CCCCCCF 2230a_100000131268_100015922095 [1,0,0,1,0,0|2,0,0]=4 16988 B14R1.26 O=C1CN(CCO1)CCCCCCO 2230a_100000131268_100000766143 [1,0,0,1,0,0|2,0,0]=4 16989 B14R1.216 CCCCCCCNC1CCCC1=O 2230a_100000229938_100000211823 [1,0,0,1,0,0|2,0,0]=4 16990 B14R1.216 CCCCCCCNC1CCNC1=O 2230a_100016995588_100000210681 [1,0,0,1,0,0|2,0,0]=4 16991 B14R1.216 CCCCCCCNC1CCNC1=O 34a_100016995588_100000210614 [1,0,0,1,0,0|2,0,0]=4 16992 B14R1.216 CCCCCCCNC1CCOC1=O 2230a_100000229938_100000211211 [1,0,0,1,0,0|1,0,0]=3 16993 B14R1.216 CCCCCCCOC1CCCC1=O 34a_100000210272_100000709159 [1,0,0,1,0,0|2,0,0]=4 16994 B14R1.216 CCCCCCCOC1CCCC1=O 34a_200000719330_100000210614 [1,0,0,1,0,0|2,0,0]=4 16995 B14R1.216 CCCCCCCOC1CCCC1=O 7a_100000210272_100000211823 [1,0,0,1,0,0|2,0,0]=4 16996 B14R1.216 CCCCCCCOC1CCOC1=O 34a_100000210272_100000211211 [1,0,0,1,0,0|1,0,0]=3 16997 B14R1.216 CCCCCCCOC1CCOC1=O 7a_100000210272_100000211211 [1,0,0,1,0,0|1,0,0]=3 16998 B14R1.216 CCCCCCCO[C@H]1CCNC1=O 34a_100000688343_100000210614 [1,0,0,1,0,0|2,0,0]=4 16999 B14R1.216 CCCCCCCSC1CCCC1=O 62a_100000210614_100000211823 [1,0,0,1,0,0|2,0,0]=4 17000 B14R1.216 CCCCCCCSC1CCCC1=O 62a_100000211823_100000210316 [1,0,0,1,0,0|2,0,0]=4 17001 B14R1.216 CCCCCCCSC1CCOC1=O 62a_100000210614_100000211211 [1,0,0,1,0,0|1,0,0]=3 17002 B14R1.216 CCCCCCCSC1CCOC1=O 62a_100000211211_100000210316 [1,0,0,1,0,0|1,0,0]=3 17003 B14R1.216 CCCCCCOCC1CCNC1=O 34a_100000133458_100000210314 [1,0,0,1,0,0|2,0,0]=4 17004 B14R1.216 CCCCOCCOC1CCOC1=O 34a_100000210238_100000211211 [1,0,0,1,0,0|2,0,0]=4 17005 B14R1.216 CCCCOCCOC1CCOC1=O 7a_100000210238_100000211211 [1,0,0,1,0,0|2,0,0]=4 17006 B14R1.216 CCCCOCCSC1CCOC1=O 62a_100000211211_100000743108 [1,0,0,1,0,0|2,0,0]=4 17007 B14R1.216 CCCCOCCSC1CCOC1=O 62a_100000743108_100000211211 [1,0,0,1,0,0|2,0,0]=4 17008 B14R1.216 CCCCSCCNC1CCOC1=O 2230a_100025743550_100000211211 [1,0,0,1,0,0|2,0,0]=4 17009 B14R1.216 CCCCSCCOC1CCOC1=O 34a_200000230436_100000211211 [1,0,0,1,0,0|2,0,0]=4 17010 B14R1.216 CCCCSCCOC1CCOC1=O 7a_200000230436_100000211211 [1,0,0,1,0,0|2,0,0]=4 17011 B14R1.216 CCCOCCCNC1CCOC1=O 2230a_100011217757_100000211211 [1,0,0,1,0,0|2,0,0]=4 17012 B14R1.216 CCCOCCCNC1CCOC1=O 34a_100011217757_100000211211 [1,0,0,1,0,0|2,0,0]=4 17013 B14R1.216 CNCCCCCOC1CCOC1=O 34a_100000722520_100000211211 [1,0,0,1,0,0|2,0,0]=4 17014 B14R1.216 COCCCCCNC1CCOC1=O 2230a_100000747528_100000211211 [1,0,0,1,0,0|2,0,0]=4 17015 B14R1.216 COCCCCCNC1CCOC1=O 34a_100000747528_100000211211 [1,0,0,1,0,0|2,0,0]=4 17016 B14R1.216 NCCCCCCOC1CCOC1=O 34a_100000686447_100000211211 [1,0,0,1,0,0|2,0,0]=4 17017 B14R1.216 O=C1OCCC1NCCCCCCO 2230a_100000686447_100000211211 [1,0,0,1,0,0|2,0,0]=4 17018 B14R1.216 O=C1OCCC1NCCCCCCO 34a_100000686447_100000211211 [1,0,0,1,0,0|2,0,0]=4 17019 B14R1.216 O=C1OCCC1OCCCCCCBr 34a_100011215345_100000211211 [1,0,0,1,0,0|2,0,0]=4 17020 B14R1.216 O=C1OCCC1OCCCCCCBr 7a_100011215345_100000211211 [1,0,0,1,0,0|2,0,0]=4 17021 B14R1.216 O=C1OCCC1OCCCCCCCl 34a_100000766143_100000211211 [1,0,0,1,0,0|2,0,0]=4 17022 B14R1.216 O=C1OCCC1OCCCCCCCl 7a_100000766143_100000211211 [1,0,0,1,0,0|2,0,0]=4 17023 B14R1.216 O=C1OCCC1OCCCCCCF 34a_100000732779_100000211211 [1,0,0,1,0,0|2,0,0]=4 17024 B14R1.216 O=C1OCCC1OCCCCCCF 7a_100000732779_100000211211 [1,0,0,1,0,0|2,0,0]=4 17025 B14R1.216 O=C1OCCC1SCCCCCCF 62a_100000211211_100015922095 [1,0,0,1,0,0|2,0,0]=4 17026 B14R1.216 O=C1OCCC1SCCCCCCF 62a_100015922095_100000211211 [1,0,0,1,0,0|2,0,0]=4 17027 B14R1.216 O=C1OCCC1SCCCCCCO 62a_100000211211_100000766143 [1,0,0,1,0,0|2,0,0]=4 17028 B14R1.216 O=C1OCCC1SCCCCCCO 62a_100000766143_100000211211 [1,0,0,1,0,0|2,0,0]=4 17029 B14R1.257 CCOC(=O)CCN1CCC1COC 2230a_100015195929_100011206558 [1,0,0,1,0,0|2,0,0]=4 17030 B14R1.257 CCOC(=O)CCN1CCC1COC 269982a_100015195929_100011206558 [1,0,0,1,0,0|2,0,0]=4 17031 B14R1.257 CCOC(=O)CCN1CCC1COC 34a_100015195929_100000765890 [1,0,0,1,0,0|2,0,0]=4 17032 B14R1.263 CCCC(=O)C1CCCCN1CCC 1458a_100000743559_100000210303 [1,0,0,1,0,0|2,0,0]=4 17033 B14R1.263 CCCC(=O)N1CCCCC1CCC 11a_100000701414_100000211992 [1,0,0,1,0,0|2,0,0]=4 17034 B14R1.263 CCCC(=O)N1CCCCC1CCC 1626a_100000701414_100000211992 [1,0,0,1,0,0|2,0,0]=4 17035 B14R1.263 CCCC(=O)N1CCCCC1CCC 240690a_100000701414_100000211992 [1,0,0,1,0,0|2,0,0]=4 17036 B14R1.263 CCCC(=O)N1CCCCC1CCC 527a_100000701414_100000211992 [1,0,0,1,0,0|2,0,0]=4 17037 B14R1.263 CCCC1CCCCN1C(=O)NCC 2708a_100015525214_100000701414 [1,0,0,1,0,0|2,0,0]=4 17038 B14R1.263 CCCC1CCCCN1C(=O)NCC 273464a_100015525214_100000701414 [1,0,0,1,0,0|2,0,0]=4 17039 B14R1.263 CCCN1CCCCC1C(=O)NCC 240690a_100015525214_100000743559 [1,0,0,1,0,0|2,0,0]=4 17040 B14R1.263 CCCN1CCCCC1C(=O)OCC 2230a_100016990872_100000210303 [1,0,0,1,0,0|1,0,0]=3 17041 B14R1.263 CCCN1CCCCC1C(=O)OCC 269982a_100016990872_100000210303 [1,0,0,1,0,0|1,0,0]=3 17042 B14R1.263 CCCN1CCOC[C@H]1C(=O)OCC 2230a_100015229691_100000210303 [1,0,0,1,0,0|2,0,0]=4 17043 B14R1.263 CCCN1CCOC[C@H]1C(=O)OCC 269982a_100015229691_100000210303 [1,0,0,1,0,0|2,0,0]=4 17044 B14R1.263 CCCN1CCSCC1C(=O)OCC 2230a_100000735462_100000210303 [1,0,0,1,0,0|2,0,0]=4 17045 B14R1.263 CCCN1CCSCC1C(=O)OCC 269982a_100000735462_100000210303 [1,0,0,1,0,0|2,0,0]=4 17046 B14R1.263 CCOC(=O)C1CCCCC1OCC 7a_100000038711_100000210202 [1,0,0,1,0,0|1,0,0]=3 17047 B14R1.263 CCOC(=O)C1CCCCC1OCF 7a_100000038711_100015361967 [1,0,0,1,0,0|2,0,0]=4 17048 B14R1.263 CCOC(=O)C1CCCCN1CCF 2230a_100016990872_100011217306 [1,0,0,1,0,0|2,0,0]=4 17049 B14R1.263 CCOC(=O)C1CCCCN1CCF 269982a_100016990872_100011217306 [1,0,0,1,0,0|2,0,0]=4 17050 B14R1.263 CCOC(=O)C1CCCCN1CCO 2230a_100016990872_100000211926 [1,0,0,1,0,0|2,0,0]=4 17051 B14R1.263 CCOC(=O)C1CCCCN1CCO 269982a_100016990872_100000211926 [1,0,0,1,0,0|2,0,0]=4 17052 B14R1.263 CCOC(=O)C1CCCCN1COC 2230a_100016990872_100000766300 [1,0,0,1,0,0|2,0,0]=4 17053 B14R1.263 CCOC(=O)C1CCCCN1COC 269982a_100016990872_100000766300 [1,0,0,1,0,0|2,0,0]=4 17054 B14R1.263 CCOC(=O)C1CCCCN1CSC 2230a_100016990872_100011218213 [1,0,0,1,0,0|2,0,0]=4 17055 B14R1.263 CCOC(=O)C1CCCCN1CSC 269982a_100016990872_100011218213 [1,0,0,1,0,0|2,0,0]=4 17056 B14R1.273 CCOC(=O)CN1CCC[C@H]1COC 2230a_100020646714_100000188475 [1,0,0,1,0,0|2,0,0]=4 17057 B14R1.273 CCOC(=O)CN1CCC[C@H]1COC 269982a_100020646714_100000188475 [1,0,0,1,0,0|2,0,0]=4 17058 B14R1.273 CCOC(=O)CN1CCC[C@H]1COC 34a_100020646714_100000188475 [1,0,0,1,0,0|2,0,0]=4 17059 B14R1.520 CC#CC(=O)CCCC1CCCCC1 1458a_100000763181_100011713725 [1,0,0,1,0,0|1,0,1]=4 17060 B14R1.520 CC=CC(=O)CCCC1CCCCC1 1458a_100000210699_100011713725 [1,0,0,1,0,0|1,0,1]=4 17061 B14R1.520 CCCC(=O)CCCC1CCCCC1 1458a_100000211478_100000210303 [1,0,0,1,0,0|1,0,0]=3 17062 B14R1.520 CCCC(=O)CCCC1CCCCC1 1458a_100000211992_100011713725 [1,0,0,1,0,0|1,0,0]=3 17063 B14R1.520 CCCC(=O)CCCN1CCCCC1 1458a_100000211992_100000690320 [1,0,0,1,0,0|2,0,0]=4 17064 B14R1.520 CCCC(=O)CCCN1CCCCC1 1458a_100000742516_100000210303 [1,0,0,1,0,0|2,0,0]=4 17065 B14R1.520 CCCC(=O)CCOC1CCCCC1 1458a_100000211992_100011211530 [1,0,0,1,0,0|2,0,0]=4 17066 B14R1.520 CCCC(=O)CNCC1CCCCC1 2230a_100000210473_100000747444 [1,0,0,1,0,0|2,0,0]=4 17067 B14R1.520 CCCC(=O)COCC1CCCCC1 7a_100000212181_100000747444 [1,0,0,1,0,0|2,0,0]=4 17068 B14R1.520 CCCC(=O)CSCC1CCCCC1 62a_100000211423_100000747444 [1,0,0,1,0,0|2,0,0]=4 17069 B14R1.520 CCCC(=O)CSCC1CCCCC1 62a_100000747444_100000211423 [1,0,0,1,0,0|2,0,0]=4 17070 B14R1.520 CCCC(=O)NCCC1CCCCC1 11a_100000738074_100000211992 [1,0,0,1,0,0|2,0,0]=4 17071 B14R1.520 CCCC(=O)NCCC1CCCCC1 1626a_100000738074_100000211992 [1,0,0,1,0,0|2,0,0]=4 17072 B14R1.520 CCCC(=O)NCCC1CCCCC1 240690a_100000738074_100000211992 [1,0,0,1,0,0|2,0,0]=4 17073 B14R1.520 CCCC(=O)NCCC1CCCCC1 527a_100000738074_100000211992 [1,0,0,1,0,0|2,0,0]=4 17074 B14R1.520 CCNC(=O)CCCC1CCCCC1 11a_100015525214_100000211478 [1,0,0,1,0,0|1,0,0]=3 17075 B14R1.520 CCNC(=O)CCCC1CCCCC1 240690a_100015525214_100000211478 [1,0,0,1,0,0|1,0,0]=3 17076 B14R1.520 CCNC(=O)CCCC1CCCCC1 527a_100015525214_100000211478 [1,0,0,1,0,0|1,0,0]=3 17077 B14R1.520 CCNC(=O)CCCN1CCCCC1 240690a_100015525214_100000742516 [1,0,0,1,0,0|2,0,0]=4 17078 B14R1.520 CCNC(=O)CCNC1CCCCC1 2230a_100000182618_100000737597 [1,0,0,1,0,0|2,0,0]=4 17079 B14R1.520 CCNC(=O)CCNC1CCCCC1 270004a_100025743525_100000210434 [1,0,0,1,0,0|2,0,0]=4 17080 B14R1.520 CCNC(=O)CCNC1CCCCC1 34a_100025743525_100000210327 [1,0,0,1,0,0|2,0,0]=4 17081 B14R1.520 CCNC(=O)CCOC1CCCCC1 7a_100000210231_100000737597 [1,0,0,1,0,0|2,0,0]=4 17082 B14R1.520 CCNC(=O)CCSC1CCCCC1 62a_100000210327_100000737597 [1,0,0,1,0,0|2,0,0]=4 17083 B14R1.520 CCNC(=O)CCSC1CCCCC1 62a_100000737597_100000210327 [1,0,0,1,0,0|2,0,0]=4 17084 B14R1.520 CCNC(=O)CNCC1CCCCC1 2230a_100000210473_100000183381 [1,0,0,1,0,0|2,0,0]=4 17085 B14R1.520 CCNC(=O)CNCC1CCCCC1 2230a_100016988866_100000211423 [1,0,0,1,0,0|2,0,0]=4 17086 B14R1.520 CCNC(=O)CNCC1CCCCC1 34a_100000210473_100000183381 [1,0,0,1,0,0|2,0,0]=4 17087 B14R1.520 CCNC(=O)COCC1CCCCC1 34a_100000212181_100000183381 [1,0,0,1,0,0|2,0,0]=4 17088 B14R1.520 CCNC(=O)COCC1CCCCC1 7a_100000212181_100000183381 [1,0,0,1,0,0|2,0,0]=4 17089 B14R1.520 CCNC(=O)CSCC1CCCCC1 62a_100000183381_100000211423 [1,0,0,1,0,0|2,0,0]=4 17090 B14R1.520 CCNC(=O)CSCC1CCCCC1 62a_100000211423_100000183381 [1,0,0,1,0,0|2,0,0]=4 17091 B14R1.520 CCNC(=O)NCCC1CCCCC1 2708a_100000738074_100015525214 [1,0,0,1,0,0|2,0,0]=4 17092 B14R1.520 CCNC(=O)NCCC1CCCCC1 2708a_100015525214_100000738074 [1,0,0,1,0,0|2,0,0]=4 17093 B14R1.520 CCNC(=O)NCCC1CCCCC1 273464a_100000738074_100015525214 [1,0,0,1,0,0|2,0,0]=4 17094 B14R1.520 CCNC(=O)NCCC1CCCCC1 273464a_100015525214_100000738074 [1,0,0,1,0,0|2,0,0]=4 17095 B14R1.520 CCNC(=O)NCCC1CCCCC1 512a_100000738074_100015525214 [1,0,0,1,0,0|2,0,0]=4 17096 B14R1.520 CCNC(=O)NCCC1CCCCC1 512a_100015525214_100000738074 [1,0,0,1,0,0|2,0,0]=4 17097 B14R1.520 CCOC(=O)CCCN1CCCOC1 2230a_100000131196_100009991533 [1,0,0,1,0,0|2,0,0]=4 17098 B14R1.520 CCOC(=O)CCCN1CCCOC1 269982a_100000131196_100009991533 [1,0,0,1,0,0|2,0,0]=4 17099 B14R1.520 CCOC(=O)CCCN1CCCOC1 34a_100000131196_100009991533 [1,0,0,1,0,0|2,0,0]=4 17100 B14R1.520 CCOC(=O)CCCN1CCOCC1 2230a_100015191051_100009991533 [1,0,0,1,0,0|2,0,0]=4 17101 B14R1.520 CCOC(=O)CCCN1CCOCC1 269982a_100015191051_100009991533 [1,0,0,1,0,0|2,0,0]=4 17102 B14R1.520 CCOC(=O)CCCN1CCOCC1 34a_100015191051_100009991533 [1,0,0,1,0,0|2,0,0]=4 17103 B14R1.520 CCOC(=O)CCCN1CCSCC1 2230a_100000737611_100009991533 [1,0,0,1,0,0|2,0,0]=4 17104 B14R1.520 CCOC(=O)CCCN1CCSCC1 269982a_100000737611_100009991533 [1,0,0,1,0,0|2,0,0]=4 17105 B14R1.520 CCOC(=O)CCNC1CCCCC1 2230a_100000182618_100011206558 [1,0,0,1,0,0|1,0,0]=3 17106 B14R1.520 CCOC(=O)CCNC1CCCCC1 34a_100000182618_100000765890 [1,0,0,1,0,0|1,0,0]=3 17107 B14R1.520 CCOC(=O)CCNC1CCCOC1 2230a_100000719290_100011206558 [1,0,0,1,0,0|2,0,0]=4 17108 B14R1.520 CCOC(=O)CCNC1CCCOC1 34a_100000719290_100000765890 [1,0,0,1,0,0|2,0,0]=4 17109 B14R1.520 CCOC(=O)CCNC1CCOCC1 2230a_100000741149_100011206558 [1,0,0,1,0,0|2,0,0]=4 17110 B14R1.520 CCOC(=O)CCNC1CCOCC1 34a_100000741149_100000765890 [1,0,0,1,0,0|2,0,0]=4 17111 B14R1.520 CCOC(=O)CCNC1CCSCC1 2230a_100000748639_100011206558 [1,0,0,1,0,0|2,0,0]=4 17112 B14R1.520 CCOC(=O)CCNC1CCSCC1 34a_100000748639_100000765890 [1,0,0,1,0,0|2,0,0]=4 17113 B14R1.520 CCOC(=O)CCOC1CCCCC1 34a_100000210231_100000765890 [1,0,0,1,0,0|1,0,0]=3 17114 B14R1.520 CCOC(=O)CCOC1CCCCC1 7a_100000210231_100011206558 [1,0,0,1,0,0|1,0,0]=3 17115 B14R1.520 CCOC(=O)CCOC1CCCCO1 34a_100000033831_100000765890 [1,0,0,1,0,0|2,0,0]=4 17116 B14R1.520 CCOC(=O)CCOC1CCCOC1 34a_100000754041_100000765890 [1,0,0,1,0,0|2,0,0]=4 17117 B14R1.520 CCOC(=O)CCOC1CCCSC1 7a_100015962668_100011206558 [1,0,0,1,0,0|2,0,0]=4 17118 B14R1.520 CCOC(=O)CCOC1CCOCC1 34a_100000744328_100000765890 [1,0,0,1,0,0|2,0,0]=4 17119 B14R1.520 CCOC(=O)CCOC1CCSCC1 34a_100000731022_100000765890 [1,0,0,1,0,0|2,0,0]=4 17120 B14R1.520 CCOC(=O)CCOC1CCSCC1 7a_100000731022_100011206558 [1,0,0,1,0,0|2,0,0]=4 17121 B14R1.520 CCOC(=O)CCSC1CCCCC1 62a_100000210327_100000765890 [1,0,0,1,0,0|1,0,0]=3 17122 B14R1.520 CCOC(=O)CCSC1CCCCC1 62a_100000765890_100000210327 [1,0,0,1,0,0|1,0,0]=3 17123 B14R1.520 CCOC(=O)CCSC1CCCOC1 62a_100000765890_100000693364 [1,0,0,1,0,0|2,0,0]=4 17124 B14R1.520 CCOC(=O)CCSC1CCOCC1 62a_100000765890_100011324220 [1,0,0,1,0,0|2,0,0]=4 17125 B14R1.520 CCOC(=O)CCSC1CCSCC1 62a_100000765890_100000069128 [1,0,0,1,0,0|2,0,0]=4 17126 B14R1.520 CCOC(=O)CNCC1CCCCC1 2230a_100000210473_100000188475 [1,0,0,1,0,0|1,0,0]=3 17127 B14R1.520 CCOC(=O)CNCC1CCCCC1 34a_100000210473_100000188475 [1,0,0,1,0,0|1,0,0]=3 17128 B14R1.520 CCOC(=O)CNCC1CCCCO1 2230a_100000174945_100000188475 [1,0,0,1,0,0|2,0,0]=4 17129 B14R1.520 CCOC(=O)CNCC1CCCCO1 34a_100000174945_100000188475 [1,0,0,1,0,0|2,0,0]=4 17130 B14R1.520 CCOC(=O)CNCC1CCCOC1 2230a_100000720124_100000188475 [1,0,0,1,0,0|2,0,0]=4 17131 B14R1.520 CCOC(=O)CNCC1CCCOC1 34a_100000720124_100000188475 [1,0,0,1,0,0|2,0,0]=4 17132 B14R1.520 CCOC(=O)CNCC1CCOCC1 2230a_100000746373_100000188475 [1,0,0,1,0,0|2,0,0]=4 17133 B14R1.520 CCOC(=O)CNCC1CCOCC1 34a_100000746373_100000188475 [1,0,0,1,0,0|2,0,0]=4 17134 B14R1.520 CCOC(=O)CNCC1CCSCC1 2230a_100015188806_100000188475 [1,0,0,1,0,0|2,0,0]=4 17135 B14R1.520 CCOC(=O)CNCC1CCSCC1 34a_100015188806_100000188475 [1,0,0,1,0,0|2,0,0]=4 17136 B14R1.520 CCOC(=O)COCC1CCCCC1 34a_100000212181_100000188475 [1,0,0,1,0,0|1,0,0]=3 17137 B14R1.520 CCOC(=O)COCC1CCCCC1 7a_100000212181_100000188475 [1,0,0,1,0,0|1,0,0]=3 17138 B14R1.520 CCOC(=O)COCC1CCCCN1 34a_100000210821_100000188475 [1,0,0,1,0,0|2,0,0]=4 17139 B14R1.520 CCOC(=O)COCC1CCCCO1 34a_100000211370_100000188475 [1,0,0,1,0,0|2,0,0]=4 17140 B14R1.520 CCOC(=O)COCC1CCCCO1 7a_100000211370_100000188475 [1,0,0,1,0,0|2,0,0]=4 17141 B14R1.520 CCOC(=O)COCC1CCCNC1 34a_100000211344_100000188475 [1,0,0,1,0,0|2,0,0]=4 17142 B14R1.520 CCOC(=O)COCC1CCCOC1 34a_100000741520_100000188475 [1,0,0,1,0,0|2,0,0]=4 17143 B14R1.520 CCOC(=O)COCC1CCNCC1 34a_100000738675_100000188475 [1,0,0,1,0,0|2,0,0]=4 17144 B14R1.520 CCOC(=O)COCC1CCOCC1 34a_100000749013_100000188475 [1,0,0,1,0,0|2,0,0]=4 17145 B14R1.520 CCOC(=O)COCC1CCSCC1 34a_100000070558_100000188475 [1,0,0,1,0,0|2,0,0]=4 17146 B14R1.520 CCOC(=O)COCC1CCSCC1 7a_100000070558_100000188475 [1,0,0,1,0,0|2,0,0]=4 17147 B14R1.520 CCOC(=O)CSCC1CCCCC1 62a_100000188475_100000211423 [1,0,0,1,0,0|1,0,0]=3 17148 B14R1.520 CCOC(=O)CSCC1CCCCC1 62a_100000211423_100000188475 [1,0,0,1,0,0|1,0,0]=3 17149 B14R1.520 CCOC(=O)CSCC1CCCCO1 62a_100000188475_100000211543 [1,0,0,1,0,0|2,0,0]=4 17150 B14R1.520 CCOC(=O)CSCC1CCCCO1 62a_100000211543_100000188475 [1,0,0,1,0,0|2,0,0]=4 17151 B14R1.520 CCOC(=O)CSCC1CCCOC1 62a_100000188475_100000741521 [1,0,0,1,0,0|2,0,0]=4 17152 B14R1.520 CCOC(=O)CSCC1CCCOC1 62a_100000741521_100000188475 [1,0,0,1,0,0|2,0,0]=4 17153 B14R1.520 CCOC(=O)CSCC1CCOCC1 62a_100000188475_100000749018 [1,0,0,1,0,0|2,0,0]=4 17154 B14R1.520 CCOC(=O)CSCC1CCOCC1 62a_100000754603_100000188475 [1,0,0,1,0,0|2,0,0]=4 17155 B14R1.520 CCOC(=O)OCSC1CCCCC1 62a_100000210327_100000075025 [1,0,0,1,0,0|2,0,0]=4 17156 B14R1.520 CNNC(=O)CCCC1CCCCC1 22a_100016993582_100000211478 [1,0,0,1,0,0|2,0,0]=4 17157 B14R1.520 COCC(=O)CCCC1CCCCC1 1458a_100000210968_100011713725 [1,0,0,1,0,0|2,0,0]=4 17158 B14R1.520 CSCC(=O)CCCC1CCCCC1 1458a_100000184570_100011713725 [1,0,0,1,0,0|2,0,0]=4 17159 B14R1.520 O=C(CCF)CCCC1CCCCC1 1458a_100000211478_100011217306 [1,0,0,1,0,0|2,0,0]=4 17160 B14R1.520 O=C(CCO)CCCC1CCCCC1 1458a_100000211478_100000211926 [1,0,0,1,0,0|2,0,0]=4 17161 B14R1.520 O=C(CCO)CCCC1CCCCC1 1458a_100011216618_100011713725 [1,0,0,1,0,0|2,0,0]=4 17162 B14R1.598 CCCC(=O)CCC1CCCCN1C 1458a_100000211992_100000211948 [1,0,0,1,0,0|2,0,0]=4 17163 B14R1.598 CCCC(=O)CCC1CCCCN1C 1458a_100000718493_100000210303 [1,0,0,1,0,0|2,0,0]=4 17164 B14R1.598 CCCC(=O)CNC1CCCCC1C 2230a_100000211402_100000747444 [1,0,0,1,0,0|2,0,0]=4 17165 B14R1.598 CCCC(=O)COC1CCCCC1C 1458a_100011223357_100000210303 [1,0,0,1,0,0|2,0,0]=4 17166 B14R1.598 CCCC(=O)COC1CCCCC1C 7a_100000211207_100000747444 [1,0,0,1,0,0|2,0,0]=4 17167 B14R1.598 CCNC(=O)CCC1CCCCN1C 240690a_100015525214_100000718493 [1,0,0,1,0,0|2,0,0]=4 17168 B14R1.598 CCNC(=O)CCC1CCCCN1C 527a_100015525214_100000718493 [1,0,0,1,0,0|2,0,0]=4 17169 B14R1.598 CCNC(=O)CCN1CCCCC1C 2230a_100000211376_100000737597 [1,0,0,1,0,0|2,0,0]=4 17170 B14R1.598 CCNC(=O)CCN1CCCCC1C 240690a_100015525214_100000727554 [1,0,0,1,0,0|2,0,0]=4 17171 B14R1.598 CCNC(=O)CCN1CCCCC1C 269982a_100000211376_100000737597 [1,0,0,1,0,0|2,0,0]=4 17172 B14R1.598 CCNC(=O)CNC1CCCCC1C 2230a_100000211402_100000183381 [1,0,0,1,0,0|2,0,0]=4 17173 B14R1.598 CCNC(=O)CNC1CCCCC1C 270004a_100016988866_100000210921 [1,0,0,1,0,0|2,0,0]=4 17174 B14R1.598 CCNC(=O)CNC1CCCCC1C 34a_100000211402_100000183381 [1,0,0,1,0,0|2,0,0]=4 17175 B14R1.598 CCNC(=O)COC1CCCCC1C 11a_100015525214_100011223357 [1,0,0,1,0,0|2,0,0]=4 17176 B14R1.598 CCNC(=O)COC1CCCCC1C 240690a_100015525214_100011223357 [1,0,0,1,0,0|2,0,0]=4 17177 B14R1.598 CCNC(=O)COC1CCCCC1C 34a_100000211207_100000183381 [1,0,0,1,0,0|2,0,0]=4 17178 B14R1.598 CCNC(=O)COC1CCCCC1C 527a_100015525214_100011223357 [1,0,0,1,0,0|2,0,0]=4 17179 B14R1.598 CCNC(=O)COC1CCCCC1C 7a_100000211207_100000183381 [1,0,0,1,0,0|2,0,0]=4 17180 B14R1.598 CCOC(=O)CCN1CCCCC1C 2230a_100000211376_100011206558 [1,0,0,1,0,0|1,0,0]=3 17181 B14R1.598 CCOC(=O)CCN1CCCCC1C 269982a_100000211376_100011206558 [1,0,0,1,0,0|1,0,0]=3 17182 B14R1.598 CCOC(=O)CCN1CCCCC1C 34a_100000211376_100000765890 [1,0,0,1,0,0|1,0,0]=3 17183 B14R1.598 CCOC(=O)CCN1CCOC[C@@H]1C 2230a_100009815349_100011206558 [1,0,0,1,0,0|2,0,0]=4 17184 B14R1.598 CCOC(=O)CCN1CCOC[C@@H]1C 269982a_100009815349_100011206558 [1,0,0,1,0,0|2,0,0]=4 17185 B14R1.598 CCOC(=O)CCN1CCOC[C@@H]1C 34a_100009815349_100000765890 [1,0,0,1,0,0|2,0,0]=4 17186 B14R1.598 CCOC(=O)CNC1CCCCC1C 2230a_100000211402_100000188475 [1,0,0,1,0,0|1,0,0]=3 17187 B14R1.598 CCOC(=O)CNC1CCCCC1C 34a_100000211402_100000188475 [1,0,0,1,0,0|1,0,0]=3 17188 B14R1.598 CCOC(=O)CN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000188475 [1,0,0,1,0,0|2,0,0]=4 17189 B14R1.598 CCOC(=O)CN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000188475 [1,0,0,1,0,0|2,0,0]=4 17190 B14R1.598 CCOC(=O)COC1CCCCC1C 34a_100000211207_100000188475 [1,0,0,1,0,0|1,0,0]=3 17191 B14R1.598 CCOC(=O)COC1CCCCC1C 7a_100000211207_100000188475 [1,0,0,1,0,0|1,0,0]=3 17192 B14R1.598 CCOC(=O)COC1CCCCC1Cl 34a_100000038908_100000188475 [1,0,0,1,0,0|2,0,0]=4 17193 B14R1.598 CCOC(=O)COC1CCCCC1Cl 7a_100000038908_100000188475 [1,0,0,1,0,0|2,0,0]=4 17194 B14R1.598 CCOC(=O)COC1CCNCC1C 34a_100011998114_100000188475 [1,0,0,1,0,0|2,0,0]=4 17195 B14R1.598 CCOC(=O)COC1CNCCC1C 34a_100000696640_100000188475 [1,0,0,1,0,0|2,0,0]=4 17196 B14R1.598 CCOC(=O)CO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000188475 [1,0,0,1,0,0|2,0,0]=4 17197 B14R1.598 CCOC(=O)CO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000188475 [1,0,0,1,0,0|2,0,0]=4 17198 B14R1.598 CCOC(=O)CO[C@H]1CCCC[C@H]1N 34a_100015191688_100000188475 [1,0,0,1,0,0|2,0,0]=4 17199 B14R1.598 CCOC(=O)CSC1CCCCC1F 62a_100000188475_100015423560 [1,0,0,1,0,0|2,0,0]=4 17200 B14R1.598 CCOC(=O)CSC1CCCCC1F 62a_100015423560_100000188475 [1,0,0,1,0,0|2,0,0]=4 17201 B14R1.598 CCOC(=O)CSC1CCCCC1O 62a_100000038908_100000188475 [1,0,0,1,0,0|2,0,0]=4 17202 B14R1.598 CCOC(=O)CSC1CCCCC1O 62a_100000188475_100000038908 [1,0,0,1,0,0|2,0,0]=4 17203 B14R1.609 CCCC(=O)CNCCC1CCCC1 2230a_100000739158_100000747444 [1,0,0,1,0,0|2,0,0]=4 17204 B14R1.609 CCCC(=O)COCCC1CCCC1 7a_100000749090_100000747444 [1,0,0,1,0,0|2,0,0]=4 17205 B14R1.609 CCCC(=O)CSCCC1CCCC1 62a_100000747444_100000760354 [1,0,0,1,0,0|2,0,0]=4 17206 B14R1.609 CCCC(=O)CSCCC1CCCC1 62a_100000760354_100000747444 [1,0,0,1,0,0|2,0,0]=4 17207 B14R1.609 CCCC(=O)NCCCC1CCCC1 11a_100000736752_100000211992 [1,0,0,1,0,0|2,0,0]=4 17208 B14R1.609 CCCC(=O)NCCCC1CCCC1 1626a_100000736752_100000211992 [1,0,0,1,0,0|2,0,0]=4 17209 B14R1.609 CCCC(=O)NCCCC1CCCC1 240690a_100000736752_100000211992 [1,0,0,1,0,0|2,0,0]=4 17210 B14R1.609 CCCC(=O)NCCCC1CCCC1 527a_100000736752_100000211992 [1,0,0,1,0,0|2,0,0]=4 17211 B14R1.609 CCNC(=O)CCNCC1CCCC1 2230a_100000737975_100000737597 [1,0,0,1,0,0|2,0,0]=4 17212 B14R1.609 CCNC(=O)CCNCC1CCCC1 269862a_100025743525_100000746403 [1,0,0,1,0,0|2,0,0]=4 17213 B14R1.609 CCNC(=O)CCNCC1CCCC1 34a_100025743525_100000740388 [1,0,0,1,0,0|2,0,0]=4 17214 B14R1.609 CCNC(=O)CCOCC1CCCC1 7a_100000742336_100000737597 [1,0,0,1,0,0|2,0,0]=4 17215 B14R1.609 CCNC(=O)CCSCC1CCCC1 62a_100000737597_100000740388 [1,0,0,1,0,0|2,0,0]=4 17216 B14R1.609 CCNC(=O)CCSCC1CCCC1 62a_100000740388_100000737597 [1,0,0,1,0,0|2,0,0]=4 17217 B14R1.609 CCNC(=O)CNCCC1CCCC1 2230a_100000739158_100000183381 [1,0,0,1,0,0|2,0,0]=4 17218 B14R1.609 CCNC(=O)CNCCC1CCCC1 2230a_100016988866_100000760354 [1,0,0,1,0,0|2,0,0]=4 17219 B14R1.609 CCNC(=O)CNCCC1CCCC1 34a_100000739158_100000183381 [1,0,0,1,0,0|2,0,0]=4 17220 B14R1.609 CCNC(=O)COCCC1CCCC1 34a_100000749090_100000183381 [1,0,0,1,0,0|2,0,0]=4 17221 B14R1.609 CCNC(=O)COCCC1CCCC1 7a_100000749090_100000183381 [1,0,0,1,0,0|2,0,0]=4 17222 B14R1.609 CCNC(=O)CSCCC1CCCC1 62a_100000183381_100000760354 [1,0,0,1,0,0|2,0,0]=4 17223 B14R1.609 CCNC(=O)CSCCC1CCCC1 62a_100000760354_100000183381 [1,0,0,1,0,0|2,0,0]=4 17224 B14R1.609 CCNC(=O)NCCCC1CCCC1 2708a_100000736752_100015525214 [1,0,0,1,0,0|2,0,0]=4 17225 B14R1.609 CCNC(=O)NCCCC1CCCC1 2708a_100015525214_100000736752 [1,0,0,1,0,0|2,0,0]=4 17226 B14R1.609 CCNC(=O)NCCCC1CCCC1 273464a_100000736752_100015525214 [1,0,0,1,0,0|2,0,0]=4 17227 B14R1.609 CCNC(=O)NCCCC1CCCC1 273464a_100015525214_100000736752 [1,0,0,1,0,0|2,0,0]=4 17228 B14R1.609 CCNC(=O)NCCCC1CCCC1 512a_100000736752_100015525214 [1,0,0,1,0,0|2,0,0]=4 17229 B14R1.609 CCNC(=O)NCCCC1CCCC1 512a_100015525214_100000736752 [1,0,0,1,0,0|2,0,0]=4 17230 B14R1.609 CCOC(=O)CCCCN1CCCC1 2230a_100000188435_100000750268 [1,0,0,1,0,0|1,0,0]=3 17231 B14R1.609 CCOC(=O)CCCCN1CCCC1 269982a_100000188435_100000750268 [1,0,0,1,0,0|1,0,0]=3 17232 B14R1.609 CCOC(=O)CCCCN1CCSC1 2230a_100011215254_100000750268 [1,0,0,1,0,0|2,0,0]=4 17233 B14R1.609 CCOC(=O)CCCCN1CCSC1 269982a_100011215254_100000750268 [1,0,0,1,0,0|2,0,0]=4 17234 B14R1.609 CCOC(=O)CCCNC1CCCC1 2230a_100000211070_100009991533 [1,0,0,1,0,0|1,0,0]=3 17235 B14R1.609 CCOC(=O)CCCNC1CCCC1 34a_100000211070_100009991533 [1,0,0,1,0,0|1,0,0]=3 17236 B14R1.609 CCOC(=O)CCCN[C@@H]1CCOC1 2230a_200015188469_100009991533 [1,0,0,1,0,0|2,0,0]=4 17237 B14R1.609 CCOC(=O)CCCN[C@H]1CCOC1 2230a_100015188467_100009991533 [1,0,0,1,0,0|2,0,0]=4 17238 B14R1.609 CCOC(=O)CCCN[C@H]1CCOC1 34a_100015188467_100009991533 [1,0,0,1,0,0|2,0,0]=4 17239 B14R1.609 CCOC(=O)CCCOC1CCCC1 34a_100000210269_100009991533 [1,0,0,1,0,0|1,0,0]=3 17240 B14R1.609 CCOC(=O)CCCOC1CCCC1 7a_100000210269_100011215271 [1,0,0,1,0,0|1,0,0]=3 17241 B14R1.609 CCOC(=O)CCCOC1CCCC1 7a_100012001163_100000179811 [1,0,0,1,0,0|1,0,0]=3 17242 B14R1.609 CCOC(=O)CCCOC1CCCO1 34a_100000085407_100009991533 [1,0,0,1,0,0|2,0,0]=4 17243 B14R1.609 CCOC(=O)CCCOC1CCOC1 7a_100012001163_100000731011 [1,0,0,1,0,0|2,0,0]=4 17244 B14R1.609 CCOC(=O)CCCOC1CCSC1 7a_100011232664_100011215271 [1,0,0,1,0,0|2,0,0]=4 17245 B14R1.609 CCOC(=O)CCCO[C@H]1CCOC1 34a_100000717292_100009991533 [1,0,0,1,0,0|2,0,0]=4 17246 B14R1.609 CCOC(=O)CCCSC1CCCC1 62a_100009991533_100000179811 [1,0,0,1,0,0|1,0,0]=3 17247 B14R1.609 CCOC(=O)CCCSC1CCCC1 62a_100011217020_100009991533 [1,0,0,1,0,0|1,0,0]=3 17248 B14R1.609 CCOC(=O)CCCSC1CCOC1 62a_100009991533_100000690089 [1,0,0,1,0,0|2,0,0]=4 17249 B14R1.609 CCOC(=O)CCNCC1CCCC1 2230a_100000737975_100011206558 [1,0,0,1,0,0|1,0,0]=3 17250 B14R1.609 CCOC(=O)CCNCC1CCCC1 34a_100000737975_100000765890 [1,0,0,1,0,0|1,0,0]=3 17251 B14R1.609 CCOC(=O)CCNCC1CCOC1 2230a_100000737293_100011206558 [1,0,0,1,0,0|2,0,0]=4 17252 B14R1.609 CCOC(=O)CCNCC1CCOC1 34a_100000737293_100000765890 [1,0,0,1,0,0|2,0,0]=4 17253 B14R1.609 CCOC(=O)CCNC[C@@H]1CCCO1 2230a_100020590478_100011206558 [1,0,0,1,0,0|2,0,0]=4 17254 B14R1.609 CCOC(=O)CCNC[C@@H]1CCCO1 34a_100020590478_100000765890 [1,0,0,1,0,0|2,0,0]=4 17255 B14R1.609 CCOC(=O)CCOCC1CCCC1 34a_100000742336_100000765890 [1,0,0,1,0,0|1,0,0]=3 17256 B14R1.609 CCOC(=O)CCOCC1CCCC1 7a_100000742336_100011206558 [1,0,0,1,0,0|1,0,0]=3 17257 B14R1.609 CCOC(=O)CCOCC1CCCO1 34a_100000210270_100000765890 [1,0,0,1,0,0|2,0,0]=4 17258 B14R1.609 CCOC(=O)CCOCC1CCCO1 7a_100000210270_100011206558 [1,0,0,1,0,0|2,0,0]=4 17259 B14R1.609 CCOC(=O)CCOCC1CCNC1 34a_100000748654_100000765890 [1,0,0,1,0,0|2,0,0]=4 17260 B14R1.609 CCOC(=O)CCOCC1CCOC1 34a_100000740260_100000765890 [1,0,0,1,0,0|2,0,0]=4 17261 B14R1.609 CCOC(=O)CCOC[C@H]1CCCN1 34a_100000745186_100000765890 [1,0,0,1,0,0|2,0,0]=4 17262 B14R1.609 CCOC(=O)CCSCC1CCCC1 62a_100000740388_100000765890 [1,0,0,1,0,0|1,0,0]=3 17263 B14R1.609 CCOC(=O)CCSCC1CCCC1 62a_100000765890_100000740388 [1,0,0,1,0,0|1,0,0]=3 17264 B14R1.609 CCOC(=O)CCSCC1CCCO1 62a_100000203698_100000765890 [1,0,0,1,0,0|2,0,0]=4 17265 B14R1.609 CCOC(=O)CCSCC1CCCO1 62a_100000765890_100000203698 [1,0,0,1,0,0|2,0,0]=4 17266 B14R1.609 CCOC(=O)CCSCC1CCOC1 62a_100000702531_100000765890 [1,0,0,1,0,0|2,0,0]=4 17267 B14R1.609 CCOC(=O)CCSCC1CCOC1 62a_100000765890_100000702531 [1,0,0,1,0,0|2,0,0]=4 17268 B14R1.609 CCOC(=O)CNCCC1CCCC1 2230a_100000739158_100000188475 [1,0,0,1,0,0|1,0,0]=3 17269 B14R1.609 CCOC(=O)CNCCC1CCCC1 34a_100000739158_100000188475 [1,0,0,1,0,0|1,0,0]=3 17270 B14R1.609 CCOC(=O)COCCC1CCCC1 34a_100000749090_100000188475 [1,0,0,1,0,0|1,0,0]=3 17271 B14R1.609 CCOC(=O)COCCC1CCCC1 7a_100000749090_100000188475 [1,0,0,1,0,0|1,0,0]=3 17272 B14R1.609 CCOC(=O)COCCC1CCNC1 34a_100016987287_100000188475 [1,0,0,1,0,0|2,0,0]=4 17273 B14R1.609 CCOC(=O)COCCC1CCOC1 34a_100011879284_100000188475 [1,0,0,1,0,0|2,0,0]=4 17274 B14R1.609 CCOC(=O)COCCN1CCCC1 2230a_100000188435_100000088970 [1,0,0,1,0,0|2,0,0]=4 17275 B14R1.609 CCOC(=O)COCCN1CCCC1 269982a_100000188435_100000088970 [1,0,0,1,0,0|2,0,0]=4 17276 B14R1.609 CCOC(=O)CSCCC1CCCC1 62a_100000188475_100000760354 [1,0,0,1,0,0|1,0,0]=3 17277 B14R1.609 CCOC(=O)CSCCC1CCCC1 62a_100000760354_100000188475 [1,0,0,1,0,0|1,0,0]=3 17278 B14R1.609 CCOC(=O)CSCCN1CCCC1 62a_100000188475_100000004467 [1,0,0,1,0,0|2,0,0]=4 17279 B14R1.609 CCOC(=O)CSCCN1CCCC1 62a_100000700749_100000188475 [1,0,0,1,0,0|2,0,0]=4 17280 B14R1.609 CCOC(=O)NCCOC1CCCC1 34a_100000158857_100000179811 [1,0,0,1,0,0|2,0,0]=4 17281 B14R1.609 CCOC(=O)NCCOC1CCCC1 7a_100000210269_200011445536 [1,0,0,1,0,0|2,0,0]=4 17282 B14R1.609 CCOC(=O)NCCSC1CCCC1 62a_100011217020_200011445536 [1,0,0,1,0,0|2,0,0]=4 17283 B14R1.609 CCOC(=O)OCSCC1CCCC1 62a_100000740388_100000075025 [1,0,0,1,0,0|2,0,0]=4 17284 B14R1.611 CCOC(=O)CCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100000750268 [1,0,0,1,0,0|2,0,0]=4 17285 B14R1.611 CCOC(=O)CCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100000750268 [1,0,0,1,0,0|2,0,0]=4 17286 B14R1.611 CCOC(=O)CCCCN[C@@H]1C[C@H]1F 34a_100025746932_100000750268 [1,0,0,1,0,0|2,0,0]=4 17287 B14R1.611 CCOC(=O)CCCOCC1CC1C 34a_100000744939_100009991533 [1,0,0,1,0,0|1,0,0]=3 17288 B14R1.611 CCOC(=O)CCCOCC1CC1C 7a_100000744939_100011215271 [1,0,0,1,0,0|1,0,0]=3 17289 B14R1.611 CCOC(=O)NCCOCC1CC1C 7a_100000744939_200011445536 [1,0,0,1,0,0|2,0,0]=4 17290 B14R1.612 CCOC(=O)CCCCCN1CCC1 269982a_100000754969_100000755133 [1,0,0,1,0,0|1,0,0]=3 17291 B14R1.612 CCOC(=O)CCCCNC1CCC1 2230a_100000749019_100000750268 [1,0,0,1,0,0|1,0,0]=3 17292 B14R1.612 CCOC(=O)CCCCNC1CCC1 34a_100000749019_100000750268 [1,0,0,1,0,0|1,0,0]=3 17293 B14R1.612 CCOC(=O)CCCCNC1COC1 2230a_100016991112_100000750268 [1,0,0,1,0,0|2,0,0]=4 17294 B14R1.612 CCOC(=O)CCCCOC1CCC1 34a_100000748187_100000750268 [1,0,0,1,0,0|1,0,0]=3 17295 B14R1.612 CCOC(=O)CCCCOC1CSC1 7a_100000072292_100000750268 [1,0,0,1,0,0|2,0,0]=4 17296 B14R1.612 CCOC(=O)CCCCSC1CCC1 62a_100000750268_100000749161 [1,0,0,1,0,0|1,0,0]=3 17297 B14R1.612 CCOC(=O)CCCCSC1COC1 62a_100000750268_100009818527 [1,0,0,1,0,0|2,0,0]=4 17298 B14R1.612 CCOC(=O)CCCNCC1CCC1 2230a_100000738700_100009991533 [1,0,0,1,0,0|1,0,0]=3 17299 B14R1.612 CCOC(=O)CCCNCC1CCC1 34a_100000738700_100009991533 [1,0,0,1,0,0|1,0,0]=3 17300 B14R1.612 CCOC(=O)CCCNCC1COC1 2230a_100015281925_100009991533 [1,0,0,1,0,0|2,0,0]=4 17301 B14R1.612 CCOC(=O)CCCNCC1COC1 34a_100015281925_100009991533 [1,0,0,1,0,0|2,0,0]=4 17302 B14R1.612 CCOC(=O)CCCNC[C@@H]1CCO1 2230a_100020831831_100009991533 [1,0,0,1,0,0|2,0,0]=4 17303 B14R1.612 CCOC(=O)CCCNC[C@@H]1CCO1 34a_100020831831_100009991533 [1,0,0,1,0,0|2,0,0]=4 17304 B14R1.612 CCOC(=O)CCCOCC1CCC1 34a_100000760304_100009991533 [1,0,0,1,0,0|1,0,0]=3 17305 B14R1.612 CCOC(=O)CCCOCC1CCC1 7a_100012001163_100000763275 [1,0,0,1,0,0|1,0,0]=3 17306 B14R1.612 CCOC(=O)CCCOCC1CCO1 34a_100000039022_100009991533 [1,0,0,1,0,0|2,0,0]=4 17307 B14R1.612 CCOC(=O)CCCOCC1CCO1 7a_100012001163_100000103362 [1,0,0,1,0,0|2,0,0]=4 17308 B14R1.612 CCOC(=O)CCCOCC1CNC1 34a_100016987283_100009991533 [1,0,0,1,0,0|2,0,0]=4 17309 B14R1.612 CCOC(=O)CCCOCC1COC1 34a_100000060846_100009991533 [1,0,0,1,0,0|2,0,0]=4 17310 B14R1.612 CCOC(=O)CCCOCC1COC1 7a_100012001163_100010264016 [1,0,0,1,0,0|2,0,0]=4 17311 B14R1.612 CCOC(=O)CCCSCC1CCC1 62a_100000763275_100009991533 [1,0,0,1,0,0|1,0,0]=3 17312 B14R1.612 CCOC(=O)CCCSCC1CCC1 62a_100009991533_100000763275 [1,0,0,1,0,0|1,0,0]=3 17313 B14R1.612 CCOC(=O)CCCSCC1CCO1 62a_100000103362_100009991533 [1,0,0,1,0,0|2,0,0]=4 17314 B14R1.612 CCOC(=O)CCCSCC1CCO1 62a_100009991533_100000103362 [1,0,0,1,0,0|2,0,0]=4 17315 B14R1.612 CCOC(=O)CCCSCC1COC1 62a_100009991533_100010264016 [1,0,0,1,0,0|2,0,0]=4 17316 B14R1.612 CCOC(=O)CCCSCC1COC1 62a_100010264016_100009991533 [1,0,0,1,0,0|2,0,0]=4 17317 B14R1.612 CCOC(=O)CCOCCC1COC1 34a_100009855314_100000765890 [1,0,0,1,0,0|2,0,0]=4 17318 B14R1.612 CCOC(=O)COCCCN1CCC1 269982a_100000754969_100009893628 [1,0,0,1,0,0|2,0,0]=4 17319 B14R1.612 CCOC(=O)COCCNC1CCC1 2230a_100000749019_100000088970 [1,0,0,1,0,0|2,0,0]=4 17320 B14R1.612 CCOC(=O)COCCNC1CCC1 34a_100000749019_100000088970 [1,0,0,1,0,0|2,0,0]=4 17321 B14R1.612 CCOC(=O)COCCOC1CCC1 34a_100000748187_100000088970 [1,0,0,1,0,0|2,0,0]=4 17322 B14R1.612 CCOC(=O)COCCSC1CCC1 62a_100000088970_100000749161 [1,0,0,1,0,0|2,0,0]=4 17323 B14R1.612 CCOC(=O)NCCOCC1CCC1 34a_100000158857_100000763275 [1,0,0,1,0,0|2,0,0]=4 17324 B14R1.612 CCOC(=O)NCCSCC1CCC1 62a_100000763275_200011445536 [1,0,0,1,0,0|2,0,0]=4 17325 B14R1.635 CCCCN1CCC[C@H]1C(=O)NCC 2230a_100020641767_100000210211 [1,0,0,1,0,0|2,0,0]=4 17326 B14R1.635 CCCCN1CCC[C@H]1C(=O)NCC 269982a_100020641767_100000210211 [1,0,0,1,0,0|2,0,0]=4 17327 B14R1.635 CCCCN1CCC[C@H]1C(=O)NCC 34a_100020641767_100000210210 [1,0,0,1,0,0|2,0,0]=4 17328 B14R1.635 CCCCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100000210211 [1,0,0,1,0,0|1,0,0]=3 17329 B14R1.635 CCCCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100000210211 [1,0,0,1,0,0|1,0,0]=3 17330 B14R1.635 CCCCN1CSC[C@H]1C(=O)OCC 269982a_100016989239_100000210211 [1,0,0,1,0,0|2,0,0]=4 17331 B14R1.635 CCCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100000210303 [1,0,0,1,0,0|1,0,0]=3 17332 B14R1.635 CCOC(=O)[C@@H]1CCCN1CCCF 2230a_100000703725_100011934791 [1,0,0,1,0,0|2,0,0]=4 17333 B14R1.635 CCOC(=O)[C@@H]1CCCN1CCCF 269982a_100000703725_100011934791 [1,0,0,1,0,0|2,0,0]=4 17334 B14R1.635 CCOC(=O)[C@@H]1CCCN1CCCO 2230a_100000703725_100000230001 [1,0,0,1,0,0|2,0,0]=4 17335 B14R1.635 CCOC(=O)[C@@H]1CCCN1CCCO 269982a_100000703725_100011215043 [1,0,0,1,0,0|2,0,0]=4 17336 B14R1.635 CCOC(=O)[C@@H]1CCCN1CCOC 2230a_100000703725_100011201679 [1,0,0,1,0,0|2,0,0]=4 17337 B14R1.635 CCOC(=O)[C@@H]1CCCN1CCOC 269982a_100000703725_100000233755 [1,0,0,1,0,0|2,0,0]=4 17338 B14R1.635 CCOC(=O)[C@@H]1CCCN1CCSC 2230a_100000703725_100000751147 [1,0,0,1,0,0|2,0,0]=4 17339 B14R1.635 CCOC(=O)[C@@H]1CCCN1CCSC 269982a_100000703725_100000212216 [1,0,0,1,0,0|2,0,0]=4 17340 B14R1.635 CCOC(=O)[C@@H]1CCC[C@@H]1OCCF 7a_200015395474_100011217306 [1,0,0,1,0,0|2,0,0]=4 17341 B14R1.635 CCOC(=O)[C@@H]1CCC[C@@H]1OCCO 7a_200015395474_100000211926 [1,0,0,1,0,0|2,0,0]=4 17342 B14R1.635 CCOCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100000739092 [1,0,0,1,0,0|2,0,0]=4 17343 B14R1.947 CCNC(=O)CCN1CCCC1CC 2230a_100000754278_100000737597 [1,0,0,1,0,0|2,0,0]=4 17344 B14R1.947 CCNC(=O)CCN1CCCC1CC 269982a_100000754278_100000737597 [1,0,0,1,0,0|2,0,0]=4 17345 B14R1.947 CCNC(=O)CNC1CCCC1CC 270004a_100016988866_100000749056 [1,0,0,1,0,0|2,0,0]=4 17346 B14R1.947 CCOC(=O)CCN1CCCC1CC 2230a_100000754278_100011206558 [1,0,0,1,0,0|1,0,0]=3 17347 B14R1.947 CCOC(=O)CCN1CCCC1CC 269982a_100000754278_100011206558 [1,0,0,1,0,0|1,0,0]=3 17348 B14R1.947 CCOC(=O)CCN1CCCC1CC 34a_100000754278_100000765890 [1,0,0,1,0,0|1,0,0]=3 17349 B14R1.947 CCOC(=O)CCN1CCC[C@@H]1CO 2230a_100000745186_100011206558 [1,0,0,1,0,0|2,0,0]=4 17350 B14R1.947 CCOC(=O)CCN1CCC[C@@H]1CO 269982a_100000745186_100011206558 [1,0,0,1,0,0|2,0,0]=4 17351 B14R1.947 CCOC(=O)CCN1CCC[C@@H]1CO 34a_100000745186_100000765890 [1,0,0,1,0,0|2,0,0]=4 17352 B14R1.948 CCNC(=O)CCNC1CCCC1C 269862a_100025743525_100000752053 [1,0,0,1,0,0|2,0,0]=4 17353 B14R1.948 CCNC(=O)CCOC1CCCC1C 7a_100011216460_100000737597 [1,0,0,1,0,0|2,0,0]=4 17354 B14R1.948 CCOC(=O)CCCN1CCC[C@@H]1C 2230a_100020605311_100009991533 [1,0,0,1,0,0|1,0,0]=3 17355 B14R1.948 CCOC(=O)CCCN1CCC[C@@H]1C 269982a_100020605311_100009991533 [1,0,0,1,0,0|1,0,0]=3 17356 B14R1.948 CCOC(=O)CCCN1CCC[C@H]1C 2230a_100015189458_100009991533 [1,0,0,1,0,0|1,0,0]=3 17357 B14R1.948 CCOC(=O)CCCN1CCC[C@H]1C 269982a_100015189458_100009991533 [1,0,0,1,0,0|1,0,0]=3 17358 B14R1.948 CCOC(=O)CCCN1CCC[C@H]1C 34a_100015189458_100009991533 [1,0,0,1,0,0|1,0,0]=3 17359 B14R1.948 CCOC(=O)CCCN1CCSC1C 2230a_200011216479_100009991533 [1,0,0,1,0,0|2,0,0]=4 17360 B14R1.948 CCOC(=O)CCCN1CCSC1C 269982a_200011216479_100009991533 [1,0,0,1,0,0|2,0,0]=4 17361 B14R1.948 CCOC(=O)CCCN1CCSC1C 34a_200011216479_100009991533 [1,0,0,1,0,0|2,0,0]=4 17362 B14R1.948 CCOC(=O)CCOC1CCCC1C 34a_100011216460_100000765890 [1,0,0,1,0,0|1,0,0]=3 17363 B14R1.948 CCOC(=O)CCOC1CCCC1C 7a_100011216460_100011206558 [1,0,0,1,0,0|1,0,0]=3 17364 B14R1.948 CCOC(=O)CCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000765890 [1,0,0,1,0,0|2,0,0]=4 17365 B14R1.948 CCOC(=O)CCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000765890 [1,0,0,1,0,0|2,0,0]=4 17366 B14R1.948 CCOC(=O)CCO[C@H]1CNC[C@H]1C 34a_200015306588_100000765890 [1,0,0,1,0,0|2,0,0]=4 17367 B14R1.948 CCOC(=O)CCS[C@@H]1CCC[C@H]1O 62a_100000765890_200016002552 [1,0,0,1,0,0|2,0,0]=4 17368 B14R1.948 CCOC(=O)CCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000765890 [1,0,0,1,0,0|2,0,0]=4 17369 B14R1.948 CCOC(=O)COCC1CCCN1C 34a_100000743107_100000188475 [1,0,0,1,0,0|2,0,0]=4 17370 B14R1.948 CCOC(=O)NCCN1CCC[C@@H]1C 269982a_100020605311_200011445536 [1,0,0,1,0,0|2,0,0]=4 17371 B14R1.948 CCOC(=O)NCCN1CCC[C@H]1C 269982a_100015189458_200011445536 [1,0,0,1,0,0|2,0,0]=4 17372 B14R1.955 CCOC(=O)CCCCCNC1CC1 34a_100000212008_100000755133 [1,0,0,1,0,0|1,0,0]=3 17373 B14R1.955 CCOC(=O)CCCCCSC1CC1 62a_100000755133_100000211595 [1,0,0,1,0,0|1,0,0]=3 17374 B14R1.955 CCOC(=O)CCCCNCC1CC1 2230a_100000735609_100000750268 [1,0,0,1,0,0|1,0,0]=3 17375 B14R1.955 CCOC(=O)CCCCNCC1CC1 34a_100000735609_100000750268 [1,0,0,1,0,0|1,0,0]=3 17376 B14R1.955 CCOC(=O)CCCCOCC1CC1 34a_100000211283_100000750268 [1,0,0,1,0,0|1,0,0]=3 17377 B14R1.955 CCOC(=O)CCCCOC[C@@H]1CO1 34a_100000757423_100000750268 [1,0,0,1,0,0|2,0,0]=4 17378 B14R1.955 CCOC(=O)CCCCSCC1CC1 62a_100000750268_100000742324 [1,0,0,1,0,0|1,0,0]=3 17379 B14R1.955 CCOC(=O)CCCCSCC1CC1 62a_100000756562_100000750268 [1,0,0,1,0,0|1,0,0]=3 17380 B14R1.955 CCOC(=O)CCCCSCC1CO1 62a_100000750268_102125554688 [1,0,0,1,0,0|2,0,0]=4 17381 B14R1.955 CCOC(=O)CCCCSCC1CO1 62a_102125554688_100000750268 [1,0,0,1,0,0|2,0,0]=4 17382 B14R1.955 CCOC(=O)CCCCSCC1CS1 62a_100000031435_100000750268 [1,0,0,1,0,0|2,0,0]=4 17383 B14R1.955 CCOC(=O)CCCCSCC1CS1 62a_100000750268_100000031435 [1,0,0,1,0,0|2,0,0]=4 17384 B14R1.955 CCOC(=O)CCCCSC[C@@H]1CO1 62a_100000745022_100000750268 [1,0,0,1,0,0|2,0,0]=4 17385 B14R1.955 CCOC(=O)CCCCSC[C@@H]1CO1 62a_100000750268_100000745022 [1,0,0,1,0,0|2,0,0]=4 17386 B14R1.955 CCOC(=O)CCCNCCC1CC1 34a_100000764129_100009991533 [1,0,0,1,0,0|1,0,0]=3 17387 B14R1.955 CCOC(=O)CCCOCCC1CC1 34a_100000754188_100009991533 [1,0,0,1,0,0|1,0,0]=3 17388 B14R1.955 CCOC(=O)CCCOCCC1CC1 7a_100000754188_100011215271 [1,0,0,1,0,0|1,0,0]=3 17389 B14R1.955 CCOC(=O)CCCOCCC1CC1 7a_100012001163_100000764125 [1,0,0,1,0,0|1,0,0]=3 17390 B14R1.955 CCOC(=O)CCCOCCC1CO1 7a_100012001163_100000732470 [1,0,0,1,0,0|2,0,0]=4 17391 B14R1.955 CCOC(=O)CCCOCC[C@@H]1CO1 34a_100009820653_100009991533 [1,0,0,1,0,0|2,0,0]=4 17392 B14R1.955 CCOC(=O)CCCSCCC1CC1 62a_100000764125_100009991533 [1,0,0,1,0,0|1,0,0]=3 17393 B14R1.955 CCOC(=O)CCCSCCC1CC1 62a_100009991533_100000764125 [1,0,0,1,0,0|1,0,0]=3 17394 B14R1.955 CCOC(=O)CCCSCCC1CO1 62a_100000732470_100009991533 [1,0,0,1,0,0|2,0,0]=4 17395 B14R1.955 CCOC(=O)CCCSCCC1CO1 62a_100009991533_100000732470 [1,0,0,1,0,0|2,0,0]=4 17396 B14R1.955 CCOC(=O)CCOCCNC1CC1 34a_100000738766_100000765890 [1,0,0,1,0,0|2,0,0]=4 17397 B14R1.955 CCOC(=O)CCSCCCC1CO1 62a_100000733510_100000765890 [1,0,0,1,0,0|2,0,0]=4 17398 B14R1.955 CCOC(=O)CCSCCCC1CO1 62a_100000765890_100000733510 [1,0,0,1,0,0|2,0,0]=4 17399 B14R1.955 CCOC(=O)COCCCNC1CC1 34a_100000212008_100009893628 [1,0,0,1,0,0|2,0,0]=4 17400 B14R1.955 CCOC(=O)COCCCSC1CC1 62a_100009893628_100000211595 [1,0,0,1,0,0|2,0,0]=4 17401 B14R1.955 CCOC(=O)COCCNCC1CC1 2230a_100000735609_100000088970 [1,0,0,1,0,0|2,0,0]=4 17402 B14R1.955 CCOC(=O)COCCNCC1CC1 34a_100000735609_100000088970 [1,0,0,1,0,0|2,0,0]=4 17403 B14R1.955 CCOC(=O)COCCOCC1CC1 34a_100000211283_100000088970 [1,0,0,1,0,0|2,0,0]=4 17404 B14R1.955 CCOC(=O)COCCSCC1CC1 62a_100000088970_100000742324 [1,0,0,1,0,0|2,0,0]=4 17405 B14R1.955 CCOC(=O)COCCSCC1CC1 62a_100000756562_100000088970 [1,0,0,1,0,0|2,0,0]=4 17406 B14R1.955 CCOC(=O)CSCCOCC1CC1 7a_200000230590_100000742324 [1,0,0,1,0,0|2,0,0]=4 17407 B14R1.955 CCOC(=O)NCCOCCC1CC1 34a_100000158857_100000694398 [1,0,0,1,0,0|2,0,0]=4 17408 B14R1.955 CCOC(=O)NCCOCCC1CC1 7a_100000754188_200011445536 [1,0,0,1,0,0|2,0,0]=4 17409 B14R1.955 CCOC(=O)NCCSCCC1CC1 62a_100000764125_200011445536 [1,0,0,1,0,0|2,0,0]=4 17410 B14R1.963 CCOC(=O)CCCCN1CCC1C 269982a_100000755817_100000750268 [1,0,0,1,0,0|1,0,0]=3 17411 B14R1.963 CCOC(=O)CCCCN1CCC1C 34a_100000755817_100000750268 [1,0,0,1,0,0|1,0,0]=3 17412 B14R1.963 CCOC(=O)COCCN1CCC1C 269982a_100000755817_100000088970 [1,0,0,1,0,0|2,0,0]=4 17413 B14R1.963 CCOC(=O)COCCN1CCC1C 34a_100000755817_100000088970 [1,0,0,1,0,0|2,0,0]=4 17414 B14R1.965 CCCC(=O)CN1CCCCC1CC 2230a_100000210034_100000747444 [1,0,0,1,0,0|2,0,0]=4 17415 B14R1.965 CCCC(=O)CN1CCCCC1CC 269982a_100000210034_100000747444 [1,0,0,1,0,0|2,0,0]=4 17416 B14R1.965 CCNC(=O)CN1CCCCC1CC 2230a_100000210034_100000183381 [1,0,0,1,0,0|2,0,0]=4 17417 B14R1.965 CCNC(=O)CN1CCCCC1CC 269982a_100000210034_100000183381 [1,0,0,1,0,0|2,0,0]=4 17418 B14R1.965 CCNC(=O)CN1CCCCC1CC 34a_100000210034_100000183381 [1,0,0,1,0,0|2,0,0]=4 17419 B14R1.965 CCOC(=O)CC1CCCCN1CC 2230a_100116209990_100000210202 [1,0,0,1,0,0|1,0,0]=3 17420 B14R1.965 CCOC(=O)CC1CCCCN1CC 269982a_100116209990_100000204670 [1,0,0,1,0,0|1,0,0]=3 17421 B14R1.965 CCOC(=O)CC1CCCCN1CF 269982a_100116209990_100015361967 [1,0,0,1,0,0|2,0,0]=4 17422 B14R1.965 CCOC(=O)CN1CCCCC1CC 2230a_100000210034_100000188475 [1,0,0,1,0,0|1,0,0]=3 17423 B14R1.965 CCOC(=O)CN1CCCCC1CC 269982a_100000210034_100000188475 [1,0,0,1,0,0|1,0,0]=3 17424 B14R1.965 CCOC(=O)CN1CCCCC1CC 34a_100000210034_100000188475 [1,0,0,1,0,0|1,0,0]=3 17425 B14R1.965 CCOC(=O)CN1CCCCC1CO 2230a_100000210821_100000188475 [1,0,0,1,0,0|2,0,0]=4 17426 B14R1.965 CCOC(=O)CN1CCCCC1CO 269982a_100000210821_100000188475 [1,0,0,1,0,0|2,0,0]=4 17427 B14R1.965 CCOC(=O)CN1CCCCC1CO 34a_100000210821_100000188475 [1,0,0,1,0,0|2,0,0]=4 17428 B14R1.965 CCOC(=O)CN1CCOC[C@@H]1CC 2230a_100016988097_100000188475 [1,0,0,1,0,0|2,0,0]=4 17429 B14R1.965 CCOC(=O)CN1CCOC[C@@H]1CC 269982a_100016988097_100000188475 [1,0,0,1,0,0|2,0,0]=4 17430 B14R1.965 CCOC(=O)CN1CCOC[C@@H]1CC 34a_100016988097_100000188475 [1,0,0,1,0,0|2,0,0]=4 17431 B14R1.1253 CCCCCCN1CCNC(=O)CC1 2230a_100000698595_100000210314 [1,0,0,1,0,0|2,0,0]=4 17432 B14R1.1253 CCCCCCN1CCNC(=O)CC1 269982a_100000698595_100000210757 [1,0,0,1,0,0|2,0,0]=4 17433 B14R1.6816 CCCCCCCCCC(=O)C1CC1 1458a_100000210395_100000210670 [1,0,0,1,0,0|1,0,0]=3 17434 B14R1.6816 CCCCCCCCCC(=O)C1CO1 1458a_100000701028_100000210670 [1,0,0,1,0,0|2,0,0]=4 17435 B14R1.6816 CCCCCCCCNC(=O)C1CC1 11a_100000229939_100000210395 [1,0,0,1,0,0|2,0,0]=4 17436 B14R1.6816 CCCCCCCCNC(=O)C1CC1 1626a_100000229939_100000210395 [1,0,0,1,0,0|2,0,0]=4 17437 B14R1.6816 CCCCCCCCNC(=O)C1CC1 240690a_100000229939_100000210395 [1,0,0,1,0,0|2,0,0]=4 17438 B14R1.6816 CCCCCCCCNC(=O)C1CC1 527a_100000229939_100000210395 [1,0,0,1,0,0|2,0,0]=4 17439 B14R1.6816 CCCCCCCNCC(=O)C1CC1 2230a_100000229938_100000746382 [1,0,0,1,0,0|2,0,0]=4 17440 B14R1.6816 CCCCCCCOCC(=O)C1CC1 34a_100000210272_100000746382 [1,0,0,1,0,0|2,0,0]=4 17441 B14R1.6816 CCCCCCCOCC(=O)C1CC1 34a_100000686663_100000210614 [1,0,0,1,0,0|2,0,0]=4 17442 B14R1.6816 CCCCCCCOCC(=O)C1CC1 7a_100000210272_100000746382 [1,0,0,1,0,0|2,0,0]=4 17443 B14R1.6816 CCCCCCCSCC(=O)C1CC1 62a_100000210614_100000746382 [1,0,0,1,0,0|2,0,0]=4 17444 B14R1.6816 CCCCCCCSCC(=O)C1CC1 62a_100000746382_100000210316 [1,0,0,1,0,0|2,0,0]=4 17445 B14R1.6816 O=C(CCCCCCCCO)C1CC1 1458a_100000210395_100000033203 [1,0,0,1,0,0|2,0,0]=4 17446 B14R1.7119 CCCC(=O)N1CCCCCCCC1 11a_100000039187_100000211992 [1,0,0,1,0,0|2,0,0]=4 17447 B14R1.7119 CCCC(=O)N1CCCCCCCC1 1626a_100000039187_100000211992 [1,0,0,1,0,0|2,0,0]=4 17448 B14R1.7119 CCCC(=O)N1CCCCCCCC1 240690a_100000039187_100000211992 [1,0,0,1,0,0|2,0,0]=4 17449 B14R1.7119 CCCC(=O)N1CCCCCCCC1 527a_100000039187_100000211992 [1,0,0,1,0,0|2,0,0]=4 17450 B14R1.7119 CCNC(=O)N1CCCCCCCC1 2708a_100015525214_100000039187 [1,0,0,1,0,0|2,0,0]=4 17451 B14R1.7119 CCNC(=O)N1CCCCCCCC1 273464a_100015525214_100000039187 [1,0,0,1,0,0|2,0,0]=4 17452 B14R1.7146 CCCC(=O)CCN1CCCCCC1 1458a_100000211992_100000722644 [1,0,0,1,0,0|2,0,0]=4 17453 B14R1.7146 CCCC(=O)CCN1CCCCCC1 1458a_100000740320_100000210303 [1,0,0,1,0,0|2,0,0]=4 17454 B14R1.7146 CCCC(=O)CNC1CCCCCC1 2230a_100000210984_100000747444 [1,0,0,1,0,0|2,0,0]=4 17455 B14R1.7146 CCCC(=O)COC1CCCCCC1 7a_100000210887_100000747444 [1,0,0,1,0,0|2,0,0]=4 17456 B14R1.7146 CCCC(=O)CSC1CCCCCC1 62a_100000747444_100011217769 [1,0,0,1,0,0|2,0,0]=4 17457 B14R1.7146 CCCC(=O)CSC1CCCCCC1 62a_100011217769_100000747444 [1,0,0,1,0,0|2,0,0]=4 17458 B14R1.7146 CCCC(=O)NCC1CCCCCC1 11a_100015204231_100000211992 [1,0,0,1,0,0|2,0,0]=4 17459 B14R1.7146 CCCC(=O)NCC1CCCCCC1 1626a_100015204231_100000211992 [1,0,0,1,0,0|2,0,0]=4 17460 B14R1.7146 CCCC(=O)NCC1CCCCCC1 240690a_100015204231_100000211992 [1,0,0,1,0,0|2,0,0]=4 17461 B14R1.7146 CCCC(=O)NCC1CCCCCC1 527a_100015204231_100000211992 [1,0,0,1,0,0|2,0,0]=4 17462 B14R1.7146 CCNC(=O)CCN1CCCCCC1 2230a_100000185865_100000737597 [1,0,0,1,0,0|2,0,0]=4 17463 B14R1.7146 CCNC(=O)CCN1CCCCCC1 240690a_100015525214_100000740320 [1,0,0,1,0,0|2,0,0]=4 17464 B14R1.7146 CCNC(=O)CCN1CCCCCC1 269982a_100000185865_100000737597 [1,0,0,1,0,0|2,0,0]=4 17465 B14R1.7146 CCNC(=O)CNC1CCCCCC1 2230a_100000210984_100000183381 [1,0,0,1,0,0|2,0,0]=4 17466 B14R1.7146 CCNC(=O)CNC1CCCCCC1 270004a_100016988866_100000210131 [1,0,0,1,0,0|2,0,0]=4 17467 B14R1.7146 CCNC(=O)CNC1CCCCCC1 34a_100000210984_100000183381 [1,0,0,1,0,0|2,0,0]=4 17468 B14R1.7146 CCNC(=O)COC1CCCCCC1 34a_100000210887_100000183381 [1,0,0,1,0,0|2,0,0]=4 17469 B14R1.7146 CCNC(=O)COC1CCCCCC1 7a_100000210887_100000183381 [1,0,0,1,0,0|2,0,0]=4 17470 B14R1.7146 CCNC(=O)CSC1CCCCCC1 62a_100000183381_100011217769 [1,0,0,1,0,0|2,0,0]=4 17471 B14R1.7146 CCNC(=O)CSC1CCCCCC1 62a_100011217769_100000183381 [1,0,0,1,0,0|2,0,0]=4 17472 B14R1.7146 CCNC(=O)NCC1CCCCCC1 2708a_100015204231_100015525214 [1,0,0,1,0,0|2,0,0]=4 17473 B14R1.7146 CCNC(=O)NCC1CCCCCC1 2708a_100015525214_100015204231 [1,0,0,1,0,0|2,0,0]=4 17474 B14R1.7146 CCNC(=O)NCC1CCCCCC1 273464a_100015204231_100015525214 [1,0,0,1,0,0|2,0,0]=4 17475 B14R1.7146 CCNC(=O)NCC1CCCCCC1 273464a_100015525214_100015204231 [1,0,0,1,0,0|2,0,0]=4 17476 B14R1.7146 CCNC(=O)NCC1CCCCCC1 512a_100015525214_100015204231 [1,0,0,1,0,0|2,0,0]=4 17477 B14R1.7146 CCOC(=O)CCN1CCCCCC1 2230a_100000185865_100011206558 [1,0,0,1,0,0|1,0,0]=3 17478 B14R1.7146 CCOC(=O)CCN1CCCCCC1 269982a_100000185865_100011206558 [1,0,0,1,0,0|1,0,0]=3 17479 B14R1.7146 CCOC(=O)CCN1CCCCCC1 34a_100000185865_100000765890 [1,0,0,1,0,0|1,0,0]=3 17480 B14R1.7146 CCOC(=O)CCN1CCCOCC1 2230a_100000685342_100011206558 [1,0,0,1,0,0|2,0,0]=4 17481 B14R1.7146 CCOC(=O)CCN1CCCOCC1 269982a_100000685342_100011206558 [1,0,0,1,0,0|2,0,0]=4 17482 B14R1.7146 CCOC(=O)CCN1CCCOCC1 34a_100000685342_100000765890 [1,0,0,1,0,0|2,0,0]=4 17483 B14R1.7146 CCOC(=O)CNC1CCCCCC1 2230a_100000210984_100000188475 [1,0,0,1,0,0|1,0,0]=3 17484 B14R1.7146 CCOC(=O)CNC1CCCCCC1 34a_100000210984_100000188475 [1,0,0,1,0,0|1,0,0]=3 17485 B14R1.7146 CCOC(=O)COC1CCCCCC1 34a_100000210887_100000188475 [1,0,0,1,0,0|1,0,0]=3 17486 B14R1.7146 CCOC(=O)COC1CCCCCC1 7a_100000210887_100000188475 [1,0,0,1,0,0|1,0,0]=3 17487 B14R1.7146 CCOC(=O)CSC1CCCCCC1 62a_100000188475_100011217769 [1,0,0,1,0,0|1,0,0]=3 17488 B14R1.7146 CCOC(=O)CSC1CCCCCC1 62a_100011217769_100000188475 [1,0,0,1,0,0|1,0,0]=3 17489 B14R1.7343 CCCC(=O)CN1CCCCCCC1 2230a_100000211400_100000747444 [1,0,0,1,0,0|2,0,0]=4 17490 B14R1.7343 CCCC(=O)CN1CCCCCCC1 269982a_100000211400_100000747444 [1,0,0,1,0,0|2,0,0]=4 17491 B14R1.7343 CCCC(=O)NC1CCCCCCC1 11a_100000211152_100000211992 [1,0,0,1,0,0|2,0,0]=4 17492 B14R1.7343 CCCC(=O)NC1CCCCCCC1 1626a_100000211152_100000211992 [1,0,0,1,0,0|2,0,0]=4 17493 B14R1.7343 CCCC(=O)NC1CCCCCCC1 240690a_100000211152_100000211992 [1,0,0,1,0,0|2,0,0]=4 17494 B14R1.7343 CCCC(=O)NC1CCCCCCC1 527a_100000211152_100000211992 [1,0,0,1,0,0|2,0,0]=4 17495 B14R1.7343 CCNC(=O)CN1CCCCCCC1 2230a_100000211400_100000183381 [1,0,0,1,0,0|2,0,0]=4 17496 B14R1.7343 CCNC(=O)CN1CCCCCCC1 269982a_100000211400_100000183381 [1,0,0,1,0,0|2,0,0]=4 17497 B14R1.7343 CCNC(=O)CN1CCCCCCC1 34a_100000211400_100000183381 [1,0,0,1,0,0|2,0,0]=4 17498 B14R1.7343 CCNC(=O)NC1CCCCCCC1 2708a_100000211152_100015525214 [1,0,0,1,0,0|2,0,0]=4 17499 B14R1.7343 CCNC(=O)NC1CCCCCCC1 2708a_100015525214_100000211152 [1,0,0,1,0,0|2,0,0]=4 17500 B14R1.7343 CCNC(=O)NC1CCCCCCC1 273464a_100000211152_100015525214 [1,0,0,1,0,0|2,0,0]=4 17501 B14R1.7343 CCNC(=O)NC1CCCCCCC1 273464a_100015525214_100000211152 [1,0,0,1,0,0|2,0,0]=4 17502 B14R1.7343 CCNC(=O)NC1CCCCCCC1 512a_100000211152_100015525214 [1,0,0,1,0,0|2,0,0]=4 17503 B14R1.7343 CCNC(=O)NC1CCCCCCC1 512a_100015525214_100000211152 [1,0,0,1,0,0|2,0,0]=4 17504 B14R1.7343 CCOC(=O)CN1CCCCCCC1 2230a_100000211400_100000188475 [1,0,0,1,0,0|1,0,0]=3 17505 B14R1.7343 CCOC(=O)CN1CCCCCCC1 269982a_100000211400_100000188475 [1,0,0,1,0,0|1,0,0]=3 17506 B14R1.7343 CCOC(=O)CN1CCCCCCC1 34a_100000211400_100000188475 [1,0,0,1,0,0|1,0,0]=3 17507 B14R1.9 CCCCCCN1CCNC(=O)C1C 2230a_100000750721_100000210314 [1,0,0,1,0,0|2,0,0]=4 17508 B14R1.9 CCCCCCN1CCNC(=O)C1C 269982a_100000750721_100000210757 [1,0,0,1,0,0|2,0,0]=4 17509 B14R1.9 CCCCCCN1CCNC(=O)C1C 34a_100000750721_100000210314 [1,0,0,1,0,0|2,0,0]=4 17510 B14R1.9 CCCCNCC1CCCC(=O)N1C 2230a_200010383782_100000210211 [1,0,0,1,0,0|2,0,0]=4 17511 B14R1.9 CCCCNCC1CCCC(=O)N1C 34a_200010383782_100000210210 [1,0,0,1,0,0|2,0,0]=4 17512 B14R1.14 C=C1CCC(CC1)COCCCCC 34a_100000074039_100000718602 [1,0,0,1,0,0|2,0,0]=4 17513 B14R1.14 C=C1CCC(CC1)NCCCCCC 270004a_100000210581_100010272673 [1,0,0,1,0,0|2,0,0]=4 17514 B14R1.14 C=C1CCN(CC1)CCCCCCC 2230a_100000752442_100000210681 [1,0,0,1,0,0|2,0,0]=4 17515 B14R1.14 C=C1CCN(CC1)CCCCCCC 269982a_100000752442_100000210681 [1,0,0,1,0,0|2,0,0]=4 17516 B14R1.14 C=C1CCN(CC1)CCCCCCC 34a_100000752442_100000210614 [1,0,0,1,0,0|2,0,0]=4 17517 B14R1.14 CCCCCCCN1CCS(=O)CC1 2230a_100000752083_100000210681 [1,0,0,1,0,0|2,0,0]=4 17518 B14R1.14 CCCCCCCN1CCS(=O)CC1 269982a_100000752083_100000210681 [1,0,0,1,0,0|2,0,0]=4 17519 B14R1.14 CCCCCCNC1CCC(=O)NC1 2230a_100000748762_100000210314 [1,0,0,1,0,0|2,0,0]=4 17520 B14R1.14 CCCCCCNC1CCC(=O)NC1 34a_100000748762_100000210314 [1,0,0,1,0,0|2,0,0]=4 17521 B14R1.14 CCCCCCOC1CCC(=O)CC1 34a_100000764474_100000210314 [1,0,0,1,0,0|1,0,0]=3 17522 B14R1.14 CCCCCCOC1CCC(=O)CC1 7a_100000764474_100000210314 [1,0,0,1,0,0|1,0,0]=3 17523 B14R1.14 CCCCCCOC1CCC(=O)NC1 34a_100000079199_100000210314 [1,0,0,1,0,0|2,0,0]=4 17524 B14R1.14 CCCCCOCC1CCC(=O)CC1 34a_100000062911_100000718602 [1,0,0,1,0,0|1,0,0]=3 17525 B14R1.14 CCCCOCOC1CCC(=O)CC1 34a_100000764474_100011995733 [1,0,0,1,0,0|2,0,0]=4 17526 B14R1.14 CCCOCCOC1CCC(=O)CC1 34a_100000764474_100011215938 [1,0,0,1,0,0|2,0,0]=4 17527 B14R1.14 CCCOCCOC1CCC(=O)CC1 7a_100000764474_100011215938 [1,0,0,1,0,0|2,0,0]=4 17528 B14R1.14 CCOCCCOC1CCC(=O)CC1 34a_100000764474_100012232248 [1,0,0,1,0,0|2,0,0]=4 17529 B14R1.14 CCOCCCOC1CCC(=O)CC1 7a_100000764474_100012232248 [1,0,0,1,0,0|2,0,0]=4 17530 B14R1.14 CCOCCOCC1CCC(=O)CC1 34a_100000062911_100000210147 [1,0,0,1,0,0|2,0,0]=4 17531 B14R1.14 CCSCCOCC1CCC(=O)CC1 34a_100000062911_100000757381 [1,0,0,1,0,0|2,0,0]=4 17532 B14R1.14 COCCCCOC1CCC(=O)CC1 34a_100000764474_100000755781 [1,0,0,1,0,0|2,0,0]=4 17533 B14R1.14 COCCCCOC1CCC(=O)CC1 7a_100000764474_100000730899 [1,0,0,1,0,0|2,0,0]=4 17534 B14R1.14 COCCCOCC1CCC(=O)CC1 34a_100000062911_100000740836 [1,0,0,1,0,0|2,0,0]=4 17535 B14R1.14 O=C1CCC(CC1)COCCCCF 34a_100000062911_100000729493 [1,0,0,1,0,0|2,0,0]=4 17536 B14R1.14 O=C1CCC(CC1)COCCCCO 34a_100000062911_100011216708 [1,0,0,1,0,0|2,0,0]=4 17537 B14R1.14 O=C1CCC(CC1)OCCCCCF 34a_100000764474_100000729378 [1,0,0,1,0,0|2,0,0]=4 17538 B14R1.14 O=C1CCC(CC1)OCCCCCF 7a_100000764474_100000729378 [1,0,0,1,0,0|2,0,0]=4 17539 B14R1.14 O=C1CCC(CC1)OCCCCCO 34a_100000764474_100000746330 [1,0,0,1,0,0|2,0,0]=4 17540 B14R1.14 O=C1CCC(CC1)OCCCCCO 7a_100000764474_100000746330 [1,0,0,1,0,0|2,0,0]=4 17541 B14R1.109 CCC(=O)COC[C@H]1CCCN1CC 7a_100011739246_100000747405 [1,0,0,1,0,0|2,0,0]=4 17542 B14R1.109 CCC1CCCC1NCCC(=O)NC 269862a_100000738227_100000749056 [1,0,0,1,0,0|2,0,0]=4 17543 B14R1.109 CCC1CCCC1NCCC(=O)NC 270004a_100000738227_100000749056 [1,0,0,1,0,0|2,0,0]=4 17544 B14R1.109 CCC1CCCN1CCCC(=O)NC 2230a_100000754278_100000741757 [1,0,0,1,0,0|2,0,0]=4 17545 B14R1.109 CCC1CCCN1CCCC(=O)NC 269982a_100000754278_100000741757 [1,0,0,1,0,0|2,0,0]=4 17546 B14R1.109 CCC1CCCN1CCCC(=O)NC 34a_100000754278_100000741757 [1,0,0,1,0,0|2,0,0]=4 17547 B14R1.109 CCC1CCCN1CCCC(=O)OC 2230a_100000754278_100011218270 [1,0,0,1,0,0|1,0,0]=3 17548 B14R1.109 CCC1CCCN1CCCC(=O)OC 269982a_100000754278_100011218270 [1,0,0,1,0,0|1,0,0]=3 17549 B14R1.109 CCC1CCCN1CCCC(=O)OC 34a_100000754278_100000742333 [1,0,0,1,0,0|1,0,0]=3 17550 B14R1.109 CCN1CCCC1CNCC(=O)OC 2230a_100000211693_100000747449 [1,0,0,1,0,0|2,0,0]=4 17551 B14R1.109 CCN1CCC[C@@H]1COCC(=O)OC 34a_100011739246_100000747449 [1,0,0,1,0,0|2,0,0]=4 17552 B14R1.109 CCN1CCC[C@@H]1COCC(=O)OC 7a_100011739246_100000747449 [1,0,0,1,0,0|2,0,0]=4 17553 B14R1.109 COC(=O)CCCN1CCC[C@@H]1CO 2230a_100000745186_100011218270 [1,0,0,1,0,0|2,0,0]=4 17554 B14R1.109 COC(=O)CCCN1CCC[C@@H]1CO 269982a_100000745186_100011218270 [1,0,0,1,0,0|2,0,0]=4 17555 B14R1.109 COC(=O)CCCN1CCC[C@@H]1CO 34a_100000745186_100000742333 [1,0,0,1,0,0|2,0,0]=4 17556 B14R1.122 CCCCCCCCN1CNC(=O)C1 2230a_200000708111_100000210759 [1,0,0,1,0,0|2,0,0]=4 17557 B14R1.122 CCCCCCCNC1CNC(=O)C1 2230a_100000697751_100000210681 [1,0,0,1,0,0|2,0,0]=4 17558 B14R1.122 CCCCCCCOC1CCC(=O)C1 34a_100012614533_100000210614 [1,0,0,1,0,0|1,0,0]=3 17559 B14R1.122 CCCCCCCOC1CNC(=O)C1 34a_100000690082_100000210614 [1,0,0,1,0,0|2,0,0]=4 17560 B14R1.122 CCCCCCCOC1COC(=O)O1 34a_100000210272_100000032252 [1,0,0,1,0,0|2,0,0]=4 17561 B14R1.122 CCCCCCCSC1COC(=O)O1 62a_100000210614_100000032252 [1,0,0,1,0,0|2,0,0]=4 17562 B14R1.122 CCCCCCNCC1CNC(=O)C1 2230a_100016993742_100000210314 [1,0,0,1,0,0|2,0,0]=4 17563 B14R1.122 CCCCCCNCC1CNC(=O)C1 34a_100016993742_100000210314 [1,0,0,1,0,0|2,0,0]=4 17564 B14R1.122 CCCCCCNC[C@@H]1CCC(=O)N1 2230a_100000210581_100015189358 [1,0,0,1,0,0|2,0,0]=4 17565 B14R1.122 CCCCCCNC[C@H]1CCC(=O)N1 2230a_100015423886_100000210314 [1,0,0,1,0,0|2,0,0]=4 17566 B14R1.122 CCCCCCNC[C@H]1CCC(=O)N1 34a_100015423886_100000210314 [1,0,0,1,0,0|2,0,0]=4 17567 B14R1.122 CCCCCCNC[C@H]1COC(=O)N1 2230a_100000210581_100015307671 [1,0,0,1,0,0|2,0,0]=4 17568 B14R1.122 CCCCCCOCC1CCC(=O)N1 34a_100000737831_100000210314 [1,0,0,1,0,0|2,0,0]=4 17569 B14R1.122 CCCCCCOCC1CNC(=O)C1 34a_100016041077_100000210314 [1,0,0,1,0,0|2,0,0]=4 17570 B14R1.122 CCCCCCOCC1COC(=O)O1 34a_100000210259_100000073702 [1,0,0,1,0,0|2,0,0]=4 17571 B14R1.122 CCCCCCOC[C@@H]1CCC(=O)N1 7a_100000210259_100015189358 [1,0,0,1,0,0|2,0,0]=4 17572 B14R1.122 CCCCCCOC[C@H]1COC(=O)N1 34a_100000210259_100015307671 [1,0,0,1,0,0|2,0,0]=4 17573 B14R1.122 CCCCCCOC[C@H]1COC(=O)N1 7a_100000210259_100015307671 [1,0,0,1,0,0|2,0,0]=4 17574 B14R1.122 CCCCCCSCC1COC(=O)O1 62a_100000073702_100000210757 [1,0,0,1,0,0|2,0,0]=4 17575 B14R1.122 CCCCCCSCC1COC(=O)O1 62a_100000210314_100000073702 [1,0,0,1,0,0|2,0,0]=4 17576 B14R1.122 CCCCCCSC[C@@H]1CCC(=O)N1 62a_100000210314_100015189358 [1,0,0,1,0,0|2,0,0]=4 17577 B14R1.122 CCCCCCSC[C@@H]1CCC(=O)N1 62a_100015189358_100000210757 [1,0,0,1,0,0|2,0,0]=4 17578 B14R1.122 CCCCCCSC[C@H]1COC(=O)N1 62a_100000210314_100015307671 [1,0,0,1,0,0|2,0,0]=4 17579 B14R1.122 CCCCCCSC[C@H]1COC(=O)N1 62a_100015307671_100000210757 [1,0,0,1,0,0|2,0,0]=4 17580 B14R1.122 CCCCOCCOC1CCC(=O)C1 34a_100012614533_100000743108 [1,0,0,1,0,0|2,0,0]=4 17581 B14R1.122 O=C1CCC(C1)OCCCCCCF 34a_100012614533_100015922095 [1,0,0,1,0,0|2,0,0]=4 17582 B14R1.122 O=C1CCC(C1)OCCCCCCO 34a_100012614533_100000766143 [1,0,0,1,0,0|2,0,0]=4 17583 B14R1.229 CCCCCCCCNC1CCC1=O 34a_100000229939_100009892977 [1,0,0,1,0,0|1,0,0]=3 17584 B14R1.229 CCCCCCCCOC1CCC1=O 34a_100000210232_100009892977 [1,0,0,1,0,0|1,0,0]=3 17585 B14R1.229 CCCCCCCCOC1CCC1=O 7a_100000210232_100009892977 [1,0,0,1,0,0|1,0,0]=3 17586 B14R1.229 CCCCCCCCSC1CCC1=O 62a_100000210759_100009892977 [1,0,0,1,0,0|1,0,0]=3 17587 B14R1.229 CCCCCCCCSC1CCC1=O 62a_100009892977_100000210317 [1,0,0,1,0,0|1,0,0]=3 17588 B14R1.229 CCCCCCNCCC1CCC1=O 2230a_100000210581_200016118888 [1,0,0,1,0,0|1,0,0]=3 17589 B14R1.229 CCCCCCOCCC1CCC1=O 7a_100000210259_200016118888 [1,0,0,1,0,0|1,0,0]=3 17590 B14R1.229 CCCCCCSCCC1CCC1=O 62a_100000210314_200016118888 [1,0,0,1,0,0|1,0,0]=3 17591 B14R1.229 CCCCCCSCCC1CCC1=O 62a_200016118888_100000210757 [1,0,0,1,0,0|1,0,0]=3 17592 B14R1.229 CCCCCNCCOC1CCC1=O 34a_100000224656_100009892977 [1,0,0,1,0,0|2,0,0]=4 17593 B14R1.229 CCCCCOCCOC1CCC1=O 34a_100011215259_100009892977 [1,0,0,1,0,0|2,0,0]=4 17594 B14R1.229 CCCCCOCCOC1CCC1=O 7a_100011215259_100009892977 [1,0,0,1,0,0|2,0,0]=4 17595 B14R1.229 CCCCOCCCNC1CCC1=O 34a_200000211371_100009892977 [1,0,0,1,0,0|2,0,0]=4 17596 B14R1.229 CCCCOCCCOC1CCC1=O 34a_200011215613_100009892977 [1,0,0,1,0,0|2,0,0]=4 17597 B14R1.229 CCCCOCCCOC1CCC1=O 7a_200011215613_100009892977 [1,0,0,1,0,0|2,0,0]=4 17598 B14R1.229 CCCCOCSCCC1CCC1=O 62a_100011995733_200016118888 [1,0,0,1,0,0|2,0,0]=4 17599 B14R1.229 CCCCOCSCCC1CCC1=O 62a_200016118888_100011995733 [1,0,0,1,0,0|2,0,0]=4 17600 B14R1.229 CCCOCCNCCC1CCC1=O 2230a_100161115042_200016118888 [1,0,0,1,0,0|2,0,0]=4 17601 B14R1.229 CCCOCCOCCC1CCC1=O 7a_100000752267_200016118888 [1,0,0,1,0,0|2,0,0]=4 17602 B14R1.229 CCCOCCSCCC1CCC1=O 62a_100011215938_200016118888 [1,0,0,1,0,0|2,0,0]=4 17603 B14R1.229 CCCOCCSCCC1CCC1=O 62a_200016118888_100011215938 [1,0,0,1,0,0|2,0,0]=4 17604 B14R1.229 CCCSCCNCCC1CCC1=O 2230a_100020603323_200016118888 [1,0,0,1,0,0|2,0,0]=4 17605 B14R1.229 CCCSCCOCCC1CCC1=O 7a_200000230433_200016118888 [1,0,0,1,0,0|2,0,0]=4 17606 B14R1.229 CCOCCCNCCC1CCC1=O 2230a_100000210961_200016118888 [1,0,0,1,0,0|2,0,0]=4 17607 B14R1.229 CCOCCCOCCC1CCC1=O 7a_100000757476_200016118888 [1,0,0,1,0,0|2,0,0]=4 17608 B14R1.229 CCOCCCSCCC1CCC1=O 62a_100012232248_200016118888 [1,0,0,1,0,0|2,0,0]=4 17609 B14R1.229 CCOCCCSCCC1CCC1=O 62a_200016118888_100012232248 [1,0,0,1,0,0|2,0,0]=4 17610 B14R1.229 CCSCCCOCCC1CCC1=O 7a_100011216438_200016118888 [1,0,0,1,0,0|2,0,0]=4 17611 B14R1.229 COCCCCCCOC1CCC1=O 34a_200012092642_100009892977 [1,0,0,1,0,0|2,0,0]=4 17612 B14R1.229 COCCCCCCOC1CCC1=O 7a_200012092642_100009892977 [1,0,0,1,0,0|2,0,0]=4 17613 B14R1.229 COCCCCCCSC1CCC1=O 62a_100009892977_100011998445 [1,0,0,1,0,0|2,0,0]=4 17614 B14R1.229 COCCCCCCSC1CCC1=O 62a_100011998445_100009892977 [1,0,0,1,0,0|2,0,0]=4 17615 B14R1.229 COCCCCSCCC1CCC1=O 62a_100000730899_200016118888 [1,0,0,1,0,0|2,0,0]=4 17616 B14R1.229 COCCCCSCCC1CCC1=O 62a_200016118888_100000730899 [1,0,0,1,0,0|2,0,0]=4 17617 B14R1.229 CSCCCCOCCC1CCC1=O 7a_100011217163_200016118888 [1,0,0,1,0,0|2,0,0]=4 17618 B14R1.229 NCCCCCCCOC1CCC1=O 34a_100011996573_100009892977 [1,0,0,1,0,0|2,0,0]=4 17619 B14R1.229 O=C1CCC1CCNCCCCCO 2230a_100000762737_200016118888 [1,0,0,1,0,0|2,0,0]=4 17620 B14R1.229 O=C1CCC1CCOCCCCCBr 7a_100000746331_200016118888 [1,0,0,1,0,0|2,0,0]=4 17621 B14R1.229 O=C1CCC1CCOCCCCCCl 7a_100000746330_200016118888 [1,0,0,1,0,0|2,0,0]=4 17622 B14R1.229 O=C1CCC1CCOCCCCCI 7a_200012148887_200016118888 [1,0,0,1,0,0|2,0,0]=4 17623 B14R1.229 O=C1CCC1CCSCCCCCF 62a_100000729378_200016118888 [1,0,0,1,0,0|2,0,0]=4 17624 B14R1.229 O=C1CCC1CCSCCCCCF 62a_200016118888_100000729378 [1,0,0,1,0,0|2,0,0]=4 17625 B14R1.229 O=C1CCC1CCSCCCCCO 62a_100000746330_200016118888 [1,0,0,1,0,0|2,0,0]=4 17626 B14R1.229 O=C1CCC1CCSCCCCCO 62a_200016118888_100000746330 [1,0,0,1,0,0|2,0,0]=4 17627 B14R1.229 O=C1CCC1NCCCCCCCO 34a_100011996573_100009892977 [1,0,0,1,0,0|2,0,0]=4 17628 B14R1.229 O=C1CCC1OCCCCCCCBr 34a_100000760002_100009892977 [1,0,0,1,0,0|2,0,0]=4 17629 B14R1.229 O=C1CCC1OCCCCCCCBr 7a_100000760002_100009892977 [1,0,0,1,0,0|2,0,0]=4 17630 B14R1.229 O=C1CCC1SCCCCCCCO 62a_100000760002_100009892977 [1,0,0,1,0,0|2,0,0]=4 17631 B14R1.229 O=C1CCC1SCCCCCCCO 62a_100009892977_100000760002 [1,0,0,1,0,0|2,0,0]=4 17632 B14R1.259 COCC1CCN1CCCC(=O)OC 2230a_100015195929_100011218270 [1,0,0,1,0,0|2,0,0]=4 17633 B14R1.259 COCC1CCN1CCCC(=O)OC 269982a_100015195929_100011218270 [1,0,0,1,0,0|2,0,0]=4 17634 B14R1.259 COCC1CCN1CCCC(=O)OC 34a_100015195929_100000742333 [1,0,0,1,0,0|2,0,0]=4 17635 B14R1.272 CCCC1CCCC1NCC(=O)NC 269862a_100000693194_100000723119 [1,0,0,1,0,0|2,0,0]=4 17636 B14R1.272 CCCC1CCCC1NCC(=O)NC 270004a_100000693194_100000723119 [1,0,0,1,0,0|2,0,0]=4 17637 B14R1.272 COC[C@@H]1CCCN1CCC(=O)OC 2230a_100020646714_100000204255 [1,0,0,1,0,0|2,0,0]=4 17638 B14R1.272 COC[C@@H]1CCCN1CCC(=O)OC 269982a_100020646714_100000204255 [1,0,0,1,0,0|2,0,0]=4 17639 B14R1.272 COC[C@@H]1CCCN1CCC(=O)OC 34a_100020646714_100000742370 [1,0,0,1,0,0|2,0,0]=4 17640 B14R1.483 CCC(=O)CN1CCCCC1CCO 269982a_100000211664_100000747405 [1,0,0,1,0,0|2,0,0]=4 17641 B14R1.483 CCC(=O)CN1CCCCC1COC 269982a_100015184032_100000747405 [1,0,0,1,0,0|2,0,0]=4 17642 B14R1.483 CCCC1CCCCN1CC(=O)CC 269982a_100000701414_100000747405 [1,0,0,1,0,0|1,0,0]=3 17643 B14R1.483 CCCC1CCCCN1CC(=O)NC 2230a_100000701414_100000183359 [1,0,0,1,0,0|2,0,0]=4 17644 B14R1.483 CCCC1CCCCN1CC(=O)NC 269982a_100000701414_100000183359 [1,0,0,1,0,0|2,0,0]=4 17645 B14R1.483 CCCC1CCCCN1CC(=O)NC 34a_100000701414_100000183359 [1,0,0,1,0,0|2,0,0]=4 17646 B14R1.483 CCCC1CCCCN1CC(=O)OC 2230a_100000701414_100000747449 [1,0,0,1,0,0|1,0,0]=3 17647 B14R1.483 CCCC1CCCCN1CC(=O)OC 269982a_100000701414_100000747449 [1,0,0,1,0,0|1,0,0]=3 17648 B14R1.483 CCCC1CCCCN1CC(=O)OC 34a_100000701414_100000747449 [1,0,0,1,0,0|1,0,0]=3 17649 B14R1.483 CCCC1COCCN1CC(=O)CC 269982a_102495339903_100000747405 [1,0,0,1,0,0|2,0,0]=4 17650 B14R1.483 CCCC1COCCN1CC(=O)OC 2230a_102495339903_100000747449 [1,0,0,1,0,0|2,0,0]=4 17651 B14R1.483 CCCC1COCCN1CC(=O)OC 269982a_102495339903_100000747449 [1,0,0,1,0,0|2,0,0]=4 17652 B14R1.483 CCCC1COCCN1CC(=O)OC 34a_102495339903_100000747449 [1,0,0,1,0,0|2,0,0]=4 17653 B14R1.483 CCCN1CCOCC1CC(=O)OC 2230a_100000731486_100000210303 [1,0,0,1,0,0|2,0,0]=4 17654 B14R1.483 CCCN1CCOCC1CC(=O)OC 34a_100000731486_100000210303 [1,0,0,1,0,0|2,0,0]=4 17655 B14R1.483 COC(=O)CN1CCCCC1CCO 2230a_100000211664_100000747449 [1,0,0,1,0,0|2,0,0]=4 17656 B14R1.483 COC(=O)CN1CCCCC1CCO 269982a_100000211664_100000747449 [1,0,0,1,0,0|2,0,0]=4 17657 B14R1.483 COC(=O)CN1CCCCC1CCO 34a_100000211664_100000747449 [1,0,0,1,0,0|2,0,0]=4 17658 B14R1.483 COCC1CCCCN1CC(=O)OC 2230a_100015184032_100000747449 [1,0,0,1,0,0|2,0,0]=4 17659 B14R1.483 COCC1CCCCN1CC(=O)OC 269982a_100015184032_100000747449 [1,0,0,1,0,0|2,0,0]=4 17660 B14R1.483 COCC1CCCCN1CC(=O)OC 34a_100015184032_100000747449 [1,0,0,1,0,0|2,0,0]=4 17661 B14R1.716 CCC(=O)CCCCC1CCCCC1 1458a_200011215547_100000210202 [1,0,0,1,0,0|0,0,0]=2 17662 B14R1.716 CCC(=O)CCCCN1CCCCC1 1458a_100000754417_100000210202 [1,0,0,1,0,0|1,0,0]=3 17663 B14R1.716 CCC(=O)CCCOC1CCCCO1 1458a_100000210414_100000700653 [1,0,0,1,0,0|2,0,0]=4 17664 B14R1.716 CCC(=O)COCCC1CCCCC1 34a_100000725409_100011209188 [1,0,0,1,0,0|1,0,0]=3 17665 B14R1.716 CCC(=O)COCCC1CCCCC1 7a_100011217863_100000747405 [1,0,0,1,0,0|1,0,0]=3 17666 B14R1.716 CCC(=O)COCCC1CCOCC1 34a_100000725409_100011934994 [1,0,0,1,0,0|2,0,0]=4 17667 B14R1.716 CCC(=O)COCCC1CCOCC1 7a_100011933979_100000747405 [1,0,0,1,0,0|2,0,0]=4 17668 B14R1.716 CCC(=O)COCCN1CCCCC1 34a_100000725409_100000739454 [1,0,0,1,0,0|2,0,0]=4 17669 B14R1.716 CCC(=O)COCOC1CCCCC1 34a_100000725409_100011935260 [1,0,0,1,0,0|2,0,0]=4 17670 B14R1.716 CCC(=O)CSCCC1CCCCC1 62a_100000747405_100012355289 [1,0,0,1,0,0|1,0,0]=3 17671 B14R1.716 CCC(=O)CSCCC1CCCCC1 62a_100012355289_100000747405 [1,0,0,1,0,0|1,0,0]=3 17672 B14R1.716 CCC(=O)CSCCC1CCOCC1 62a_100000747405_100011934994 [1,0,0,1,0,0|2,0,0]=4 17673 B14R1.716 CCC(=O)CSCCC1CCOCC1 62a_100011934994_100000747405 [1,0,0,1,0,0|2,0,0]=4 17674 B14R1.716 CCC(=O)CSCCN1CCCCC1 62a_100000739454_100000747405 [1,0,0,1,0,0|2,0,0]=4 17675 B14R1.716 CCC(=O)CSCCN1CCCCC1 62a_100000747405_100000739454 [1,0,0,1,0,0|2,0,0]=4 17676 B14R1.716 CCC(=O)CSCOC1CCCCC1 62a_100000747405_100011935260 [1,0,0,1,0,0|2,0,0]=4 17677 B14R1.716 CCC(=O)CSCOC1CCCCC1 62a_100011935260_100000747405 [1,0,0,1,0,0|2,0,0]=4 17678 B14R1.716 CCC(=O)NCCCC1CCCCC1 11a_100011211642_100000210414 [1,0,0,1,0,0|1,0,0]=3 17679 B14R1.716 CCC(=O)NCCCC1CCCCC1 1626a_100011211642_100000210414 [1,0,0,1,0,0|1,0,0]=3 17680 B14R1.716 CCC(=O)NCCCC1CCCCC1 240690a_100011211642_100000210414 [1,0,0,1,0,0|1,0,0]=3 17681 B14R1.716 CCC(=O)NCCCC1CCCCC1 527a_100011211642_100000210414 [1,0,0,1,0,0|1,0,0]=3 17682 B14R1.716 CCC(=O)NCCCN1CCCCC1 240690a_100000204581_100000210414 [1,0,0,1,0,0|2,0,0]=4 17683 B14R1.716 CCC(=O)NCCCN1CCCCC1 527a_100000204581_100000210414 [1,0,0,1,0,0|2,0,0]=4 17684 B14R1.716 CCC(=O)NCCNC1CCCCC1 270004a_100132302217_100000210434 [1,0,0,1,0,0|2,0,0]=4 17685 B14R1.716 CCC(=O)NCCNC1CCCCC1 34a_100132302217_100000210327 [1,0,0,1,0,0|2,0,0]=4 17686 B14R1.716 CCC(=O)NCCOC1CCCCC1 11a_100015206981_100000210414 [1,0,0,1,0,0|2,0,0]=4 17687 B14R1.716 CCC(=O)NCCOC1CCCCC1 1626a_100015206981_100000210414 [1,0,0,1,0,0|2,0,0]=4 17688 B14R1.716 CCC(=O)NCCOC1CCCCC1 240690a_100015206981_100000210414 [1,0,0,1,0,0|2,0,0]=4 17689 B14R1.716 CCC(=O)NCCOC1CCCCC1 34a_200000158885_100000210327 [1,0,0,1,0,0|2,0,0]=4 17690 B14R1.716 CCC(=O)NCCOC1CCCCC1 527a_100015206981_100000210414 [1,0,0,1,0,0|2,0,0]=4 17691 B14R1.716 CCC(=O)NCCOC1CCCCC1 7a_200000158885_100000210327 [1,0,0,1,0,0|2,0,0]=4 17692 B14R1.716 CCC(=O)OCCOC1CCCCC1 7a_200000031056_100000210327 [1,0,0,1,0,0|2,0,0]=4 17693 B14R1.716 CNC(=O)CCCCC1CCCCC1 11a_106832991635_200011215547 [1,0,0,1,0,0|1,0,0]=3 17694 B14R1.716 CNC(=O)CCCCC1CCCCC1 1626a_100102657272_200011215547 [1,0,0,1,0,0|1,0,0]=3 17695 B14R1.716 CNC(=O)CCCCC1CCCCC1 240690a_100102657272_200011215547 [1,0,0,1,0,0|1,0,0]=3 17696 B14R1.716 CNC(=O)CCCCC1CCCCC1 527a_100102657272_200011215547 [1,0,0,1,0,0|1,0,0]=3 17697 B14R1.716 CNC(=O)CCCCN1CCCCC1 11a_106832991635_100000754417 [1,0,0,1,0,0|2,0,0]=4 17698 B14R1.716 CNC(=O)CCCCN1CCCCC1 240690a_100102657272_100000754417 [1,0,0,1,0,0|2,0,0]=4 17699 B14R1.716 CNC(=O)CCCNC1CCCCC1 2230a_100000182618_100000741757 [1,0,0,1,0,0|2,0,0]=4 17700 B14R1.716 CNC(=O)CCCNC1CCCCC1 270004a_100000740002_100000210434 [1,0,0,1,0,0|2,0,0]=4 17701 B14R1.716 CNC(=O)CCCNC1CCCCC1 34a_100000182618_100000741757 [1,0,0,1,0,0|2,0,0]=4 17702 B14R1.716 CNC(=O)CCCNC1CCCCC1 34a_100000740002_100000210327 [1,0,0,1,0,0|2,0,0]=4 17703 B14R1.716 CNC(=O)CCCOC1CCCCC1 34a_100000210231_100000741757 [1,0,0,1,0,0|2,0,0]=4 17704 B14R1.716 CNC(=O)CCCOC1CCCCC1 7a_100000210231_100000741757 [1,0,0,1,0,0|2,0,0]=4 17705 B14R1.716 CNC(=O)CCCSC1CCCCC1 62a_100000210327_100000741757 [1,0,0,1,0,0|2,0,0]=4 17706 B14R1.716 CNC(=O)CCCSC1CCCCC1 62a_100000741757_100000210327 [1,0,0,1,0,0|2,0,0]=4 17707 B14R1.716 CNC(=O)CCNCC1CCCCC1 2230a_100000210473_100000737683 [1,0,0,1,0,0|2,0,0]=4 17708 B14R1.716 CNC(=O)CCNCC1CCCCC1 2230a_100000738227_100000211423 [1,0,0,1,0,0|2,0,0]=4 17709 B14R1.716 CNC(=O)CCNCC1CCCCC1 269862a_100000738227_100000211278 [1,0,0,1,0,0|2,0,0]=4 17710 B14R1.716 CNC(=O)CCNCC1CCCCC1 34a_100000210473_100012179268 [1,0,0,1,0,0|2,0,0]=4 17711 B14R1.716 CNC(=O)CCNCC1CCCCC1 34a_100000738227_100000211423 [1,0,0,1,0,0|2,0,0]=4 17712 B14R1.716 CNC(=O)CCOCC1CCCCC1 34a_100000212181_100012179268 [1,0,0,1,0,0|2,0,0]=4 17713 B14R1.716 CNC(=O)CCOCC1CCCCC1 34a_100000754576_100000211423 [1,0,0,1,0,0|2,0,0]=4 17714 B14R1.716 CNC(=O)CCOCC1CCCCC1 7a_100000212181_100000737683 [1,0,0,1,0,0|2,0,0]=4 17715 B14R1.716 CNC(=O)CCSCC1CCCCC1 62a_100000211423_100000737683 [1,0,0,1,0,0|2,0,0]=4 17716 B14R1.716 CNC(=O)CCSCC1CCCCC1 62a_100000737683_100000211423 [1,0,0,1,0,0|2,0,0]=4 17717 B14R1.716 CNC(=O)CNCCC1CCCCC1 2230a_100000693194_100012355289 [1,0,0,1,0,0|2,0,0]=4 17718 B14R1.716 CNC(=O)CNCCC1CCCCC1 2230a_100000738074_100000183359 [1,0,0,1,0,0|2,0,0]=4 17719 B14R1.716 CNC(=O)CNCCC1CCCCC1 270004a_100000693194_100011713444 [1,0,0,1,0,0|2,0,0]=4 17720 B14R1.716 CNC(=O)CNCCC1CCCCC1 34a_100000738074_100000183359 [1,0,0,1,0,0|2,0,0]=4 17721 B14R1.716 CNC(=O)COCCC1CCCCC1 34a_100000750040_100011209188 [1,0,0,1,0,0|2,0,0]=4 17722 B14R1.716 CNC(=O)COCCC1CCCCC1 34a_100011217863_100000183359 [1,0,0,1,0,0|2,0,0]=4 17723 B14R1.716 CNC(=O)COCCC1CCCCC1 7a_100011217863_100000183359 [1,0,0,1,0,0|2,0,0]=4 17724 B14R1.716 CNC(=O)CSCCC1CCCCC1 62a_100000183359_100012355289 [1,0,0,1,0,0|2,0,0]=4 17725 B14R1.716 CNC(=O)CSCCC1CCCCC1 62a_100012355289_100000183359 [1,0,0,1,0,0|2,0,0]=4 17726 B14R1.716 CNC(=O)NCCCC1CCCCC1 2708a_100011211642_106832991635 [1,0,0,1,0,0|2,0,0]=4 17727 B14R1.716 CNC(=O)NCCCC1CCCCC1 2708a_100102657272_100011211642 [1,0,0,1,0,0|2,0,0]=4 17728 B14R1.716 CNC(=O)NCCCC1CCCCC1 273464a_100011211642_100102657272 [1,0,0,1,0,0|2,0,0]=4 17729 B14R1.716 CNC(=O)NCCCC1CCCCC1 273464a_100102657272_100011211642 [1,0,0,1,0,0|2,0,0]=4 17730 B14R1.716 CNC(=O)NCCCC1CCCCC1 512a_100011211642_100102657272 [1,0,0,1,0,0|2,0,0]=4 17731 B14R1.716 CNC(=O)NCCCC1CCCCC1 512a_106832991638_100011211642 [1,0,0,1,0,0|2,0,0]=4 17732 B14R1.716 COC(=O)CCCCN1CCCOC1 2230a_100000131196_100000204269 [1,0,0,1,0,0|2,0,0]=4 17733 B14R1.716 COC(=O)CCCCN1CCCOC1 269982a_100000131196_100000204269 [1,0,0,1,0,0|2,0,0]=4 17734 B14R1.716 COC(=O)CCCCN1CCCOC1 34a_100000131196_100000204269 [1,0,0,1,0,0|2,0,0]=4 17735 B14R1.716 COC(=O)CCCCN1CCOCC1 2230a_100015191051_100000204269 [1,0,0,1,0,0|2,0,0]=4 17736 B14R1.716 COC(=O)CCCCN1CCOCC1 269982a_100015191051_100000204269 [1,0,0,1,0,0|2,0,0]=4 17737 B14R1.716 COC(=O)CCCCN1CCOCC1 34a_100015191051_100000204269 [1,0,0,1,0,0|2,0,0]=4 17738 B14R1.716 COC(=O)CCCCN1CCSCC1 2230a_100000737611_100000204269 [1,0,0,1,0,0|2,0,0]=4 17739 B14R1.716 COC(=O)CCCCN1CCSCC1 269982a_100000737611_100000204269 [1,0,0,1,0,0|2,0,0]=4 17740 B14R1.716 COC(=O)CCCNC1CCCCC1 2230a_100000182618_100011218270 [1,0,0,1,0,0|1,0,0]=3 17741 B14R1.716 COC(=O)CCCNC1CCCCC1 34a_100000182618_100000742333 [1,0,0,1,0,0|1,0,0]=3 17742 B14R1.716 COC(=O)CCCNC1CCCOC1 2230a_100000719290_100011218270 [1,0,0,1,0,0|2,0,0]=4 17743 B14R1.716 COC(=O)CCCNC1CCCOC1 34a_100000719290_100000742333 [1,0,0,1,0,0|2,0,0]=4 17744 B14R1.716 COC(=O)CCCNC1CCOCC1 2230a_100000741149_100011218270 [1,0,0,1,0,0|2,0,0]=4 17745 B14R1.716 COC(=O)CCCNC1CCOCC1 34a_100000741149_100000742333 [1,0,0,1,0,0|2,0,0]=4 17746 B14R1.716 COC(=O)CCCNC1CCSCC1 2230a_100000748639_100011218270 [1,0,0,1,0,0|2,0,0]=4 17747 B14R1.716 COC(=O)CCCNC1CCSCC1 34a_100000748639_100000742333 [1,0,0,1,0,0|2,0,0]=4 17748 B14R1.716 COC(=O)CCCOC1CCCCC1 34a_100000210231_100000742333 [1,0,0,1,0,0|1,0,0]=3 17749 B14R1.716 COC(=O)CCCOC1CCCCC1 7a_100000210231_100011218270 [1,0,0,1,0,0|1,0,0]=3 17750 B14R1.716 COC(=O)CCCOC1CCCCO1 34a_100000033831_100000742333 [1,0,0,1,0,0|2,0,0]=4 17751 B14R1.716 COC(=O)CCCOC1CCCOC1 34a_100000754041_100000742333 [1,0,0,1,0,0|2,0,0]=4 17752 B14R1.716 COC(=O)CCCOC1CCCSC1 7a_100015962668_100011218270 [1,0,0,1,0,0|2,0,0]=4 17753 B14R1.716 COC(=O)CCCOC1CCOCC1 34a_100000744328_100000742333 [1,0,0,1,0,0|2,0,0]=4 17754 B14R1.716 COC(=O)CCCOC1CCSCC1 34a_100000731022_100000742333 [1,0,0,1,0,0|2,0,0]=4 17755 B14R1.716 COC(=O)CCCOC1CCSCC1 7a_100000731022_100011218270 [1,0,0,1,0,0|2,0,0]=4 17756 B14R1.716 COC(=O)CCCSC1CCCCC1 62a_100000210327_100011218270 [1,0,0,1,0,0|1,0,0]=3 17757 B14R1.716 COC(=O)CCCSC1CCCCC1 62a_100011218270_100000210327 [1,0,0,1,0,0|1,0,0]=3 17758 B14R1.716 COC(=O)CCCSC1CCCOC1 62a_100011218270_100000693364 [1,0,0,1,0,0|2,0,0]=4 17759 B14R1.716 COC(=O)CCCSC1CCOCC1 62a_100011218270_100011324220 [1,0,0,1,0,0|2,0,0]=4 17760 B14R1.716 COC(=O)CCCSC1CCSCC1 62a_100011218270_100000069128 [1,0,0,1,0,0|2,0,0]=4 17761 B14R1.716 COC(=O)CCNCC1CCCCC1 2230a_100000210473_100000204255 [1,0,0,1,0,0|1,0,0]=3 17762 B14R1.716 COC(=O)CCNCC1CCCCC1 34a_100000210473_100000742370 [1,0,0,1,0,0|1,0,0]=3 17763 B14R1.716 COC(=O)CCNCC1CCCCO1 2230a_100000174945_100000204255 [1,0,0,1,0,0|2,0,0]=4 17764 B14R1.716 COC(=O)CCNCC1CCCCO1 34a_100000174945_100000742370 [1,0,0,1,0,0|2,0,0]=4 17765 B14R1.716 COC(=O)CCNCC1CCCOC1 2230a_100000720124_100000204255 [1,0,0,1,0,0|2,0,0]=4 17766 B14R1.716 COC(=O)CCNCC1CCCOC1 34a_100000720124_100000742370 [1,0,0,1,0,0|2,0,0]=4 17767 B14R1.716 COC(=O)CCNCC1CCOCC1 2230a_100000746373_100000204255 [1,0,0,1,0,0|2,0,0]=4 17768 B14R1.716 COC(=O)CCNCC1CCOCC1 34a_100000746373_100000742370 [1,0,0,1,0,0|2,0,0]=4 17769 B14R1.716 COC(=O)CCNCC1CCSCC1 2230a_100015188806_100000204255 [1,0,0,1,0,0|2,0,0]=4 17770 B14R1.716 COC(=O)CCNCC1CCSCC1 34a_100015188806_100000742370 [1,0,0,1,0,0|2,0,0]=4 17771 B14R1.716 COC(=O)CCOCC1CCCCC1 34a_100000212181_100000742370 [1,0,0,1,0,0|1,0,0]=3 17772 B14R1.716 COC(=O)CCOCC1CCCCC1 7a_100000212181_100000204255 [1,0,0,1,0,0|1,0,0]=3 17773 B14R1.716 COC(=O)CCOCC1CCCCN1 34a_100000210821_100000742370 [1,0,0,1,0,0|2,0,0]=4 17774 B14R1.716 COC(=O)CCOCC1CCCCO1 34a_100000211370_100000742370 [1,0,0,1,0,0|2,0,0]=4 17775 B14R1.716 COC(=O)CCOCC1CCCCO1 7a_100000211370_100000204255 [1,0,0,1,0,0|2,0,0]=4 17776 B14R1.716 COC(=O)CCOCC1CCCNC1 34a_100000211344_100000742370 [1,0,0,1,0,0|2,0,0]=4 17777 B14R1.716 COC(=O)CCOCC1CCCOC1 34a_100000741520_100000742370 [1,0,0,1,0,0|2,0,0]=4 17778 B14R1.716 COC(=O)CCOCC1CCNCC1 34a_100000738675_100000742370 [1,0,0,1,0,0|2,0,0]=4 17779 B14R1.716 COC(=O)CCOCC1CCOCC1 34a_100000749013_100000742370 [1,0,0,1,0,0|2,0,0]=4 17780 B14R1.716 COC(=O)CCOCC1CCSCC1 34a_100000070558_100000742370 [1,0,0,1,0,0|2,0,0]=4 17781 B14R1.716 COC(=O)CCOCC1CCSCC1 7a_100000070558_100000204255 [1,0,0,1,0,0|2,0,0]=4 17782 B14R1.716 COC(=O)CCSCC1CCCCC1 62a_100000204255_100000211423 [1,0,0,1,0,0|1,0,0]=3 17783 B14R1.716 COC(=O)CCSCC1CCCCC1 62a_100000211423_100000204255 [1,0,0,1,0,0|1,0,0]=3 17784 B14R1.716 COC(=O)CCSCC1CCCCO1 62a_100000204255_100000211543 [1,0,0,1,0,0|2,0,0]=4 17785 B14R1.716 COC(=O)CCSCC1CCCCO1 62a_100000211543_100000204255 [1,0,0,1,0,0|2,0,0]=4 17786 B14R1.716 COC(=O)CCSCC1CCCOC1 62a_100000204255_100000741521 [1,0,0,1,0,0|2,0,0]=4 17787 B14R1.716 COC(=O)CCSCC1CCCOC1 62a_100000741521_100000204255 [1,0,0,1,0,0|2,0,0]=4 17788 B14R1.716 COC(=O)CCSCC1CCOCC1 62a_100000204255_100000749018 [1,0,0,1,0,0|2,0,0]=4 17789 B14R1.716 COC(=O)CCSCC1CCOCC1 62a_100000754603_100000204255 [1,0,0,1,0,0|2,0,0]=4 17790 B14R1.716 COC(=O)CNCCC1CCCCC1 2230a_100000738074_100000747449 [1,0,0,1,0,0|1,0,0]=3 17791 B14R1.716 COC(=O)CNCCC1CCCCC1 34a_100000738074_100000747449 [1,0,0,1,0,0|1,0,0]=3 17792 B14R1.716 COC(=O)CNCCC1CCCCO1 2230a_100015183643_100000747449 [1,0,0,1,0,0|2,0,0]=4 17793 B14R1.716 COC(=O)CNCCC1CCCCO1 34a_100015183643_100000747449 [1,0,0,1,0,0|2,0,0]=4 17794 B14R1.716 COC(=O)CNCCC1CCOCC1 2230a_100000755988_100000747449 [1,0,0,1,0,0|2,0,0]=4 17795 B14R1.716 COC(=O)CNCCC1CCOCC1 34a_100000755988_100000747449 [1,0,0,1,0,0|2,0,0]=4 17796 B14R1.716 COC(=O)COCCC1CCCCC1 34a_100011217863_100000747449 [1,0,0,1,0,0|1,0,0]=3 17797 B14R1.716 COC(=O)COCCC1CCCCC1 7a_100011217863_100000747449 [1,0,0,1,0,0|1,0,0]=3 17798 B14R1.716 COC(=O)COCCC1CCCCN1 34a_100000211664_100000747449 [1,0,0,1,0,0|2,0,0]=4 17799 B14R1.716 COC(=O)COCCC1CCCNC1 34a_100000752241_100000747449 [1,0,0,1,0,0|2,0,0]=4 17800 B14R1.716 COC(=O)COCCC1CCNCC1 34a_100015190746_100000747449 [1,0,0,1,0,0|2,0,0]=4 17801 B14R1.716 COC(=O)COCCC1CCOCC1 34a_100011933979_100000747449 [1,0,0,1,0,0|2,0,0]=4 17802 B14R1.716 COC(=O)COCCC1CCOCC1 7a_100011933979_100000747449 [1,0,0,1,0,0|2,0,0]=4 17803 B14R1.716 COC(=O)CSCCC1CCCCC1 62a_100000747449_100012355289 [1,0,0,1,0,0|1,0,0]=3 17804 B14R1.716 COC(=O)CSCCC1CCCCC1 62a_100012355289_100000747449 [1,0,0,1,0,0|1,0,0]=3 17805 B14R1.716 COC(=O)CSCCC1CCOCC1 62a_100000747449_100011934994 [1,0,0,1,0,0|2,0,0]=4 17806 B14R1.716 COC(=O)CSCCC1CCOCC1 62a_100011934994_100000747449 [1,0,0,1,0,0|2,0,0]=4 17807 B14R1.716 COC(=O)CSCCN1CCCCC1 62a_100000739454_100000747449 [1,0,0,1,0,0|2,0,0]=4 17808 B14R1.716 COC(=O)CSCCN1CCCCC1 62a_100000747449_100000739454 [1,0,0,1,0,0|2,0,0]=4 17809 B14R1.716 COC(=O)CSCOC1CCCCC1 62a_100000747449_100011935260 [1,0,0,1,0,0|2,0,0]=4 17810 B14R1.716 COC(=O)CSCOC1CCCCC1 62a_100011935260_100000747449 [1,0,0,1,0,0|2,0,0]=4 17811 B14R1.716 COC(=O)NCCOC1CCCCC1 34a_100000757965_100000210327 [1,0,0,1,0,0|2,0,0]=4 17812 B14R1.716 COC(=O)OCCOC1CCCCC1 34a_100010262106_100000210327 [1,0,0,1,0,0|2,0,0]=4 17813 B14R1.716 COC(=O)OCSCC1CCCCC1 62a_100000211423_100000139417 [1,0,0,1,0,0|2,0,0]=4 17814 B14R1.716 O=C(CF)CCCCC1CCCCC1 1458a_200011215547_100015361967 [1,0,0,1,0,0|1,0,0]=3 17815 B14R1.716 O=C(CF)CCCCN1CCCCC1 1458a_100000754417_100015361967 [1,0,0,1,0,0|2,0,0]=4 17816 B14R1.716 O=C(CO)NCCCC1CCCCC1 240690a_100011211642_100000210174 [1,0,0,1,0,0|2,0,0]=4 17817 B14R1.716 O=C(CO)NCCCC1CCCCC1 527a_100011211642_100000210174 [1,0,0,1,0,0|2,0,0]=4 17818 B14R1.730 CCC(=O)COCCCC1CCCC1 34a_100000725409_100011713738 [1,0,0,1,0,0|1,0,0]=3 17819 B14R1.730 CCC(=O)COCCCC1CCCC1 7a_100011215328_100000747405 [1,0,0,1,0,0|1,0,0]=3 17820 B14R1.730 CCC(=O)COCCCN1CCCC1 34a_100000725409_100016991639 [1,0,0,1,0,0|2,0,0]=4 17821 B14R1.730 CCC(=O)COCCOC1CCCC1 7a_100000738311_100000747405 [1,0,0,1,0,0|2,0,0]=4 17822 B14R1.730 CCC(=O)CSCCCC1CCCC1 62a_100000747405_100011713738 [1,0,0,1,0,0|1,0,0]=3 17823 B14R1.730 CCC(=O)CSCCCC1CCCC1 62a_100011713738_100000747405 [1,0,0,1,0,0|1,0,0]=3 17824 B14R1.730 CCC(=O)CSCCCN1CCCC1 62a_100000747405_100011445909 [1,0,0,1,0,0|2,0,0]=4 17825 B14R1.730 CCC(=O)CSCCCN1CCCC1 62a_100016991639_100000747405 [1,0,0,1,0,0|2,0,0]=4 17826 B14R1.730 CCC(=O)NCCCCN1CCCC1 1626a_100000740493_100000210414 [1,0,0,1,0,0|2,0,0]=4 17827 B14R1.730 CCC(=O)NCCCCN1CCCC1 240690a_100000740493_100000210414 [1,0,0,1,0,0|2,0,0]=4 17828 B14R1.730 CCC(=O)NCCCOC1CCCC1 11a_100000747560_100000210414 [1,0,0,1,0,0|2,0,0]=4 17829 B14R1.730 CCC(=O)NCCCOC1CCCC1 1626a_100000747560_100000210414 [1,0,0,1,0,0|2,0,0]=4 17830 B14R1.730 CCC(=O)NCCCOC1CCCC1 240690a_100000747560_100000210414 [1,0,0,1,0,0|2,0,0]=4 17831 B14R1.730 CCC(=O)NCCCOC1CCCC1 527a_100000747560_100000210414 [1,0,0,1,0,0|2,0,0]=4 17832 B14R1.730 CCC(=O)NCCNCC1CCCC1 269862a_100132302217_100000746403 [1,0,0,1,0,0|2,0,0]=4 17833 B14R1.730 CCC(=O)NCCNCC1CCCC1 34a_100132302217_100000740388 [1,0,0,1,0,0|2,0,0]=4 17834 B14R1.730 CCC(=O)NCCOCC1CCCC1 34a_200000158885_100000740388 [1,0,0,1,0,0|2,0,0]=4 17835 B14R1.730 CCC(=O)NCCOCC1CCCC1 7a_200000158885_100000740388 [1,0,0,1,0,0|2,0,0]=4 17836 B14R1.730 CCC(=O)OCCOCC1CCCC1 7a_200000031056_100000740388 [1,0,0,1,0,0|2,0,0]=4 17837 B14R1.730 CNC(=O)CCCNCC1CCCC1 2230a_100000737975_100000741757 [1,0,0,1,0,0|2,0,0]=4 17838 B14R1.730 CNC(=O)CCCNCC1CCCC1 2230a_100000740002_100000740388 [1,0,0,1,0,0|2,0,0]=4 17839 B14R1.730 CNC(=O)CCCNCC1CCCC1 269862a_100000740002_100000746403 [1,0,0,1,0,0|2,0,0]=4 17840 B14R1.730 CNC(=O)CCCNCC1CCCC1 34a_100000737975_100000741757 [1,0,0,1,0,0|2,0,0]=4 17841 B14R1.730 CNC(=O)CCCNCC1CCCC1 34a_100000740002_100000740388 [1,0,0,1,0,0|2,0,0]=4 17842 B14R1.730 CNC(=O)CCCOCC1CCCC1 34a_100000742336_100000741757 [1,0,0,1,0,0|2,0,0]=4 17843 B14R1.730 CNC(=O)CCCOCC1CCCC1 7a_100000742336_100000741757 [1,0,0,1,0,0|2,0,0]=4 17844 B14R1.730 CNC(=O)CCCSCC1CCCC1 62a_100000740388_100000741757 [1,0,0,1,0,0|2,0,0]=4 17845 B14R1.730 CNC(=O)CCCSCC1CCCC1 62a_100000741757_100000740388 [1,0,0,1,0,0|2,0,0]=4 17846 B14R1.730 CNC(=O)CCNCCC1CCCC1 2230a_100000738227_100000760354 [1,0,0,1,0,0|2,0,0]=4 17847 B14R1.730 CNC(=O)CCNCCC1CCCC1 2230a_100000739158_100000737683 [1,0,0,1,0,0|2,0,0]=4 17848 B14R1.730 CNC(=O)CCNCCC1CCCC1 34a_100000738227_100000760354 [1,0,0,1,0,0|2,0,0]=4 17849 B14R1.730 CNC(=O)CCNCCC1CCCC1 34a_100000739158_100012179268 [1,0,0,1,0,0|2,0,0]=4 17850 B14R1.730 CNC(=O)CCOCCC1CCCC1 34a_100000749090_100012179268 [1,0,0,1,0,0|2,0,0]=4 17851 B14R1.730 CNC(=O)CCOCCC1CCCC1 34a_100000754576_100000760354 [1,0,0,1,0,0|2,0,0]=4 17852 B14R1.730 CNC(=O)CCOCCC1CCCC1 7a_100000749090_100000737683 [1,0,0,1,0,0|2,0,0]=4 17853 B14R1.730 CNC(=O)CCSCCC1CCCC1 62a_100000737683_100000760354 [1,0,0,1,0,0|2,0,0]=4 17854 B14R1.730 CNC(=O)CCSCCC1CCCC1 62a_100000760354_100000737683 [1,0,0,1,0,0|2,0,0]=4 17855 B14R1.730 CNC(=O)CNCCCC1CCCC1 2230a_100000693194_100011713738 [1,0,0,1,0,0|2,0,0]=4 17856 B14R1.730 CNC(=O)CNCCCC1CCCC1 2230a_100000736752_100000183359 [1,0,0,1,0,0|2,0,0]=4 17857 B14R1.730 CNC(=O)CNCCCC1CCCC1 34a_100000736752_100000183359 [1,0,0,1,0,0|2,0,0]=4 17858 B14R1.730 CNC(=O)COCCCC1CCCC1 34a_100000750040_100011713738 [1,0,0,1,0,0|2,0,0]=4 17859 B14R1.730 CNC(=O)COCCCC1CCCC1 34a_100011215328_100000183359 [1,0,0,1,0,0|2,0,0]=4 17860 B14R1.730 CNC(=O)COCCCC1CCCC1 7a_100011215328_100000183359 [1,0,0,1,0,0|2,0,0]=4 17861 B14R1.730 CNC(=O)CSCCCC1CCCC1 62a_100000183359_100011713738 [1,0,0,1,0,0|2,0,0]=4 17862 B14R1.730 CNC(=O)CSCCCC1CCCC1 62a_100011713738_100000183359 [1,0,0,1,0,0|2,0,0]=4 17863 B14R1.730 COC(=O)CCCCCN1CCCC1 2230a_100000188435_100009816466 [1,0,0,1,0,0|1,0,0]=3 17864 B14R1.730 COC(=O)CCCCCN1CCCC1 269982a_100000188435_100009816466 [1,0,0,1,0,0|1,0,0]=3 17865 B14R1.730 COC(=O)CCCCCN1CCSC1 2230a_100011215254_100009816466 [1,0,0,1,0,0|2,0,0]=4 17866 B14R1.730 COC(=O)CCCCCN1CCSC1 269982a_100011215254_100009816466 [1,0,0,1,0,0|2,0,0]=4 17867 B14R1.730 COC(=O)CCCCNC1CCCC1 2230a_100000211070_100000204269 [1,0,0,1,0,0|1,0,0]=3 17868 B14R1.730 COC(=O)CCCCNC1CCCC1 34a_100000211070_100000204269 [1,0,0,1,0,0|1,0,0]=3 17869 B14R1.730 COC(=O)CCCCN[C@@H]1CCOC1 2230a_200015188469_100000204269 [1,0,0,1,0,0|2,0,0]=4 17870 B14R1.730 COC(=O)CCCCN[C@H]1CCOC1 2230a_100015188467_100000204269 [1,0,0,1,0,0|2,0,0]=4 17871 B14R1.730 COC(=O)CCCCN[C@H]1CCOC1 34a_100015188467_100000204269 [1,0,0,1,0,0|2,0,0]=4 17872 B14R1.730 COC(=O)CCCCOC1CCCC1 34a_100000059025_100000179811 [1,0,0,1,0,0|1,0,0]=3 17873 B14R1.730 COC(=O)CCCCOC1CCCC1 34a_100000210269_100000204269 [1,0,0,1,0,0|1,0,0]=3 17874 B14R1.730 COC(=O)CCCCOC1CCCC1 7a_100000059025_100000179811 [1,0,0,1,0,0|1,0,0]=3 17875 B14R1.730 COC(=O)CCCCOC1CCCC1 7a_100000210269_100000204269 [1,0,0,1,0,0|1,0,0]=3 17876 B14R1.730 COC(=O)CCCCOC1CCCO1 34a_100000085407_100000204269 [1,0,0,1,0,0|2,0,0]=4 17877 B14R1.730 COC(=O)CCCCOC1CCOC1 34a_100000059025_100000690089 [1,0,0,1,0,0|2,0,0]=4 17878 B14R1.730 COC(=O)CCCCOC1CCOC1 7a_100000059025_100000731011 [1,0,0,1,0,0|2,0,0]=4 17879 B14R1.730 COC(=O)CCCCOC1CCSC1 7a_100011232664_100000204269 [1,0,0,1,0,0|2,0,0]=4 17880 B14R1.730 COC(=O)CCCCO[C@H]1CCOC1 34a_100000717292_100000204269 [1,0,0,1,0,0|2,0,0]=4 17881 B14R1.730 COC(=O)CCCCSC1CCCC1 62a_100000204269_100000179811 [1,0,0,1,0,0|1,0,0]=3 17882 B14R1.730 COC(=O)CCCCSC1CCCC1 62a_100011217020_100000204269 [1,0,0,1,0,0|1,0,0]=3 17883 B14R1.730 COC(=O)CCCCSC1CCOC1 62a_100000204269_100000690089 [1,0,0,1,0,0|2,0,0]=4 17884 B14R1.730 COC(=O)CCCNCC1CCCC1 2230a_100000737975_100011218270 [1,0,0,1,0,0|1,0,0]=3 17885 B14R1.730 COC(=O)CCCNCC1CCCC1 34a_100000737975_100000742333 [1,0,0,1,0,0|1,0,0]=3 17886 B14R1.730 COC(=O)CCCNCC1CCOC1 2230a_100000737293_100011218270 [1,0,0,1,0,0|2,0,0]=4 17887 B14R1.730 COC(=O)CCCNCC1CCOC1 34a_100000737293_100000742333 [1,0,0,1,0,0|2,0,0]=4 17888 B14R1.730 COC(=O)CCCNC[C@@H]1CCCO1 2230a_100020590478_100011218270 [1,0,0,1,0,0|2,0,0]=4 17889 B14R1.730 COC(=O)CCCNC[C@@H]1CCCO1 34a_100020590478_100000742333 [1,0,0,1,0,0|2,0,0]=4 17890 B14R1.730 COC(=O)CCCOCC1CCCC1 34a_100000742336_100000742333 [1,0,0,1,0,0|1,0,0]=3 17891 B14R1.730 COC(=O)CCCOCC1CCCC1 7a_100000742336_100011218270 [1,0,0,1,0,0|1,0,0]=3 17892 B14R1.730 COC(=O)CCCOCC1CCCO1 34a_100000210270_100000742333 [1,0,0,1,0,0|2,0,0]=4 17893 B14R1.730 COC(=O)CCCOCC1CCCO1 7a_100000210270_100011218270 [1,0,0,1,0,0|2,0,0]=4 17894 B14R1.730 COC(=O)CCCOCC1CCNC1 34a_100000748654_100000742333 [1,0,0,1,0,0|2,0,0]=4 17895 B14R1.730 COC(=O)CCCOCC1CCOC1 34a_100000740260_100000742333 [1,0,0,1,0,0|2,0,0]=4 17896 B14R1.730 COC(=O)CCCOC[C@H]1CCCN1 34a_100000745186_100000742333 [1,0,0,1,0,0|2,0,0]=4 17897 B14R1.730 COC(=O)CCCSCC1CCCC1 62a_100000740388_100011218270 [1,0,0,1,0,0|1,0,0]=3 17898 B14R1.730 COC(=O)CCCSCC1CCCC1 62a_100011218270_100000740388 [1,0,0,1,0,0|1,0,0]=3 17899 B14R1.730 COC(=O)CCCSCC1CCCO1 62a_100000203698_100011218270 [1,0,0,1,0,0|2,0,0]=4 17900 B14R1.730 COC(=O)CCCSCC1CCCO1 62a_100011218270_100000203698 [1,0,0,1,0,0|2,0,0]=4 17901 B14R1.730 COC(=O)CCCSCC1CCOC1 62a_100000702531_100011218270 [1,0,0,1,0,0|2,0,0]=4 17902 B14R1.730 COC(=O)CCCSCC1CCOC1 62a_100011218270_100000702531 [1,0,0,1,0,0|2,0,0]=4 17903 B14R1.730 COC(=O)CCNCCC1CCCC1 2230a_100000739158_100000204255 [1,0,0,1,0,0|1,0,0]=3 17904 B14R1.730 COC(=O)CCNCCC1CCCC1 34a_100000739158_100000742370 [1,0,0,1,0,0|1,0,0]=3 17905 B14R1.730 COC(=O)CCOCCC1CCCC1 34a_100000749090_100000742370 [1,0,0,1,0,0|1,0,0]=3 17906 B14R1.730 COC(=O)CCOCCC1CCCC1 7a_100000749090_100000204255 [1,0,0,1,0,0|1,0,0]=3 17907 B14R1.730 COC(=O)CCOCCC1CCNC1 34a_100016987287_100000742370 [1,0,0,1,0,0|2,0,0]=4 17908 B14R1.730 COC(=O)CCOCCC1CCOC1 34a_100011879284_100000742370 [1,0,0,1,0,0|2,0,0]=4 17909 B14R1.730 COC(=O)CCSCCC1CCCC1 62a_100000204255_100000760354 [1,0,0,1,0,0|1,0,0]=3 17910 B14R1.730 COC(=O)CCSCCC1CCCC1 62a_100000760354_100000204255 [1,0,0,1,0,0|1,0,0]=3 17911 B14R1.730 COC(=O)CCSCCN1CCCC1 62a_100000204255_100000004467 [1,0,0,1,0,0|2,0,0]=4 17912 B14R1.730 COC(=O)CCSCCN1CCCC1 62a_100000700749_100000204255 [1,0,0,1,0,0|2,0,0]=4 17913 B14R1.730 COC(=O)CNCCCC1CCCC1 2230a_100000736752_100000747449 [1,0,0,1,0,0|1,0,0]=3 17914 B14R1.730 COC(=O)CNCCCC1CCCC1 34a_100000736752_100000747449 [1,0,0,1,0,0|1,0,0]=3 17915 B14R1.730 COC(=O)CNCCOC1CCCC1 34a_100000741755_100000747449 [1,0,0,1,0,0|2,0,0]=4 17916 B14R1.730 COC(=O)COCCCC1CCCC1 34a_100011215328_100000747449 [1,0,0,1,0,0|1,0,0]=3 17917 B14R1.730 COC(=O)COCCCC1CCCC1 7a_100011215328_100000747449 [1,0,0,1,0,0|1,0,0]=3 17918 B14R1.730 COC(=O)COCCNC1CCCC1 2230a_100000211070_100000090808 [1,0,0,1,0,0|2,0,0]=4 17919 B14R1.730 COC(=O)COCCNC1CCCC1 34a_100000211070_100000090808 [1,0,0,1,0,0|2,0,0]=4 17920 B14R1.730 COC(=O)COCCNC1CCCC1 34a_200000200444_100000747449 [1,0,0,1,0,0|2,0,0]=4 17921 B14R1.730 COC(=O)COCCOC1CCCC1 34a_100000210269_100000090808 [1,0,0,1,0,0|2,0,0]=4 17922 B14R1.730 COC(=O)COCCOC1CCCC1 34a_100000738311_100000747449 [1,0,0,1,0,0|2,0,0]=4 17923 B14R1.730 COC(=O)COCCOC1CCCC1 7a_100000210269_100000090808 [1,0,0,1,0,0|2,0,0]=4 17924 B14R1.730 COC(=O)COCCOC1CCCC1 7a_100000738311_100000747449 [1,0,0,1,0,0|2,0,0]=4 17925 B14R1.730 COC(=O)COCCSC1CCCC1 62a_100000090808_100000179811 [1,0,0,1,0,0|2,0,0]=4 17926 B14R1.730 COC(=O)COCCSC1CCCC1 62a_100011217020_100000090808 [1,0,0,1,0,0|2,0,0]=4 17927 B14R1.730 COC(=O)CSCCCC1CCCC1 62a_100000747449_100011713738 [1,0,0,1,0,0|1,0,0]=3 17928 B14R1.730 COC(=O)CSCCCC1CCCC1 62a_100011713738_100000747449 [1,0,0,1,0,0|1,0,0]=3 17929 B14R1.730 COC(=O)CSCCCN1CCCC1 62a_100000747449_100011445909 [1,0,0,1,0,0|2,0,0]=4 17930 B14R1.730 COC(=O)CSCCCN1CCCC1 62a_100016991639_100000747449 [1,0,0,1,0,0|2,0,0]=4 17931 B14R1.730 COC(=O)NCCOCC1CCCC1 34a_100000757965_100000740388 [1,0,0,1,0,0|2,0,0]=4 17932 B14R1.730 COC(=O)OCCOCC1CCCC1 34a_100010262106_100000740388 [1,0,0,1,0,0|2,0,0]=4 17933 B14R1.730 COC(=O)OCSCCC1CCCC1 62a_100000760354_100000139417 [1,0,0,1,0,0|2,0,0]=4 17934 B14R1.789 CCC(=O)N1CCCCC1CCCO 240690a_100011934581_100000210414 [1,0,0,1,0,0|2,0,0]=4 17935 B14R1.789 CCC(=O)N1CCCCC1CCOC 11a_100015186528_100000210414 [1,0,0,1,0,0|2,0,0]=4 17936 B14R1.789 CCC(=O)N1CCCCC1CCOC 1626a_100015186528_100000210414 [1,0,0,1,0,0|2,0,0]=4 17937 B14R1.789 CCC(=O)N1CCCCC1CCOC 240690a_100015186528_100000210414 [1,0,0,1,0,0|2,0,0]=4 17938 B14R1.789 CCC(=O)N1CCCCC1CCOC 527a_100015186528_100000210414 [1,0,0,1,0,0|2,0,0]=4 17939 B14R1.789 CCCCN1CCCCC1C(=O)NC 2230a_100011209383_100000210211 [1,0,0,1,0,0|2,0,0]=4 17940 B14R1.789 CCCCN1CCCCC1C(=O)NC 269982a_100011209383_100000210211 [1,0,0,1,0,0|2,0,0]=4 17941 B14R1.789 CCCCN1CCCCC1C(=O)NC 34a_100011209383_100000210210 [1,0,0,1,0,0|2,0,0]=4 17942 B14R1.789 CCCCN1CCCCC1C(=O)OC 2230a_100000734855_100000210211 [1,0,0,1,0,0|1,0,0]=3 17943 B14R1.789 CCCCN1CCCCC1C(=O)OC 269982a_100000734855_100000210211 [1,0,0,1,0,0|1,0,0]=3 17944 B14R1.789 CCCCN1CCCCC1C(=O)OC 34a_100000734855_100000210210 [1,0,0,1,0,0|1,0,0]=3 17945 B14R1.789 CCCCN1CCOCC1C(=O)OC 2230a_100000765174_100000210211 [1,0,0,1,0,0|2,0,0]=4 17946 B14R1.789 CCCCN1CCOCC1C(=O)OC 34a_100000765174_100000210210 [1,0,0,1,0,0|2,0,0]=4 17947 B14R1.789 CCCOC1CCNCC1C(=O)OC 34a_200103168510_100000210303 [1,0,0,1,0,0|2,0,0]=4 17948 B14R1.789 CCCO[C@H]1CCCC[C@H]1C(=O)OC 34a_100015709673_100000210303 [1,0,0,1,0,0|1,0,0]=3 17949 B14R1.789 CCCO[C@H]1CCCC[C@H]1C(=O)OC 7a_100015709673_100000210303 [1,0,0,1,0,0|1,0,0]=3 17950 B14R1.789 CCOCN1CCCCC1C(=O)OC 269982a_100000734855_100000739092 [1,0,0,1,0,0|2,0,0]=4 17951 B14R1.789 COC(=O)C1CCCCN1CCCF 2230a_100000734855_100011934791 [1,0,0,1,0,0|2,0,0]=4 17952 B14R1.789 COC(=O)C1CCCCN1CCCF 269982a_100000734855_100011934791 [1,0,0,1,0,0|2,0,0]=4 17953 B14R1.789 COC(=O)C1CCCCN1CCCF 34a_100000734855_100011934791 [1,0,0,1,0,0|2,0,0]=4 17954 B14R1.789 COC(=O)C1CCCCN1CCCO 2230a_100000734855_100000230001 [1,0,0,1,0,0|2,0,0]=4 17955 B14R1.789 COC(=O)C1CCCCN1CCCO 269982a_100000734855_100011215043 [1,0,0,1,0,0|2,0,0]=4 17956 B14R1.789 COC(=O)C1CCCCN1CCCO 34a_100000734855_100000230001 [1,0,0,1,0,0|2,0,0]=4 17957 B14R1.789 COC(=O)C1CCCCN1CCSC 2230a_100000734855_100000751147 [1,0,0,1,0,0|2,0,0]=4 17958 B14R1.789 COC(=O)C1CCCCN1CCSC 269982a_100000734855_100000212216 [1,0,0,1,0,0|2,0,0]=4 17959 B14R1.789 COC(=O)C1CCCCN1CCSC 34a_100000734855_100000212216 [1,0,0,1,0,0|2,0,0]=4 17960 B14R1.789 COC(=O)[C@@H]1CCCC[C@@H]1OCCF 34a_100015709673_100011217306 [1,0,0,1,0,0|2,0,0]=4 17961 B14R1.789 COC(=O)[C@@H]1CCCC[C@@H]1OCCF 7a_100015709673_100011217306 [1,0,0,1,0,0|2,0,0]=4 17962 B14R1.789 COC(=O)[C@@H]1CCCC[C@@H]1OCCO 34a_100015709673_100000211926 [1,0,0,1,0,0|2,0,0]=4 17963 B14R1.789 COC(=O)[C@@H]1CCCC[C@@H]1OCCO 7a_100015709673_100000211926 [1,0,0,1,0,0|2,0,0]=4 17964 B14R1.789 COC(=O)[C@@H]1CCCC[C@@H]1OCSC 34a_100015709673_100011218213 [1,0,0,1,0,0|2,0,0]=4 17965 B14R1.789 COCCN1CCCCC1C(=O)OC 2230a_100000734855_100011201679 [1,0,0,1,0,0|2,0,0]=4 17966 B14R1.789 COCCN1CCCCC1C(=O)OC 269982a_100000734855_100000233755 [1,0,0,1,0,0|2,0,0]=4 17967 B14R1.789 COCCN1CCCCC1C(=O)OC 34a_100000734855_100011201679 [1,0,0,1,0,0|2,0,0]=4 17968 B14R1.800 CCCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100000210211 [1,0,0,1,0,0|1,0,0]=3 17969 B14R1.800 CCCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000210211 [1,0,0,1,0,0|1,0,0]=3 17970 B14R1.800 CCCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100000210210 [1,0,0,1,0,0|1,0,0]=3 17971 B14R1.800 CCOCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000739092 [1,0,0,1,0,0|2,0,0]=4 17972 B14R1.800 COC(=O)C[C@H]1CCCN1CCCF 2230a_100025726698_100011934791 [1,0,0,1,0,0|2,0,0]=4 17973 B14R1.800 COC(=O)C[C@H]1CCCN1CCCF 269982a_100025726698_100011934791 [1,0,0,1,0,0|2,0,0]=4 17974 B14R1.800 COC(=O)C[C@H]1CCCN1CCCF 34a_100025726698_100011934791 [1,0,0,1,0,0|2,0,0]=4 17975 B14R1.800 COC(=O)C[C@H]1CCCN1CCCO 2230a_100025726698_100000230001 [1,0,0,1,0,0|2,0,0]=4 17976 B14R1.800 COC(=O)C[C@H]1CCCN1CCCO 269982a_100025726698_100011215043 [1,0,0,1,0,0|2,0,0]=4 17977 B14R1.800 COC(=O)C[C@H]1CCCN1CCCO 34a_100025726698_100000230001 [1,0,0,1,0,0|2,0,0]=4 17978 B14R1.800 COC(=O)C[C@H]1CCCN1CCSC 2230a_100025726698_100000751147 [1,0,0,1,0,0|2,0,0]=4 17979 B14R1.800 COC(=O)C[C@H]1CCCN1CCSC 269982a_100025726698_100000212216 [1,0,0,1,0,0|2,0,0]=4 17980 B14R1.800 COC(=O)C[C@H]1CCCN1CCSC 34a_100025726698_100000212216 [1,0,0,1,0,0|2,0,0]=4 17981 B14R1.800 COCCN1CCC[C@@H]1CC(=O)OC 2230a_100025726698_100011201679 [1,0,0,1,0,0|2,0,0]=4 17982 B14R1.800 COCCN1CCC[C@@H]1CC(=O)OC 269982a_100025726698_100000233755 [1,0,0,1,0,0|2,0,0]=4 17983 B14R1.800 COCCN1CCC[C@@H]1CC(=O)OC 34a_100025726698_100011201679 [1,0,0,1,0,0|2,0,0]=4 17984 B14R1.819 CCC(=O)COCCC1CCCN1C 34a_100000725409_100000005710 [1,0,0,1,0,0|2,0,0]=4 17985 B14R1.819 CCC(=O)COCCC1CCCN1C 7a_100011215177_100000747405 [1,0,0,1,0,0|2,0,0]=4 17986 B14R1.819 CCC(=O)CSCCC1CCCN1C 62a_100000005710_100000747405 [1,0,0,1,0,0|2,0,0]=4 17987 B14R1.819 CCC(=O)CSCCC1CCCN1C 62a_100000747405_100000005710 [1,0,0,1,0,0|2,0,0]=4 17988 B14R1.819 CCC(=O)NCCNC1CCCC1C 269862a_100132302217_100000752053 [1,0,0,1,0,0|2,0,0]=4 17989 B14R1.819 CNC(=O)CCCNC1CCCC1C 269862a_100000740002_100000752053 [1,0,0,1,0,0|2,0,0]=4 17990 B14R1.819 CNC(=O)CCCOC1CCCC1C 34a_100011216460_100000741757 [1,0,0,1,0,0|2,0,0]=4 17991 B14R1.819 CNC(=O)CCCOC1CCCC1C 7a_100011216460_100000741757 [1,0,0,1,0,0|2,0,0]=4 17992 B14R1.819 COC(=O)CCCCN1CCC[C@@H]1C 2230a_100020605311_100000204269 [1,0,0,1,0,0|1,0,0]=3 17993 B14R1.819 COC(=O)CCCCN1CCC[C@@H]1C 269982a_100020605311_100000204269 [1,0,0,1,0,0|1,0,0]=3 17994 B14R1.819 COC(=O)CCCCN1CCC[C@H]1C 2230a_100015189458_100000204269 [1,0,0,1,0,0|1,0,0]=3 17995 B14R1.819 COC(=O)CCCCN1CCC[C@H]1C 269982a_100015189458_100000204269 [1,0,0,1,0,0|1,0,0]=3 17996 B14R1.819 COC(=O)CCCCN1CCC[C@H]1C 34a_100015189458_100000204269 [1,0,0,1,0,0|1,0,0]=3 17997 B14R1.819 COC(=O)CCCCN1CCSC1C 2230a_200011216479_100000204269 [1,0,0,1,0,0|2,0,0]=4 17998 B14R1.819 COC(=O)CCCCN1CCSC1C 269982a_200011216479_100000204269 [1,0,0,1,0,0|2,0,0]=4 17999 B14R1.819 COC(=O)CCCCN1CCSC1C 34a_200011216479_100000204269 [1,0,0,1,0,0|2,0,0]=4 18000 B14R1.819 COC(=O)CCCOC1CCCC1C 34a_100011216460_100000742333 [1,0,0,1,0,0|1,0,0]=3 18001 B14R1.819 COC(=O)CCCOC1CCCC1C 7a_100011216460_100011218270 [1,0,0,1,0,0|1,0,0]=3 18002 B14R1.819 COC(=O)CCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000742333 [1,0,0,1,0,0|2,0,0]=4 18003 B14R1.819 COC(=O)CCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000742333 [1,0,0,1,0,0|2,0,0]=4 18004 B14R1.819 COC(=O)CCCO[C@H]1CNC[C@H]1C 34a_200015306588_100000742333 [1,0,0,1,0,0|2,0,0]=4 18005 B14R1.819 COC(=O)CCCS[C@@H]1CCC[C@H]1O 62a_100011218270_200016002552 [1,0,0,1,0,0|2,0,0]=4 18006 B14R1.819 COC(=O)CCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100011218270 [1,0,0,1,0,0|2,0,0]=4 18007 B14R1.819 COC(=O)CCOCC1CCCN1C 34a_100000743107_100000742370 [1,0,0,1,0,0|2,0,0]=4 18008 B14R1.819 COC(=O)COCCC1CCCN1C 34a_100011215177_100000747449 [1,0,0,1,0,0|2,0,0]=4 18009 B14R1.819 COC(=O)COCCC1CCCN1C 7a_100011215177_100000747449 [1,0,0,1,0,0|2,0,0]=4 18010 B14R1.819 COC(=O)COCCN1CCC[C@@H]1C 2230a_100020605311_100000090808 [1,0,0,1,0,0|2,0,0]=4 18011 B14R1.819 COC(=O)COCCN1CCC[C@H]1C 2230a_100015189458_100000090808 [1,0,0,1,0,0|2,0,0]=4 18012 B14R1.819 COC(=O)COCCN1CCC[C@H]1C 34a_100015189458_100000090808 [1,0,0,1,0,0|2,0,0]=4 18013 B14R1.819 COC(=O)CSCCC1CCCN1C 62a_100000005710_100000747449 [1,0,0,1,0,0|2,0,0]=4 18014 B14R1.819 COC(=O)CSCCC1CCCN1C 62a_100000747449_100000005710 [1,0,0,1,0,0|2,0,0]=4 18015 B14R1.822 COC(=O)CCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100009816466 [1,0,0,1,0,0|2,0,0]=4 18016 B14R1.822 COC(=O)CCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100009816466 [1,0,0,1,0,0|2,0,0]=4 18017 B14R1.822 COC(=O)CCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100009816466 [1,0,0,1,0,0|2,0,0]=4 18018 B14R1.822 COC(=O)CCCCOCC1CC1C 34a_100000744939_100000204269 [1,0,0,1,0,0|1,0,0]=3 18019 B14R1.822 COC(=O)CCCCOCC1CC1C 7a_100000744939_100000204269 [1,0,0,1,0,0|1,0,0]=3 18020 B14R1.822 COC(=O)COCCOCC1CC1C 34a_100000744939_100000090808 [1,0,0,1,0,0|2,0,0]=4 18021 B14R1.822 COC(=O)COCCOCC1CC1C 7a_100000744939_100000090808 [1,0,0,1,0,0|2,0,0]=4 18022 B14R1.823 COC(=O)CCCCCCN1CCC1 269982a_100000754969_100009815986 [1,0,0,1,0,0|1,0,0]=3 18023 B14R1.823 COC(=O)CCCCCNC1CCC1 2230a_100000749019_100009816466 [1,0,0,1,0,0|1,0,0]=3 18024 B14R1.823 COC(=O)CCCCCNC1CCC1 34a_100000749019_100009816466 [1,0,0,1,0,0|1,0,0]=3 18025 B14R1.823 COC(=O)CCCCCNC1COC1 2230a_100016991112_100009816466 [1,0,0,1,0,0|2,0,0]=4 18026 B14R1.823 COC(=O)CCCCCOC1CCC1 34a_100000074720_100000749161 [1,0,0,1,0,0|1,0,0]=3 18027 B14R1.823 COC(=O)CCCCCOC1CCC1 34a_100000748187_100009816466 [1,0,0,1,0,0|1,0,0]=3 18028 B14R1.823 COC(=O)CCCCCOC1COC1 34a_100000074720_100009818527 [1,0,0,1,0,0|2,0,0]=4 18029 B14R1.823 COC(=O)CCCCCOC1COC1 7a_100000074720_100009818527 [1,0,0,1,0,0|2,0,0]=4 18030 B14R1.823 COC(=O)CCCCCOC1CSC1 7a_100000072292_100009816466 [1,0,0,1,0,0|2,0,0]=4 18031 B14R1.823 COC(=O)CCCCCSC1CCC1 62a_100009816466_100000749161 [1,0,0,1,0,0|1,0,0]=3 18032 B14R1.823 COC(=O)CCCCCSC1COC1 62a_100009816466_100009818527 [1,0,0,1,0,0|2,0,0]=4 18033 B14R1.823 COC(=O)CCCCNCC1CCC1 2230a_100000738700_100000204269 [1,0,0,1,0,0|1,0,0]=3 18034 B14R1.823 COC(=O)CCCCNCC1CCC1 34a_100000738700_100000204269 [1,0,0,1,0,0|1,0,0]=3 18035 B14R1.823 COC(=O)CCCCNCC1COC1 2230a_100015281925_100000204269 [1,0,0,1,0,0|2,0,0]=4 18036 B14R1.823 COC(=O)CCCCNCC1COC1 34a_100015281925_100000204269 [1,0,0,1,0,0|2,0,0]=4 18037 B14R1.823 COC(=O)CCCCNC[C@@H]1CCO1 2230a_100020831831_100000204269 [1,0,0,1,0,0|2,0,0]=4 18038 B14R1.823 COC(=O)CCCCNC[C@@H]1CCO1 34a_100020831831_100000204269 [1,0,0,1,0,0|2,0,0]=4 18039 B14R1.823 COC(=O)CCCCOCC1CCC1 34a_100000059025_100000763275 [1,0,0,1,0,0|1,0,0]=3 18040 B14R1.823 COC(=O)CCCCOCC1CCC1 34a_100000760304_100000204269 [1,0,0,1,0,0|1,0,0]=3 18041 B14R1.823 COC(=O)CCCCOCC1CCC1 7a_100000059025_100000763275 [1,0,0,1,0,0|1,0,0]=3 18042 B14R1.823 COC(=O)CCCCOCC1CCO1 34a_100000039022_100000204269 [1,0,0,1,0,0|2,0,0]=4 18043 B14R1.823 COC(=O)CCCCOCC1CCO1 34a_100000059025_100000103362 [1,0,0,1,0,0|2,0,0]=4 18044 B14R1.823 COC(=O)CCCCOCC1CCO1 7a_100000059025_100000103362 [1,0,0,1,0,0|2,0,0]=4 18045 B14R1.823 COC(=O)CCCCOCC1CNC1 34a_100016987283_100000204269 [1,0,0,1,0,0|2,0,0]=4 18046 B14R1.823 COC(=O)CCCCOCC1COC1 34a_100000059025_100010264016 [1,0,0,1,0,0|2,0,0]=4 18047 B14R1.823 COC(=O)CCCCOCC1COC1 34a_100000060846_100000204269 [1,0,0,1,0,0|2,0,0]=4 18048 B14R1.823 COC(=O)CCCCOCC1COC1 7a_100000059025_100010264016 [1,0,0,1,0,0|2,0,0]=4 18049 B14R1.823 COC(=O)CCCCSCC1CCC1 62a_100000204269_100000763275 [1,0,0,1,0,0|1,0,0]=3 18050 B14R1.823 COC(=O)CCCCSCC1CCC1 62a_100000763275_100000204269 [1,0,0,1,0,0|1,0,0]=3 18051 B14R1.823 COC(=O)CCCCSCC1CCO1 62a_100000103362_100000204269 [1,0,0,1,0,0|2,0,0]=4 18052 B14R1.823 COC(=O)CCCCSCC1CCO1 62a_100000204269_100000103362 [1,0,0,1,0,0|2,0,0]=4 18053 B14R1.823 COC(=O)CCCCSCC1COC1 62a_100000204269_100010264016 [1,0,0,1,0,0|2,0,0]=4 18054 B14R1.823 COC(=O)CCCCSCC1COC1 62a_100010264016_100000204269 [1,0,0,1,0,0|2,0,0]=4 18055 B14R1.823 COC(=O)CCCOCCC1COC1 34a_100009855314_100000742333 [1,0,0,1,0,0|2,0,0]=4 18056 B14R1.823 COC(=O)COCCNCC1CCC1 2230a_100000738700_100000090808 [1,0,0,1,0,0|2,0,0]=4 18057 B14R1.823 COC(=O)COCCNCC1CCC1 34a_100000738700_100000090808 [1,0,0,1,0,0|2,0,0]=4 18058 B14R1.823 COC(=O)COCCOCC1CCC1 34a_100000760304_100000090808 [1,0,0,1,0,0|2,0,0]=4 18059 B14R1.823 COC(=O)COCCSCC1CCC1 62a_100000090808_100000763275 [1,0,0,1,0,0|2,0,0]=4 18060 B14R1.823 COC(=O)COCCSCC1CCC1 62a_100000763275_100000090808 [1,0,0,1,0,0|2,0,0]=4 18061 B14R1.827 COC(=O)CCCCCCNC1CC1 34a_100000212008_100009815986 [1,0,0,1,0,0|1,0,0]=3 18062 B14R1.827 COC(=O)CCCCCCOC1CC1 34a_100009863599_100000211595 [1,0,0,1,0,0|1,0,0]=3 18063 B14R1.827 COC(=O)CCCCCCSC1CC1 62a_100009815986_100000211595 [1,0,0,1,0,0|1,0,0]=3 18064 B14R1.827 COC(=O)CCCCCNCC1CC1 2230a_100000735609_100009816466 [1,0,0,1,0,0|1,0,0]=3 18065 B14R1.827 COC(=O)CCCCCNCC1CC1 34a_100000735609_100009816466 [1,0,0,1,0,0|1,0,0]=3 18066 B14R1.827 COC(=O)CCCCCOCC1CC1 34a_100000074720_100000742324 [1,0,0,1,0,0|1,0,0]=3 18067 B14R1.827 COC(=O)CCCCCOCC1CC1 34a_100000211283_100009816466 [1,0,0,1,0,0|1,0,0]=3 18068 B14R1.827 COC(=O)CCCCCOCC1CC1 7a_100000074720_100000742324 [1,0,0,1,0,0|1,0,0]=3 18069 B14R1.827 COC(=O)CCCCCOCC1CO1 34a_100000074720_102125554688 [1,0,0,1,0,0|2,0,0]=4 18070 B14R1.827 COC(=O)CCCCCOCC1CO1 7a_100000074720_102125554688 [1,0,0,1,0,0|2,0,0]=4 18071 B14R1.827 COC(=O)CCCCCOCC1CS1 7a_100000074720_100000031435 [1,0,0,1,0,0|2,0,0]=4 18072 B14R1.827 COC(=O)CCCCCOC[C@@H]1CO1 34a_100000757423_100009816466 [1,0,0,1,0,0|2,0,0]=4 18073 B14R1.827 COC(=O)CCCCCOC[C@@H]1CO1 7a_100000074720_100000745022 [1,0,0,1,0,0|2,0,0]=4 18074 B14R1.827 COC(=O)CCCCCSCC1CC1 62a_100000756562_100009816466 [1,0,0,1,0,0|1,0,0]=3 18075 B14R1.827 COC(=O)CCCCCSCC1CC1 62a_100009816466_100000742324 [1,0,0,1,0,0|1,0,0]=3 18076 B14R1.827 COC(=O)CCCCCSCC1CO1 62a_100009816466_102125554688 [1,0,0,1,0,0|2,0,0]=4 18077 B14R1.827 COC(=O)CCCCCSCC1CO1 62a_102125554688_100009816466 [1,0,0,1,0,0|2,0,0]=4 18078 B14R1.827 COC(=O)CCCCCSCC1CS1 62a_100000031435_100009816466 [1,0,0,1,0,0|2,0,0]=4 18079 B14R1.827 COC(=O)CCCCCSCC1CS1 62a_100009816466_100000031435 [1,0,0,1,0,0|2,0,0]=4 18080 B14R1.827 COC(=O)CCCCCSC[C@@H]1CO1 62a_100000745022_100009816466 [1,0,0,1,0,0|2,0,0]=4 18081 B14R1.827 COC(=O)CCCCCSC[C@@H]1CO1 62a_100009816466_100000745022 [1,0,0,1,0,0|2,0,0]=4 18082 B14R1.827 COC(=O)CCCCNCCC1CC1 34a_100000764129_100000204269 [1,0,0,1,0,0|1,0,0]=3 18083 B14R1.827 COC(=O)CCCCOCCC1CC1 34a_100000059025_100000694398 [1,0,0,1,0,0|1,0,0]=3 18084 B14R1.827 COC(=O)CCCCOCCC1CC1 34a_100000754188_100000204269 [1,0,0,1,0,0|1,0,0]=3 18085 B14R1.827 COC(=O)CCCCOCCC1CC1 7a_100000059025_100000764125 [1,0,0,1,0,0|1,0,0]=3 18086 B14R1.827 COC(=O)CCCCOCCC1CC1 7a_100000754188_100000204269 [1,0,0,1,0,0|1,0,0]=3 18087 B14R1.827 COC(=O)CCCCOCCC1CO1 34a_100000059025_100000732470 [1,0,0,1,0,0|2,0,0]=4 18088 B14R1.827 COC(=O)CCCCOCCC1CO1 7a_100000059025_100000732470 [1,0,0,1,0,0|2,0,0]=4 18089 B14R1.827 COC(=O)CCCCOCC[C@@H]1CO1 34a_100009820653_100000204269 [1,0,0,1,0,0|2,0,0]=4 18090 B14R1.827 COC(=O)CCCCSCCC1CC1 62a_100000204269_100000764125 [1,0,0,1,0,0|1,0,0]=3 18091 B14R1.827 COC(=O)CCCCSCCC1CC1 62a_100000764125_100000204269 [1,0,0,1,0,0|1,0,0]=3 18092 B14R1.827 COC(=O)CCCCSCCC1CO1 62a_100000204269_100000732470 [1,0,0,1,0,0|2,0,0]=4 18093 B14R1.827 COC(=O)CCCCSCCC1CO1 62a_100000732470_100000204269 [1,0,0,1,0,0|2,0,0]=4 18094 B14R1.827 COC(=O)CCCOCCNC1CC1 34a_100000738766_100000742333 [1,0,0,1,0,0|2,0,0]=4 18095 B14R1.827 COC(=O)CCCSCCCC1CO1 62a_100000733510_100011218270 [1,0,0,1,0,0|2,0,0]=4 18096 B14R1.827 COC(=O)CCCSCCCC1CO1 62a_100011218270_100000733510 [1,0,0,1,0,0|2,0,0]=4 18097 B14R1.827 COC(=O)COCCNCCC1CC1 34a_100000764129_100000090808 [1,0,0,1,0,0|2,0,0]=4 18098 B14R1.827 COC(=O)COCCOCCC1CC1 34a_100000754188_100000090808 [1,0,0,1,0,0|2,0,0]=4 18099 B14R1.827 COC(=O)COCCOCCC1CC1 7a_100000754188_100000090808 [1,0,0,1,0,0|2,0,0]=4 18100 B14R1.827 COC(=O)COCCSCCC1CC1 62a_100000090808_100000764125 [1,0,0,1,0,0|2,0,0]=4 18101 B14R1.827 COC(=O)COCCSCCC1CC1 62a_100000764125_100000090808 [1,0,0,1,0,0|2,0,0]=4 18102 B14R1.831 COC(=O)CCCCCN1CCC1C 269982a_100000755817_100009816466 [1,0,0,1,0,0|1,0,0]=3 18103 B14R1.831 COC(=O)CCCCCN1CCC1C 34a_100000755817_100009816466 [1,0,0,1,0,0|1,0,0]=3 18104 B14R1.837 CCC(=O)COCC1CCCCN1C 34a_100000725409_100015186950 [1,0,0,1,0,0|2,0,0]=4 18105 B14R1.837 CCC(=O)CSCC1CCCCN1C 62a_100000747405_100015185383 [1,0,0,1,0,0|2,0,0]=4 18106 B14R1.837 CCC(=O)CSCC1CCCCN1C 62a_100015185383_100000747405 [1,0,0,1,0,0|2,0,0]=4 18107 B14R1.837 CCC(=O)NCCN1CCCCC1C 240690a_100000739827_100000210414 [1,0,0,1,0,0|2,0,0]=4 18108 B14R1.837 CCC(=O)NCCN1CCCCC1C 527a_100000739827_100000210414 [1,0,0,1,0,0|2,0,0]=4 18109 B14R1.837 CNC(=O)CCCN1CCCCC1C 2230a_100000211376_100000741757 [1,0,0,1,0,0|2,0,0]=4 18110 B14R1.837 CNC(=O)CCCN1CCCCC1C 269982a_100000211376_100000741757 [1,0,0,1,0,0|2,0,0]=4 18111 B14R1.837 CNC(=O)CCCN1CCCCC1C 34a_100000211376_100000741757 [1,0,0,1,0,0|2,0,0]=4 18112 B14R1.837 CNC(=O)CCNC1CCCCC1C 2230a_100000211402_100000737683 [1,0,0,1,0,0|2,0,0]=4 18113 B14R1.837 CNC(=O)CCNC1CCCCC1C 269862a_100000738227_100000210921 [1,0,0,1,0,0|2,0,0]=4 18114 B14R1.837 CNC(=O)CCNC1CCCCC1C 270004a_100000738227_100000210921 [1,0,0,1,0,0|2,0,0]=4 18115 B14R1.837 CNC(=O)CCNC1CCCCC1C 34a_100000211402_100012179268 [1,0,0,1,0,0|2,0,0]=4 18116 B14R1.837 CNC(=O)CCOC1CCCCC1C 34a_100000211207_100012179268 [1,0,0,1,0,0|2,0,0]=4 18117 B14R1.837 CNC(=O)CCOC1CCCCC1C 7a_100000211207_100000737683 [1,0,0,1,0,0|2,0,0]=4 18118 B14R1.837 COC(=O)CCCN1CCCCC1C 2230a_100000211376_100011218270 [1,0,0,1,0,0|1,0,0]=3 18119 B14R1.837 COC(=O)CCCN1CCCCC1C 269982a_100000211376_100011218270 [1,0,0,1,0,0|1,0,0]=3 18120 B14R1.837 COC(=O)CCCN1CCCCC1C 34a_100000211376_100000742333 [1,0,0,1,0,0|1,0,0]=3 18121 B14R1.837 COC(=O)CCCN1CCOC[C@@H]1C 2230a_100009815349_100011218270 [1,0,0,1,0,0|2,0,0]=4 18122 B14R1.837 COC(=O)CCCN1CCOC[C@@H]1C 269982a_100009815349_100011218270 [1,0,0,1,0,0|2,0,0]=4 18123 B14R1.837 COC(=O)CCCN1CCOC[C@@H]1C 34a_100009815349_100000742333 [1,0,0,1,0,0|2,0,0]=4 18124 B14R1.837 COC(=O)CCNC1CCCCC1C 2230a_100000211402_100000204255 [1,0,0,1,0,0|1,0,0]=3 18125 B14R1.837 COC(=O)CCNC1CCCCC1C 34a_100000211402_100000742370 [1,0,0,1,0,0|1,0,0]=3 18126 B14R1.837 COC(=O)CCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000204255 [1,0,0,1,0,0|2,0,0]=4 18127 B14R1.837 COC(=O)CCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000742370 [1,0,0,1,0,0|2,0,0]=4 18128 B14R1.837 COC(=O)CCOC1CCCCC1C 34a_100000211207_100000742370 [1,0,0,1,0,0|1,0,0]=3 18129 B14R1.837 COC(=O)CCOC1CCCCC1C 7a_100000211207_100000204255 [1,0,0,1,0,0|1,0,0]=3 18130 B14R1.837 COC(=O)CCOC1CCCCC1Cl 34a_100000038908_100000742370 [1,0,0,1,0,0|2,0,0]=4 18131 B14R1.837 COC(=O)CCOC1CCCCC1Cl 7a_100000038908_100000204255 [1,0,0,1,0,0|2,0,0]=4 18132 B14R1.837 COC(=O)CCOC1CCNCC1C 34a_100011998114_100000742370 [1,0,0,1,0,0|2,0,0]=4 18133 B14R1.837 COC(=O)CCOC1CNCCC1C 34a_100000696640_100000742370 [1,0,0,1,0,0|2,0,0]=4 18134 B14R1.837 COC(=O)CCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000742370 [1,0,0,1,0,0|2,0,0]=4 18135 B14R1.837 COC(=O)CCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000204255 [1,0,0,1,0,0|2,0,0]=4 18136 B14R1.837 COC(=O)CCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000742370 [1,0,0,1,0,0|2,0,0]=4 18137 B14R1.837 COC(=O)CCSC1CCCCC1F 62a_100000204255_100015423560 [1,0,0,1,0,0|2,0,0]=4 18138 B14R1.837 COC(=O)CCSC1CCCCC1F 62a_100015423560_100000204255 [1,0,0,1,0,0|2,0,0]=4 18139 B14R1.837 COC(=O)CCSC1CCCCC1O 62a_100000038908_100000204255 [1,0,0,1,0,0|2,0,0]=4 18140 B14R1.837 COC(=O)CCSC1CCCCC1O 62a_100000204255_100000038908 [1,0,0,1,0,0|2,0,0]=4 18141 B14R1.837 COC(=O)CNCC1CCCCC1O 34a_100011216029_100000747449 [1,0,0,1,0,0|2,0,0]=4 18142 B14R1.837 COC(=O)CNCC1CCCCN1C 34a_100011228421_100000747449 [1,0,0,1,0,0|2,0,0]=4 18143 B14R1.837 COC(=O)COCC1CCCCN1C 34a_100000225079_100000747449 [1,0,0,1,0,0|2,0,0]=4 18144 B14R1.837 COC(=O)CSCC1CCCCN1C 62a_100000747449_100015185383 [1,0,0,1,0,0|2,0,0]=4 18145 B14R1.837 COC(=O)CSCC1CCCCN1C 62a_100015185383_100000747449 [1,0,0,1,0,0|2,0,0]=4 18146 B14R1.845 COC1CCCCCCCCCCC1 34a_100000211378_200000210301 [1,0,0,1,0,0|1,0,1]=4 18147 B14R1.845 COC1CCCCCCCCCCC1 7a_100000211378_200000210301 [1,0,0,1,0,0|1,0,1]=4 18148 B14R1.845 [13CH3]OC1CCCCCCCCCCC1 34a_100000211378_200025704644 [1,0,0,1,0,0|1,0,1]=4 18149 B14R1.845 [13CH3]OC1CCCCCCCCCCC1 7a_100000211378_200025704644 [1,0,0,1,0,0|1,0,1]=4 18150 B14R1.863 CCC(=O)COC1CCCCC1CC 7a_100000210738_100000747405 [1,0,0,1,0,0|1,0,0]=3 18151 B14R1.863 CCC(=O)CO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000747405 [1,0,0,1,0,0|2,0,0]=4 18152 B14R1.863 CCC(=O)NCC1CCCCN1CC 11a_100000754393_100000210414 [1,0,0,1,0,0|2,0,0]=4 18153 B14R1.863 CCC(=O)NCC1CCCCN1CC 1626a_100000754393_100000210414 [1,0,0,1,0,0|2,0,0]=4 18154 B14R1.863 CCC(=O)NCC1CCCCN1CC 240690a_100000754393_100000210414 [1,0,0,1,0,0|2,0,0]=4 18155 B14R1.863 CCC(=O)NCC1CCCCN1CC 527a_100000754393_100000210414 [1,0,0,1,0,0|2,0,0]=4 18156 B14R1.863 CCC1CCCCC1NCC(=O)NC 269862a_100000693194_100000757040 [1,0,0,1,0,0|2,0,0]=4 18157 B14R1.863 CCC1CCCCC1NCC(=O)NC 270004a_100000693194_100000757040 [1,0,0,1,0,0|2,0,0]=4 18158 B14R1.863 CCC1CCCCC1OCC(=O)NC 34a_100000210738_100000183359 [1,0,0,1,0,0|2,0,0]=4 18159 B14R1.863 CCC1CCCCC1OCC(=O)NC 7a_100000210738_100000183359 [1,0,0,1,0,0|2,0,0]=4 18160 B14R1.863 CCC1CCCCC1OCC(=O)OC 34a_100000210738_100000747449 [1,0,0,1,0,0|1,0,0]=3 18161 B14R1.863 CCC1CCCCC1OCC(=O)OC 7a_100000210738_100000747449 [1,0,0,1,0,0|1,0,0]=3 18162 B14R1.863 CCC1CCCCN1CCC(=O)NC 2230a_100000210034_100000737683 [1,0,0,1,0,0|2,0,0]=4 18163 B14R1.863 CCC1CCCCN1CCC(=O)NC 269982a_100000210034_100000737683 [1,0,0,1,0,0|2,0,0]=4 18164 B14R1.863 CCC1CCCCN1CCC(=O)NC 34a_100000210034_100012179268 [1,0,0,1,0,0|2,0,0]=4 18165 B14R1.863 CCC1CCCCN1CCC(=O)OC 2230a_100000210034_100000204255 [1,0,0,1,0,0|1,0,0]=3 18166 B14R1.863 CCC1CCCCN1CCC(=O)OC 269982a_100000210034_100000204255 [1,0,0,1,0,0|1,0,0]=3 18167 B14R1.863 CCC1CCCCN1CCC(=O)OC 34a_100000210034_100000742370 [1,0,0,1,0,0|1,0,0]=3 18168 B14R1.863 CC[C@H]1COCCN1CCC(=O)OC 2230a_100016988097_100000204255 [1,0,0,1,0,0|2,0,0]=4 18169 B14R1.863 CC[C@H]1COCCN1CCC(=O)OC 269982a_100016988097_100000204255 [1,0,0,1,0,0|2,0,0]=4 18170 B14R1.863 CC[C@H]1COCCN1CCC(=O)OC 34a_100016988097_100000742370 [1,0,0,1,0,0|2,0,0]=4 18171 B14R1.863 CN[C@@H]1CCCC[C@H]1OCC(=O)OC 34a_100000708425_100000747449 [1,0,0,1,0,0|2,0,0]=4 18172 B14R1.863 COC(=O)CCN1CCCCC1CO 2230a_100000210821_100000204255 [1,0,0,1,0,0|2,0,0]=4 18173 B14R1.863 COC(=O)CCN1CCCCC1CO 269982a_100000210821_100000204255 [1,0,0,1,0,0|2,0,0]=4 18174 B14R1.863 COC(=O)CCN1CCCCC1CO 34a_100000210821_100000742370 [1,0,0,1,0,0|2,0,0]=4 18175 B14R1.863 COC(=O)CNC1CCCCC1OC 34a_100011208099_100000747449 [1,0,0,1,0,0|2,0,0]=4 18176 B14R1.863 COC(=O)COC1CCCCC1CN 34a_100011216029_100000747449 [1,0,0,1,0,0|2,0,0]=4 18177 B14R1.863 COC(=O)CO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000747449 [1,0,0,1,0,0|2,0,0]=4 18178 B14R1.863 COC(=O)CO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000747449 [1,0,0,1,0,0|2,0,0]=4 18179 B14R1.891 CCCCCCCCCCN1CCC1 269982a_100000754969_100000210320 [1,0,0,1,0,0|2,0,0]=4 18180 B14R1.913 CCCCCN1CCC[C@H]1C(=O)NC 2230a_100015185040_100000210326 [1,0,0,1,0,0|2,0,0]=4 18181 B14R1.913 CCCCCN1CCC[C@H]1C(=O)NC 269982a_100015185040_100000210215 [1,0,0,1,0,0|2,0,0]=4 18182 B14R1.913 CCCCCN1CCC[C@H]1C(=O)NC 34a_100015185040_100000718602 [1,0,0,1,0,0|2,0,0]=4 18183 B14R1.913 CCCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000210326 [1,0,0,1,0,0|1,0,0]=3 18184 B14R1.913 CCCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000210215 [1,0,0,1,0,0|1,0,0]=3 18185 B14R1.913 CCCCCN1CCSC1C(=O)OC 2230a_100015296106_100000210326 [1,0,0,1,0,0|2,0,0]=4 18186 B14R1.913 CCCCCN1CCSC1C(=O)OC 269982a_100015296106_100000210215 [1,0,0,1,0,0|2,0,0]=4 18187 B14R1.913 CCCCCN1CSCC1C(=O)OC 269982a_200000724679_100000210215 [1,0,0,1,0,0|2,0,0]=4 18188 B14R1.913 CCCCOC1CCCC1C(=O)OC 34a_200000081814_100000210210 [1,0,0,1,0,0|1,0,0]=3 18189 B14R1.913 CCCCOC1CCCC1C(=O)OC 7a_200000081814_100000210211 [1,0,0,1,0,0|1,0,0]=3 18190 B14R1.913 CCOCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100011215890 [1,0,0,1,0,0|2,0,0]=4 18191 B14R1.913 CCOCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100011215890 [1,0,0,1,0,0|2,0,0]=4 18192 B14R1.913 CCSCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000757381 [1,0,0,1,0,0|2,0,0]=4 18193 B14R1.913 CCSCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000757381 [1,0,0,1,0,0|2,0,0]=4 18194 B14R1.913 COC(=O)C1CCCC1OCCCF 34a_200000081814_100011934791 [1,0,0,1,0,0|2,0,0]=4 18195 B14R1.913 COC(=O)C1CCCC1OCCCF 7a_200000081814_100011934791 [1,0,0,1,0,0|2,0,0]=4 18196 B14R1.913 COC(=O)C1CCCC1OCCCO 34a_200000081814_100000230001 [1,0,0,1,0,0|2,0,0]=4 18197 B14R1.913 COC(=O)C1CCCC1OCCCO 7a_200000081814_100011215043 [1,0,0,1,0,0|2,0,0]=4 18198 B14R1.913 COC(=O)C1CCCC1OCCSC 34a_200000081814_100000212216 [1,0,0,1,0,0|2,0,0]=4 18199 B14R1.913 COC(=O)C1CCCC1OCCSC 7a_200000081814_100000212216 [1,0,0,1,0,0|2,0,0]=4 18200 B14R1.913 COC(=O)[C@@H]1CCCN1CCCCF 2230a_100000752040_100000729493 [1,0,0,1,0,0|2,0,0]=4 18201 B14R1.913 COC(=O)[C@@H]1CCCN1CCCCF 269982a_100000752040_100000729493 [1,0,0,1,0,0|2,0,0]=4 18202 B14R1.913 COC(=O)[C@@H]1CCCN1CCCCO 2230a_100000752040_100000210776 [1,0,0,1,0,0|2,0,0]=4 18203 B14R1.913 COC(=O)[C@@H]1CCCN1CCCCO 269982a_100000752040_100000210776 [1,0,0,1,0,0|2,0,0]=4 18204 B14R1.913 COCCCN1CCC[C@H]1C(=O)OC 2230a_100000752040_100000740836 [1,0,0,1,0,0|2,0,0]=4 18205 B14R1.913 COCCCN1CCC[C@H]1C(=O)OC 269982a_100000752040_100000740836 [1,0,0,1,0,0|2,0,0]=4 18206 B14R1.913 COCCOC1CCCC1C(=O)OC 34a_200000081814_100011201679 [1,0,0,1,0,0|2,0,0]=4 18207 B14R1.913 COCCOC1CCCC1C(=O)OC 7a_200000081814_100000233755 [1,0,0,1,0,0|2,0,0]=4 18208 B14R1.1224 CCC(=O)CN1CCCCCCCC1 269982a_100000039187_100000747405 [1,0,0,1,0,0|1,0,0]=3 18209 B14R1.1224 CNC(=O)CN1CCCCCCCC1 2230a_100000039187_100000183359 [1,0,0,1,0,0|2,0,0]=4 18210 B14R1.1224 CNC(=O)CN1CCCCCCCC1 269982a_100000039187_100000183359 [1,0,0,1,0,0|2,0,0]=4 18211 B14R1.1224 CNC(=O)CN1CCCCCCCC1 34a_100000039187_100000183359 [1,0,0,1,0,0|2,0,0]=4 18212 B14R1.1224 COC(=O)CN1CCCCCCCC1 2230a_100000039187_100000747449 [1,0,0,1,0,0|1,0,0]=3 18213 B14R1.1224 COC(=O)CN1CCCCCCCC1 269982a_100000039187_100000747449 [1,0,0,1,0,0|1,0,0]=3 18214 B14R1.1224 COC(=O)CN1CCCCCCCC1 34a_100000039187_100000747449 [1,0,0,1,0,0|1,0,0]=3 18215 B14R1.1586 CCC(=O)COCC1CCCCCC1 34a_100000725409_200000696569 [1,0,0,1,0,0|1,0,0]=3 18216 B14R1.1586 CCC(=O)COCC1CCCCCC1 7a_100000699130_100000747405 [1,0,0,1,0,0|1,0,0]=3 18217 B14R1.1586 CCC(=O)CSCC1CCCCCC1 62a_100000747405_200000696569 [1,0,0,1,0,0|1,0,0]=3 18218 B14R1.1586 CCC(=O)CSCC1CCCCCC1 62a_200000696569_100000747405 [1,0,0,1,0,0|1,0,0]=3 18219 B14R1.1586 CCC(=O)NCCC1CCCCCC1 11a_100011532351_100000210414 [1,0,0,1,0,0|1,0,0]=3 18220 B14R1.1586 CCC(=O)NCCC1CCCCCC1 1626a_100011532351_100000210414 [1,0,0,1,0,0|1,0,0]=3 18221 B14R1.1586 CCC(=O)NCCC1CCCCCC1 240690a_100011532351_100000210414 [1,0,0,1,0,0|1,0,0]=3 18222 B14R1.1586 CCC(=O)NCCC1CCCCCC1 527a_100011532351_100000210414 [1,0,0,1,0,0|1,0,0]=3 18223 B14R1.1586 CCC(=O)NCCN1CCCCCC1 11a_100000738142_100000210414 [1,0,0,1,0,0|2,0,0]=4 18224 B14R1.1586 CCC(=O)NCCN1CCCCCC1 240690a_100000738142_100000210414 [1,0,0,1,0,0|2,0,0]=4 18225 B14R1.1586 CCC(=O)NCCN1CCCCCC1 527a_100000738142_100000210414 [1,0,0,1,0,0|2,0,0]=4 18226 B14R1.1586 CNC(=O)CCCN1CCCCCC1 2230a_100000185865_100000741757 [1,0,0,1,0,0|2,0,0]=4 18227 B14R1.1586 CNC(=O)CCCN1CCCCCC1 269982a_100000185865_100000741757 [1,0,0,1,0,0|2,0,0]=4 18228 B14R1.1586 CNC(=O)CCCN1CCCCCC1 34a_100000185865_100000741757 [1,0,0,1,0,0|2,0,0]=4 18229 B14R1.1586 CNC(=O)CCNC1CCCCCC1 2230a_100000210984_100000737683 [1,0,0,1,0,0|2,0,0]=4 18230 B14R1.1586 CNC(=O)CCNC1CCCCCC1 270004a_100000738227_100000210131 [1,0,0,1,0,0|2,0,0]=4 18231 B14R1.1586 CNC(=O)CCNC1CCCCCC1 34a_100000210984_100012179268 [1,0,0,1,0,0|2,0,0]=4 18232 B14R1.1586 CNC(=O)CCNC1CCCCCC1 34a_100000738227_100011217769 [1,0,0,1,0,0|2,0,0]=4 18233 B14R1.1586 CNC(=O)CCOC1CCCCCC1 34a_100000210887_100012179268 [1,0,0,1,0,0|2,0,0]=4 18234 B14R1.1586 CNC(=O)CCOC1CCCCCC1 34a_100000754576_100011217769 [1,0,0,1,0,0|2,0,0]=4 18235 B14R1.1586 CNC(=O)CCOC1CCCCCC1 7a_100000210887_100000737683 [1,0,0,1,0,0|2,0,0]=4 18236 B14R1.1586 CNC(=O)CCSC1CCCCCC1 62a_100000737683_100011217769 [1,0,0,1,0,0|2,0,0]=4 18237 B14R1.1586 CNC(=O)CCSC1CCCCCC1 62a_100011217769_100000737683 [1,0,0,1,0,0|2,0,0]=4 18238 B14R1.1586 CNC(=O)CNCC1CCCCCC1 2230a_100000693194_200000696569 [1,0,0,1,0,0|2,0,0]=4 18239 B14R1.1586 CNC(=O)CNCC1CCCCCC1 2230a_100015204231_100000183359 [1,0,0,1,0,0|2,0,0]=4 18240 B14R1.1586 CNC(=O)CNCC1CCCCCC1 269862a_100000693194_200000763224 [1,0,0,1,0,0|2,0,0]=4 18241 B14R1.1586 CNC(=O)CNCC1CCCCCC1 34a_100015204231_100000183359 [1,0,0,1,0,0|2,0,0]=4 18242 B14R1.1586 CNC(=O)COCC1CCCCCC1 34a_100000699130_100000183359 [1,0,0,1,0,0|2,0,0]=4 18243 B14R1.1586 CNC(=O)COCC1CCCCCC1 34a_100000750040_200000696569 [1,0,0,1,0,0|2,0,0]=4 18244 B14R1.1586 CNC(=O)COCC1CCCCCC1 7a_100000699130_100000183359 [1,0,0,1,0,0|2,0,0]=4 18245 B14R1.1586 CNC(=O)CSCC1CCCCCC1 62a_100000183359_200000696569 [1,0,0,1,0,0|2,0,0]=4 18246 B14R1.1586 CNC(=O)CSCC1CCCCCC1 62a_200000696569_100000183359 [1,0,0,1,0,0|2,0,0]=4 18247 B14R1.1586 CNC(=O)NCCC1CCCCCC1 2708a_100011532351_106832991635 [1,0,0,1,0,0|2,0,0]=4 18248 B14R1.1586 CNC(=O)NCCC1CCCCCC1 2708a_100102657272_100011532351 [1,0,0,1,0,0|2,0,0]=4 18249 B14R1.1586 CNC(=O)NCCC1CCCCCC1 273464a_100011532351_100102657272 [1,0,0,1,0,0|2,0,0]=4 18250 B14R1.1586 CNC(=O)NCCC1CCCCCC1 273464a_100102657272_100011532351 [1,0,0,1,0,0|2,0,0]=4 18251 B14R1.1586 CNC(=O)NCCC1CCCCCC1 512a_106832991638_100011532351 [1,0,0,1,0,0|2,0,0]=4 18252 B14R1.1586 COC(=O)CCCN1CCCCCC1 2230a_100000185865_100011218270 [1,0,0,1,0,0|1,0,0]=3 18253 B14R1.1586 COC(=O)CCCN1CCCCCC1 269982a_100000185865_100011218270 [1,0,0,1,0,0|1,0,0]=3 18254 B14R1.1586 COC(=O)CCCN1CCCCCC1 34a_100000185865_100000742333 [1,0,0,1,0,0|1,0,0]=3 18255 B14R1.1586 COC(=O)CCCN1CCCOCC1 2230a_100000685342_100011218270 [1,0,0,1,0,0|2,0,0]=4 18256 B14R1.1586 COC(=O)CCCN1CCCOCC1 269982a_100000685342_100011218270 [1,0,0,1,0,0|2,0,0]=4 18257 B14R1.1586 COC(=O)CCCN1CCCOCC1 34a_100000685342_100000742333 [1,0,0,1,0,0|2,0,0]=4 18258 B14R1.1586 COC(=O)CCNC1CCCCCC1 2230a_100000210984_100000204255 [1,0,0,1,0,0|1,0,0]=3 18259 B14R1.1586 COC(=O)CCNC1CCCCCC1 34a_100000210984_100000742370 [1,0,0,1,0,0|1,0,0]=3 18260 B14R1.1586 COC(=O)CCOC1CCCCCC1 34a_100000210887_100000742370 [1,0,0,1,0,0|1,0,0]=3 18261 B14R1.1586 COC(=O)CCOC1CCCCCC1 7a_100000210887_100000204255 [1,0,0,1,0,0|1,0,0]=3 18262 B14R1.1586 COC(=O)CCSC1CCCCCC1 62a_100000204255_100011217769 [1,0,0,1,0,0|1,0,0]=3 18263 B14R1.1586 COC(=O)CCSC1CCCCCC1 62a_100011217769_100000204255 [1,0,0,1,0,0|1,0,0]=3 18264 B14R1.1586 COC(=O)CNCC1CCCCCC1 2230a_100015204231_100000747449 [1,0,0,1,0,0|1,0,0]=3 18265 B14R1.1586 COC(=O)CNCC1CCCCCC1 34a_100015204231_100000747449 [1,0,0,1,0,0|1,0,0]=3 18266 B14R1.1586 COC(=O)COCC1CCCCCC1 34a_100000699130_100000747449 [1,0,0,1,0,0|1,0,0]=3 18267 B14R1.1586 COC(=O)COCC1CCCCCC1 7a_100000699130_100000747449 [1,0,0,1,0,0|1,0,0]=3 18268 B14R1.1586 COC(=O)CSCC1CCCCCC1 62a_100000747449_200000696569 [1,0,0,1,0,0|1,0,0]=3 18269 B14R1.1586 COC(=O)CSCC1CCCCCC1 62a_200000696569_100000747449 [1,0,0,1,0,0|1,0,0]=3 18270 B14R1.1586 COC(=O)OCSC1CCCCCC1 62a_100011217769_100000139417 [1,0,0,1,0,0|2,0,0]=4 18271 B14R1.1586 O=C(CO)NCCC1CCCCCC1 240690a_100011532351_100000210174 [1,0,0,1,0,0|2,0,0]=4 18272 B14R1.1586 O=C(CO)NCCC1CCCCCC1 527a_100011532351_100000210174 [1,0,0,1,0,0|2,0,0]=4 18273 B14R1.2350 CCCCCCCN1CC1C(=O)OC 2230a_200009830135_100000210681 [1,0,0,1,0,0|1,0,0]=3 18274 B14R1.2350 CCCCOCCN1CC1C(=O)OC 2230a_200009830135_100000743108 [1,0,0,1,0,0|2,0,0]=4 18275 B14R1.2350 COC(=O)C1CN1CCCCCCF 2230a_200009830135_100015922095 [1,0,0,1,0,0|2,0,0]=4 18276 B14R1.2350 COC(=O)C1CN1CCCCCCO 2230a_200009830135_100000766143 [1,0,0,1,0,0|2,0,0]=4 18277 B14R1.4297 CCCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100000210314 [1,0,0,1,0,0|1,0,0]=3 18278 B14R1.4297 CCCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100000210757 [1,0,0,1,0,0|1,0,0]=3 18279 B14R1.4297 CCCCOCN1CC[C@H]1C(=O)OC 2230a_102516456887_100011995733 [1,0,0,1,0,0|2,0,0]=4 18280 B14R1.4297 CCCCOCN1CC[C@H]1C(=O)OC 269982a_102516456887_100011995733 [1,0,0,1,0,0|2,0,0]=4 18281 B14R1.4297 CCCOCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100011215938 [1,0,0,1,0,0|2,0,0]=4 18282 B14R1.4297 CCCOCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100011215938 [1,0,0,1,0,0|2,0,0]=4 18283 B14R1.4297 CCOCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100012232248 [1,0,0,1,0,0|2,0,0]=4 18284 B14R1.4297 CCOCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100012232248 [1,0,0,1,0,0|2,0,0]=4 18285 B14R1.4297 COC(=O)[C@@H]1CCN1CCCCCF 2230a_102516456887_100000729378 [1,0,0,1,0,0|2,0,0]=4 18286 B14R1.4297 COC(=O)[C@@H]1CCN1CCCCCF 269982a_102516456887_100000729378 [1,0,0,1,0,0|2,0,0]=4 18287 B14R1.4297 COC(=O)[C@@H]1CCN1CCCCCO 2230a_102516456887_100000746330 [1,0,0,1,0,0|2,0,0]=4 18288 B14R1.4297 COC(=O)[C@@H]1CCN1CCCCCO 269982a_102516456887_100000746330 [1,0,0,1,0,0|2,0,0]=4 18289 B14R1.4297 COCCCCN1CC[C@H]1C(=O)OC 2230a_102516456887_100000730899 [1,0,0,1,0,0|2,0,0]=4 18290 B14R1.4297 COCCCCN1CC[C@H]1C(=O)OC 269982a_102516456887_100000730899 [1,0,0,1,0,0|2,0,0]=4 18291 B14R1.7684 CCC(=O)CCN1CCCCCCC1 1458a_200015187237_100000210202 [1,0,0,1,0,0|1,0,0]=3 18292 B14R1.7684 CCC(=O)COC1CCCCCCC1 7a_100000210054_100000747405 [1,0,0,1,0,0|1,0,0]=3 18293 B14R1.7684 CNC(=O)CCN1CCCCCCC1 2230a_100000211400_100000737683 [1,0,0,1,0,0|2,0,0]=4 18294 B14R1.7684 CNC(=O)CCN1CCCCCCC1 240690a_100102657272_200015187237 [1,0,0,1,0,0|2,0,0]=4 18295 B14R1.7684 CNC(=O)CCN1CCCCCCC1 269982a_100000211400_100000737683 [1,0,0,1,0,0|2,0,0]=4 18296 B14R1.7684 CNC(=O)CCN1CCCCCCC1 34a_100000211400_100012179268 [1,0,0,1,0,0|2,0,0]=4 18297 B14R1.7684 CNC(=O)CNC1CCCCCCC1 2230a_100000211152_100000183359 [1,0,0,1,0,0|2,0,0]=4 18298 B14R1.7684 CNC(=O)CNC1CCCCCCC1 270004a_100000693194_100000210524 [1,0,0,1,0,0|2,0,0]=4 18299 B14R1.7684 CNC(=O)CNC1CCCCCCC1 34a_100000211152_100000183359 [1,0,0,1,0,0|2,0,0]=4 18300 B14R1.7684 CNC(=O)COC1CCCCCCC1 34a_100000210054_100000183359 [1,0,0,1,0,0|2,0,0]=4 18301 B14R1.7684 CNC(=O)COC1CCCCCCC1 7a_100000210054_100000183359 [1,0,0,1,0,0|2,0,0]=4 18302 B14R1.7684 COC(=O)CCN1CCCCCCC1 2230a_100000211400_100000204255 [1,0,0,1,0,0|1,0,0]=3 18303 B14R1.7684 COC(=O)CCN1CCCCCCC1 269982a_100000211400_100000204255 [1,0,0,1,0,0|1,0,0]=3 18304 B14R1.7684 COC(=O)CCN1CCCCCCC1 34a_100000211400_100000742370 [1,0,0,1,0,0|1,0,0]=3 18305 B14R1.7684 COC(=O)CNC1CCCCCCC1 2230a_100000211152_100000747449 [1,0,0,1,0,0|1,0,0]=3 18306 B14R1.7684 COC(=O)CNC1CCCCCCC1 34a_100000211152_100000747449 [1,0,0,1,0,0|1,0,0]=3 18307 B14R1.7684 COC(=O)COC1CCCCCCC1 34a_100000210054_100000747449 [1,0,0,1,0,0|1,0,0]=3 18308 B14R1.7684 COC(=O)COC1CCCCCCC1 7a_100000210054_100000747449 [1,0,0,1,0,0|1,0,0]=3 18309 B14R1.7684 O=C(CF)CCN1CCCCCCC1 1458a_200015187237_100015361967 [1,0,0,1,0,0|2,0,0]=4 18310 B14R1.62 CCOCCCNC1CCCC1CC 269862a_100000210961_100000749056 [1,0,0,1,0,0|1,0,1]=4 18311 B14R1.62 CCOCCCNC1CCCC1CC 270004a_100000210961_100000749056 [1,0,0,1,0,0|1,0,1]=4 18312 B14R1.123 CC/C=C/CCCOC1CCCCC1 34a_100016287902_100000210327 [1,0,0,1,0,0|2,0,0]=4 18313 B14R1.123 CC/C=C/CCCOC1CCCCC1 7a_100016287902_100000210327 [1,0,0,1,0,0|2,0,0]=4 18314 B14R1.123 CC/C=C\CCNCC1CCCCC1 2230a_100000210473_100015370543 [1,0,0,1,0,0|2,0,0]=4 18315 B14R1.123 CC/C=C\CCNCC1CCCCC1 34a_100000210473_100015370543 [1,0,0,1,0,0|2,0,0]=4 18316 B14R1.123 CC/C=C\CCOCC1CCCCC1 34a_100000212181_100015370543 [1,0,0,1,0,0|2,0,0]=4 18317 B14R1.123 CC/C=C\CCOCC1CCCCC1 34a_100016288707_100000211423 [1,0,0,1,0,0|2,0,0]=4 18318 B14R1.123 CC/C=C\CCOCC1CCCCC1 7a_100000212181_100015370543 [1,0,0,1,0,0|2,0,0]=4 18319 B14R1.123 CC/C=C\CCOCC1CCCCC1 7a_100016288707_100000211423 [1,0,0,1,0,0|2,0,0]=4 18320 B14R1.123 CC/C=C\CCSCC1CCCCC1 62a_100000211423_100015370543 [1,0,0,1,0,0|2,0,0]=4 18321 B14R1.123 CC/C=C\CCSCC1CCCCC1 62a_100015370543_100000211423 [1,0,0,1,0,0|2,0,0]=4 18322 B14R1.123 CC/C=C\CNCCC1CCCCC1 2230a_100000738074_100103147603 [1,0,0,1,0,0|2,0,0]=4 18323 B14R1.123 CC/C=C\CNCCC1CCCCC1 34a_100000738074_100103147603 [1,0,0,1,0,0|2,0,0]=4 18324 B14R1.123 CC/C=C\COCCC1CCCCC1 34a_100011217863_100103147603 [1,0,0,1,0,0|2,0,0]=4 18325 B14R1.123 CC/C=C\COCCC1CCCCC1 34a_100016268518_100011209188 [1,0,0,1,0,0|2,0,0]=4 18326 B14R1.123 CC/C=C\COCCC1CCCCC1 7a_100011217863_100103147603 [1,0,0,1,0,0|2,0,0]=4 18327 B14R1.123 CC/C=C\CSCCC1CCCCC1 62a_100012355289_100103147603 [1,0,0,1,0,0|2,0,0]=4 18328 B14R1.123 CC/C=C\CSCCC1CCCCC1 62a_100103147603_100012355289 [1,0,0,1,0,0|2,0,0]=4 18329 B14R1.123 CCCCCCCCN1CC=CCC1 2230a_100000698166_100000210759 [1,0,0,1,0,0|2,0,0]=4 18330 B14R1.123 CCCCCCCCN1CC=CCC1 269982a_100000698166_100000210759 [1,0,0,1,0,0|2,0,0]=4 18331 B14R1.123 CCCCCCCCN1CC=CCC1 34a_100000698166_100000210759 [1,0,0,1,0,0|2,0,0]=4 18332 B14R1.123 CCCCCCCCN1CCOCC1 2230a_100015191051_100000210759 [1,0,0,1,0,0|1,0,1]=4 18333 B14R1.123 CCCCCCCCN1CCOCC1 269982a_100015191051_100000210759 [1,0,0,1,0,0|1,0,1]=4 18334 B14R1.123 CCCCCCCCN1CCOCC1 34a_100015191051_100000210759 [1,0,0,1,0,0|1,0,1]=4 18335 B14R1.123 CCCCCCCNC1CCOCC1 2230a_100000741149_100000210681 [1,0,0,1,0,0|1,0,1]=4 18336 B14R1.123 CCCCCCCNC1CCOCC1 270004a_100000229938_100011217826 [1,0,0,1,0,0|1,0,1]=4 18337 B14R1.123 CCCCCCCNC1CCOCC1 34a_100000741149_100000210614 [1,0,0,1,0,0|1,0,1]=4 18338 B14R1.123 CCCCCCCOC1CC=CCC1 34a_100000073881_100000210614 [1,0,0,1,0,0|2,0,0]=4 18339 B14R1.123 CCCCCCCOC1CCOCC1 34a_100000744328_100000210614 [1,0,0,1,0,0|1,0,1]=4 18340 B14R1.123 CCCCCCCOC1CCOCC1 7a_100000210272_100000686592 [1,0,0,1,0,0|1,0,1]=4 18341 B14R1.123 CCCCCCCSC1CCOCC1 62a_100000210614_100011324220 [1,0,0,1,0,0|1,0,1]=4 18342 B14R1.123 CCCCCCNCC1CC=CCC1 270004a_100000210581_100000189434 [1,0,0,1,0,0|2,0,0]=4 18343 B14R1.123 CCCCCCNCC1CCOCC1 2230a_100000210581_100000754603 [1,0,0,1,0,0|1,0,1]=4 18344 B14R1.123 CCCCCCNCC1CCOCC1 2230a_100000746373_100000210314 [1,0,0,1,0,0|1,0,1]=4 18345 B14R1.123 CCCCCCNCC1CCOCC1 269862a_100000210581_100000749017 [1,0,0,1,0,0|1,0,1]=4 18346 B14R1.123 CCCCCCNCC1CCOCC1 34a_100000746373_100000210314 [1,0,0,1,0,0|1,0,1]=4 18347 B14R1.123 CCCCCCOCC1CC=CCC1 34a_100000210713_100000210314 [1,0,0,1,0,0|2,0,0]=4 18348 B14R1.123 CCCCCCOCC1CCOCC1 34a_100000210259_100000754603 [1,0,0,1,0,0|1,0,1]=4 18349 B14R1.123 CCCCCCOCC1CCOCC1 34a_100000749013_100000210314 [1,0,0,1,0,0|1,0,1]=4 18350 B14R1.123 CCCCCCOCC1CCOCC1 7a_100000210259_100000754603 [1,0,0,1,0,0|1,0,1]=4 18351 B14R1.123 CCCCCCSCC1CCOCC1 62a_100000210314_100000749018 [1,0,0,1,0,0|1,0,1]=4 18352 B14R1.123 CCCCCCSCC1CCOCC1 62a_100000754603_100000210757 [1,0,0,1,0,0|1,0,1]=4 18353 B14R1.123 CCCCCNCCC1CCOCC1 2230a_100000209983_100011934994 [1,0,0,1,0,0|1,0,1]=4 18354 B14R1.123 CCCCCNCCC1CCOCC1 2230a_100000755988_100000210326 [1,0,0,1,0,0|1,0,1]=4 18355 B14R1.123 CCCCCNCCC1CCOCC1 34a_100000755988_100000718602 [1,0,0,1,0,0|1,0,1]=4 18356 B14R1.123 CCCCCOCCC1CCOCC1 34a_100000210253_100011934994 [1,0,0,1,0,0|1,0,1]=4 18357 B14R1.123 CCCCCOCCC1CCOCC1 34a_100011933979_100000718602 [1,0,0,1,0,0|1,0,1]=4 18358 B14R1.123 CCCCCOCCC1CCOCC1 7a_100000210253_100011934994 [1,0,0,1,0,0|1,0,1]=4 18359 B14R1.123 CCCCCOCCC1CCOCC1 7a_100011933979_100000210326 [1,0,0,1,0,0|1,0,1]=4 18360 B14R1.123 CCCCCSCCC1CCOCC1 62a_100000210326_100011934994 [1,0,0,1,0,0|1,0,1]=4 18361 B14R1.123 CCCCCSCCC1CCOCC1 62a_100011934994_100000210326 [1,0,0,1,0,0|1,0,1]=4 18362 B14R1.123 CCCOCCCCC1CCCCC1 34a_100011215267_100000210303 [1,0,0,1,0,0|2,0,0]=4 18363 B14R1.123 CCCOCCCCC1CCCCC1 7a_100011215267_100000210303 [1,0,0,1,0,0|2,0,0]=4 18364 B14R1.123 CCOCCCCCN1CCCCC1 34a_100011216611_100000210202 [1,0,0,1,0,0|1,0,1]=4 18365 B14R1.123 CCOCCCCCN1CCCCC1 7a_100011216611_100000210202 [1,0,0,1,0,0|1,0,1]=4 18366 B14R1.123 CCOCCCNCC1CCCCC1 2230a_100000210473_100012232248 [1,0,0,1,0,0|1,0,1]=4 18367 B14R1.123 CCOCCCNCC1CCCCC1 2230a_100000210961_100000211423 [1,0,0,1,0,0|1,0,1]=4 18368 B14R1.123 CCOCCCNCC1CCCCC1 269862a_100000210961_100000211278 [1,0,0,1,0,0|1,0,1]=4 18369 B14R1.123 CCOCCCNCC1CCCCC1 34a_100000210473_100012232248 [1,0,0,1,0,0|1,0,1]=4 18370 B14R1.123 CCOCCCNCC1CCCCC1 34a_100000210961_100000211423 [1,0,0,1,0,0|1,0,1]=4 18371 B14R1.123 CCOCCCOCC1CCCCC1 34a_100000212181_100012232248 [1,0,0,1,0,0|1,0,1]=4 18372 B14R1.123 CCOCCCOCC1CCCCC1 34a_100000757476_100000211423 [1,0,0,1,0,0|1,0,1]=4 18373 B14R1.123 CCOCCCOCC1CCCCC1 7a_100000212181_100012232248 [1,0,0,1,0,0|1,0,1]=4 18374 B14R1.123 CCOCCCOCC1CCCCC1 7a_100000757476_100000211423 [1,0,0,1,0,0|1,0,1]=4 18375 B14R1.123 CCOCCCSCC1CCCCC1 62a_100000211423_100012232248 [1,0,0,1,0,0|1,0,1]=4 18376 B14R1.123 CCOCCCSCC1CCCCC1 62a_100012232248_100000211423 [1,0,0,1,0,0|1,0,1]=4 18377 B14R1.123 CCOCCNCCC1CCCCC1 2230a_100000738074_100011215890 [1,0,0,1,0,0|1,0,1]=4 18378 B14R1.123 CCOCCNCCC1CCCCC1 2230a_102516460346_100012355289 [1,0,0,1,0,0|1,0,1]=4 18379 B14R1.123 CCOCCNCCC1CCCCC1 270004a_102516460346_100011713444 [1,0,0,1,0,0|1,0,1]=4 18380 B14R1.123 CCOCCNCCC1CCCCC1 34a_100000738074_100000210147 [1,0,0,1,0,0|1,0,1]=4 18381 B14R1.123 CCOCCNCCC1CCCCC1 34a_102516460346_100011209188 [1,0,0,1,0,0|1,0,1]=4 18382 B14R1.123 CCOCCOCCC1CCCCC1 34a_100000210136_100011209188 [1,0,0,1,0,0|1,0,1]=4 18383 B14R1.123 CCOCCOCCC1CCCCC1 34a_100011217863_100000210147 [1,0,0,1,0,0|1,0,1]=4 18384 B14R1.123 CCOCCOCCC1CCCCC1 7a_100000210136_100011273959 [1,0,0,1,0,0|1,0,1]=4 18385 B14R1.123 CCOCCOCCC1CCCCC1 7a_100011217863_100011215890 [1,0,0,1,0,0|1,0,1]=4 18386 B14R1.123 CCOCCSCCC1CCCCC1 62a_100000210147_100012355289 [1,0,0,1,0,0|1,0,1]=4 18387 B14R1.123 CCOCCSCCC1CCCCC1 62a_100012355289_100011215890 [1,0,0,1,0,0|1,0,1]=4 18388 B14R1.123 CCOCSCCCC1CCCCC1 62a_100000739092_100011713725 [1,0,0,1,0,0|1,0,1]=4 18389 B14R1.123 CCOCSCCCC1CCCCC1 62a_100011713725_100000739092 [1,0,0,1,0,0|1,0,1]=4 18390 B14R1.221 CC/C=C\CCCCCOCC1CC1 34a_100016268722_100000742324 [1,0,0,1,0,0|2,0,0]=4 18391 B14R1.221 CC/C=C\CCCCCOCC1CC1 7a_100016268722_100000742324 [1,0,0,1,0,0|2,0,0]=4 18392 B14R1.221 CC/C=C\CCCCOCCC1CC1 34a_100016287862_100000694398 [1,0,0,1,0,0|2,0,0]=4 18393 B14R1.221 CC/C=C\CCCCOCCC1CC1 7a_100016287862_100000764125 [1,0,0,1,0,0|2,0,0]=4 18394 B14R1.221 CCCCCCCCCCNC1CC1 34a_100000212008_100000210320 [1,0,0,1,0,0|2,0,0]=4 18395 B14R1.221 CCCCCCCCCCNC1CC1 34a_100000684558_100000211595 [1,0,0,1,0,0|2,0,0]=4 18396 B14R1.221 CCCCCCCCCCOC1CC1 34a_100000210711_100000211595 [1,0,0,1,0,0|2,0,0]=4 18397 B14R1.234 CCCC1CCCC1NCCOCC 269862a_100011200944_100000723119 [1,0,0,1,0,0|1,0,1]=4 18398 B14R1.234 CCCC1CCCC1NCCOCC 270004a_102516460346_100000723119 [1,0,0,1,0,0|1,0,1]=4 18399 B14R1.234 CCCCCCC1CCCC1NCC 269862a_100015525214_100000189428 [1,0,0,1,0,0|1,0,1]=4 18400 B14R1.234 CCCCCCC1CCCC1NCC 270004a_100015525214_100000189428 [1,0,0,1,0,0|1,0,1]=4 18401 B14R1.476 CC/C=C\CCN1CCCCC1CC 2230a_100000210034_100015370543 [1,0,0,1,0,0|2,0,0]=4 18402 B14R1.476 CC/C=C\CCN1CCCCC1CC 269982a_100000210034_100015370543 [1,0,0,1,0,0|2,0,0]=4 18403 B14R1.476 CC/C=C\CCN1CCCCC1CC 34a_100000210034_100015370543 [1,0,0,1,0,0|2,0,0]=4 18404 B14R1.476 CC/C=C\COC1CCCCC1CC 34a_100000210738_100103147603 [1,0,0,1,0,0|2,0,0]=4 18405 B14R1.476 CC/C=C\COC1CCCCC1CC 7a_100000210738_100103147603 [1,0,0,1,0,0|2,0,0]=4 18406 B14R1.476 CCOCCCN1CCCCC1CC 2230a_100000210034_100012232248 [1,0,0,1,0,0|1,0,1]=4 18407 B14R1.476 CCOCCCN1CCCCC1CC 269982a_100000210034_100012232248 [1,0,0,1,0,0|1,0,1]=4 18408 B14R1.476 CCOCCCN1CCCCC1CC 34a_100000210034_100012232248 [1,0,0,1,0,0|1,0,1]=4 18409 B14R1.476 CCOCCNC1CCCCC1CC 269862a_100011200944_100000757040 [1,0,0,1,0,0|1,0,1]=4 18410 B14R1.476 CCOCCNC1CCCCC1CC 270004a_102516460346_100000757040 [1,0,0,1,0,0|1,0,1]=4 18411 B14R1.476 CCOCCOC1CCCCC1CC 34a_100000210738_100000210147 [1,0,0,1,0,0|1,0,1]=4 18412 B14R1.476 CCOCCOC1CCCCC1CC 7a_100000210738_100011215890 [1,0,0,1,0,0|1,0,1]=4 18413 B14R1.882 CC/C=C\CCNC1CCCCC1C 2230a_100000211402_100015370543 [1,0,0,1,0,0|2,0,0]=4 18414 B14R1.882 CC/C=C\CCNC1CCCCC1C 34a_100000211402_100015370543 [1,0,0,1,0,0|2,0,0]=4 18415 B14R1.882 CC/C=C\CCOC1CCCCC1C 34a_100000211207_100015370543 [1,0,0,1,0,0|2,0,0]=4 18416 B14R1.882 CC/C=C\CCOC1CCCCC1C 7a_100000211207_100015370543 [1,0,0,1,0,0|2,0,0]=4 18417 B14R1.882 CCOCCCNC1CCCCC1C 2230a_100000211402_100012232248 [1,0,0,1,0,0|1,0,1]=4 18418 B14R1.882 CCOCCCNC1CCCCC1C 269862a_100000210961_100000210921 [1,0,0,1,0,0|1,0,1]=4 18419 B14R1.882 CCOCCCNC1CCCCC1C 270004a_100000210961_100000210921 [1,0,0,1,0,0|1,0,1]=4 18420 B14R1.882 CCOCCCNC1CCCCC1C 34a_100000211402_100012232248 [1,0,0,1,0,0|1,0,1]=4 18421 B14R1.882 CCOCCCOC1CCCCC1C 34a_100000211207_100012232248 [1,0,0,1,0,0|1,0,1]=4 18422 B14R1.882 CCOCCCOC1CCCCC1C 7a_100000211207_100012232248 [1,0,0,1,0,0|1,0,1]=4 18423 B14R1.904 CC/C=C\CN1CCCCC1CCC 2230a_100000701414_100103147603 [1,0,0,1,0,0|2,0,0]=4 18424 B14R1.904 CC/C=C\CN1CCCCC1CCC 269982a_100000701414_100103147603 [1,0,0,1,0,0|2,0,0]=4 18425 B14R1.904 CC/C=C\CN1CCCCC1CCC 34a_100000701414_100103147603 [1,0,0,1,0,0|2,0,0]=4 18426 B14R1.904 CCCC1CCCCN1CCOCC 2230a_100000701414_100011215890 [1,0,0,1,0,0|1,0,1]=4 18427 B14R1.904 CCCC1CCCCN1CCOCC 269982a_100000701414_100011215890 [1,0,0,1,0,0|1,0,1]=4 18428 B14R1.904 CCCC1CCCCN1CCOCC 34a_100000701414_100000210147 [1,0,0,1,0,0|1,0,1]=4 18429 B14R1.904 CCCCNC1CCCCC1OCC 270004a_100000102301_200000031474 [1,0,0,1,0,0|1,0,1]=4 18430 B14R1.911 CCCCCC1CCCC1NCCC 269862a_100020643023_200000198059 [1,0,0,1,0,0|2,0,0]=4 18431 B14R1.911 CCCCCC1CCCC1NCCC 270004a_100020643023_200000198059 [1,0,0,1,0,0|2,0,0]=4 18432 B14R1.1254 CC/C=C\CCN1CCCCCCC1 2230a_100000211400_100015370543 [1,0,0,1,0,0|2,0,0]=4 18433 B14R1.1254 CC/C=C\CCN1CCCCCCC1 269982a_100000211400_100015370543 [1,0,0,1,0,0|2,0,0]=4 18434 B14R1.1254 CC/C=C\CCN1CCCCCCC1 34a_100000211400_100015370543 [1,0,0,1,0,0|2,0,0]=4 18435 B14R1.1254 CC/C=C\CNC1CCCCCCC1 2230a_100000211152_100103147603 [1,0,0,1,0,0|2,0,0]=4 18436 B14R1.1254 CC/C=C\CNC1CCCCCCC1 34a_100000211152_100103147603 [1,0,0,1,0,0|2,0,0]=4 18437 B14R1.1254 CC/C=C\COC1CCCCCCC1 34a_100000210054_100103147603 [1,0,0,1,0,0|2,0,0]=4 18438 B14R1.1254 CC/C=C\COC1CCCCCCC1 7a_100000210054_100103147603 [1,0,0,1,0,0|2,0,0]=4 18439 B14R1.1254 CCCCCOC1CC/C=C\CCC1 34a_100000210253_100021000466 [1,0,0,1,0,0|2,0,0]=4 18440 B14R1.1254 CCCCCOC1CC/C=C\CCC1 34a_100016989180_100000718602 [1,0,0,1,0,0|2,0,0]=4 18441 B14R1.1254 CCCCCOC1CC/C=C\CCC1 7a_100000210253_100021000466 [1,0,0,1,0,0|2,0,0]=4 18442 B14R1.1254 CCCCCSC1CC/C=C\CCC1 62a_100000210326_100021000466 [1,0,0,1,0,0|2,0,0]=4 18443 B14R1.1254 CCCCCSC1CC/C=C\CCC1 62a_100021000466_100000210326 [1,0,0,1,0,0|2,0,0]=4 18444 B14R1.1254 CCCCNCC1CC/C=C\CCC1 2230a_100102730862_100000210211 [1,0,0,1,0,0|2,0,0]=4 18445 B14R1.1254 CCCCNCC1CC/C=C\CCC1 34a_100102730862_100000210210 [1,0,0,1,0,0|2,0,0]=4 18446 B14R1.1254 CCCNCCC1CCCCCCC1 2230a_100011532352_100000210303 [1,0,0,1,0,0|2,0,0]=4 18447 B14R1.1254 CCCNCCC1CCCCCCC1 34a_100011532352_100000210303 [1,0,0,1,0,0|2,0,0]=4 18448 B14R1.1254 CCOCCCN1CCCCCCC1 2230a_100000211400_100012232248 [1,0,0,1,0,0|1,0,1]=4 18449 B14R1.1254 CCOCCCN1CCCCCCC1 269982a_100000211400_100012232248 [1,0,0,1,0,0|1,0,1]=4 18450 B14R1.1254 CCOCCCN1CCCCCCC1 34a_100000211400_100012232248 [1,0,0,1,0,0|1,0,1]=4 18451 B14R1.1254 CCOCCNC1CCCCCCC1 2230a_100000211152_100011215890 [1,0,0,1,0,0|1,0,1]=4 18452 B14R1.1254 CCOCCNC1CCCCCCC1 270004a_102516460346_100000210524 [1,0,0,1,0,0|1,0,1]=4 18453 B14R1.1254 CCOCCNC1CCCCCCC1 34a_100000211152_100000210147 [1,0,0,1,0,0|1,0,1]=4 18454 B14R1.1254 CCOCCOC1CCCCCCC1 34a_100000210054_100000210147 [1,0,0,1,0,0|1,0,1]=4 18455 B14R1.1254 CCOCCOC1CCCCCCC1 7a_100000210054_100011215890 [1,0,0,1,0,0|1,0,1]=4 18456 B14R1.2352 CC/C=C\CCNC1CCCCCC1 2230a_100000210984_100015370543 [1,0,0,1,0,0|2,0,0]=4 18457 B14R1.2352 CC/C=C\CCNC1CCCCCC1 34a_100000210984_100015370543 [1,0,0,1,0,0|2,0,0]=4 18458 B14R1.2352 CC/C=C\CCOC1CCCCCC1 34a_100000210887_100015370543 [1,0,0,1,0,0|2,0,0]=4 18459 B14R1.2352 CC/C=C\CCOC1CCCCCC1 34a_100016288707_100011217769 [1,0,0,1,0,0|2,0,0]=4 18460 B14R1.2352 CC/C=C\CCOC1CCCCCC1 7a_100000210887_100015370543 [1,0,0,1,0,0|2,0,0]=4 18461 B14R1.2352 CC/C=C\CCSC1CCCCCC1 62a_100011217769_100015370543 [1,0,0,1,0,0|2,0,0]=4 18462 B14R1.2352 CC/C=C\CCSC1CCCCCC1 62a_100015370543_100011217769 [1,0,0,1,0,0|2,0,0]=4 18463 B14R1.2352 CC/C=C\CNCC1CCCCCC1 2230a_100015204231_100103147603 [1,0,0,1,0,0|2,0,0]=4 18464 B14R1.2352 CC/C=C\CNCC1CCCCCC1 34a_100015204231_100103147603 [1,0,0,1,0,0|2,0,0]=4 18465 B14R1.2352 CC/C=C\COCC1CCCCCC1 34a_100000699130_100103147603 [1,0,0,1,0,0|2,0,0]=4 18466 B14R1.2352 CC/C=C\COCC1CCCCCC1 34a_100016268518_200000696569 [1,0,0,1,0,0|2,0,0]=4 18467 B14R1.2352 CC/C=C\COCC1CCCCCC1 7a_100000699130_100103147603 [1,0,0,1,0,0|2,0,0]=4 18468 B14R1.2352 CC/C=C\CSCC1CCCCCC1 62a_100103147603_200000696569 [1,0,0,1,0,0|2,0,0]=4 18469 B14R1.2352 CC/C=C\CSCC1CCCCCC1 62a_200000696569_100103147603 [1,0,0,1,0,0|2,0,0]=4 18470 B14R1.2352 CCCCCCCN1CCCOCC1 2230a_100000685342_100000210681 [1,0,0,1,0,0|1,0,1]=4 18471 B14R1.2352 CCCCCCCN1CCCOCC1 269982a_100000685342_100000210681 [1,0,0,1,0,0|1,0,1]=4 18472 B14R1.2352 CCCCCCCN1CCCOCC1 34a_100000685342_100000210614 [1,0,0,1,0,0|1,0,1]=4 18473 B14R1.2352 CCOCCCCN1CCCCCC1 34a_100011305542_100000210202 [1,0,0,1,0,0|1,0,1]=4 18474 B14R1.2352 CCOCCCNC1CCCCCC1 2230a_100000210984_100012232248 [1,0,0,1,0,0|1,0,1]=4 18475 B14R1.2352 CCOCCCNC1CCCCCC1 270004a_100000210961_100000210131 [1,0,0,1,0,0|1,0,1]=4 18476 B14R1.2352 CCOCCCNC1CCCCCC1 34a_100000210961_100011217769 [1,0,0,1,0,0|1,0,1]=4 18477 B14R1.2352 CCOCCCNC1CCCCCC1 34a_100000210984_100012232248 [1,0,0,1,0,0|1,0,1]=4 18478 B14R1.2352 CCOCCCOC1CCCCCC1 34a_100000210887_100012232248 [1,0,0,1,0,0|1,0,1]=4 18479 B14R1.2352 CCOCCCOC1CCCCCC1 34a_100000757476_100011217769 [1,0,0,1,0,0|1,0,1]=4 18480 B14R1.2352 CCOCCCOC1CCCCCC1 7a_100000210887_100012232248 [1,0,0,1,0,0|1,0,1]=4 18481 B14R1.2352 CCOCCCSC1CCCCCC1 62a_100011217769_100012232248 [1,0,0,1,0,0|1,0,1]=4 18482 B14R1.2352 CCOCCCSC1CCCCCC1 62a_100012232248_100011217769 [1,0,0,1,0,0|1,0,1]=4 18483 B14R1.2352 CCOCCNCC1CCCCCC1 2230a_100015204231_100011215890 [1,0,0,1,0,0|1,0,1]=4 18484 B14R1.2352 CCOCCNCC1CCCCCC1 2230a_102516460346_200000696569 [1,0,0,1,0,0|1,0,1]=4 18485 B14R1.2352 CCOCCNCC1CCCCCC1 269862a_100011200944_200000763224 [1,0,0,1,0,0|1,0,1]=4 18486 B14R1.2352 CCOCCNCC1CCCCCC1 34a_100015204231_100000210147 [1,0,0,1,0,0|1,0,1]=4 18487 B14R1.2352 CCOCCNCC1CCCCCC1 34a_102516460346_200000696569 [1,0,0,1,0,0|1,0,1]=4 18488 B14R1.2352 CCOCCOCC1CCCCCC1 34a_100000210136_200000696569 [1,0,0,1,0,0|1,0,1]=4 18489 B14R1.2352 CCOCCOCC1CCCCCC1 34a_100000699130_100000210147 [1,0,0,1,0,0|1,0,1]=4 18490 B14R1.2352 CCOCCOCC1CCCCCC1 7a_100000210136_200000696569 [1,0,0,1,0,0|1,0,1]=4 18491 B14R1.2352 CCOCCOCC1CCCCCC1 7a_100000699130_100011215890 [1,0,0,1,0,0|1,0,1]=4 18492 B14R1.2352 CCOCCSCC1CCCCCC1 62a_100000210147_200000696569 [1,0,0,1,0,0|1,0,1]=4 18493 B14R1.2352 CCOCCSCC1CCCCCC1 62a_200000696569_100011215890 [1,0,0,1,0,0|1,0,1]=4 18494 B14R1.6533 CC/C=C\CN1CCCCCCCC1 2230a_100000039187_100103147603 [1,0,0,1,0,0|2,0,0]=4 18495 B14R1.6533 CC/C=C\CN1CCCCCCCC1 269982a_100000039187_100103147603 [1,0,0,1,0,0|2,0,0]=4 18496 B14R1.6533 CC/C=C\CN1CCCCCCCC1 34a_100000039187_100103147603 [1,0,0,1,0,0|2,0,0]=4 18497 B14R1.6533 CCOCCN1CCCCCCCC1 2230a_100000039187_100011215890 [1,0,0,1,0,0|1,0,1]=4 18498 B14R1.6533 CCOCCN1CCCCCCCC1 269982a_100000039187_100011215890 [1,0,0,1,0,0|1,0,1]=4 18499 B14R1.6533 CCOCCN1CCCCCCCC1 34a_100000039187_100000210147 [1,0,0,1,0,0|1,0,1]=4 18500 B16R1.889 CCCC(=O)CNCCN1CCCCC1C 2230a_100000739827_100000747444 [0,1,0,1,0,0|2,0,0]=4 18501 B16R1.889 CCCC(=O)CSCCC1CCCCN1C 62a_100000211948_100000747444 [0,1,0,1,0,0|2,0,0]=4 18502 B16R1.889 CCCC(=O)CSCCC1CCCCN1C 62a_100000747444_100000211948 [0,1,0,1,0,0|2,0,0]=4 18503 B16R1.889 CCCC(=O)NCCCN1CCCCC1C 240690a_100000212276_100000211992 [0,1,0,1,0,0|2,0,0]=4 18504 B16R1.889 CCCC(=O)NCCCN1CCCCC1C 527a_100000212276_100000211992 [0,1,0,1,0,0|2,0,0]=4 18505 B16R1.889 CCNC(=O)CCNCC1CCCCN1C 34a_100025743525_100015186950 [0,1,0,1,0,0|2,0,0]=4 18506 B16R1.889 CCNC(=O)CCSCC1CCCCN1C 62a_100000737597_100015185383 [0,1,0,1,0,0|2,0,0]=4 18507 B16R1.889 CCNC(=O)CCSCC1CCCCN1C 62a_100015185383_100000737597 [0,1,0,1,0,0|2,0,0]=4 18508 B16R1.889 CCNC(=O)CNCCC1CCCCN1C 2230a_100016988866_100000211948 [0,1,0,1,0,0|2,0,0]=4 18509 B16R1.889 CCNC(=O)CNCCN1CCCCC1C 2230a_100000739827_100000183381 [0,1,0,1,0,0|2,0,0]=4 18510 B16R1.889 CCNC(=O)CNCCN1CCCCC1C 34a_100000739827_100000183381 [0,1,0,1,0,0|2,0,0]=4 18511 B16R1.889 CCNC(=O)COCCN1CCCCC1C 34a_100011305533_100000183381 [0,1,0,1,0,0|2,0,0]=4 18512 B16R1.889 CCNC(=O)CSCCC1CCCCN1C 62a_100000183381_100000211948 [0,1,0,1,0,0|2,0,0]=4 18513 B16R1.889 CCNC(=O)CSCCC1CCCCN1C 62a_100000211948_100000183381 [0,1,0,1,0,0|2,0,0]=4 18514 B16R1.889 CCNC(=O)NCCCN1CCCCC1C 2708a_100015525214_100000212276 [0,1,0,1,0,0|2,0,0]=4 18515 B16R1.889 CCNC(=O)NCCCN1CCCCC1C 273464a_100000212276_100015525214 [0,1,0,1,0,0|2,0,0]=4 18516 B16R1.889 CCNC(=O)NCCCN1CCCCC1C 273464a_100015525214_100000212276 [0,1,0,1,0,0|2,0,0]=4 18517 B16R1.889 CCNC(=O)NCCCN1CCCCC1C 512a_100015525214_100000212276 [0,1,0,1,0,0|2,0,0]=4 18518 B16R1.889 CCOC(=O)/C=C/CNC1CCCCC1C 2230a_100000211402_100016267167 [0,1,0,1,0,0|0,0,2]=4 18519 B16R1.889 CCOC(=O)/C=C/CNC1CCCCC1C 34a_100000211402_100016267167 [0,1,0,1,0,0|0,0,2]=4 18520 B16R1.889 CCOC(=O)/C=C/COC1CCCCC1C 34a_100000211207_100016267167 [0,1,0,1,0,0|0,0,2]=4 18521 B16R1.889 CCOC(=O)/C=C/COC1CCCCC1C 7a_100000211207_100016267167 [0,1,0,1,0,0|0,0,2]=4 18522 B16R1.889 CCOC(=O)CCCCN1CCCCC1C 2230a_100000211376_100000750268 [0,1,0,1,0,0|0,0,0]=2 18523 B16R1.889 CCOC(=O)CCCCN1CCCCC1C 269982a_100000211376_100000750268 [0,1,0,1,0,0|0,0,0]=2 18524 B16R1.889 CCOC(=O)CCCCN1CCCCC1C 34a_100000211376_100000750268 [0,1,0,1,0,0|0,0,0]=2 18525 B16R1.889 CCOC(=O)CCCCN1CCOC[C@@H]1C 2230a_100009815349_100000750268 [0,1,0,1,0,0|1,0,0]=3 18526 B16R1.889 CCOC(=O)CCCCN1CCOC[C@@H]1C 269982a_100009815349_100000750268 [0,1,0,1,0,0|1,0,0]=3 18527 B16R1.889 CCOC(=O)CCCCN1CCOC[C@@H]1C 34a_100009815349_100000750268 [0,1,0,1,0,0|1,0,0]=3 18528 B16R1.889 CCOC(=O)CCCNC1CCCCC1C 2230a_100000211402_100009991533 [0,1,0,1,0,0|0,0,0]=2 18529 B16R1.889 CCOC(=O)CCCNC1CCCCC1C 34a_100000211402_100009991533 [0,1,0,1,0,0|0,0,0]=2 18530 B16R1.889 CCOC(=O)CCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100009991533 [0,1,0,1,0,0|1,0,0]=3 18531 B16R1.889 CCOC(=O)CCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100009991533 [0,1,0,1,0,0|1,0,0]=3 18532 B16R1.889 CCOC(=O)CCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100009991533 [0,1,0,1,0,0|2,0,0]=4 18533 B16R1.889 CCOC(=O)CCCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_100009991533 [0,1,0,1,0,0|2,0,0]=4 18534 B16R1.889 CCOC(=O)CCCN[C@H]1CCOC[C@@H]1F 34a_100016994078_100009991533 [0,1,0,1,0,0|2,0,0]=4 18535 B16R1.889 CCOC(=O)CCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100009991533 [0,1,0,1,0,0|2,0,0]=4 18536 B16R1.889 CCOC(=O)CCCOC1CCCCC1=O 34a_100011214950_100009991533 [0,1,0,1,0,0|1,0,1]=4 18537 B16R1.889 CCOC(=O)CCCOC1CCCCC1=O 7a_100012001163_100000204591 [0,1,0,1,0,0|1,0,1]=4 18538 B16R1.889 CCOC(=O)CCCOC1CCCCC1C 34a_100000211207_100009991533 [0,1,0,1,0,0|0,0,0]=2 18539 B16R1.889 CCOC(=O)CCCOC1CCCCC1C 7a_100000211207_100011215271 [0,1,0,1,0,0|0,0,0]=2 18540 B16R1.889 CCOC(=O)CCCOC1CCCCC1Cl 34a_100000038908_100009991533 [0,1,0,1,0,0|1,0,0]=3 18541 B16R1.889 CCOC(=O)CCCOC1CCCCC1Cl 7a_100000038908_100011215271 [0,1,0,1,0,0|1,0,0]=3 18542 B16R1.889 CCOC(=O)CCCOC1CCNCC1C 34a_100011998114_100009991533 [0,1,0,1,0,0|1,0,0]=3 18543 B16R1.889 CCOC(=O)CCCOC1CNCCC1C 34a_100000696640_100009991533 [0,1,0,1,0,0|1,0,0]=3 18544 B16R1.889 CCOC(=O)CCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100009991533 [0,1,0,1,0,0|1,0,0]=3 18545 B16R1.889 CCOC(=O)CCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100011215271 [0,1,0,1,0,0|1,0,0]=3 18546 B16R1.889 CCOC(=O)CCCO[C@@H]1CCNC[C@@H]1F 34a_200016994291_100009991533 [0,1,0,1,0,0|2,0,0]=4 18547 B16R1.889 CCOC(=O)CCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100009991533 [0,1,0,1,0,0|1,0,0]=3 18548 B16R1.889 CCOC(=O)CCCO[C@H]1CCOC[C@@H]1N 34a_100015739063_100009991533 [0,1,0,1,0,0|2,0,0]=4 18549 B16R1.889 CCOC(=O)CCCO[C@H]1COCC[C@H]1N 34a_100016994285_100009991533 [0,1,0,1,0,0|2,0,0]=4 18550 B16R1.889 CCOC(=O)CCCSC1CCCCC1=O 62a_100000204591_100009991533 [0,1,0,1,0,0|1,0,1]=4 18551 B16R1.889 CCOC(=O)CCCSC1CCCCC1=O 62a_100009991533_100000204591 [0,1,0,1,0,0|1,0,1]=4 18552 B16R1.889 CCOC(=O)CCCSC1CCCCC1F 62a_100009991533_100015423560 [0,1,0,1,0,0|1,0,0]=3 18553 B16R1.889 CCOC(=O)CCCSC1CCCCC1F 62a_100015423560_100009991533 [0,1,0,1,0,0|1,0,0]=3 18554 B16R1.889 CCOC(=O)CCCSC1CCCCC1O 62a_100000038908_100009991533 [0,1,0,1,0,0|1,0,0]=3 18555 B16R1.889 CCOC(=O)CCCSC1CCCCC1O 62a_100009991533_100000038908 [0,1,0,1,0,0|1,0,0]=3 18556 B16R1.889 CCOC(=O)CCNCC1CCCCC1O 34a_100011216029_100000765890 [0,1,0,1,0,0|1,0,0]=3 18557 B16R1.889 CCOC(=O)CCNCC1CCCCN1C 34a_100011228421_100000765890 [0,1,0,1,0,0|1,0,0]=3 18558 B16R1.889 CCOC(=O)CCOCC1CC=CCC1C 34a_100000211322_100000765890 [0,1,0,1,0,0|0,0,2]=4 18559 B16R1.889 CCOC(=O)CCOCC1CCCCC1=O 34a_100009861125_100000765890 [0,1,0,1,0,0|1,0,1]=4 18560 B16R1.889 CCOC(=O)CCOCC1CCCCC1=O 7a_100009861125_100011206558 [0,1,0,1,0,0|1,0,1]=4 18561 B16R1.889 CCOC(=O)CCOCC1CCCCN1C 34a_100000225079_100000765890 [0,1,0,1,0,0|1,0,0]=3 18562 B16R1.889 CCOC(=O)CCOCC1COCCC1N 34a_214813039666_100000765890 [0,1,0,1,0,0|2,0,0]=4 18563 B16R1.889 CCOC(=O)CCOCC1COCCN1C 34a_100013547906_100000765890 [0,1,0,1,0,0|2,0,0]=4 18564 B16R1.889 CCOC(=O)CCSCC1CCCCN1C 62a_100000765890_100015185383 [0,1,0,1,0,0|1,0,0]=3 18565 B16R1.889 CCOC(=O)CCSCC1CCCCN1C 62a_100015185383_100000765890 [0,1,0,1,0,0|1,0,0]=3 18566 B16R1.889 CCOC(=O)CNCCN1CCCCC1C 2230a_100000739827_100000188475 [0,1,0,1,0,0|1,0,0]=3 18567 B16R1.889 CCOC(=O)CNCCN1CCCCC1C 34a_100000739827_100000188475 [0,1,0,1,0,0|1,0,0]=3 18568 B16R1.889 CCOC(=O)COCCN1CCCCC1C 2230a_100000211376_100000088970 [0,1,0,1,0,0|1,0,0]=3 18569 B16R1.889 CCOC(=O)COCCN1CCCCC1C 269982a_100000211376_100000088970 [0,1,0,1,0,0|1,0,0]=3 18570 B16R1.889 CCOC(=O)COCCN1CCCCC1C 34a_100000211376_100000088970 [0,1,0,1,0,0|1,0,0]=3 18571 B16R1.889 CCOC(=O)COCCN1CCCCC1C 34a_100011305533_100000188475 [0,1,0,1,0,0|1,0,0]=3 18572 B16R1.889 CCOC(=O)COCCN1CCOC[C@@H]1C 2230a_100009815349_100000088970 [0,1,0,1,0,0|2,0,0]=4 18573 B16R1.889 CCOC(=O)COCCN1CCOC[C@@H]1C 269982a_100009815349_100000088970 [0,1,0,1,0,0|2,0,0]=4 18574 B16R1.889 CCOC(=O)COCCN1CCOC[C@@H]1C 34a_100009815349_100000088970 [0,1,0,1,0,0|2,0,0]=4 18575 B16R1.889 CCOC(=O)CSCCC1CCCCN1C 62a_100000188475_100000211948 [0,1,0,1,0,0|1,0,0]=3 18576 B16R1.889 CCOC(=O)CSCCC1CCCCN1C 62a_100000211948_100000188475 [0,1,0,1,0,0|1,0,0]=3 18577 B16R1.889 CCOC(=O)NCCOC1CCCCC1C 7a_100000211207_200011445536 [0,1,0,1,0,0|1,0,0]=3 18578 B16R1.889 CCOC(=O)NCCOC1CCCCC1Cl 7a_100000038908_200011445536 [0,1,0,1,0,0|2,0,0]=4 18579 B16R1.889 CCOC(=O)NCCOC1CCCCC1F 34a_100000158857_100015423560 [0,1,0,1,0,0|2,0,0]=4 18580 B16R1.889 CCOC(=O)NCCOC1CCCCC1O 34a_100000158857_100000038908 [0,1,0,1,0,0|2,0,0]=4 18581 B16R1.889 CCOC(=O)NCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_200011445536 [0,1,0,1,0,0|2,0,0]=4 18582 B16R1.889 CCOC(=O)NCCSC1CCCCC1F 62a_100015423560_200011445536 [0,1,0,1,0,0|2,0,0]=4 18583 B16R1.889 CCOC(=O)NCCSC1CCCCC1O 62a_100000038908_200011445536 [0,1,0,1,0,0|2,0,0]=4 18584 B16R1.889 CCOC(=O)OCSCC1CCCCN1C 62a_100015185383_100000075025 [0,1,0,1,0,0|2,0,0]=4 18585 B16R1.924 CCOC(=O)CCN1CCN(CC1CC)C 2230a_100011941019_100011206558 [0,1,0,1,0,0|2,0,0]=4 18586 B16R1.924 CCOC(=O)CCN1CCN(CC1CC)C 269982a_100011941019_100011206558 [0,1,0,1,0,0|2,0,0]=4 18587 B16R1.931 CCOC(=O)CCCCCN1CCC(C1)O 2230a_100011215560_100000755133 [0,1,0,1,0,0|1,0,0]=3 18588 B16R1.931 CCOC(=O)CCCCCN1CCC(C1)O 269982a_100011215560_100000755133 [0,1,0,1,0,0|1,0,0]=3 18589 B16R1.931 CCOC(=O)CCCCCN1CC[C@@H](C1)F 2230a_100015203821_100000755133 [0,1,0,1,0,0|1,0,0]=3 18590 B16R1.931 CCOC(=O)CCCCCN1CC[C@@H](C1)F 269982a_100015203821_100000755133 [0,1,0,1,0,0|1,0,0]=3 18591 B16R1.931 CCOC(=O)CCCCCN1CC[C@@H](C1)F 34a_100015203821_100000755133 [0,1,0,1,0,0|1,0,0]=3 18592 B16R1.931 CCOC(=O)CCCCCN1CC[C@H](C1)C 2230a_100016987628_100000755133 [0,1,0,1,0,0|1,0,0]=3 18593 B16R1.931 CCOC(=O)CCCCCN1CC[C@H](C1)C 269982a_100016987628_100000755133 [0,1,0,1,0,0|1,0,0]=3 18594 B16R1.931 CCOC(=O)CCCCCN1CC[C@H](C1)C 34a_100016987628_100000755133 [0,1,0,1,0,0|1,0,0]=3 18595 B16R1.931 CCOC(=O)CCCCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000750268 [0,1,0,1,0,0|1,0,0]=3 18596 B16R1.931 CCOC(=O)CCCCOC1CCC(=O)C1 34a_100012614533_100000750268 [0,1,0,1,0,0|1,0,1]=4 18597 B16R1.931 CCOC(=O)CCCCOC1CCC(C1)C 34a_100000698185_100000750268 [0,1,0,1,0,0|1,0,0]=3 18598 B16R1.931 CCOC(=O)CCCCSC1CCN(C1)C 62a_100000750268_200012183744 [0,1,0,1,0,0|2,0,0]=4 18599 B16R1.931 CCOC(=O)CCCOCC1CCN(C1)C 7a_100012001163_200000690779 [0,1,0,1,0,0|2,0,0]=4 18600 B16R1.931 CCOC(=O)CCCOC[C@@H]1C[C@@H](CN1)F 34a_100015204000_100009991533 [0,1,0,1,0,0|2,0,0]=4 18601 B16R1.931 CCOC(=O)CCCSCC1CCN(C1)C 62a_100009991533_200000690779 [0,1,0,1,0,0|2,0,0]=4 18602 B16R1.931 CCOC(=O)CCCSCC1CCN(C1)C 62a_200000690779_100009991533 [0,1,0,1,0,0|2,0,0]=4 18603 B16R1.931 CCOC(=O)COCCCN1CCC(C1)O 2230a_100011215560_100009893628 [0,1,0,1,0,0|2,0,0]=4 18604 B16R1.931 CCOC(=O)COCCCN1CCC(C1)O 269982a_100011215560_100009893628 [0,1,0,1,0,0|2,0,0]=4 18605 B16R1.931 CCOC(=O)COCCCN1CC[C@@H](C1)F 2230a_100015203821_100009893628 [0,1,0,1,0,0|2,0,0]=4 18606 B16R1.931 CCOC(=O)COCCCN1CC[C@@H](C1)F 269982a_100015203821_100009893628 [0,1,0,1,0,0|2,0,0]=4 18607 B16R1.931 CCOC(=O)COCCCN1CC[C@@H](C1)F 34a_100015203821_100009893628 [0,1,0,1,0,0|2,0,0]=4 18608 B16R1.931 CCOC(=O)COCCCN1CC[C@H](C1)C 2230a_100016987628_100009893628 [0,1,0,1,0,0|2,0,0]=4 18609 B16R1.931 CCOC(=O)COCCCN1CC[C@H](C1)C 269982a_100016987628_100009893628 [0,1,0,1,0,0|2,0,0]=4 18610 B16R1.931 CCOC(=O)COCCCN1CC[C@H](C1)C 34a_100016987628_100009893628 [0,1,0,1,0,0|2,0,0]=4 18611 B16R1.931 CCOC(=O)COCCN[C@H]1CC[C@H](C1)O 2230a_100015195300_100000088970 [0,1,0,1,0,0|2,0,0]=4 18612 B16R1.931 CCOC(=O)COCCOC1CCC(C1)C 34a_100000698185_100000088970 [0,1,0,1,0,0|2,0,0]=4 18613 B16R1.932 C=COC(=O)CNCCCC1CCCCC1 2230a_100011211642_100000036128 [0,1,0,1,0,0|0,0,2]=4 18614 B16R1.932 C=COC(=O)CNCCCC1CCCCC1 34a_100011211642_100000036128 [0,1,0,1,0,0|0,0,2]=4 18615 B16R1.932 C=COC(=O)COCCCC1CCCCC1 34a_100000198086_100000036128 [0,1,0,1,0,0|0,0,2]=4 18616 B16R1.932 C=COC(=O)CSCCCC1CCCCC1 62a_100000036128_100011713725 [0,1,0,1,0,0|0,0,2]=4 18617 B16R1.932 C=COC(=O)CSCCCC1CCCCC1 62a_100011713725_100000036128 [0,1,0,1,0,0|0,0,2]=4 18618 B16R1.932 CCCC(=O)CCCCCN1CCCCC1 1458a_100012051570_100000210303 [0,1,0,1,0,0|1,0,0]=3 18619 B16R1.932 CCCC(=O)CCCCCN1CCOCC1 1458a_100012051560_100000210303 [0,1,0,1,0,0|2,0,0]=4 18620 B16R1.932 CCCC(=O)CCCCOC1CCCCO1 1458a_100000211992_100000031530 [0,1,0,1,0,0|2,0,0]=4 18621 B16R1.932 CCCC(=O)CNCCCC1CCCCC1 2230a_100011211642_100000747444 [0,1,0,1,0,0|1,0,0]=3 18622 B16R1.932 CCCC(=O)COCCCC1CCCCC1 7a_100000198086_100000747444 [0,1,0,1,0,0|1,0,0]=3 18623 B16R1.932 CCCC(=O)COCCOC1CCCCC1 7a_100011249652_100000747444 [0,1,0,1,0,0|2,0,0]=4 18624 B16R1.932 CCCC(=O)CSCCCC1CCCCC1 62a_100000747444_100011713725 [0,1,0,1,0,0|1,0,0]=3 18625 B16R1.932 CCCC(=O)CSCCCC1CCCCC1 62a_100011713725_100000747444 [0,1,0,1,0,0|1,0,0]=3 18626 B16R1.932 CCCC(=O)CSCCCN1CCCCC1 62a_100000747444_100000007876 [0,1,0,1,0,0|2,0,0]=4 18627 B16R1.932 CCCC(=O)CSCCCN1CCCCC1 62a_100132302099_100000747444 [0,1,0,1,0,0|2,0,0]=4 18628 B16R1.932 CCCC(=O)CSCCOC1CCCCC1 62a_100000747444_100011211530 [0,1,0,1,0,0|2,0,0]=4 18629 B16R1.932 CCCC(=O)CSCCOC1CCCCC1 62a_100011211530_100000747444 [0,1,0,1,0,0|2,0,0]=4 18630 B16R1.932 CCCC(=O)NCCCCN1CCCCC1 240690a_200011207366_100000211992 [0,1,0,1,0,0|2,0,0]=4 18631 B16R1.932 CCCC(=O)NCCCOC1CCCCC1 11a_100000205933_100000211992 [0,1,0,1,0,0|2,0,0]=4 18632 B16R1.932 CCCC(=O)NCCCOC1CCCCC1 1626a_100000205933_100000211992 [0,1,0,1,0,0|2,0,0]=4 18633 B16R1.932 CCCC(=O)NCCCOC1CCCCC1 240690a_100000205933_100000211992 [0,1,0,1,0,0|2,0,0]=4 18634 B16R1.932 CCCC(=O)NCCCOC1CCCCC1 527a_100000205933_100000211992 [0,1,0,1,0,0|2,0,0]=4 18635 B16R1.932 CCCC(=O)OCNCCC1CCCCC1 2230a_100000738074_100000034017 [0,1,0,1,0,0|2,0,0]=4 18636 B16R1.932 CCCC(=O)OCNCCC1CCCCC1 34a_100000738074_100000034017 [0,1,0,1,0,0|2,0,0]=4 18637 B16R1.932 CCCC(=O)OCOCCC1CCCCC1 34a_100011217863_100000034017 [0,1,0,1,0,0|2,0,0]=4 18638 B16R1.932 CCCC(=O)OCSCCC1CCCCC1 62a_100012355289_100000034017 [0,1,0,1,0,0|2,0,0]=4 18639 B16R1.932 CCNC(=O)CCCCCN1CCCCC1 11a_100015525214_100012051570 [0,1,0,1,0,0|1,0,0]=3 18640 B16R1.932 CCNC(=O)CCCCCN1CCCCC1 240690a_100015525214_100012051570 [0,1,0,1,0,0|1,0,0]=3 18641 B16R1.932 CCNC(=O)CCCCCN1CCOCC1 11a_100015525214_100012051560 [0,1,0,1,0,0|2,0,0]=4 18642 B16R1.932 CCNC(=O)CCCCCN1CCOCC1 240690a_100015525214_100012051560 [0,1,0,1,0,0|2,0,0]=4 18643 B16R1.932 CCNC(=O)CCNCCC1CCCCC1 2230a_100000738074_100000737597 [0,1,0,1,0,0|1,0,0]=3 18644 B16R1.932 CCNC(=O)CCNCCC1CCCCC1 270004a_100025743525_100011713444 [0,1,0,1,0,0|1,0,0]=3 18645 B16R1.932 CCNC(=O)CCNCCC1CCCCC1 34a_100025743525_100011209188 [0,1,0,1,0,0|1,0,0]=3 18646 B16R1.932 CCNC(=O)CCNCCC1CCCCO1 2230a_100015183643_100000737597 [0,1,0,1,0,0|2,0,0]=4 18647 B16R1.932 CCNC(=O)CCNCCC1CCOCC1 2230a_100000755988_100000737597 [0,1,0,1,0,0|2,0,0]=4 18648 B16R1.932 CCNC(=O)CCNCCC1CCOCC1 34a_100025743525_100011934994 [0,1,0,1,0,0|2,0,0]=4 18649 B16R1.932 CCNC(=O)CCNCCN1CCCCC1 34a_100025743525_100000739454 [0,1,0,1,0,0|2,0,0]=4 18650 B16R1.932 CCNC(=O)CCNCOC1CCCCC1 34a_100025743525_100011935260 [0,1,0,1,0,0|2,0,0]=4 18651 B16R1.932 CCNC(=O)CCOCCC1CCCCC1 7a_100011217863_100000737597 [0,1,0,1,0,0|1,0,0]=3 18652 B16R1.932 CCNC(=O)CCOCCC1CCOCC1 7a_100011933979_100000737597 [0,1,0,1,0,0|2,0,0]=4 18653 B16R1.932 CCNC(=O)CCSCCC1CCCCC1 62a_100000737597_100012355289 [0,1,0,1,0,0|1,0,0]=3 18654 B16R1.932 CCNC(=O)CCSCCC1CCCCC1 62a_100012355289_100000737597 [0,1,0,1,0,0|1,0,0]=3 18655 B16R1.932 CCNC(=O)CCSCCC1CCOCC1 62a_100000737597_100011934994 [0,1,0,1,0,0|2,0,0]=4 18656 B16R1.932 CCNC(=O)CCSCCC1CCOCC1 62a_100011934994_100000737597 [0,1,0,1,0,0|2,0,0]=4 18657 B16R1.932 CCNC(=O)CCSCCN1CCCCC1 62a_100000737597_100000739454 [0,1,0,1,0,0|2,0,0]=4 18658 B16R1.932 CCNC(=O)CCSCCN1CCCCC1 62a_100000739454_100000737597 [0,1,0,1,0,0|2,0,0]=4 18659 B16R1.932 CCNC(=O)CCSCOC1CCCCC1 62a_100000737597_100011935260 [0,1,0,1,0,0|2,0,0]=4 18660 B16R1.932 CCNC(=O)CCSCOC1CCCCC1 62a_100011935260_100000737597 [0,1,0,1,0,0|2,0,0]=4 18661 B16R1.932 CCNC(=O)CNCCCC1CCCCC1 2230a_100011211642_100000183381 [0,1,0,1,0,0|1,0,0]=3 18662 B16R1.932 CCNC(=O)CNCCCC1CCCCC1 2230a_100016988866_100011713725 [0,1,0,1,0,0|1,0,0]=3 18663 B16R1.932 CCNC(=O)CNCCCC1CCCCC1 34a_100011211642_100000183381 [0,1,0,1,0,0|1,0,0]=3 18664 B16R1.932 CCNC(=O)CNCCCN1CCCCC1 2230a_100016988866_100000690320 [0,1,0,1,0,0|2,0,0]=4 18665 B16R1.932 CCNC(=O)CNCCOC1CCCCC1 2230a_100016988866_100011211530 [0,1,0,1,0,0|2,0,0]=4 18666 B16R1.932 CCNC(=O)CNCCOC1CCCCC1 34a_100015206981_100000183381 [0,1,0,1,0,0|2,0,0]=4 18667 B16R1.932 CCNC(=O)COCCCC1CCCCC1 34a_100000198086_100000183381 [0,1,0,1,0,0|1,0,0]=3 18668 B16R1.932 CCNC(=O)COCCCC1CCCCC1 7a_100000198086_100000183381 [0,1,0,1,0,0|1,0,0]=3 18669 B16R1.932 CCNC(=O)COCCCC1CCCCN1 34a_100011934581_100000183381 [0,1,0,1,0,0|2,0,0]=4 18670 B16R1.932 CCNC(=O)COCCCC1CCCNC1 34a_100150707839_100000183381 [0,1,0,1,0,0|2,0,0]=4 18671 B16R1.932 CCNC(=O)COCCCC1CCNCC1 34a_100016988962_100000183381 [0,1,0,1,0,0|2,0,0]=4 18672 B16R1.932 CCNC(=O)COCCCN1CCCCC1 34a_100000212458_100000183381 [0,1,0,1,0,0|2,0,0]=4 18673 B16R1.932 CCNC(=O)COCCNC1CCCCC1 34a_100000200466_100000183381 [0,1,0,1,0,0|2,0,0]=4 18674 B16R1.932 CCNC(=O)COCCOC1CCCCC1 34a_100011249652_100000183381 [0,1,0,1,0,0|2,0,0]=4 18675 B16R1.932 CCNC(=O)COCCOC1CCCCC1 7a_100011249652_100000183381 [0,1,0,1,0,0|2,0,0]=4 18676 B16R1.932 CCNC(=O)CSCCCC1CCCCC1 62a_100000183381_100011713725 [0,1,0,1,0,0|1,0,0]=3 18677 B16R1.932 CCNC(=O)CSCCCC1CCCCC1 62a_100011713725_100000183381 [0,1,0,1,0,0|1,0,0]=3 18678 B16R1.932 CCNC(=O)CSCCCN1CCCCC1 62a_100000183381_100000007876 [0,1,0,1,0,0|2,0,0]=4 18679 B16R1.932 CCNC(=O)CSCCCN1CCCCC1 62a_100132302099_100000183381 [0,1,0,1,0,0|2,0,0]=4 18680 B16R1.932 CCNC(=O)CSCCOC1CCCCC1 62a_100000183381_100011211530 [0,1,0,1,0,0|2,0,0]=4 18681 B16R1.932 CCNC(=O)CSCCOC1CCCCC1 62a_100011211530_100000183381 [0,1,0,1,0,0|2,0,0]=4 18682 B16R1.932 CCNC(=O)NCCCCN1CCCCC1 2708a_100015525214_200011207366 [0,1,0,1,0,0|2,0,0]=4 18683 B16R1.932 CCNC(=O)NCCCCN1CCCCC1 2708a_200011207366_100015525214 [0,1,0,1,0,0|2,0,0]=4 18684 B16R1.932 CCNC(=O)NCCCCN1CCCCC1 273464a_100015525214_200011207366 [0,1,0,1,0,0|2,0,0]=4 18685 B16R1.932 CCNC(=O)NCCCCN1CCCCC1 273464a_200011207366_100015525214 [0,1,0,1,0,0|2,0,0]=4 18686 B16R1.932 CCNC(=O)NCCCCN1CCCCC1 512a_100015525214_200011207366 [0,1,0,1,0,0|2,0,0]=4 18687 B16R1.932 CCNC(=O)NCCCOC1CCCCC1 2708a_100000205933_100015525214 [0,1,0,1,0,0|2,0,0]=4 18688 B16R1.932 CCNC(=O)NCCCOC1CCCCC1 2708a_100015525214_100000205933 [0,1,0,1,0,0|2,0,0]=4 18689 B16R1.932 CCNC(=O)NCCCOC1CCCCC1 273464a_100000205933_100015525214 [0,1,0,1,0,0|2,0,0]=4 18690 B16R1.932 CCNC(=O)NCCCOC1CCCCC1 273464a_100015525214_100000205933 [0,1,0,1,0,0|2,0,0]=4 18691 B16R1.932 CCNC(=O)NCCCOC1CCCCC1 512a_100000205933_100015525214 [0,1,0,1,0,0|2,0,0]=4 18692 B16R1.932 CCNC(=O)NCCCOC1CCCCC1 512a_100015525214_100000205933 [0,1,0,1,0,0|2,0,0]=4 18693 B16R1.932 CCOC(=O)/C=C/CNCC1CCCCC1 2230a_100000210473_100016267167 [0,1,0,1,0,0|0,0,2]=4 18694 B16R1.932 CCOC(=O)/C=C/CNCC1CCCCC1 34a_100000210473_100016267167 [0,1,0,1,0,0|0,0,2]=4 18695 B16R1.932 CCOC(=O)/C=C/COCC1CCCCC1 34a_100000212181_100016267167 [0,1,0,1,0,0|0,0,2]=4 18696 B16R1.932 CCOC(=O)/C=C/COCC1CCCCC1 7a_100000212181_100016267167 [0,1,0,1,0,0|0,0,2]=4 18697 B16R1.932 CCOC(=O)/C=C/CSCC1CCCCC1 62a_100000211423_100016267167 [0,1,0,1,0,0|0,0,2]=4 18698 B16R1.932 CCOC(=O)/C=C/CSCC1CCCCC1 62a_100016267167_100000211423 [0,1,0,1,0,0|0,0,2]=4 18699 B16R1.932 CCOC(=O)CCCCCN1CC=CCC1 2230a_100000698166_100000755133 [0,1,0,1,0,0|0,0,2]=4 18700 B16R1.932 CCOC(=O)CCCCCN1CC=CCC1 269982a_100000698166_100000755133 [0,1,0,1,0,0|0,0,2]=4 18701 B16R1.932 CCOC(=O)CCCCCN1CC=CCC1 34a_100000698166_100000755133 [0,1,0,1,0,0|0,0,2]=4 18702 B16R1.932 CCOC(=O)CCCCCN1CCCOC1 2230a_100000131196_100000755133 [0,1,0,1,0,0|1,0,0]=3 18703 B16R1.932 CCOC(=O)CCCCCN1CCCOC1 269982a_100000131196_100000755133 [0,1,0,1,0,0|1,0,0]=3 18704 B16R1.932 CCOC(=O)CCCCCN1CCCOC1 34a_100000131196_100000755133 [0,1,0,1,0,0|1,0,0]=3 18705 B16R1.932 CCOC(=O)CCCCCN1CCOCC1 2230a_100015191051_100000755133 [0,1,0,1,0,0|1,0,0]=3 18706 B16R1.932 CCOC(=O)CCCCCN1CCOCC1 269982a_100015191051_100000755133 [0,1,0,1,0,0|1,0,0]=3 18707 B16R1.932 CCOC(=O)CCCCCN1CCOCC1 34a_100015191051_100000755133 [0,1,0,1,0,0|1,0,0]=3 18708 B16R1.932 CCOC(=O)CCCCCN1CCSCC1 2230a_100000737611_100000755133 [0,1,0,1,0,0|1,0,0]=3 18709 B16R1.932 CCOC(=O)CCCCCN1CCSCC1 269982a_100000737611_100000755133 [0,1,0,1,0,0|1,0,0]=3 18710 B16R1.932 CCOC(=O)CCCCNC1CCCCC1 2230a_100000182618_100000750268 [0,1,0,1,0,0|0,0,0]=2 18711 B16R1.932 CCOC(=O)CCCCNC1CCCCC1 34a_100000182618_100000750268 [0,1,0,1,0,0|0,0,0]=2 18712 B16R1.932 CCOC(=O)CCCCNC1CCCOC1 2230a_100000719290_100000750268 [0,1,0,1,0,0|1,0,0]=3 18713 B16R1.932 CCOC(=O)CCCCNC1CCCOC1 34a_100000719290_100000750268 [0,1,0,1,0,0|1,0,0]=3 18714 B16R1.932 CCOC(=O)CCCCNC1CCOCC1 2230a_100000741149_100000750268 [0,1,0,1,0,0|1,0,0]=3 18715 B16R1.932 CCOC(=O)CCCCNC1CCOCC1 34a_100000741149_100000750268 [0,1,0,1,0,0|1,0,0]=3 18716 B16R1.932 CCOC(=O)CCCCNC1CCSCC1 2230a_100000748639_100000750268 [0,1,0,1,0,0|1,0,0]=3 18717 B16R1.932 CCOC(=O)CCCCNC1CCSCC1 34a_100000748639_100000750268 [0,1,0,1,0,0|1,0,0]=3 18718 B16R1.932 CCOC(=O)CCCCOC1C=CCCC1 34a_100011215024_100000750268 [0,1,0,1,0,0|0,0,2]=4 18719 B16R1.932 CCOC(=O)CCCCOC1CC=CCC1 34a_100000073881_100000750268 [0,1,0,1,0,0|0,0,2]=4 18720 B16R1.932 CCOC(=O)CCCCOC1CCCCC1 34a_100000210231_100000750268 [0,1,0,1,0,0|0,0,0]=2 18721 B16R1.932 CCOC(=O)CCCCOC1CCCCC1 7a_100000210231_100000750268 [0,1,0,1,0,0|0,0,0]=2 18722 B16R1.932 CCOC(=O)CCCCOC1CCCCO1 34a_100000033831_100000750268 [0,1,0,1,0,0|1,0,0]=3 18723 B16R1.932 CCOC(=O)CCCCOC1CCCOC1 34a_100000754041_100000750268 [0,1,0,1,0,0|1,0,0]=3 18724 B16R1.932 CCOC(=O)CCCCOC1CCCSC1 7a_100015962668_100000750268 [0,1,0,1,0,0|1,0,0]=3 18725 B16R1.932 CCOC(=O)CCCCOC1CCOCC1 34a_100000744328_100000750268 [0,1,0,1,0,0|1,0,0]=3 18726 B16R1.932 CCOC(=O)CCCCOC1CCSCC1 34a_100000731022_100000750268 [0,1,0,1,0,0|1,0,0]=3 18727 B16R1.932 CCOC(=O)CCCCOC1CCSCC1 7a_100000731022_100000750268 [0,1,0,1,0,0|1,0,0]=3 18728 B16R1.932 CCOC(=O)CCCCSC1C=CCCC1 62a_100000750268_100000751183 [0,1,0,1,0,0|0,0,2]=4 18729 B16R1.932 CCOC(=O)CCCCSC1C=CCCC1 62a_100000751183_100000750268 [0,1,0,1,0,0|0,0,2]=4 18730 B16R1.932 CCOC(=O)CCCCSC1CCCCC1 62a_100000210327_100000750268 [0,1,0,1,0,0|0,0,0]=2 18731 B16R1.932 CCOC(=O)CCCCSC1CCCCC1 62a_100000750268_100000210327 [0,1,0,1,0,0|0,0,0]=2 18732 B16R1.932 CCOC(=O)CCCCSC1CCCOC1 62a_100000750268_100000693364 [0,1,0,1,0,0|1,0,0]=3 18733 B16R1.932 CCOC(=O)CCCCSC1CCOCC1 62a_100000750268_100011324220 [0,1,0,1,0,0|1,0,0]=3 18734 B16R1.932 CCOC(=O)CCCCSC1CCSCC1 62a_100000750268_100000069128 [0,1,0,1,0,0|1,0,0]=3 18735 B16R1.932 CCOC(=O)CCCNCC1CCCCC1 2230a_100000210473_100009991533 [0,1,0,1,0,0|0,0,0]=2 18736 B16R1.932 CCOC(=O)CCCNCC1CCCCC1 34a_100000210473_100009991533 [0,1,0,1,0,0|0,0,0]=2 18737 B16R1.932 CCOC(=O)CCCNCC1CCCCO1 2230a_100000174945_100009991533 [0,1,0,1,0,0|1,0,0]=3 18738 B16R1.932 CCOC(=O)CCCNCC1CCCCO1 34a_100000174945_100009991533 [0,1,0,1,0,0|1,0,0]=3 18739 B16R1.932 CCOC(=O)CCCNCC1CCCOC1 2230a_100000720124_100009991533 [0,1,0,1,0,0|1,0,0]=3 18740 B16R1.932 CCOC(=O)CCCNCC1CCCOC1 34a_100000720124_100009991533 [0,1,0,1,0,0|1,0,0]=3 18741 B16R1.932 CCOC(=O)CCCNCC1CCOCC1 2230a_100000746373_100009991533 [0,1,0,1,0,0|1,0,0]=3 18742 B16R1.932 CCOC(=O)CCCNCC1CCOCC1 34a_100000746373_100009991533 [0,1,0,1,0,0|1,0,0]=3 18743 B16R1.932 CCOC(=O)CCCNCC1CCSCC1 2230a_100015188806_100009991533 [0,1,0,1,0,0|1,0,0]=3 18744 B16R1.932 CCOC(=O)CCCNCC1CCSCC1 34a_100015188806_100009991533 [0,1,0,1,0,0|1,0,0]=3 18745 B16R1.932 CCOC(=O)CCCNC[C@H]1COCCO1 2230a_100010981119_100009991533 [0,1,0,1,0,0|2,0,0]=4 18746 B16R1.932 CCOC(=O)CCCNC[C@H]1COCCO1 34a_100010981119_100009991533 [0,1,0,1,0,0|2,0,0]=4 18747 B16R1.932 CCOC(=O)CCCOCC1CC=CCC1 34a_100000210713_100009991533 [0,1,0,1,0,0|0,0,2]=4 18748 B16R1.932 CCOC(=O)CCCOCC1CCCCC1 34a_100000212181_100009991533 [0,1,0,1,0,0|0,0,0]=2 18749 B16R1.932 CCOC(=O)CCCOCC1CCCCC1 7a_100000212181_100011215271 [0,1,0,1,0,0|0,0,0]=2 18750 B16R1.932 CCOC(=O)CCCOCC1CCCCC1 7a_100012001163_100000211423 [0,1,0,1,0,0|0,0,0]=2 18751 B16R1.932 CCOC(=O)CCCOCC1CCCCN1 34a_100000210821_100009991533 [0,1,0,1,0,0|1,0,0]=3 18752 B16R1.932 CCOC(=O)CCCOCC1CCCCO1 34a_100000211370_100009991533 [0,1,0,1,0,0|1,0,0]=3 18753 B16R1.932 CCOC(=O)CCCOCC1CCCCO1 7a_100000211370_100011215271 [0,1,0,1,0,0|1,0,0]=3 18754 B16R1.932 CCOC(=O)CCCOCC1CCCCO1 7a_100012001163_100000211543 [0,1,0,1,0,0|1,0,0]=3 18755 B16R1.932 CCOC(=O)CCCOCC1CCCNC1 34a_100000211344_100009991533 [0,1,0,1,0,0|1,0,0]=3 18756 B16R1.932 CCOC(=O)CCCOCC1CCCOC1 34a_100000741520_100009991533 [0,1,0,1,0,0|1,0,0]=3 18757 B16R1.932 CCOC(=O)CCCOCC1CCCOC1 7a_100012001163_100000741521 [0,1,0,1,0,0|1,0,0]=3 18758 B16R1.932 CCOC(=O)CCCOCC1CCNCC1 34a_100000738675_100009991533 [0,1,0,1,0,0|1,0,0]=3 18759 B16R1.932 CCOC(=O)CCCOCC1CCOCC1 34a_100000749013_100009991533 [0,1,0,1,0,0|1,0,0]=3 18760 B16R1.932 CCOC(=O)CCCOCC1CCOCC1 7a_100012001163_100000754603 [0,1,0,1,0,0|1,0,0]=3 18761 B16R1.932 CCOC(=O)CCCOCC1CCSCC1 34a_100000070558_100009991533 [0,1,0,1,0,0|1,0,0]=3 18762 B16R1.932 CCOC(=O)CCCOCC1CCSCC1 7a_100000070558_100011215271 [0,1,0,1,0,0|1,0,0]=3 18763 B16R1.932 CCOC(=O)CCCOC[C@@H]1CNCCO1 34a_100015189573_100009991533 [0,1,0,1,0,0|2,0,0]=4 18764 B16R1.932 CCOC(=O)CCCOC[C@@H]1COCCN1 34a_100000717676_100009991533 [0,1,0,1,0,0|2,0,0]=4 18765 B16R1.932 CCOC(=O)CCCOC[C@H]1COCCO1 34a_100009875890_100009991533 [0,1,0,1,0,0|2,0,0]=4 18766 B16R1.932 CCOC(=O)CCCSCC1CCCCC1 62a_100000211423_100009991533 [0,1,0,1,0,0|0,0,0]=2 18767 B16R1.932 CCOC(=O)CCCSCC1CCCCC1 62a_100009991533_100000211423 [0,1,0,1,0,0|0,0,0]=2 18768 B16R1.932 CCOC(=O)CCCSCC1CCCCO1 62a_100000211543_100009991533 [0,1,0,1,0,0|1,0,0]=3 18769 B16R1.932 CCOC(=O)CCCSCC1CCCCO1 62a_100009991533_100000211543 [0,1,0,1,0,0|1,0,0]=3 18770 B16R1.932 CCOC(=O)CCCSCC1CCCOC1 62a_100000741521_100009991533 [0,1,0,1,0,0|1,0,0]=3 18771 B16R1.932 CCOC(=O)CCCSCC1CCCOC1 62a_100009991533_100000741521 [0,1,0,1,0,0|1,0,0]=3 18772 B16R1.932 CCOC(=O)CCCSCC1CCOCC1 62a_100000754603_100009991533 [0,1,0,1,0,0|1,0,0]=3 18773 B16R1.932 CCOC(=O)CCCSCC1CCOCC1 62a_100009991533_100000749018 [0,1,0,1,0,0|1,0,0]=3 18774 B16R1.932 CCOC(=O)CCNCCC1=CCCCC1 2230a_100000212019_100011206558 [0,1,0,1,0,0|0,0,2]=4 18775 B16R1.932 CCOC(=O)CCNCCC1=CCCCC1 34a_100000212019_100000765890 [0,1,0,1,0,0|0,0,2]=4 18776 B16R1.932 CCOC(=O)CCNCCC1CCCCC1 2230a_100000738074_100011206558 [0,1,0,1,0,0|0,0,0]=2 18777 B16R1.932 CCOC(=O)CCNCCC1CCCCC1 34a_100000738074_100000765890 [0,1,0,1,0,0|0,0,0]=2 18778 B16R1.932 CCOC(=O)CCNCCC1CCCCO1 2230a_100015183643_100011206558 [0,1,0,1,0,0|1,0,0]=3 18779 B16R1.932 CCOC(=O)CCNCCC1CCCCO1 34a_100015183643_100000765890 [0,1,0,1,0,0|1,0,0]=3 18780 B16R1.932 CCOC(=O)CCNCCC1CCOCC1 2230a_100000755988_100011206558 [0,1,0,1,0,0|1,0,0]=3 18781 B16R1.932 CCOC(=O)CCNCCC1CCOCC1 34a_100000755988_100000765890 [0,1,0,1,0,0|1,0,0]=3 18782 B16R1.932 CCOC(=O)CCNCCN1CCSCC1 2230a_100000755026_100011206558 [0,1,0,1,0,0|2,0,0]=4 18783 B16R1.932 CCOC(=O)CCOCCC1CCCCC1 34a_100011217863_100000765890 [0,1,0,1,0,0|0,0,0]=2 18784 B16R1.932 CCOC(=O)CCOCCC1CCCCC1 7a_100011217863_100011206558 [0,1,0,1,0,0|0,0,0]=2 18785 B16R1.932 CCOC(=O)CCOCCC1CCCCN1 34a_100000211664_100000765890 [0,1,0,1,0,0|1,0,0]=3 18786 B16R1.932 CCOC(=O)CCOCCC1CCCNC1 34a_100000752241_100000765890 [0,1,0,1,0,0|1,0,0]=3 18787 B16R1.932 CCOC(=O)CCOCCC1CCNCC1 34a_100015190746_100000765890 [0,1,0,1,0,0|1,0,0]=3 18788 B16R1.932 CCOC(=O)CCOCCC1CCOCC1 34a_100011933979_100000765890 [0,1,0,1,0,0|1,0,0]=3 18789 B16R1.932 CCOC(=O)CCOCCC1CCOCC1 7a_100011933979_100011206558 [0,1,0,1,0,0|1,0,0]=3 18790 B16R1.932 CCOC(=O)CCOCCC1SCCCS1 34a_200011025297_100000765890 [0,1,0,1,0,0|2,0,0]=4 18791 B16R1.932 CCOC(=O)CCOCCC1SCCCS1 7a_200011025297_100011206558 [0,1,0,1,0,0|2,0,0]=4 18792 B16R1.932 CCOC(=O)CCOCCN1CCSCC1 7a_100000686052_100011206558 [0,1,0,1,0,0|2,0,0]=4 18793 B16R1.932 CCOC(=O)CCOCC[C@@H]1CNCCN1 34a_100016989929_100000765890 [0,1,0,1,0,0|2,0,0]=4 18794 B16R1.932 CCOC(=O)CCSCCC1CCCCC1 62a_100000765890_100012355289 [0,1,0,1,0,0|0,0,0]=2 18795 B16R1.932 CCOC(=O)CCSCCC1CCCCC1 62a_100012355289_100000765890 [0,1,0,1,0,0|0,0,0]=2 18796 B16R1.932 CCOC(=O)CCSCCC1CCOCC1 62a_100000765890_100011934994 [0,1,0,1,0,0|1,0,0]=3 18797 B16R1.932 CCOC(=O)CCSCCC1CCOCC1 62a_100011934994_100000765890 [0,1,0,1,0,0|1,0,0]=3 18798 B16R1.932 CCOC(=O)CCSCCC1OCCCO1 62a_100000764188_100000765890 [0,1,0,1,0,0|2,0,0]=4 18799 B16R1.932 CCOC(=O)CCSCCC1OCCCO1 62a_100000765890_100000764188 [0,1,0,1,0,0|2,0,0]=4 18800 B16R1.932 CCOC(=O)CCSCCN1CCCCC1 62a_100000739454_100000765890 [0,1,0,1,0,0|1,0,0]=3 18801 B16R1.932 CCOC(=O)CCSCCN1CCCCC1 62a_100000765890_100000739454 [0,1,0,1,0,0|1,0,0]=3 18802 B16R1.932 CCOC(=O)CCSCCN1CCOCC1 62a_100000765890_100000211760 [0,1,0,1,0,0|2,0,0]=4 18803 B16R1.932 CCOC(=O)CCSCOC1CCCCC1 62a_100000765890_100011935260 [0,1,0,1,0,0|1,0,0]=3 18804 B16R1.932 CCOC(=O)CCSCOC1CCCCC1 62a_100011935260_100000765890 [0,1,0,1,0,0|1,0,0]=3 18805 B16R1.932 CCOC(=O)CNCCCC1CCCCC1 2230a_100011211642_100000188475 [0,1,0,1,0,0|0,0,0]=2 18806 B16R1.932 CCOC(=O)CNCCCC1CCCCC1 34a_100011211642_100000188475 [0,1,0,1,0,0|0,0,0]=2 18807 B16R1.932 CCOC(=O)CNCCOC1CCCCC1 34a_100015206981_100000188475 [0,1,0,1,0,0|1,0,0]=3 18808 B16R1.932 CCOC(=O)COCCCC1CCCCC1 34a_100000198086_100000188475 [0,1,0,1,0,0|0,0,0]=2 18809 B16R1.932 CCOC(=O)COCCCC1CCCCC1 7a_100000198086_100000188475 [0,1,0,1,0,0|0,0,0]=2 18810 B16R1.932 CCOC(=O)COCCCC1CCCCN1 34a_100011934581_100000188475 [0,1,0,1,0,0|1,0,0]=3 18811 B16R1.932 CCOC(=O)COCCCC1CCCNC1 34a_100150707839_100000188475 [0,1,0,1,0,0|1,0,0]=3 18812 B16R1.932 CCOC(=O)COCCCC1CCNCC1 34a_100016988962_100000188475 [0,1,0,1,0,0|1,0,0]=3 18813 B16R1.932 CCOC(=O)COCCCN1CCCCC1 34a_100000212458_100000188475 [0,1,0,1,0,0|1,0,0]=3 18814 B16R1.932 CCOC(=O)COCCCN1CCCOC1 2230a_100000131196_100009893628 [0,1,0,1,0,0|2,0,0]=4 18815 B16R1.932 CCOC(=O)COCCCN1CCCOC1 269982a_100000131196_100009893628 [0,1,0,1,0,0|2,0,0]=4 18816 B16R1.932 CCOC(=O)COCCCN1CCCOC1 34a_100000131196_100009893628 [0,1,0,1,0,0|2,0,0]=4 18817 B16R1.932 CCOC(=O)COCCCN1CCOCC1 2230a_100015191051_100009893628 [0,1,0,1,0,0|2,0,0]=4 18818 B16R1.932 CCOC(=O)COCCCN1CCOCC1 269982a_100015191051_100009893628 [0,1,0,1,0,0|2,0,0]=4 18819 B16R1.932 CCOC(=O)COCCCN1CCOCC1 34a_100000212840_100000188475 [0,1,0,1,0,0|2,0,0]=4 18820 B16R1.932 CCOC(=O)COCCCN1CCOCC1 34a_100015191051_100009893628 [0,1,0,1,0,0|2,0,0]=4 18821 B16R1.932 CCOC(=O)COCCCN1CCSCC1 2230a_100000737611_100009893628 [0,1,0,1,0,0|2,0,0]=4 18822 B16R1.932 CCOC(=O)COCCCN1CCSCC1 269982a_100000737611_100009893628 [0,1,0,1,0,0|2,0,0]=4 18823 B16R1.932 CCOC(=O)COCCNC1CCCCC1 2230a_100000182618_100000088970 [0,1,0,1,0,0|1,0,0]=3 18824 B16R1.932 CCOC(=O)COCCNC1CCCCC1 34a_100000182618_100000088970 [0,1,0,1,0,0|1,0,0]=3 18825 B16R1.932 CCOC(=O)COCCNC1CCCCC1 34a_100000200466_100000188475 [0,1,0,1,0,0|1,0,0]=3 18826 B16R1.932 CCOC(=O)COCCNC1CCCOC1 2230a_100000719290_100000088970 [0,1,0,1,0,0|2,0,0]=4 18827 B16R1.932 CCOC(=O)COCCNC1CCCOC1 34a_100000719290_100000088970 [0,1,0,1,0,0|2,0,0]=4 18828 B16R1.932 CCOC(=O)COCCNC1CCOCC1 2230a_100000741149_100000088970 [0,1,0,1,0,0|2,0,0]=4 18829 B16R1.932 CCOC(=O)COCCNC1CCOCC1 34a_100000708129_100000188475 [0,1,0,1,0,0|2,0,0]=4 18830 B16R1.932 CCOC(=O)COCCNC1CCOCC1 34a_100000741149_100000088970 [0,1,0,1,0,0|2,0,0]=4 18831 B16R1.932 CCOC(=O)COCCNC1CCSCC1 2230a_100000748639_100000088970 [0,1,0,1,0,0|2,0,0]=4 18832 B16R1.932 CCOC(=O)COCCNC1CCSCC1 34a_100000748639_100000088970 [0,1,0,1,0,0|2,0,0]=4 18833 B16R1.932 CCOC(=O)COCCOC1CCCCC1 34a_100000210231_100000088970 [0,1,0,1,0,0|1,0,0]=3 18834 B16R1.932 CCOC(=O)COCCOC1CCCCC1 34a_100011249652_100000188475 [0,1,0,1,0,0|1,0,0]=3 18835 B16R1.932 CCOC(=O)COCCOC1CCCCC1 7a_100000210231_100000088970 [0,1,0,1,0,0|1,0,0]=3 18836 B16R1.932 CCOC(=O)COCCOC1CCCCC1 7a_100011249652_100000188475 [0,1,0,1,0,0|1,0,0]=3 18837 B16R1.932 CCOC(=O)COCCOC1CCCCO1 34a_100000033831_100000088970 [0,1,0,1,0,0|2,0,0]=4 18838 B16R1.932 CCOC(=O)COCCOC1CCCCO1 34a_100000034223_100000188475 [0,1,0,1,0,0|2,0,0]=4 18839 B16R1.932 CCOC(=O)COCCOC1CCCCO1 7a_100000034223_100000188475 [0,1,0,1,0,0|2,0,0]=4 18840 B16R1.932 CCOC(=O)COCCOC1CCCOC1 34a_100000754041_100000088970 [0,1,0,1,0,0|2,0,0]=4 18841 B16R1.932 CCOC(=O)COCCOC1CCCSC1 7a_100015962668_100000088970 [0,1,0,1,0,0|2,0,0]=4 18842 B16R1.932 CCOC(=O)COCCOC1CCOCC1 34a_100000744328_100000088970 [0,1,0,1,0,0|2,0,0]=4 18843 B16R1.932 CCOC(=O)COCCOC1CCSCC1 34a_100000731022_100000088970 [0,1,0,1,0,0|2,0,0]=4 18844 B16R1.932 CCOC(=O)COCCOC1CCSCC1 7a_100000731022_100000088970 [0,1,0,1,0,0|2,0,0]=4 18845 B16R1.932 CCOC(=O)COCCSC1CCCCC1 62a_100000088970_100000210327 [0,1,0,1,0,0|1,0,0]=3 18846 B16R1.932 CCOC(=O)COCCSC1CCCCC1 62a_100000210327_100000088970 [0,1,0,1,0,0|1,0,0]=3 18847 B16R1.932 CCOC(=O)COCCSC1CCCOC1 62a_100000088970_100000693364 [0,1,0,1,0,0|2,0,0]=4 18848 B16R1.932 CCOC(=O)COCCSC1CCOCC1 62a_100000088970_100011324220 [0,1,0,1,0,0|2,0,0]=4 18849 B16R1.932 CCOC(=O)COCCSC1CCSCC1 62a_100000088970_100000069128 [0,1,0,1,0,0|2,0,0]=4 18850 B16R1.932 CCOC(=O)CSCCCC1CCCCC1 62a_100000188475_100011713725 [0,1,0,1,0,0|0,0,0]=2 18851 B16R1.932 CCOC(=O)CSCCCC1CCCCC1 62a_100011713725_100000188475 [0,1,0,1,0,0|0,0,0]=2 18852 B16R1.932 CCOC(=O)CSCCCN1CCCCC1 62a_100000188475_100000007876 [0,1,0,1,0,0|1,0,0]=3 18853 B16R1.932 CCOC(=O)CSCCCN1CCCCC1 62a_100132302099_100000188475 [0,1,0,1,0,0|1,0,0]=3 18854 B16R1.932 CCOC(=O)CSCCCN1CCOCC1 62a_100000188475_100000748698 [0,1,0,1,0,0|2,0,0]=4 18855 B16R1.932 CCOC(=O)CSCCOC1CCCCC1 62a_100000188475_100011211530 [0,1,0,1,0,0|1,0,0]=3 18856 B16R1.932 CCOC(=O)CSCCOC1CCCCC1 62a_100011211530_100000188475 [0,1,0,1,0,0|1,0,0]=3 18857 B16R1.932 CCOC(=O)CSCCOC1CCCCC1 7a_200000230590_100000210327 [0,1,0,1,0,0|1,0,0]=3 18858 B16R1.932 CCOC(=O)CSCCOC1CCCCO1 62a_100000188475_100000744793 [0,1,0,1,0,0|2,0,0]=4 18859 B16R1.932 CCOC(=O)CSCCOC1CCCCO1 62a_100000744793_100000188475 [0,1,0,1,0,0|2,0,0]=4 18860 B16R1.932 CCOC(=O)CSCCOC1CCCOC1 7a_200000230590_100000693364 [0,1,0,1,0,0|2,0,0]=4 18861 B16R1.932 CCOC(=O)CSCCOC1CCOCC1 7a_200000230590_100000686592 [0,1,0,1,0,0|2,0,0]=4 18862 B16R1.932 CCOC(=O)CSCCOC1CCSCC1 7a_200000230590_100011500858 [0,1,0,1,0,0|2,0,0]=4 18863 B16R1.932 CCOC(=O)NCCOCC1CCCCC1 34a_100000158857_100000211423 [0,1,0,1,0,0|1,0,0]=3 18864 B16R1.932 CCOC(=O)NCCOCC1CCCCC1 7a_100000212181_200011445536 [0,1,0,1,0,0|1,0,0]=3 18865 B16R1.932 CCOC(=O)NCCOCC1CCCCO1 34a_100000158857_100000211543 [0,1,0,1,0,0|2,0,0]=4 18866 B16R1.932 CCOC(=O)NCCOCC1CCCCO1 7a_100000211370_200011445536 [0,1,0,1,0,0|2,0,0]=4 18867 B16R1.932 CCOC(=O)NCCOCC1CCCOC1 34a_100000158857_100000741521 [0,1,0,1,0,0|2,0,0]=4 18868 B16R1.932 CCOC(=O)NCCOCC1CCOCC1 34a_100000158857_100000754603 [0,1,0,1,0,0|2,0,0]=4 18869 B16R1.932 CCOC(=O)NCCOCC1CCSCC1 7a_100000070558_200011445536 [0,1,0,1,0,0|2,0,0]=4 18870 B16R1.932 CCOC(=O)NCCSCC1CCCCC1 62a_100000211423_200011445536 [0,1,0,1,0,0|1,0,0]=3 18871 B16R1.932 CCOC(=O)NCCSCC1CCCCO1 62a_100000211543_200011445536 [0,1,0,1,0,0|2,0,0]=4 18872 B16R1.932 CCOC(=O)NCCSCC1CCCOC1 62a_100000741521_200011445536 [0,1,0,1,0,0|2,0,0]=4 18873 B16R1.932 CCOC(=O)NCCSCC1CCOCC1 62a_100000754603_200011445536 [0,1,0,1,0,0|2,0,0]=4 18874 B16R1.932 CCOC(=O)OCSCCC1CCCCC1 62a_100012355289_100000075025 [0,1,0,1,0,0|1,0,0]=3 18875 B16R1.932 CCOC(=O)OCSCCC1CCOCC1 62a_100011934994_100000075025 [0,1,0,1,0,0|2,0,0]=4 18876 B16R1.932 CCOC(=O)OCSCCN1CCCCC1 62a_100000739454_100000075025 [0,1,0,1,0,0|2,0,0]=4 18877 B16R1.932 CCOC(=O)OCSCOC1CCCCC1 62a_100011935260_100000075025 [0,1,0,1,0,0|2,0,0]=4 18878 B16R1.932 CNNC(=O)CCCCCN1CCCCC1 22a_100016993582_100012051570 [0,1,0,1,0,0|2,0,0]=4 18879 B16R1.932 O=C(CCF)CCCCCN1CCCCC1 1458a_100012051570_100011217306 [0,1,0,1,0,0|2,0,0]=4 18880 B16R1.932 O=C(CCO)CCCCCN1CCCCC1 1458a_100012051570_100000211926 [0,1,0,1,0,0|2,0,0]=4 18881 B16R1.932 O=C(CNCCCC1CCCCC1)NCO 2230a_100011211642_100000185155 [0,1,0,1,0,0|2,0,0]=4 18882 B16R1.932 O=C(CNCCCC1CCCCC1)NCO 34a_100011211642_100000185155 [0,1,0,1,0,0|2,0,0]=4 18883 B16R1.932 O=C(COCCCC1CCCCC1)NCO 34a_100000198086_100000185155 [0,1,0,1,0,0|2,0,0]=4 18884 B16R1.932 O=C(COCCCC1CCCCC1)NCO 7a_100000198086_100000185155 [0,1,0,1,0,0|2,0,0]=4 18885 B16R1.932 O=C(CSCCCC1CCCCC1)NCO 62a_100000185155_100011713725 [0,1,0,1,0,0|2,0,0]=4 18886 B16R1.932 O=C(CSCCCC1CCCCC1)NCO 62a_100011713725_100000185155 [0,1,0,1,0,0|2,0,0]=4 18887 B16R1.1013 CCCOC1CN(C1)CCCC(=O)OCC 269982a_200020626125_100009991533 [0,1,0,1,0,0|2,0,0]=4 18888 B16R1.1013 CCCOC1CN(C1)CCCC(=O)OCC 34a_200020626125_100009991533 [0,1,0,1,0,0|2,0,0]=4 18889 B16R1.1482 C=C(CNCCCC1CCCC1)OCOC 34a_100000736752_100000042856 [0,1,0,1,0,0|2,0,0]=4 18890 B16R1.1482 C=C(COCCCC1CCCC1)OCOC 34a_100011215328_100000042856 [0,1,0,1,0,0|2,0,0]=4 18891 B16R1.1482 C=C(CSCCCC1CCCC1)OCOC 62a_100000042856_100011713738 [0,1,0,1,0,0|2,0,0]=4 18892 B16R1.1482 C=C(CSCCCC1CCCC1)OCOC 62a_100011713738_100000042856 [0,1,0,1,0,0|2,0,0]=4 18893 B16R1.1482 C=CCOC(=O)CNCCCC1CCCC1 2230a_100000736752_100000033060 [0,1,0,1,0,0|1,0,1]=4 18894 B16R1.1482 C=CCOC(=O)CNCCCC1CCCC1 34a_100000736752_100000033060 [0,1,0,1,0,0|1,0,1]=4 18895 B16R1.1482 C=CCOC(=O)COCCCC1CCCC1 34a_100011215328_100000033060 [0,1,0,1,0,0|1,0,1]=4 18896 B16R1.1482 C=CCOC(=O)COCCCC1CCCC1 7a_100011215328_100000033060 [0,1,0,1,0,0|1,0,1]=4 18897 B16R1.1482 C=CCOC(=O)CSCCCC1CCCC1 62a_100000033060_100011713738 [0,1,0,1,0,0|1,0,1]=4 18898 B16R1.1482 C=CCOC(=O)CSCCCC1CCCC1 62a_100011713738_100000033060 [0,1,0,1,0,0|1,0,1]=4 18899 B16R1.1482 CCCNC(=O)CCCNCC1CCCC1 2230a_100000737975_100011194427 [0,1,0,1,0,0|2,0,0]=4 18900 B16R1.1482 CCCNC(=O)CCCOCC1CCCC1 7a_100000742336_100011194427 [0,1,0,1,0,0|2,0,0]=4 18901 B16R1.1482 CCCNC(=O)CCCSCC1CCCC1 62a_100000740388_100011194427 [0,1,0,1,0,0|2,0,0]=4 18902 B16R1.1482 CCCNC(=O)CCCSCC1CCCC1 62a_100011194427_100000740388 [0,1,0,1,0,0|2,0,0]=4 18903 B16R1.1482 CCCNC(=O)CNCCCC1CCCC1 2230a_100000174927_100011713738 [0,1,0,1,0,0|2,0,0]=4 18904 B16R1.1482 CCCNC(=O)CNCCCC1CCCC1 2230a_100000736752_100000183358 [0,1,0,1,0,0|2,0,0]=4 18905 B16R1.1482 CCCNC(=O)CNCCCC1CCCC1 34a_100000736752_100000183358 [0,1,0,1,0,0|2,0,0]=4 18906 B16R1.1482 CCCNC(=O)COCCCC1CCCC1 34a_100011215328_100000183358 [0,1,0,1,0,0|2,0,0]=4 18907 B16R1.1482 CCCNC(=O)COCCCC1CCCC1 7a_100011215328_100000183358 [0,1,0,1,0,0|2,0,0]=4 18908 B16R1.1482 CCCNC(=O)CSCCCC1CCCC1 62a_100000183358_100011713738 [0,1,0,1,0,0|2,0,0]=4 18909 B16R1.1482 CCCNC(=O)CSCCCC1CCCC1 62a_100011713738_100000183358 [0,1,0,1,0,0|2,0,0]=4 18910 B16R1.1482 CCCOC(=O)CNCCCC1CCCC1 2230a_100000736752_200011215008 [0,1,0,1,0,0|1,0,0]=3 18911 B16R1.1482 CCCOC(=O)CNCCCC1CCCC1 34a_100000736752_200011215008 [0,1,0,1,0,0|1,0,0]=3 18912 B16R1.1482 CCCOC(=O)CNCCOC1CCCC1 34a_100000741755_200011215008 [0,1,0,1,0,0|2,0,0]=4 18913 B16R1.1482 CCCOC(=O)COCCCC1CCCC1 34a_100011215328_200011215008 [0,1,0,1,0,0|1,0,0]=3 18914 B16R1.1482 CCCOC(=O)COCCCC1CCCC1 7a_100011215328_200011215008 [0,1,0,1,0,0|1,0,0]=3 18915 B16R1.1482 CCCOC(=O)COCCNC1CCCC1 34a_200000200444_200011215008 [0,1,0,1,0,0|2,0,0]=4 18916 B16R1.1482 CCCOC(=O)COCCOC1CCCC1 34a_100000738311_200011215008 [0,1,0,1,0,0|2,0,0]=4 18917 B16R1.1482 CCCOC(=O)COCCOC1CCCC1 7a_100000738311_200011215008 [0,1,0,1,0,0|2,0,0]=4 18918 B16R1.1482 CCCOC(=O)CSCCCC1CCCC1 62a_100011713738_200011215008 [0,1,0,1,0,0|1,0,0]=3 18919 B16R1.1482 CCCOC(=O)CSCCCC1CCCC1 62a_200011215008_100011713738 [0,1,0,1,0,0|1,0,0]=3 18920 B16R1.1482 CCCOC(=O)CSCCCN1CCCC1 62a_100016991639_200011215008 [0,1,0,1,0,0|2,0,0]=4 18921 B16R1.1482 CCCOC(=O)CSCCCN1CCCC1 62a_200011215008_100011445909 [0,1,0,1,0,0|2,0,0]=4 18922 B16R1.1482 CCCOC(=O)OCNCCC1CCCC1 34a_100000739158_200000139673 [0,1,0,1,0,0|2,0,0]=4 18923 B16R1.1482 CCCOC(=O)OCOCCC1CCCC1 34a_100000749090_200000139673 [0,1,0,1,0,0|2,0,0]=4 18924 B16R1.1482 CCCOC(=O)OCOCCC1CCCC1 7a_100000749090_200000139673 [0,1,0,1,0,0|2,0,0]=4 18925 B16R1.1482 CCCOC(=O)OCSCCC1CCCC1 62a_100000760354_200000139673 [0,1,0,1,0,0|2,0,0]=4 18926 B16R1.1482 CCOCC(=O)NCCCCN1CCCC1 1626a_100000740493_100000211967 [0,1,0,1,0,0|2,0,0]=4 18927 B16R1.1482 CCOCC(=O)NCCCCN1CCCC1 240690a_100000740493_100000211967 [0,1,0,1,0,0|2,0,0]=4 18928 B16R1.1482 CCOCC(=O)NCCCOC1CCCC1 11a_100000747560_100000211967 [0,1,0,1,0,0|2,0,0]=4 18929 B16R1.1482 CCOCC(=O)NCCCOC1CCCC1 1626a_100000747560_100000211967 [0,1,0,1,0,0|2,0,0]=4 18930 B16R1.1482 CCOCC(=O)NCCCOC1CCCC1 240690a_100000747560_100000211967 [0,1,0,1,0,0|2,0,0]=4 18931 B16R1.1482 CCOCC(=O)NCCCOC1CCCC1 527a_100000747560_100000211967 [0,1,0,1,0,0|2,0,0]=4 18932 B16R1.1482 O=C(CNCCCC1CCCC1)NCCF 2230a_100000725713_100011713738 [0,1,0,1,0,0|2,0,0]=4 18933 B16R1.1992 CCOC(=O)CCCCN1C(CCC1C)C 2230a_100000687148_100000750268 [0,1,0,1,0,0|1,0,0]=3 18934 B16R1.1992 CCOC(=O)CCCCN1C(CCC1C)C 269982a_100000687148_100000750268 [0,1,0,1,0,0|1,0,0]=3 18935 B16R1.1992 CCOC(=O)CCCCN1C(CCC1C)C 34a_100000687148_100000750268 [0,1,0,1,0,0|1,0,0]=3 18936 B16R1.1992 CCOC(=O)COCCN1C(CCC1C)C 2230a_100000687148_100000088970 [0,1,0,1,0,0|2,0,0]=4 18937 B16R1.1992 CCOC(=O)COCCN1C(CCC1C)C 269982a_100000687148_100000088970 [0,1,0,1,0,0|2,0,0]=4 18938 B16R1.1992 CCOC(=O)COCCN1C(CCC1C)C 34a_100000687148_100000088970 [0,1,0,1,0,0|2,0,0]=4 18939 B16R1.2032 CCOC(=O)CCCN1CCCCC(C1)O 2230a_100025706797_100009991533 [0,1,0,1,0,0|1,0,0]=3 18940 B16R1.2032 CCOC(=O)CCCN1CCCCC(C1)O 269982a_100025706797_100009991533 [0,1,0,1,0,0|1,0,0]=3 18941 B16R1.2032 CCOC(=O)CCCN1CCOC[C@@H](C1)O 2230a_100016073750_100009991533 [0,1,0,1,0,0|2,0,0]=4 18942 B16R1.2032 CCOC(=O)CCCN1CCOC[C@@H](C1)O 269982a_100016073750_100009991533 [0,1,0,1,0,0|2,0,0]=4 18943 B16R1.2032 CCOC(=O)NCCN1CCCCC(C1)O 269982a_100025706797_200011445536 [0,1,0,1,0,0|2,0,0]=4 18944 B16R1.7333 CCCNC(=O)CCCOC1CCCC1C 7a_100011216460_100011194427 [0,1,0,1,0,0|2,0,0]=4 18945 B16R1.7333 CCCOC(=O)COCCC1CCCN1C 34a_100011215177_200011215008 [0,1,0,1,0,0|2,0,0]=4 18946 B16R1.7333 CCCOC(=O)COCCC1CCCN1C 7a_100011215177_200011215008 [0,1,0,1,0,0|2,0,0]=4 18947 B16R1.7333 CCCOC(=O)CSCCC1CCCN1C 62a_100000005710_200011215008 [0,1,0,1,0,0|2,0,0]=4 18948 B16R1.7333 CCCOC(=O)CSCCC1CCCN1C 62a_200011215008_100000005710 [0,1,0,1,0,0|2,0,0]=4 18949 B16R1.14010 CCNC(=O)CCNC1CC(CCC1C)C 269862a_100025743525_100000034887 [0,1,0,1,0,0|2,0,0]=4 18950 B16R1.14010 CCNC(=O)CCNC1CC(CCC1C)C 270004a_100025743525_100000034887 [0,1,0,1,0,0|2,0,0]=4 18951 B16R1.14010 CCNC(=O)CCOC1CC(CCC1C)C 7a_100011217446_100000737597 [0,1,0,1,0,0|2,0,0]=4 18952 B16R1.14010 CCOC(=O)CCCN1C[C@H](OC[C@H]1C)C 2230a_100016991869_100009991533 [0,1,0,1,0,0|2,0,0]=4 18953 B16R1.14010 CCOC(=O)CCCN1C[C@H](OC[C@H]1C)C 269982a_100016991869_100009991533 [0,1,0,1,0,0|2,0,0]=4 18954 B16R1.14010 CCOC(=O)CCCN1C[C@H](OC[C@H]1C)C 34a_100016991869_100009991533 [0,1,0,1,0,0|2,0,0]=4 18955 B16R1.14010 CCOC(=O)CCOC1CC(CCC1C)C 34a_100011217446_100000765890 [0,1,0,1,0,0|1,0,0]=3 18956 B16R1.14010 CCOC(=O)CCOC1CC(CCC1C)C 7a_100011217446_100011206558 [0,1,0,1,0,0|1,0,0]=3 18957 B16R1.14012 CCOC(=O)CCCN1C[C@@H](C[C@H]1CO)O 2230a_100000707816_100009991533 [0,1,0,1,0,0|2,0,0]=4 18958 B16R1.14012 CCOC(=O)CCCN1C[C@@H](C[C@H]1CO)O 269982a_100000707816_100009991533 [0,1,0,1,0,0|2,0,0]=4 18959 B16R1.14012 CCOC(=O)CCCN1C[C@H](C[C@H]1CO)F 2230a_100015204000_100009991533 [0,1,0,1,0,0|2,0,0]=4 18960 B16R1.14012 CCOC(=O)CCCN1C[C@H](C[C@H]1CO)F 269982a_100015204000_100009991533 [0,1,0,1,0,0|2,0,0]=4 18961 B16R1.14012 CCOC(=O)CCCN1C[C@H](C[C@H]1CO)F 34a_100015204000_100009991533 [0,1,0,1,0,0|2,0,0]=4 18962 B16R1.15161 CCOC(=O)CCCCCN1CC(C1)CC 2230a_100015205115_100000755133 [0,1,0,1,0,0|1,0,0]=3 18963 B16R1.15161 CCOC(=O)CCCCCN1CC(C1)CC 269982a_100015205115_100000755133 [0,1,0,1,0,0|1,0,0]=3 18964 B16R1.15161 CCOC(=O)CCCCCN1CC(C1)CF 269982a_100010363649_100000755133 [0,1,0,1,0,0|2,0,0]=4 18965 B16R1.15161 CCOC(=O)CCCCCN1CC(C1)CF 34a_100010363649_100000755133 [0,1,0,1,0,0|2,0,0]=4 18966 B16R1.15161 CCOC(=O)CCCCCN1CC(C1)CO 269982a_100016987283_100000755133 [0,1,0,1,0,0|2,0,0]=4 18967 B16R1.15161 CCOC(=O)CCCCCN1CC(C1)CO 34a_100016987283_100000755133 [0,1,0,1,0,0|2,0,0]=4 18968 B16R1.15161 CCOC(=O)CCCCCN1CC(C1)OC 269982a_100000755009_100000755133 [0,1,0,1,0,0|2,0,0]=4 18969 B16R1.15161 CCOC(=O)CCCCCN1CC(C1)SC 269982a_100016990038_100000755133 [0,1,0,1,0,0|2,0,0]=4 18970 B16R1.15161 CCOC(=O)CCCCNC1CN(C1)CC 2230a_200015199589_100000750268 [0,1,0,1,0,0|2,0,0]=4 18971 B16R1.15161 CCOC(=O)CCCCN[C@H]1C[C@@H](C1)OC 2230a_100121570643_100000750268 [0,1,0,1,0,0|2,0,0]=4 18972 B16R1.15161 CCOC(=O)CCCCSC1CC(C1)CO 62a_100000750268_100009874164 [0,1,0,1,0,0|2,0,0]=4 18973 B16R1.15161 CCOC(=O)CCCCSC1CC(C1)CO 62a_100009874164_100000750268 [0,1,0,1,0,0|2,0,0]=4 18974 B16R1.15161 CCOC(=O)COCCCN1CC(C1)CC 2230a_100015205115_100009893628 [0,1,0,1,0,0|2,0,0]=4 18975 B16R1.15161 CCOC(=O)COCCCN1CC(C1)CC 269982a_100015205115_100009893628 [0,1,0,1,0,0|2,0,0]=4 18976 B16R1.15397 CCOC(=O)CCCCCC(=O)C1CCC1 1458a_100000037472_100000749161 [0,1,0,1,0,0|0,0,1]=3 18977 B16R1.15397 CCOC(=O)CCCCCC(=O)C1CCC1 1458a_100000209988_100000755133 [0,1,0,1,0,0|0,0,1]=3 18978 B16R1.15397 CCOC(=O)CCCCCC(=O)C1CCO1 1458a_100000089072_100000755133 [0,1,0,1,0,0|1,0,1]=4 18979 B16R1.15397 CCOC(=O)CCCCCC(=O)C1COC1 1458a_100000037472_100000687716 [0,1,0,1,0,0|1,0,1]=4 18980 B16R1.15397 CCOC(=O)CCCCCC(=O)C1COC1 1458a_100000758290_100000755133 [0,1,0,1,0,0|1,0,1]=4 18981 B16R1.15397 CCOC(=O)CCCCCC(=O)N1CCC1 11a_100000754969_100000037472 [0,1,0,1,0,0|1,0,1]=4 18982 B16R1.15397 CCOC(=O)CCCCCC(=O)N1CCC1 240690a_100000754969_100000037472 [0,1,0,1,0,0|1,0,1]=4 18983 B16R1.15397 CCOC(=O)CCCCCC(=O)N1CCC1 527a_100000754969_100000037472 [0,1,0,1,0,0|1,0,1]=4 18984 B16R1.15397 CCOC(=O)CCCCCN(C)C1CCC1 2230a_100000758072_100000755133 [0,1,0,1,0,0|1,0,0]=3 18985 B16R1.15397 CCOC(=O)CCCCCN(C)C1CCC1 269982a_100000758072_100000755133 [0,1,0,1,0,0|1,0,0]=3 18986 B16R1.15397 CCOC(=O)CCCCCN(C)C1CCC1 34a_100000758072_100000755133 [0,1,0,1,0,0|1,0,0]=3 18987 B16R1.15397 CCOC(=O)CCCCCN(C)C1COC1 2230a_100102693430_100000755133 [0,1,0,1,0,0|2,0,0]=4 18988 B16R1.15397 CCOC(=O)CCCCCN(C)C1COC1 269982a_100102693430_100000755133 [0,1,0,1,0,0|2,0,0]=4 18989 B16R1.15397 CCOC(=O)CCCCNC(=O)C1CCC1 188690a_100000718961_100000209988 [0,1,0,1,0,0|1,0,1]=4 18990 B16R1.15397 CCOC(=O)CCCCNC(C)C1CCC1 2230a_100016994624_100000750268 [0,1,0,1,0,0|1,0,0]=3 18991 B16R1.15397 CCOC(=O)CCCCNC(C)C1CCC1 34a_100016994624_100000750268 [0,1,0,1,0,0|1,0,0]=3 18992 B16R1.15397 CCOC(=O)CCCCOC(C)C1CCC1 34a_100000766398_100000750268 [0,1,0,1,0,0|1,0,0]=3 18993 B16R1.15397 CCOC(=O)CCCCOC(C)C1CCC1 7a_100000766398_100000750268 [0,1,0,1,0,0|1,0,0]=3 18994 B16R1.15397 CCOC(=O)CCCOCC(=O)C1CCC1 7a_100012001163_100000686122 [0,1,0,1,0,0|1,0,1]=4 18995 B16R1.15397 CCOC(=O)CCCOC[C@@H](N)C1COC1 34a_217856628679_100009991533 [0,1,0,1,0,0|2,0,0]=4 18996 B16R1.15397 CCOC(=O)CCCSCC(=O)C1CCC1 62a_100000686122_100009991533 [0,1,0,1,0,0|1,0,1]=4 18997 B16R1.15397 CCOC(=O)CCCSCC(=O)C1CCC1 62a_100009991533_100000686122 [0,1,0,1,0,0|1,0,1]=4 18998 B16R1.15397 CCOC(=O)COCCCC(=O)C1CCC1 1458a_100000209988_100009893628 [0,1,0,1,0,0|1,0,1]=4 18999 B16R1.15397 CCOC(=O)COCCCN(C)C1CCC1 2230a_100000758072_100009893628 [0,1,0,1,0,0|2,0,0]=4 19000 B16R1.15397 CCOC(=O)COCCCN(C)C1CCC1 269982a_100000758072_100009893628 [0,1,0,1,0,0|2,0,0]=4 19001 B16R1.15397 CCOC(=O)COCCCN(C)C1CCC1 34a_100000758072_100009893628 [0,1,0,1,0,0|2,0,0]=4 19002 B16R1.15397 CCOC(=O)COCCNC(C)C1CCC1 2230a_100016994624_100000088970 [0,1,0,1,0,0|2,0,0]=4 19003 B16R1.15397 CCOC(=O)COCCNC(C)C1CCC1 34a_100016994624_100000088970 [0,1,0,1,0,0|2,0,0]=4 19004 B16R1.15397 CCOC(=O)COCCOC(C)C1CCC1 34a_100000766398_100000088970 [0,1,0,1,0,0|2,0,0]=4 19005 B16R1.15397 CCOC(=O)COCCOC(C)C1CCC1 7a_100000766398_100000088970 [0,1,0,1,0,0|2,0,0]=4 19006 B16R1.15399 CCOC(=O)CCCCCC(=O)CC1CC1 1458a_100000037472_100000742324 [0,1,0,1,0,0|0,0,1]=3 19007 B16R1.15399 CCOC(=O)CCCCCC(=O)CC1CC1 1458a_100000738066_100000755133 [0,1,0,1,0,0|0,0,1]=3 19008 B16R1.15399 CCOC(=O)CCCCCC(=O)CC1CO1 1458a_100000037472_100011216344 [0,1,0,1,0,0|1,0,1]=4 19009 B16R1.15399 CCOC(=O)CCCCCC(=O)CC1CS1 1458a_100000037472_100000031435 [0,1,0,1,0,0|1,0,1]=4 19010 B16R1.15399 CCOC(=O)CCCCCC(=O)C[C@@H]1CO1 1458a_100000037472_100000745022 [0,1,0,1,0,0|1,0,1]=4 19011 B16R1.15399 CCOC(=O)CCCCCC(=O)NC1CC1 1626a_100000212008_100000037472 [0,1,0,1,0,0|1,0,1]=4 19012 B16R1.15399 CCOC(=O)CCCCCC(=O)NC1CC1 240690a_100000212008_100000037472 [0,1,0,1,0,0|1,0,1]=4 19013 B16R1.15399 CCOC(=O)CCCCCC(=O)NC1CC1 527a_100000212008_100000037472 [0,1,0,1,0,0|1,0,1]=4 19014 B16R1.15399 CCOC(=O)CCCCCN(C)CC1CC1 2230a_100000741881_100000755133 [0,1,0,1,0,0|1,0,0]=3 19015 B16R1.15399 CCOC(=O)CCCCCN(C)CC1CC1 269982a_100000741881_100000755133 [0,1,0,1,0,0|1,0,0]=3 19016 B16R1.15399 CCOC(=O)CCCCNC(=O)CC1CC1 188690a_100000718961_100000738066 [0,1,0,1,0,0|1,0,1]=4 19017 B16R1.15399 CCOC(=O)COCCCC(=O)CC1CC1 1458a_100000738066_100009893628 [0,1,0,1,0,0|1,0,1]=4 19018 B16R1.15399 CCOC(=O)COCCCN(C)CC1CC1 2230a_100000741881_100009893628 [0,1,0,1,0,0|2,0,0]=4 19019 B16R1.15399 CCOC(=O)COCCCN(C)CC1CC1 269982a_100000741881_100009893628 [0,1,0,1,0,0|2,0,0]=4 19020 B16R1.17745 CCCCN1CCCC(C1)CC(=O)OCC 2230a_100015200144_100000210211 [0,1,0,1,0,0|1,0,0]=3 19021 B16R1.17745 CCCCN1CCCC(C1)CC(=O)OCC 269982a_100015200144_100000210211 [0,1,0,1,0,0|1,0,0]=3 19022 B16R1.17745 CCCOC1CCCN(C1)CC(=O)OCC 2230a_100000743837_100000188475 [0,1,0,1,0,0|2,0,0]=4 19023 B16R1.17745 CCCOC1CCCN(C1)CC(=O)OCC 269982a_100000743837_100000188475 [0,1,0,1,0,0|2,0,0]=4 19024 B16R1.17745 CCCOC1CCCN(C1)CC(=O)OCC 34a_100000743837_100000188475 [0,1,0,1,0,0|2,0,0]=4 19025 B16R1.17745 CCOC(=O)CC1CCCN(C1)CCCF 2230a_100015200144_100011934791 [0,1,0,1,0,0|2,0,0]=4 19026 B16R1.17745 CCOC(=O)CC1CCCN(C1)CCCF 269982a_100015200144_100011934791 [0,1,0,1,0,0|2,0,0]=4 19027 B16R1.17745 CCOC(=O)CC1CCCN(C1)CCCO 2230a_100015200144_100000230001 [0,1,0,1,0,0|2,0,0]=4 19028 B16R1.17745 CCOC(=O)CC1CCCN(C1)CCCO 269982a_100015200144_100011215043 [0,1,0,1,0,0|2,0,0]=4 19029 B16R1.17745 CCOC(=O)CC1CCCN(C1)CCOC 2230a_100015200144_100011201679 [0,1,0,1,0,0|2,0,0]=4 19030 B16R1.17745 CCOC(=O)CC1CCCN(C1)CCOC 269982a_100015200144_100000233755 [0,1,0,1,0,0|2,0,0]=4 19031 B16R1.17745 CCOC(=O)CC1CCCN(C1)CCSC 2230a_100015200144_100000751147 [0,1,0,1,0,0|2,0,0]=4 19032 B16R1.17745 CCOC(=O)CC1CCCN(C1)CCSC 269982a_100015200144_100000212216 [0,1,0,1,0,0|2,0,0]=4 19033 B16R1.17745 CCOC(=O)CN1CCCC(C1)CCCO 2230a_100150707839_100000188475 [0,1,0,1,0,0|2,0,0]=4 19034 B16R1.17745 CCOC(=O)CN1CCCC(C1)CCCO 269982a_100150707839_100000188475 [0,1,0,1,0,0|2,0,0]=4 19035 B16R1.17745 CCOC(=O)CN1CCCC(C1)CCCO 34a_100150707839_100000188475 [0,1,0,1,0,0|2,0,0]=4 19036 B16R1.17745 CCOC(=O)CN1CCCC(C1)CCOC 2230a_100011653411_100000188475 [0,1,0,1,0,0|2,0,0]=4 19037 B16R1.17745 CCOC(=O)CN1CCCC(C1)CCOC 269982a_100011653411_100000188475 [0,1,0,1,0,0|2,0,0]=4 19038 B16R1.17745 CCOC(=O)CN1CCCC(C1)CCOC 34a_100011653411_100000188475 [0,1,0,1,0,0|2,0,0]=4 19039 B16R1.17745 CCOCN1CCCC(C1)CC(=O)OCC 269982a_100015200144_100000739092 [0,1,0,1,0,0|2,0,0]=4 19040 B16R1.20667 CCCCC(=O)N1CCC[C@H]1C(=O)OCC 11a_100000703725_100000210183 [0,1,0,1,0,0|1,0,1]=4 19041 B16R1.20667 CCCCC(=O)N1CCC[C@H]1C(=O)OCC 1626a_100000703725_100000210183 [0,1,0,1,0,0|1,0,1]=4 19042 B16R1.20667 CCCCC(=O)N1CCC[C@H]1C(=O)OCC 240690a_100000703725_100000210183 [0,1,0,1,0,0|1,0,1]=4 19043 B16R1.20667 CCCCC(=O)N1CCC[C@H]1C(=O)OCC 527a_100000703725_100000210183 [0,1,0,1,0,0|1,0,1]=4 19044 B16R1.20667 CCCCC(C)N1CCC[C@H]1C(=O)NCC 2230a_100020641767_200011215066 [0,1,0,1,0,0|2,0,0]=4 19045 B16R1.20667 CCCCC(C)N1CCC[C@H]1C(=O)NCC 269982a_100020641767_200011215066 [0,1,0,1,0,0|2,0,0]=4 19046 B16R1.20667 CCCCC(C)N1CCC[C@H]1C(=O)NCC 270004a_100020641767_100000210087 [0,1,0,1,0,0|2,0,0]=4 19047 B16R1.20667 CCCCC(C)N1CCC[C@H]1C(=O)NCC 34a_100020641767_200011215066 [0,1,0,1,0,0|2,0,0]=4 19048 B16R1.20667 CCCCC(C)N1CCC[C@H]1C(=O)OCC 2230a_100000703725_200011215066 [0,1,0,1,0,0|1,0,0]=3 19049 B16R1.20667 CCCCC(C)N1CCC[C@H]1C(=O)OCC 269982a_100000703725_200011215066 [0,1,0,1,0,0|1,0,0]=3 19050 B16R1.20667 CCCCC(C)N1CCC[C@H]1C(=O)OCC 270004a_100000703725_100000210087 [0,1,0,1,0,0|1,0,0]=3 19051 B16R1.20667 CCCCC(C)N1CSC[C@H]1C(=O)OCC 269982a_100016989239_200011215066 [0,1,0,1,0,0|2,0,0]=4 19052 B16R1.20667 CCCCC(C)N1CSC[C@H]1C(=O)OCC 270004a_100016989239_100000210087 [0,1,0,1,0,0|2,0,0]=4 19053 B16R1.20667 CCOC(=O)[C@@H]1CCCN1C(C)CCOC 270004a_100000703725_100000742357 [0,1,0,1,0,0|2,0,0]=4 19054 B16R1.20667 CCOC(=O)[C@@H]1CCCN1C(C)CCSC 270004a_100000703725_100011217047 [0,1,0,1,0,0|2,0,0]=4 19055 B16R1.20667 CCOC(=O)[C@@H]1CCCN1C(C)CSCC 270004a_100000703725_200011216171 [0,1,0,1,0,0|2,0,0]=4 19056 B16R1.66071 CCOC(=O)CCCCNC1(CCOC1)C 2230a_100000693475_100000750268 [0,1,0,1,0,0|2,0,0]=4 19057 B16R1.66071 CCOC(=O)CCCCOC1(CCCC1)C 34a_100000751722_100000750268 [0,1,0,1,0,0|1,0,0]=3 19058 B16R1.66071 CCOC(=O)CCCCOC1(CCCC1)C 7a_100000751722_100000750268 [0,1,0,1,0,0|1,0,0]=3 19059 B16R1.66071 CCOC(=O)CCCNCC1(CCCC1)O 2230a_100000737848_100009991533 [0,1,0,1,0,0|1,0,0]=3 19060 B16R1.66071 CCOC(=O)CCCOCC1(CCCC1)N 34a_100000749328_100009991533 [0,1,0,1,0,0|1,0,0]=3 19061 B16R1.66071 CCOC(=O)CCCOC[C@@]1(CCCN1)C 34a_100016195882_100009991533 [0,1,0,1,0,0|2,0,0]=4 19062 B16R1.66071 CCOC(=O)CCNCCC1(CCCC1)O 34a_100000719956_100000765890 [0,1,0,1,0,0|1,0,0]=3 19063 B16R1.66071 CCOC(=O)COCCOC1(CCCC1)C 34a_100000751722_100000088970 [0,1,0,1,0,0|2,0,0]=4 19064 B16R1.66071 CCOC(=O)COCCOC1(CCCC1)C 7a_100000751722_100000088970 [0,1,0,1,0,0|2,0,0]=4 19065 B16R1.69343 CCOC(=O)CCCCCC(=O)C1CC1C 1458a_100000211227_100000755133 [0,1,0,1,0,0|0,0,1]=3 19066 B16R1.69343 CCOC(=O)CCCCCC(=O)[C@@H]1C[C@@H]1F 1458a_100015396687_100000755133 [0,1,0,1,0,0|1,0,1]=4 19067 B16R1.69343 CCOC(=O)CCCCNC(=O)C1CC1C 188690a_100000718961_100000211227 [0,1,0,1,0,0|1,0,1]=4 19068 B16R1.69343 CCOC(=O)COCCCC(=O)C1CC1C 1458a_100000211227_100009893628 [0,1,0,1,0,0|1,0,1]=4 19069 B16R1.55 CCCCCCC(C)NC1CCNC(=O)C1 2230a_100016994916_100011215978 [0,1,0,1,0,0|2,0,0]=4 19070 B16R1.55 CCCCCCC(C)NC1CCNC(=O)C1 34a_100016994916_100011215978 [0,1,0,1,0,0|2,0,0]=4 19071 B16R1.55 CCCCCCC(C)OC1CCCC(=O)C1 34a_100012613340_100011215978 [0,1,0,1,0,0|2,0,0]=4 19072 B16R1.55 CCCCCCC(C)O[C@@H]1CCNC(=O)C1 34a_100015189427_100011215978 [0,1,0,1,0,0|2,0,0]=4 19073 B16R1.249 CCCCCCN1CCC(C1)C(=O)OCC 2230a_100016987290_100000210314 [0,1,0,1,0,0|1,0,0]=3 19074 B16R1.249 CCCCCCN1CCC(C1)C(=O)OCC 269982a_100016987290_100000210757 [0,1,0,1,0,0|1,0,0]=3 19075 B16R1.249 CCCCCNC1CCC(C1)C(=O)OCC 270004a_100000209983_100000077466 [0,1,0,1,0,0|1,0,0]=3 19076 B16R1.249 CCCCOCN1CCC(C1)C(=O)OCC 2230a_100016987290_100011995733 [0,1,0,1,0,0|2,0,0]=4 19077 B16R1.249 CCCCOCN1CCC(C1)C(=O)OCC 269982a_100016987290_100011995733 [0,1,0,1,0,0|2,0,0]=4 19078 B16R1.249 CCCOCCN1CCC(C1)C(=O)OCC 2230a_100016987290_100011215938 [0,1,0,1,0,0|2,0,0]=4 19079 B16R1.249 CCCOCCN1CCC(C1)C(=O)OCC 269982a_100016987290_100011215938 [0,1,0,1,0,0|2,0,0]=4 19080 B16R1.249 CCOC(=O)C1CCC(C1)NCCCCO 270004a_100000750430_100000077466 [0,1,0,1,0,0|2,0,0]=4 19081 B16R1.249 CCOC(=O)C1CCC(C1)NCCCOC 270004a_100150723488_100000077466 [0,1,0,1,0,0|2,0,0]=4 19082 B16R1.249 CCOC(=O)C1CCC(C1)NCCCSC 270004a_100000749238_100000077466 [0,1,0,1,0,0|2,0,0]=4 19083 B16R1.249 CCOC(=O)C1CCC(C1)NCCSCC 270004a_100000106463_100000077466 [0,1,0,1,0,0|2,0,0]=4 19084 B16R1.249 CCOC(=O)C1CCN(C1)CCCCCF 2230a_100016987290_100000729378 [0,1,0,1,0,0|2,0,0]=4 19085 B16R1.249 CCOC(=O)C1CCN(C1)CCCCCF 269982a_100016987290_100000729378 [0,1,0,1,0,0|2,0,0]=4 19086 B16R1.249 CCOC(=O)C1CCN(C1)CCCCCO 2230a_100016987290_100000746330 [0,1,0,1,0,0|2,0,0]=4 19087 B16R1.249 CCOC(=O)C1CCN(C1)CCCCCO 269982a_100016987290_100000746330 [0,1,0,1,0,0|2,0,0]=4 19088 B16R1.249 CCOC(=O)C1CCN(C1)CCCCOC 2230a_100016987290_100000730899 [0,1,0,1,0,0|2,0,0]=4 19089 B16R1.249 CCOC(=O)C1CCN(C1)CCCCOC 269982a_100016987290_100000730899 [0,1,0,1,0,0|2,0,0]=4 19090 B16R1.249 CCOCCCN1CCC(C1)C(=O)OCC 2230a_100016987290_100012232248 [0,1,0,1,0,0|2,0,0]=4 19091 B16R1.249 CCOCCCN1CCC(C1)C(=O)OCC 269982a_100016987290_100012232248 [0,1,0,1,0,0|2,0,0]=4 19092 B16R1.249 CCOCCNC1CCC(C1)C(=O)OCC 270004a_102516460346_100000077466 [0,1,0,1,0,0|2,0,0]=4 19093 B16R1.651 CCCC1CCC(C1)NCCC(=O)NCC 270004a_100025743525_200012087856 [0,1,0,1,0,0|2,0,0]=4 19094 B16R1.651 CCOC(=O)CCCN1CCC(C1)CCO 2230a_100016987287_100009991533 [0,1,0,1,0,0|2,0,0]=4 19095 B16R1.651 CCOC(=O)CCCN1CCC(C1)CCO 269982a_100016987287_100009991533 [0,1,0,1,0,0|2,0,0]=4 19096 B16R1.651 CCOC(=O)CCCN1CCC(C1)CCO 34a_100016987287_100009991533 [0,1,0,1,0,0|2,0,0]=4 19097 B16R1.651 CCOC(=O)CCCN1CCC(C1)COC 2230a_100025706693_100009991533 [0,1,0,1,0,0|2,0,0]=4 19098 B16R1.651 CCOC(=O)CCCN1CCC(C1)COC 269982a_100025706693_100009991533 [0,1,0,1,0,0|2,0,0]=4 19099 B16R1.651 CCOC(=O)CCCN1CCC(C1)COC 34a_100025706693_100009991533 [0,1,0,1,0,0|2,0,0]=4 19100 B16R1.651 CCOC(=O)CCCN1CC[C@@H](C1)OCC 2230a_100011787710_100009991533 [0,1,0,1,0,0|2,0,0]=4 19101 B16R1.651 CCOC(=O)CCCN1CC[C@@H](C1)OCC 269982a_100011787710_100009991533 [0,1,0,1,0,0|2,0,0]=4 19102 B16R1.651 CCOC(=O)CCCN1CC[C@@H](C1)OCC 34a_100011787710_100009991533 [0,1,0,1,0,0|2,0,0]=4 19103 B16R1.929 CCNC(=O)CCCC(=O)C1CCCCC1 1458a_100000199580_100000210327 [0,1,0,1,0,0|1,0,1]=4 19104 B16R1.929 CCNC(=O)CCNC(C)C1CCCCC1 269862a_100025743525_100000210989 [0,1,0,1,0,0|2,0,0]=4 19105 B16R1.929 CCNC(=O)CCN[C@H](C)C1CCCCC1 2230a_100025707633_100000737597 [0,1,0,1,0,0|2,0,0]=4 19106 B16R1.929 CCNC(=O)CCOC(C)C1CCCCC1 7a_100011216961_100000737597 [0,1,0,1,0,0|2,0,0]=4 19107 B16R1.929 CCNC(=O)COC[C@H](N)C1CCCCC1 34a_100009817630_100000183381 [0,1,0,1,0,0|2,0,0]=4 19108 B16R1.929 CCOC(=O)CCCC(=O)C1CCCCC1 1458a_100000210647_100011215271 [0,1,0,1,0,0|0,0,1]=3 19109 B16R1.929 CCOC(=O)CCCC(=O)C1CCCCC1 1458a_100000210991_100000210327 [0,1,0,1,0,0|0,0,1]=3 19110 B16R1.929 CCOC(=O)CCCC(=O)C1CCCCO1 1458a_100000748299_100011215271 [0,1,0,1,0,0|1,0,1]=4 19111 B16R1.929 CCOC(=O)CCCC(=O)C1CCCOC1 1458a_100000210991_100000693364 [0,1,0,1,0,0|1,0,1]=4 19112 B16R1.929 CCOC(=O)CCCC(=O)C1CCCOC1 1458a_100000741522_100011215271 [0,1,0,1,0,0|1,0,1]=4 19113 B16R1.929 CCOC(=O)CCCC(=O)C1CCOCC1 1458a_100000195482_100011215271 [0,1,0,1,0,0|1,0,1]=4 19114 B16R1.929 CCOC(=O)CCCC(=O)C1CCOCC1 1458a_100000210991_100011324220 [0,1,0,1,0,0|1,0,1]=4 19115 B16R1.929 CCOC(=O)CCCC(=O)C1CCSCC1 1458a_100000755232_100011215271 [0,1,0,1,0,0|1,0,1]=4 19116 B16R1.929 CCOC(=O)CCCN(C)C1CCCCC1 2230a_100000207522_100009991533 [0,1,0,1,0,0|1,0,0]=3 19117 B16R1.929 CCOC(=O)CCCN(C)C1CCCCC1 269982a_100000207522_100009991533 [0,1,0,1,0,0|1,0,0]=3 19118 B16R1.929 CCOC(=O)CCCN(C)C1CCCCC1 34a_100000207522_100009991533 [0,1,0,1,0,0|1,0,0]=3 19119 B16R1.929 CCOC(=O)CCCN(C)C1CCOCC1 2230a_100020587155_100009991533 [0,1,0,1,0,0|2,0,0]=4 19120 B16R1.929 CCOC(=O)CCCN(C)C1CCOCC1 269982a_100020587155_100009991533 [0,1,0,1,0,0|2,0,0]=4 19121 B16R1.929 CCOC(=O)CCCN(C)C1CCOCC1 34a_100020587155_100009991533 [0,1,0,1,0,0|2,0,0]=4 19122 B16R1.929 CCOC(=O)CCCN(C)C1CCSCC1 2230a_100015184757_100009991533 [0,1,0,1,0,0|2,0,0]=4 19123 B16R1.929 CCOC(=O)CCCN(C)C1CCSCC1 269982a_100015184757_100009991533 [0,1,0,1,0,0|2,0,0]=4 19124 B16R1.929 CCOC(=O)CCCN(C)C1CCSCC1 34a_100015184757_100009991533 [0,1,0,1,0,0|2,0,0]=4 19125 B16R1.929 CCOC(=O)CCNC(=O)C1CCCCC1 188690a_100000746078_100000210647 [0,1,0,1,0,0|1,0,1]=4 19126 B16R1.929 CCOC(=O)CCN[C@H](C)C1CCCCC1 2230a_100025707633_100011206558 [0,1,0,1,0,0|1,0,0]=3 19127 B16R1.929 CCOC(=O)CCN[C@H](C)C1CCCCC1 34a_100025707633_100000765890 [0,1,0,1,0,0|1,0,0]=3 19128 B16R1.929 CCOC(=O)CCOC(C)C1CCCCC1 34a_100011216961_100000765890 [0,1,0,1,0,0|1,0,0]=3 19129 B16R1.929 CCOC(=O)CCOC(C)C1CCCCC1 7a_100011216961_100011206558 [0,1,0,1,0,0|1,0,0]=3 19130 B16R1.929 CCOC(=O)CCOC(C)C1CCCNC1 34a_100000740858_100000765890 [0,1,0,1,0,0|2,0,0]=4 19131 B16R1.929 CCOC(=O)CCOC(C)C1CCNCC1 34a_100011728446_100000765890 [0,1,0,1,0,0|2,0,0]=4 19132 B16R1.929 CCOC(=O)CCO[C@H](C)C1CCOCC1 34a_100000703848_100000765890 [0,1,0,1,0,0|2,0,0]=4 19133 B16R1.929 CCOC(=O)CCO[C@H](C)C1CCOCC1 7a_100000703848_100011206558 [0,1,0,1,0,0|2,0,0]=4 19134 B16R1.929 CCOC(=O)COC[C@H](N)C1CCCCC1 34a_100009817630_100000188475 [0,1,0,1,0,0|1,0,0]=3 19135 B16R1.929 CCOC(=O)CSCC(=O)C1CCCCC1 62a_100000188475_100000241979 [0,1,0,1,0,0|1,0,1]=4 19136 B16R1.929 CCOC(=O)CSCC(=O)C1CCCCC1 62a_100000241979_100000188475 [0,1,0,1,0,0|1,0,1]=4 19137 B16R1.929 CCOC(=O)NCCC(=O)C1CCCCC1 1458a_100000210647_200011445536 [0,1,0,1,0,0|1,0,1]=4 19138 B16R1.929 CCOC(=O)NCCN(C)C1CCCCC1 269982a_100000207522_200011445536 [0,1,0,1,0,0|2,0,0]=4 19139 B16R1.1544 CCNC(=O)CCCC(=O)CC1CCCC1 1458a_100000199580_100000740388 [0,1,0,1,0,0|1,0,1]=4 19140 B16R1.1544 CCNC(=O)CCNC(C)CC1CCCC1 270004a_100025743525_100000692464 [0,1,0,1,0,0|2,0,0]=4 19141 B16R1.1544 CCOC(=O)CCCC(=O)CC1CCCC1 1458a_100000210891_100011215271 [0,1,0,1,0,0|0,0,1]=3 19142 B16R1.1544 CCOC(=O)CCCC(=O)CC1CCCC1 1458a_100000210991_100000740388 [0,1,0,1,0,0|0,0,1]=3 19143 B16R1.1544 CCOC(=O)CCCC(=O)CC1CCCO1 1458a_100000210991_100000203698 [0,1,0,1,0,0|1,0,1]=4 19144 B16R1.1544 CCOC(=O)CCCC(=O)CC1CCOC1 1458a_100000210991_100000702531 [0,1,0,1,0,0|1,0,1]=4 19145 B16R1.1544 CCOC(=O)CCCC(=O)CC1CCOC1 1458a_100011218419_100011215271 [0,1,0,1,0,0|1,0,1]=4 19146 B16R1.1544 CCOC(=O)CCCC(=O)CN1CCCC1 1458a_100000740243_100011215271 [0,1,0,1,0,0|1,0,1]=4 19147 B16R1.1544 CCOC(=O)CCCC(=O)NC1CCCC1 11a_100000211070_100000210991 [0,1,0,1,0,0|1,0,1]=4 19148 B16R1.1544 CCOC(=O)CCCC(=O)NC1CCCC1 1626a_100000211070_100000210991 [0,1,0,1,0,0|1,0,1]=4 19149 B16R1.1544 CCOC(=O)CCCC(=O)NC1CCCC1 240690a_100000211070_100000210991 [0,1,0,1,0,0|1,0,1]=4 19150 B16R1.1544 CCOC(=O)CCCC(=O)NC1CCCC1 527a_100000211070_100000210991 [0,1,0,1,0,0|1,0,1]=4 19151 B16R1.1544 CCOC(=O)CCCN(C)CC1CCCO1 2230a_100102946541_100009991533 [0,1,0,1,0,0|2,0,0]=4 19152 B16R1.1544 CCOC(=O)CCCN(C)CC1CCCO1 269982a_100102946541_100009991533 [0,1,0,1,0,0|2,0,0]=4 19153 B16R1.1544 CCOC(=O)CCCN(C)CC1CCCO1 34a_100102946541_100009991533 [0,1,0,1,0,0|2,0,0]=4 19154 B16R1.1544 CCOC(=O)CCCN(C)CC1CCOC1 2230a_100000684583_100009991533 [0,1,0,1,0,0|2,0,0]=4 19155 B16R1.1544 CCOC(=O)CCCN(C)CC1CCOC1 269982a_100000684583_100009991533 [0,1,0,1,0,0|2,0,0]=4 19156 B16R1.1544 CCOC(=O)CCCN(C)CC1CCOC1 34a_100000684583_100009991533 [0,1,0,1,0,0|2,0,0]=4 19157 B16R1.1544 CCOC(=O)CCNC(=O)CC1CCCC1 188690a_100000746078_100000210891 [0,1,0,1,0,0|1,0,1]=4 19158 B16R1.1544 CCOC(=O)COCC(C)CN1CCCC1 7a_200011934648_100000188475 [0,1,0,1,0,0|2,0,0]=4 19159 B16R1.1544 CCOC(=O)NCCC(=O)CC1CCCC1 1458a_100000210891_200011445536 [0,1,0,1,0,0|1,0,1]=4 19160 B16R1.2034 C=COC(=O)COCC1CCCCCCC1 34a_100011216312_100000036128 [0,1,0,1,0,0|0,0,2]=4 19161 B16R1.2034 CC=CC(=O)NCCC1CCCCCCC1 11a_100011532352_100000210699 [0,1,0,1,0,0|1,0,1]=4 19162 B16R1.2034 CC=CC(=O)NCCC1CCCCCCC1 1626a_100011532352_100000210699 [0,1,0,1,0,0|1,0,1]=4 19163 B16R1.2034 CC=CC(=O)NCCC1CCCCCCC1 240690a_100011532352_100000210699 [0,1,0,1,0,0|1,0,1]=4 19164 B16R1.2034 CCCC(=O)COCC1CCCCCCC1 7a_100011216312_100000747444 [0,1,0,1,0,0|1,0,0]=3 19165 B16R1.2034 CCCC(=O)NCCC1CCCCCCC1 11a_100011532352_100000211992 [0,1,0,1,0,0|1,0,0]=3 19166 B16R1.2034 CCCC(=O)NCCC1CCCCCCC1 1626a_100011532352_100000211992 [0,1,0,1,0,0|1,0,0]=3 19167 B16R1.2034 CCCC(=O)NCCC1CCCCCCC1 240690a_100011532352_100000211992 [0,1,0,1,0,0|1,0,0]=3 19168 B16R1.2034 CCCC(=O)NCCC1CCCCCCC1 527a_100011532352_100000211992 [0,1,0,1,0,0|1,0,0]=3 19169 B16R1.2034 CCCC(=O)OCNC1CCCCCCC1 2230a_100000211152_100000034017 [0,1,0,1,0,0|2,0,0]=4 19170 B16R1.2034 CCCC(=O)OCNC1CCCCCCC1 34a_100000211152_100000034017 [0,1,0,1,0,0|2,0,0]=4 19171 B16R1.2034 CCCC(=O)OCOC1CCCCCCC1 34a_100000210054_100000034017 [0,1,0,1,0,0|2,0,0]=4 19172 B16R1.2034 CCNC(=O)CCNC1CCCCCCC1 2230a_100000211152_100000737597 [0,1,0,1,0,0|1,0,0]=3 19173 B16R1.2034 CCNC(=O)CCNC1CCCCCCC1 270004a_100025743525_100000210524 [0,1,0,1,0,0|1,0,0]=3 19174 B16R1.2034 CCNC(=O)CCOC1CCCCCCC1 7a_100000210054_100000737597 [0,1,0,1,0,0|1,0,0]=3 19175 B16R1.2034 CCNC(=O)COCC1CCCCCCC1 34a_100011216312_100000183381 [0,1,0,1,0,0|1,0,0]=3 19176 B16R1.2034 CCNC(=O)COCC1CCCCCCC1 7a_100011216312_100000183381 [0,1,0,1,0,0|1,0,0]=3 19177 B16R1.2034 CCNC(=O)NCCC1CCCCCCC1 2708a_100011532352_100015525214 [0,1,0,1,0,0|1,0,0]=3 19178 B16R1.2034 CCNC(=O)NCCC1CCCCCCC1 2708a_100015525214_100011532352 [0,1,0,1,0,0|1,0,0]=3 19179 B16R1.2034 CCNC(=O)NCCC1CCCCCCC1 273464a_100011532352_100015525214 [0,1,0,1,0,0|1,0,0]=3 19180 B16R1.2034 CCNC(=O)NCCC1CCCCCCC1 273464a_100015525214_100011532352 [0,1,0,1,0,0|1,0,0]=3 19181 B16R1.2034 CCNC(=O)NCCC1CCCCCCC1 512a_100015525214_100011532352 [0,1,0,1,0,0|1,0,0]=3 19182 B16R1.2034 CCOC(=O)/C=C/CN1CCCCCCC1 2230a_100000211400_100016267167 [0,1,0,1,0,0|0,0,2]=4 19183 B16R1.2034 CCOC(=O)/C=C/CN1CCCCCCC1 269982a_100000211400_100016267167 [0,1,0,1,0,0|0,0,2]=4 19184 B16R1.2034 CCOC(=O)/C=C/CN1CCCCCCC1 34a_100000211400_100016267167 [0,1,0,1,0,0|0,0,2]=4 19185 B16R1.2034 CCOC(=O)CCCN1CCCCCCC1 2230a_100000211400_100009991533 [0,1,0,1,0,0|0,0,0]=2 19186 B16R1.2034 CCOC(=O)CCCN1CCCCCCC1 269982a_100000211400_100009991533 [0,1,0,1,0,0|0,0,0]=2 19187 B16R1.2034 CCOC(=O)CCCN1CCCCCCC1 34a_100000211400_100009991533 [0,1,0,1,0,0|0,0,0]=2 19188 B16R1.2034 CCOC(=O)CCNC1CCCCCCC1 2230a_100000211152_100011206558 [0,1,0,1,0,0|0,0,0]=2 19189 B16R1.2034 CCOC(=O)CCNC1CCCCCCC1 34a_100000211152_100000765890 [0,1,0,1,0,0|0,0,0]=2 19190 B16R1.2034 CCOC(=O)CCOC1C=CCCCCC1 34a_100000688657_100000765890 [0,1,0,1,0,0|0,0,2]=4 19191 B16R1.2034 CCOC(=O)CCOC1CC/C=C\CCC1 34a_100016989180_100000765890 [0,1,0,1,0,0|0,0,2]=4 19192 B16R1.2034 CCOC(=O)CCOC1CCCCCCC1 34a_100000210054_100000765890 [0,1,0,1,0,0|0,0,0]=2 19193 B16R1.2034 CCOC(=O)CCOC1CCCCCCC1 7a_100000210054_100011206558 [0,1,0,1,0,0|0,0,0]=2 19194 B16R1.2034 CCOC(=O)CCSC1CC/C=C\CCC1 62a_100000765890_100021000466 [0,1,0,1,0,0|0,0,2]=4 19195 B16R1.2034 CCOC(=O)CCSC1CC/C=C\CCC1 62a_100021000466_100000765890 [0,1,0,1,0,0|0,0,2]=4 19196 B16R1.2034 CCOC(=O)CNCC1CC/C=C\CCC1 2230a_100102730862_100000188475 [0,1,0,1,0,0|0,0,2]=4 19197 B16R1.2034 CCOC(=O)CNCC1CC/C=C\CCC1 34a_100102730862_100000188475 [0,1,0,1,0,0|0,0,2]=4 19198 B16R1.2034 CCOC(=O)COCC1CCCCCCC1 34a_100011216312_100000188475 [0,1,0,1,0,0|0,0,0]=2 19199 B16R1.2034 CCOC(=O)COCC1CCCCCCC1 7a_100011216312_100000188475 [0,1,0,1,0,0|0,0,0]=2 19200 B16R1.2034 CCOC(=O)NCCN1CCCCCCC1 269982a_100000211400_200011445536 [0,1,0,1,0,0|1,0,0]=3 19201 B16R1.2034 CNNC(=O)NCCC1CCCCCCC1 273464a_100011532352_100016993582 [0,1,0,1,0,0|2,0,0]=4 19202 B16R1.2034 CNNC(=O)NCCC1CCCCCCC1 512a_100016993582_100011532352 [0,1,0,1,0,0|2,0,0]=4 19203 B16R1.2034 COCC(=O)NCCC1CCCCCCC1 11a_100011532352_100000210968 [0,1,0,1,0,0|2,0,0]=4 19204 B16R1.2034 COCC(=O)NCCC1CCCCCCC1 1626a_100011532352_100000210968 [0,1,0,1,0,0|2,0,0]=4 19205 B16R1.2034 COCC(=O)NCCC1CCCCCCC1 240690a_100011532352_100000210968 [0,1,0,1,0,0|2,0,0]=4 19206 B16R1.2034 COCC(=O)NCCC1CCCCCCC1 527a_100011532352_100000210968 [0,1,0,1,0,0|2,0,0]=4 19207 B16R1.2034 CSCC(=O)NCCC1CCCCCCC1 11a_100011532352_100000184570 [0,1,0,1,0,0|2,0,0]=4 19208 B16R1.2034 CSCC(=O)NCCC1CCCCCCC1 1626a_100011532352_100000184570 [0,1,0,1,0,0|2,0,0]=4 19209 B16R1.2034 CSCC(=O)NCCC1CCCCCCC1 240690a_100011532352_100000184570 [0,1,0,1,0,0|2,0,0]=4 19210 B16R1.2034 CSCC(=O)NCCC1CCCCCCC1 527a_100011532352_100000184570 [0,1,0,1,0,0|2,0,0]=4 19211 B16R1.2034 O=C(CCO)NCCC1CCCCCCC1 240690a_100011532352_100011216618 [0,1,0,1,0,0|2,0,0]=4 19212 B16R1.2034 O=C(COCC1CCCCCCC1)NCO 34a_100011216312_100000185155 [0,1,0,1,0,0|2,0,0]=4 19213 B16R1.2034 O=C(COCC1CCCCCCC1)NCO 7a_100011216312_100000185155 [0,1,0,1,0,0|2,0,0]=4 19214 B16R1.2112 CCOC(=O)CCCC(=O)NCC1CCC1 11a_100000738700_100000210991 [0,1,0,1,0,0|1,0,1]=4 19215 B16R1.2112 CCOC(=O)CCCC(=O)NCC1CCC1 1626a_100000738700_100000210991 [0,1,0,1,0,0|1,0,1]=4 19216 B16R1.2112 CCOC(=O)CCCC(=O)NCC1CCC1 240690a_100000738700_100000210991 [0,1,0,1,0,0|1,0,1]=4 19217 B16R1.2112 CCOC(=O)CCCC(=O)NCC1CCC1 527a_100000738700_100000210991 [0,1,0,1,0,0|1,0,1]=4 19218 B16R1.2113 CCOC(=O)CCCC(=O)CCCC1CO1 1458a_100000210991_100000733510 [0,1,0,1,0,0|1,0,1]=4 19219 B16R1.2113 CCOC(=O)CCCC(=O)CSCC1CC1 1458a_200011316215_100011215271 [0,1,0,1,0,0|1,0,1]=4 19220 B16R1.2113 CCOC(=O)CCCC(=O)NCCC1CC1 1626a_100000764129_100000210991 [0,1,0,1,0,0|1,0,1]=4 19221 B16R1.2113 CCOC(=O)CCCC(=O)NCCC1CC1 240690a_100000764129_100000210991 [0,1,0,1,0,0|1,0,1]=4 19222 B16R1.2113 CCOC(=O)CCCC(=O)NCCC1CC1 527a_100000764129_100000210991 [0,1,0,1,0,0|1,0,1]=4 19223 B16R1.4593 CCCCCCC(=O)CCC1CCOC1=O 1458a_100000117037_100000210757 [0,1,0,1,0,0|0,0,1]=3 19224 B16R1.4593 CCCCCCC(=O)CCN1CCOC1=O 1458a_100000744634_100000210757 [0,1,0,1,0,0|1,0,1]=4 19225 B16R1.4593 CCCCCCC(C)OCC1CCNC1=O 34a_100000133458_100011215978 [0,1,0,1,0,0|2,0,0]=4 19226 B16R1.4593 CCCCCNC(=O)CCC1CCOC1=O 11a_100000209983_100000117037 [0,1,0,1,0,0|1,0,1]=4 19227 B16R1.4593 CCCCCNC(=O)CCC1CCOC1=O 1626a_100000209983_100000117037 [0,1,0,1,0,0|1,0,1]=4 19228 B16R1.4593 CCCCCNC(=O)CCC1CCOC1=O 240690a_100000209983_100000117037 [0,1,0,1,0,0|1,0,1]=4 19229 B16R1.4593 CCCCCNC(=O)CCC1CCOC1=O 527a_100000209983_100000117037 [0,1,0,1,0,0|1,0,1]=4 19230 B16R1.4593 CCCCOCC(=O)CCC1CCOC1=O 1458a_100000117037_100011995733 [0,1,0,1,0,0|1,0,1]=4 19231 B16R1.4593 CCCOCCC(=O)CCC1CCOC1=O 1458a_100000117037_100011215938 [0,1,0,1,0,0|1,0,1]=4 19232 B16R1.4593 CCOCCCC(=O)CCC1CCOC1=O 1458a_100000117037_100012232248 [0,1,0,1,0,0|1,0,1]=4 19233 B16R1.4593 COCCCCC(=O)CCC1CCOC1=O 1458a_100000117037_100000755781 [0,1,0,1,0,0|1,0,1]=4 19234 B16R1.4593 O=C(CCCCCF)CCC1CCOC1=O 1458a_100000117037_100000729378 [0,1,0,1,0,0|1,0,1]=4 19235 B16R1.4593 O=C(CCCCCO)CCC1CCOC1=O 1458a_100000117037_100000746330 [0,1,0,1,0,0|1,0,1]=4 19236 B16R1.15191 CCOC(=O)CCCC(=O)C1CCCC1C 1458a_100000690547_100011215271 [0,1,0,1,0,0|0,0,1]=3 19237 B16R1.15191 CCOC(=O)CCCC(=O)N1CCC[C@@H]1C 240690a_100020605311_100000210991 [0,1,0,1,0,0|1,0,1]=4 19238 B16R1.15191 CCOC(=O)CCCC(=O)N1CCC[C@@H]1C 527a_100020605311_100000210991 [0,1,0,1,0,0|1,0,1]=4 19239 B16R1.15191 CCOC(=O)CCCC(=O)N1CCC[C@H]1C 11a_100015189458_100000210991 [0,1,0,1,0,0|1,0,1]=4 19240 B16R1.15191 CCOC(=O)CCCC(=O)N1CCC[C@H]1C 240690a_100015189458_100000210991 [0,1,0,1,0,0|1,0,1]=4 19241 B16R1.15191 CCOC(=O)CCCC(=O)N1CCC[C@H]1C 527a_100015189458_100000210991 [0,1,0,1,0,0|1,0,1]=4 19242 B16R1.15191 CCOC(=O)CCCC(=O)[C@@H]1CCCN1C 1458a_100009816429_100011215271 [0,1,0,1,0,0|1,0,1]=4 19243 B16R1.15191 CCOC(=O)CCNC(=O)C1CCCC1C 188690a_100000746078_100000690547 [0,1,0,1,0,0|1,0,1]=4 19244 B16R1.15191 CCOC(=O)CCO[C@@H](C)[C@@H]1CCCN1C 34a_100160487421_100000765890 [0,1,0,1,0,0|2,0,0]=4 19245 B16R1.15191 CCOC(=O)NCCC(=O)C1CCCC1C 1458a_100000690547_200011445536 [0,1,0,1,0,0|1,0,1]=4 19246 B16R1.15307 CCNC(=O)CCNC1CCCC(C1)CC 270004a_100025743525_100000756783 [0,1,0,1,0,0|2,0,0]=4 19247 B16R1.15307 CCNC(=O)CCOC1CCCC(C1)CC 7a_100011985506_100000737597 [0,1,0,1,0,0|2,0,0]=4 19248 B16R1.15307 CCOC(=O)CCCN1CCCC(C1)CF 2230a_100016992999_100009991533 [0,1,0,1,0,0|2,0,0]=4 19249 B16R1.15307 CCOC(=O)CCCN1CCCC(C1)CF 269982a_100016992999_100009991533 [0,1,0,1,0,0|2,0,0]=4 19250 B16R1.15307 CCOC(=O)CCCN1CCCC(C1)CF 34a_100016992999_100009991533 [0,1,0,1,0,0|2,0,0]=4 19251 B16R1.15307 CCOC(=O)CCCN1CCCC(C1)CO 2230a_100000211344_100009991533 [0,1,0,1,0,0|2,0,0]=4 19252 B16R1.15307 CCOC(=O)CCCN1CCCC(C1)CO 269982a_100000211344_100009991533 [0,1,0,1,0,0|2,0,0]=4 19253 B16R1.15307 CCOC(=O)CCCN1CCCC(C1)CO 34a_100000211344_100009991533 [0,1,0,1,0,0|2,0,0]=4 19254 B16R1.15307 CCOC(=O)CCCN1CCCC(C1)OC 2230a_100000695604_100009991533 [0,1,0,1,0,0|2,0,0]=4 19255 B16R1.15307 CCOC(=O)CCCN1CCCC(C1)OC 269982a_100000695604_100009991533 [0,1,0,1,0,0|2,0,0]=4 19256 B16R1.15307 CCOC(=O)CCCN1CCCC(C1)OC 34a_100000695604_100009991533 [0,1,0,1,0,0|2,0,0]=4 19257 B16R1.15307 CCOC(=O)CCCN1CCOC(C1)CC 2230a_100000736320_100009991533 [0,1,0,1,0,0|2,0,0]=4 19258 B16R1.15307 CCOC(=O)CCCN1CCOC(C1)CC 269982a_100000736320_100009991533 [0,1,0,1,0,0|2,0,0]=4 19259 B16R1.15307 CCOC(=O)CCCN1CCOC(C1)CC 34a_100000736320_100009991533 [0,1,0,1,0,0|2,0,0]=4 19260 B16R1.15307 CCOC(=O)CCN[C@@H]1CCCN(C1)CC 2230a_100025775482_100011206558 [0,1,0,1,0,0|2,0,0]=4 19261 B16R1.15307 CCOC(=O)CCOC1CCCC(C1)CC 7a_100011985506_100011206558 [0,1,0,1,0,0|1,0,0]=3 19262 B16R1.15307 CCOC(=O)CCOC1CCCC(C1)CN 34a_100011254705_100000765890 [0,1,0,1,0,0|2,0,0]=4 19263 B16R1.15307 CCOC(=O)CNCC1CCCN(C1)CC 2230a_100000747413_100000188475 [0,1,0,1,0,0|2,0,0]=4 19264 B16R1.15307 CCOC(=O)COCC1CCCN(C1)CC 7a_200000227639_100000188475 [0,1,0,1,0,0|2,0,0]=4 19265 B16R1.26545 CCCCCCC(C)N1CCNC(=O)CC1 2230a_100000698595_100011215978 [0,1,0,1,0,0|2,0,0]=4 19266 B16R1.26545 CCCCCCC(C)N1CCNC(=O)CC1 269982a_100000698595_100011215978 [0,1,0,1,0,0|2,0,0]=4 19267 B16R1.26545 CCCCCCC(C)N1CCNC(=O)CC1 270004a_100000698595_100000210826 [0,1,0,1,0,0|2,0,0]=4 19268 B16R1.26599 CCCCCCC(=O)[C@@H]1C[C@H]1C(=O)OCC 1458a_100009818562_100000210757 [0,1,0,1,0,0|0,0,1]=3 19269 B16R1.26599 CCCCCNC(=O)[C@@H]1C[C@H]1C(=O)OCC 11a_100000209983_100009818562 [0,1,0,1,0,0|1,0,1]=4 19270 B16R1.26599 CCCCCNC(=O)[C@@H]1C[C@H]1C(=O)OCC 240690a_100000209983_100009818562 [0,1,0,1,0,0|1,0,1]=4 19271 B16R1.26599 CCCCOCC(=O)[C@@H]1C[C@H]1C(=O)OCC 1458a_100009818562_100011995733 [0,1,0,1,0,0|1,0,1]=4 19272 B16R1.26599 CCCOCCC(=O)[C@@H]1C[C@H]1C(=O)OCC 1458a_100009818562_100011215938 [0,1,0,1,0,0|1,0,1]=4 19273 B16R1.26599 CCOC(=O)[C@@H]1C[C@H]1C(=O)CCCCCF 1458a_100009818562_100000729378 [0,1,0,1,0,0|1,0,1]=4 19274 B16R1.26599 CCOC(=O)[C@@H]1C[C@H]1C(=O)CCCCCO 1458a_100009818562_100000746330 [0,1,0,1,0,0|1,0,1]=4 19275 B16R1.26599 CCOC(=O)[C@@H]1C[C@H]1C(=O)CCCCOC 1458a_100009818562_100000755781 [0,1,0,1,0,0|1,0,1]=4 19276 B16R1.26599 CCOCCCC(=O)[C@@H]1C[C@H]1C(=O)OCC 1458a_100009818562_100012232248 [0,1,0,1,0,0|1,0,1]=4 19277 B16R1.78765 CCCCCOC1CC(C1)CC(=O)OCC 7a_100010742785_100000210326 [0,1,0,1,0,0|1,0,0]=3 19278 B16R1.78765 CCOC(=O)CC1CC(C1)OCCCCF 7a_100010742785_100000729493 [0,1,0,1,0,0|2,0,0]=4 19279 B16R1.78765 CCOC(=O)CC1CC(C1)OCCCCO 7a_100010742785_100000210776 [0,1,0,1,0,0|2,0,0]=4 19280 B16R1.78765 CCOC(=O)CC1CC(C1)OCCCOC 7a_100010742785_100000740836 [0,1,0,1,0,0|2,0,0]=4 19281 B16R1.78765 CCOC(=O)CC1CC(C1)OCCSCC 7a_100010742785_100000757381 [0,1,0,1,0,0|2,0,0]=4 19282 B16R1.78765 CCOCCOC1CC(C1)CC(=O)OCC 7a_100010742785_100011215890 [0,1,0,1,0,0|2,0,0]=4 19283 B16R1.91304 CCNC(=O)CCNC1(CCCCCC1)C 2230a_100000704638_100000737597 [0,1,0,1,0,0|2,0,0]=4 19284 B16R1.91304 CCNC(=O)CCOC1(CCCCCC1)C 7a_100000708895_100000737597 [0,1,0,1,0,0|2,0,0]=4 19285 B16R1.91304 CCOC(=O)CCNC1(CCCCCC1)C 2230a_100000704638_100011206558 [0,1,0,1,0,0|1,0,0]=3 19286 B16R1.91304 CCOC(=O)CCNC1(CCCCCC1)C 34a_100000704638_100000765890 [0,1,0,1,0,0|1,0,0]=3 19287 B16R1.91304 CCOC(=O)CCOC1(CCCCCC1)C 34a_100000708895_100000765890 [0,1,0,1,0,0|1,0,0]=3 19288 B16R1.91304 CCOC(=O)CCOC1(CCCCCC1)C 7a_100000708895_100011206558 [0,1,0,1,0,0|1,0,0]=3 19289 B16R1.91304 CCOC(=O)CCOC1(CCCNCC1)C 34a_100000723723_100000765890 [0,1,0,1,0,0|2,0,0]=4 19290 B16R1.56 CC(C)OC(=O)CCN1CCCCC1CO 2230a_100000210821_100000760027 [0,1,0,1,0,0|2,0,0]=4 19291 B16R1.56 CC(C)OC(=O)CCN1CCCCC1CO 269982a_100000210821_100000760027 [0,1,0,1,0,0|2,0,0]=4 19292 B16R1.56 CC(C)OC(=O)COC1CCCCC1CN 34a_100011216029_100011215430 [0,1,0,1,0,0|2,0,0]=4 19293 B16R1.56 CCC1CCCCC1NCC(=O)NC(C)C 269862a_100000168517_100000757040 [0,1,0,1,0,0|2,0,0]=4 19294 B16R1.56 CCC1CCCCC1NCC(=O)NC(C)C 270004a_100000168517_100000757040 [0,1,0,1,0,0|2,0,0]=4 19295 B16R1.56 CCC1CCCCC1OCC(=O)NC(C)C 34a_100000210738_100000183996 [0,1,0,1,0,0|2,0,0]=4 19296 B16R1.56 CCC1CCCCC1OCC(=O)NC(C)C 7a_100000210738_100000183996 [0,1,0,1,0,0|2,0,0]=4 19297 B16R1.56 CCC1CCCCC1OCC(=O)OC(C)C 34a_100000210738_100011215430 [0,1,0,1,0,0|1,0,0]=3 19298 B16R1.56 CCC1CCCCC1OCC(=O)OC(C)C 7a_100000210738_100011215430 [0,1,0,1,0,0|1,0,0]=3 19299 B16R1.56 CCC1CCCCN1CCC(=O)NC(C)C 2230a_100000210034_100000737564 [0,1,0,1,0,0|2,0,0]=4 19300 B16R1.56 CCC1CCCCN1CCC(=O)NC(C)C 269982a_100000210034_100000737564 [0,1,0,1,0,0|2,0,0]=4 19301 B16R1.56 CCC1CCCCN1CCC(=O)OC(C)C 2230a_100000210034_100000760027 [0,1,0,1,0,0|1,0,0]=3 19302 B16R1.56 CCC1CCCCN1CCC(=O)OC(C)C 269982a_100000210034_100000760027 [0,1,0,1,0,0|1,0,0]=3 19303 B16R1.56 CCC1CCCCN1COC(=O)OC(C)C 269982a_100000210034_100010125566 [0,1,0,1,0,0|2,0,0]=4 19304 B16R1.56 CC[C@H]1COCCN1CCC(=O)OC(C)C 2230a_100016988097_100000760027 [0,1,0,1,0,0|2,0,0]=4 19305 B16R1.56 CC[C@H]1COCCN1CCC(=O)OC(C)C 269982a_100016988097_100000760027 [0,1,0,1,0,0|2,0,0]=4 19306 B16R1.56 CN[C@@H]1CCCC[C@H]1OCC(=O)OC(C)C 34a_100000708425_100011215430 [0,1,0,1,0,0|2,0,0]=4 19307 B16R1.56 COC1CCCCC1NCC(=O)OC(C)C 34a_100011208099_100011215430 [0,1,0,1,0,0|2,0,0]=4 19308 B16R1.56 CO[C@H]1CCCC[C@@H]1OCC(=O)OC(C)C 34a_200009815850_100011215430 [0,1,0,1,0,0|2,0,0]=4 19309 B16R1.56 CO[C@H]1CCCC[C@@H]1OCC(=O)OC(C)C 7a_200009815850_100011215430 [0,1,0,1,0,0|2,0,0]=4 19310 B16R1.289 CC(C)NC(=O)CCNC1CCCCC1C 2230a_100000211402_100000737564 [0,1,0,1,0,0|2,0,0]=4 19311 B16R1.289 CC(C)NC(=O)CCOC1CCCCC1C 7a_100000211207_100000737564 [0,1,0,1,0,0|2,0,0]=4 19312 B16R1.289 CC(C)OC(=O)CCNC1CCCCC1C 2230a_100000211402_100000760027 [0,1,0,1,0,0|1,0,0]=3 19313 B16R1.289 CC(C)OC(=O)CCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000760027 [0,1,0,1,0,0|2,0,0]=4 19314 B16R1.289 CC(C)OC(=O)CCOC1CCCCC1C 7a_100000211207_100000760027 [0,1,0,1,0,0|1,0,0]=3 19315 B16R1.289 CC(C)OC(=O)CCOC1CCCCC1Cl 7a_100000038908_100000760027 [0,1,0,1,0,0|2,0,0]=4 19316 B16R1.289 CC(C)OC(=O)CCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000760027 [0,1,0,1,0,0|2,0,0]=4 19317 B16R1.289 CC(C)OC(=O)CCSC1CCCCC1F 62a_100000760027_100015423560 [0,1,0,1,0,0|2,0,0]=4 19318 B16R1.289 CC(C)OC(=O)CCSC1CCCCC1F 62a_100015423560_100000760027 [0,1,0,1,0,0|2,0,0]=4 19319 B16R1.289 CC(C)OC(=O)CCSC1CCCCC1O 62a_100000038908_100000760027 [0,1,0,1,0,0|2,0,0]=4 19320 B16R1.289 CC(C)OC(=O)CCSC1CCCCC1O 62a_100000760027_100000038908 [0,1,0,1,0,0|2,0,0]=4 19321 B16R1.289 CC(C)OC(=O)CNCC1CCCCC1O 34a_100011216029_100011215430 [0,1,0,1,0,0|2,0,0]=4 19322 B16R1.289 CC(C)OC(=O)CNCC1CCCCN1C 34a_100011228421_100011215430 [0,1,0,1,0,0|2,0,0]=4 19323 B16R1.289 CC(C)OC(=O)COCC1CCCCN1C 34a_100000225079_100011215430 [0,1,0,1,0,0|2,0,0]=4 19324 B16R1.289 CC(C)OC(=O)CSCC1CCCCN1C 62a_100011215430_100015185383 [0,1,0,1,0,0|2,0,0]=4 19325 B16R1.289 CC(C)OC(=O)CSCC1CCCCN1C 62a_100015185383_100011215430 [0,1,0,1,0,0|2,0,0]=4 19326 B16R1.393 CC(C)OC(=O)COCCC1CCCN1C 34a_100011215177_100011215430 [0,1,0,1,0,0|2,0,0]=4 19327 B16R1.393 CC(C)OC(=O)COCCC1CCCN1C 7a_100011215177_100011215430 [0,1,0,1,0,0|2,0,0]=4 19328 B16R1.393 CC(C)OC(=O)CSCCC1CCCN1C 62a_100000005710_100011215430 [0,1,0,1,0,0|2,0,0]=4 19329 B16R1.393 CC(C)OC(=O)CSCCC1CCCN1C 62a_100011215430_100000005710 [0,1,0,1,0,0|2,0,0]=4 19330 B16R1.642 CCCCCCCCCCc1nc(no1)C 270196a_100000212224_100000210375 [0,1,0,1,0,0|1,0,1]=4 19331 B16R1.642 CCCCCCCCCCc1nnc(o1)C 271570a_100000061613_100000708914 [0,1,0,1,0,0|1,0,1]=4 19332 B16R1.642 CCCCCCCCCCc1noc(n1)C 270196a_200011216699_100000070787 [0,1,0,1,0,0|1,0,1]=4 19333 B16R1.642 CCCCCCCCCCc1noc(n1)C 271570a_100000061613_100012003639 [0,1,0,1,0,0|1,0,1]=4 19334 B16R1.707 CCCC1CCCC1NCC(=O)NC(C)C 269862a_100000168517_100000723119 [0,1,0,1,0,0|2,0,0]=4 19335 B16R1.707 CCCC1CCCC1NCC(=O)NC(C)C 270004a_100000168517_100000723119 [0,1,0,1,0,0|2,0,0]=4 19336 B16R1.707 COC[C@@H]1CCCN1CCC(=O)OC(C)C 2230a_100020646714_100000760027 [0,1,0,1,0,0|2,0,0]=4 19337 B16R1.707 COC[C@@H]1CCCN1CCC(=O)OC(C)C 269982a_100020646714_100000760027 [0,1,0,1,0,0|2,0,0]=4 19338 B16R1.3909 CCN1CCCC1CNCC(=O)OC(C)C 2230a_100000211693_100011215430 [0,1,0,1,0,0|2,0,0]=4 19339 B16R1.3909 CCN1CCC[C@@H]1COCC(=O)OC(C)C 34a_100011739246_100011215430 [0,1,0,1,0,0|2,0,0]=4 19340 B16R1.3909 CCN1CCC[C@@H]1COCC(=O)OC(C)C 7a_100011739246_100011215430 [0,1,0,1,0,0|2,0,0]=4 19341 B16R1.4459 CC(C)OC(=O)CN1CCCCC1CCO 2230a_100000211664_100011215430 [0,1,0,1,0,0|2,0,0]=4 19342 B16R1.4459 CC(C)OC(=O)CN1CCCCC1CCO 269982a_100000211664_100011215430 [0,1,0,1,0,0|2,0,0]=4 19343 B16R1.4459 CC(C)OC(=O)CN1CCCCC1CCO 34a_100000211664_100011215430 [0,1,0,1,0,0|2,0,0]=4 19344 B16R1.4459 CCCC1CCCCN1CC(=O)NC(C)C 2230a_100000701414_100000183996 [0,1,0,1,0,0|2,0,0]=4 19345 B16R1.4459 CCCC1CCCCN1CC(=O)NC(C)C 269982a_100000701414_100000183996 [0,1,0,1,0,0|2,0,0]=4 19346 B16R1.4459 CCCC1CCCCN1CC(=O)NC(C)C 34a_100000701414_100000183996 [0,1,0,1,0,0|2,0,0]=4 19347 B16R1.4459 CCCC1CCCCN1CC(=O)OC(C)C 2230a_100000701414_100011215430 [0,1,0,1,0,0|1,0,0]=3 19348 B16R1.4459 CCCC1CCCCN1CC(=O)OC(C)C 269982a_100000701414_100011215430 [0,1,0,1,0,0|1,0,0]=3 19349 B16R1.4459 CCCC1CCCCN1CC(=O)OC(C)C 34a_100000701414_100011215430 [0,1,0,1,0,0|1,0,0]=3 19350 B16R1.4459 CCCC1COCCN1CC(=O)OC(C)C 2230a_102495339903_100011215430 [0,1,0,1,0,0|2,0,0]=4 19351 B16R1.4459 CCCC1COCCN1CC(=O)OC(C)C 269982a_102495339903_100011215430 [0,1,0,1,0,0|2,0,0]=4 19352 B16R1.4459 CCCC1COCCN1CC(=O)OC(C)C 34a_102495339903_100011215430 [0,1,0,1,0,0|2,0,0]=4 19353 B16R1.4459 COCC1CCCCN1CC(=O)OC(C)C 2230a_100015184032_100011215430 [0,1,0,1,0,0|2,0,0]=4 19354 B16R1.4459 COCC1CCCCN1CC(=O)OC(C)C 269982a_100015184032_100011215430 [0,1,0,1,0,0|2,0,0]=4 19355 B16R1.4459 COCC1CCCCN1CC(=O)OC(C)C 34a_100015184032_100011215430 [0,1,0,1,0,0|2,0,0]=4 19356 B16R1.4695 CC1CC(C(=O)O1)NCCCCCCCO 2230a_100011996573_200000216747 [0,1,0,1,0,0|2,0,0]=4 19357 B16R1.4695 CC1CC(C(=O)O1)NCCCCCCCO 34a_100011996573_200000216747 [0,1,0,1,0,0|2,0,0]=4 19358 B16R1.4695 CC1CC(C(=O)O1)OCCCCCCCBr 34a_100000760002_200000216747 [0,1,0,1,0,0|2,0,0]=4 19359 B16R1.4695 CC1CC(C(=O)O1)OCCCCCCCBr 7a_100000760002_200000216747 [0,1,0,1,0,0|2,0,0]=4 19360 B16R1.4695 CC1CC(C(=O)O1)OCCCCCCCN 34a_100011996573_200000216747 [0,1,0,1,0,0|2,0,0]=4 19361 B16R1.4695 CC1CC(C(=O)O1)SCCCCCCCO 62a_100000760002_200000216747 [0,1,0,1,0,0|2,0,0]=4 19362 B16R1.4695 CC1CC(C(=O)O1)SCCCCCCCO 62a_200000216747_100000760002 [0,1,0,1,0,0|2,0,0]=4 19363 B16R1.4695 CCCCCCCCNC1CC(OC1=O)C 2230a_100000229939_200000216747 [0,1,0,1,0,0|1,0,0]=3 19364 B16R1.4695 CCCCCCCCNC1CC(OC1=O)C 34a_100000229939_200000216747 [0,1,0,1,0,0|1,0,0]=3 19365 B16R1.4695 CCCCCCCCOC1CC(OC1=O)C 34a_100000210232_200000216747 [0,1,0,1,0,0|1,0,0]=3 19366 B16R1.4695 CCCCCCCCOC1CC(OC1=O)C 7a_100000210232_200000216747 [0,1,0,1,0,0|1,0,0]=3 19367 B16R1.4695 CCCCCCCCSC1CC(OC1=O)C 62a_100000210759_200000216747 [0,1,0,1,0,0|1,0,0]=3 19368 B16R1.4695 CCCCCCCCSC1CC(OC1=O)C 62a_200000216747_100000210317 [0,1,0,1,0,0|1,0,0]=3 19369 B16R1.4695 CCCCCNCCOC1CC(OC1=O)C 34a_100000224656_200000216747 [0,1,0,1,0,0|2,0,0]=4 19370 B16R1.4695 CCCCCOCCOC1CC(OC1=O)C 34a_100011215259_200000216747 [0,1,0,1,0,0|2,0,0]=4 19371 B16R1.4695 CCCCCOCCOC1CC(OC1=O)C 7a_100011215259_200000216747 [0,1,0,1,0,0|2,0,0]=4 19372 B16R1.4695 CCCCOCCCNC1CC(OC1=O)C 2230a_200000211371_200000216747 [0,1,0,1,0,0|2,0,0]=4 19373 B16R1.4695 CCCCOCCCNC1CC(OC1=O)C 34a_200000211371_200000216747 [0,1,0,1,0,0|2,0,0]=4 19374 B16R1.4695 CCCCOCCCOC1CC(OC1=O)C 34a_200011215613_200000216747 [0,1,0,1,0,0|2,0,0]=4 19375 B16R1.4695 CCCCOCCCOC1CC(OC1=O)C 7a_200011215613_200000216747 [0,1,0,1,0,0|2,0,0]=4 19376 B16R1.4695 COCCCCCCOC1CC(OC1=O)C 34a_200012092642_200000216747 [0,1,0,1,0,0|2,0,0]=4 19377 B16R1.4695 COCCCCCCOC1CC(OC1=O)C 7a_200012092642_200000216747 [0,1,0,1,0,0|2,0,0]=4 19378 B16R1.4695 COCCCCCCSC1CC(OC1=O)C 62a_100011998445_200000216747 [0,1,0,1,0,0|2,0,0]=4 19379 B16R1.4695 COCCCCCCSC1CC(OC1=O)C 62a_200000216747_100011998445 [0,1,0,1,0,0|2,0,0]=4 19380 B16R1.6929 C=C(C)CC(=O)CCCCC1CCCCC1 1458a_200011215547_100000748629 [0,1,0,1,0,0|1,0,1]=4 19381 B16R1.6929 CC(C)CC(=O)CCCCC1CCCCC1 1458a_200011215547_100000210624 [0,1,0,1,0,0|1,0,0]=3 19382 B16R1.6929 CC(C)CC(=O)CCCCN1CCCCC1 1458a_100000754417_100000210624 [0,1,0,1,0,0|2,0,0]=4 19383 B16R1.6929 CC(C)CC(=O)NCCCC1CCCCC1 11a_100011211642_100000210554 [0,1,0,1,0,0|2,0,0]=4 19384 B16R1.6929 CC(C)CC(=O)NCCCC1CCCCC1 1626a_100011211642_100000210554 [0,1,0,1,0,0|2,0,0]=4 19385 B16R1.6929 CC(C)CC(=O)NCCCC1CCCCC1 240690a_100011211642_100000210554 [0,1,0,1,0,0|2,0,0]=4 19386 B16R1.6929 CC(C)CC(=O)NCCCC1CCCCC1 527a_100011211642_100000210554 [0,1,0,1,0,0|2,0,0]=4 19387 B16R1.6929 CC(C)NC(=O)CCCCC1CCCCC1 11a_100138425928_200011215547 [0,1,0,1,0,0|1,0,0]=3 19388 B16R1.6929 CC(C)NC(=O)CCCCC1CCCCC1 1626a_100138425928_200011215547 [0,1,0,1,0,0|1,0,0]=3 19389 B16R1.6929 CC(C)NC(=O)CCCCC1CCCCC1 240690a_100138425928_200011215547 [0,1,0,1,0,0|1,0,0]=3 19390 B16R1.6929 CC(C)NC(=O)CCCCC1CCCCC1 527a_100138425928_200011215547 [0,1,0,1,0,0|1,0,0]=3 19391 B16R1.6929 CC(C)NC(=O)CCCCN1CCCCC1 11a_100138425928_100000754417 [0,1,0,1,0,0|2,0,0]=4 19392 B16R1.6929 CC(C)NC(=O)CCCCN1CCCCC1 240690a_100138425928_100000754417 [0,1,0,1,0,0|2,0,0]=4 19393 B16R1.6929 CC(C)NC(=O)CCNCC1CCCCC1 2230a_100000210473_100000737564 [0,1,0,1,0,0|2,0,0]=4 19394 B16R1.6929 CC(C)NC(=O)CCOCC1CCCCC1 7a_100000212181_100000737564 [0,1,0,1,0,0|2,0,0]=4 19395 B16R1.6929 CC(C)NC(=O)CCSCC1CCCCC1 62a_100000211423_100000737564 [0,1,0,1,0,0|2,0,0]=4 19396 B16R1.6929 CC(C)NC(=O)CCSCC1CCCCC1 62a_100000737564_100000211423 [0,1,0,1,0,0|2,0,0]=4 19397 B16R1.6929 CC(C)NC(=O)CNCCC1CCCCC1 2230a_100000168517_100012355289 [0,1,0,1,0,0|2,0,0]=4 19398 B16R1.6929 CC(C)NC(=O)CNCCC1CCCCC1 2230a_100000738074_100000183996 [0,1,0,1,0,0|2,0,0]=4 19399 B16R1.6929 CC(C)NC(=O)CNCCC1CCCCC1 270004a_100000168517_100011713444 [0,1,0,1,0,0|2,0,0]=4 19400 B16R1.6929 CC(C)NC(=O)CNCCC1CCCCC1 34a_100000738074_100000183996 [0,1,0,1,0,0|2,0,0]=4 19401 B16R1.6929 CC(C)NC(=O)COCCC1CCCCC1 34a_100011217863_100000183996 [0,1,0,1,0,0|2,0,0]=4 19402 B16R1.6929 CC(C)NC(=O)COCCC1CCCCC1 7a_100011217863_100000183996 [0,1,0,1,0,0|2,0,0]=4 19403 B16R1.6929 CC(C)NC(=O)CSCCC1CCCCC1 62a_100000183996_100012355289 [0,1,0,1,0,0|2,0,0]=4 19404 B16R1.6929 CC(C)NC(=O)CSCCC1CCCCC1 62a_100012355289_100000183996 [0,1,0,1,0,0|2,0,0]=4 19405 B16R1.6929 CC(C)NC(=O)NCCCC1CCCCC1 2708a_100011211642_100138425928 [0,1,0,1,0,0|2,0,0]=4 19406 B16R1.6929 CC(C)NC(=O)NCCCC1CCCCC1 2708a_100138425928_100011211642 [0,1,0,1,0,0|2,0,0]=4 19407 B16R1.6929 CC(C)NC(=O)NCCCC1CCCCC1 273464a_100138425928_100011211642 [0,1,0,1,0,0|2,0,0]=4 19408 B16R1.6929 CC(C)NC(=O)NCCCC1CCCCC1 512a_100011211642_100138425928 [0,1,0,1,0,0|2,0,0]=4 19409 B16R1.6929 CC(C)NC(=O)NCCCC1CCCCC1 512a_100138425928_100011211642 [0,1,0,1,0,0|2,0,0]=4 19410 B16R1.6929 CC(C)OC(=O)CCNCC1CCCCC1 2230a_100000210473_100000760027 [0,1,0,1,0,0|1,0,0]=3 19411 B16R1.6929 CC(C)OC(=O)CCNCC1CCCCO1 2230a_100000174945_100000760027 [0,1,0,1,0,0|2,0,0]=4 19412 B16R1.6929 CC(C)OC(=O)CCNCC1CCCOC1 2230a_100000720124_100000760027 [0,1,0,1,0,0|2,0,0]=4 19413 B16R1.6929 CC(C)OC(=O)CCNCC1CCOCC1 2230a_100000746373_100000760027 [0,1,0,1,0,0|2,0,0]=4 19414 B16R1.6929 CC(C)OC(=O)CCNCC1CCSCC1 2230a_100015188806_100000760027 [0,1,0,1,0,0|2,0,0]=4 19415 B16R1.6929 CC(C)OC(=O)CCOCC1CCCCC1 7a_100000212181_100000760027 [0,1,0,1,0,0|1,0,0]=3 19416 B16R1.6929 CC(C)OC(=O)CCOCC1CCCCO1 7a_100000211370_100000760027 [0,1,0,1,0,0|2,0,0]=4 19417 B16R1.6929 CC(C)OC(=O)CCOCC1CCSCC1 7a_100000070558_100000760027 [0,1,0,1,0,0|2,0,0]=4 19418 B16R1.6929 CC(C)OC(=O)CCSCC1CCCCC1 62a_100000211423_100000760027 [0,1,0,1,0,0|1,0,0]=3 19419 B16R1.6929 CC(C)OC(=O)CCSCC1CCCCC1 62a_100000760027_100000211423 [0,1,0,1,0,0|1,0,0]=3 19420 B16R1.6929 CC(C)OC(=O)CCSCC1CCCCO1 62a_100000211543_100000760027 [0,1,0,1,0,0|2,0,0]=4 19421 B16R1.6929 CC(C)OC(=O)CCSCC1CCCCO1 62a_100000760027_100000211543 [0,1,0,1,0,0|2,0,0]=4 19422 B16R1.6929 CC(C)OC(=O)CCSCC1CCCOC1 62a_100000741521_100000760027 [0,1,0,1,0,0|2,0,0]=4 19423 B16R1.6929 CC(C)OC(=O)CCSCC1CCCOC1 62a_100000760027_100000741521 [0,1,0,1,0,0|2,0,0]=4 19424 B16R1.6929 CC(C)OC(=O)CCSCC1CCOCC1 62a_100000754603_100000760027 [0,1,0,1,0,0|2,0,0]=4 19425 B16R1.6929 CC(C)OC(=O)CCSCC1CCOCC1 62a_100000760027_100000749018 [0,1,0,1,0,0|2,0,0]=4 19426 B16R1.6929 CC(C)OC(=O)CNCCC1CCCCC1 2230a_100000738074_100011215430 [0,1,0,1,0,0|1,0,0]=3 19427 B16R1.6929 CC(C)OC(=O)CNCCC1CCCCC1 34a_100000738074_100011215430 [0,1,0,1,0,0|1,0,0]=3 19428 B16R1.6929 CC(C)OC(=O)CNCCC1CCCCO1 2230a_100015183643_100011215430 [0,1,0,1,0,0|2,0,0]=4 19429 B16R1.6929 CC(C)OC(=O)CNCCC1CCCCO1 34a_100015183643_100011215430 [0,1,0,1,0,0|2,0,0]=4 19430 B16R1.6929 CC(C)OC(=O)CNCCC1CCOCC1 2230a_100000755988_100011215430 [0,1,0,1,0,0|2,0,0]=4 19431 B16R1.6929 CC(C)OC(=O)CNCCC1CCOCC1 34a_100000755988_100011215430 [0,1,0,1,0,0|2,0,0]=4 19432 B16R1.6929 CC(C)OC(=O)COCCC1CCCCC1 34a_100011217863_100011215430 [0,1,0,1,0,0|1,0,0]=3 19433 B16R1.6929 CC(C)OC(=O)COCCC1CCCCC1 7a_100011217863_100011215430 [0,1,0,1,0,0|1,0,0]=3 19434 B16R1.6929 CC(C)OC(=O)COCCC1CCCCN1 34a_100000211664_100011215430 [0,1,0,1,0,0|2,0,0]=4 19435 B16R1.6929 CC(C)OC(=O)COCCC1CCCNC1 34a_100000752241_100011215430 [0,1,0,1,0,0|2,0,0]=4 19436 B16R1.6929 CC(C)OC(=O)COCCC1CCNCC1 34a_100015190746_100011215430 [0,1,0,1,0,0|2,0,0]=4 19437 B16R1.6929 CC(C)OC(=O)COCCC1CCOCC1 34a_100011933979_100011215430 [0,1,0,1,0,0|2,0,0]=4 19438 B16R1.6929 CC(C)OC(=O)COCCC1CCOCC1 7a_100011933979_100011215430 [0,1,0,1,0,0|2,0,0]=4 19439 B16R1.6929 CC(C)OC(=O)CSCCC1CCCCC1 62a_100011215430_100012355289 [0,1,0,1,0,0|1,0,0]=3 19440 B16R1.6929 CC(C)OC(=O)CSCCC1CCCCC1 62a_100012355289_100011215430 [0,1,0,1,0,0|1,0,0]=3 19441 B16R1.6929 CC(C)OC(=O)CSCCC1CCOCC1 62a_100011215430_100011934994 [0,1,0,1,0,0|2,0,0]=4 19442 B16R1.6929 CC(C)OC(=O)CSCCC1CCOCC1 62a_100011934994_100011215430 [0,1,0,1,0,0|2,0,0]=4 19443 B16R1.6929 CC(C)OC(=O)CSCCN1CCCCC1 62a_100000739454_100011215430 [0,1,0,1,0,0|2,0,0]=4 19444 B16R1.6929 CC(C)OC(=O)CSCCN1CCCCC1 62a_100011215430_100000739454 [0,1,0,1,0,0|2,0,0]=4 19445 B16R1.6929 CC(C)OC(=O)CSCOC1CCCCC1 62a_100011215430_100011935260 [0,1,0,1,0,0|2,0,0]=4 19446 B16R1.6929 CC(C)OC(=O)CSCOC1CCCCC1 62a_100011935260_100011215430 [0,1,0,1,0,0|2,0,0]=4 19447 B16R1.6929 CC(C)OC(=O)OCSCC1CCCCC1 62a_100000003507_100000211423 [0,1,0,1,0,0|2,0,0]=4 19448 B16R1.6929 CC(C)OC(=O)OCSCC1CCCCC1 62a_100000211423_100000003507 [0,1,0,1,0,0|2,0,0]=4 19449 B16R1.6929 CC(O)CC(=O)CCCCC1CCCCC1 1458a_200011215547_100011218427 [0,1,0,1,0,0|1,0,0]=3 19450 B16R1.6929 CC(O)CC(=O)CCCCN1CCCCC1 1458a_100000754417_100011218427 [0,1,0,1,0,0|2,0,0]=4 19451 B16R1.6929 C[C@@H](O)CC(=O)NCCCC1CCCCC1 240690a_100011211642_100011933948 [0,1,0,1,0,0|2,0,0]=4 19452 B16R1.6929 O=C(CCCCC1CCCCC1)CC(F)F 1458a_200011215547_100011934356 [0,1,0,1,0,0|2,0,0]=4 19453 B16R1.6935 CC(C)NC(=O)CCNCCC1CCCC1 2230a_100000739158_100000737564 [0,1,0,1,0,0|2,0,0]=4 19454 B16R1.6935 CC(C)NC(=O)CCOCCC1CCCC1 7a_100000749090_100000737564 [0,1,0,1,0,0|2,0,0]=4 19455 B16R1.6935 CC(C)NC(=O)CCSCCC1CCCC1 62a_100000737564_100000760354 [0,1,0,1,0,0|2,0,0]=4 19456 B16R1.6935 CC(C)NC(=O)CCSCCC1CCCC1 62a_100000760354_100000737564 [0,1,0,1,0,0|2,0,0]=4 19457 B16R1.6935 CC(C)NC(=O)CNCCCC1CCCC1 2230a_100000168517_100011713738 [0,1,0,1,0,0|2,0,0]=4 19458 B16R1.6935 CC(C)NC(=O)CNCCCC1CCCC1 2230a_100000736752_100000183996 [0,1,0,1,0,0|2,0,0]=4 19459 B16R1.6935 CC(C)NC(=O)CNCCCC1CCCC1 34a_100000736752_100000183996 [0,1,0,1,0,0|2,0,0]=4 19460 B16R1.6935 CC(C)NC(=O)COCCCC1CCCC1 34a_100011215328_100000183996 [0,1,0,1,0,0|2,0,0]=4 19461 B16R1.6935 CC(C)NC(=O)COCCCC1CCCC1 7a_100011215328_100000183996 [0,1,0,1,0,0|2,0,0]=4 19462 B16R1.6935 CC(C)NC(=O)CSCCCC1CCCC1 62a_100000183996_100011713738 [0,1,0,1,0,0|2,0,0]=4 19463 B16R1.6935 CC(C)NC(=O)CSCCCC1CCCC1 62a_100011713738_100000183996 [0,1,0,1,0,0|2,0,0]=4 19464 B16R1.6935 CC(C)OC(=O)CCCCCN1CCCC1 2230a_100000188435_200010986244 [0,1,0,1,0,0|1,0,0]=3 19465 B16R1.6935 CC(C)OC(=O)CCCCCN1CCCC1 269982a_100000188435_200010986244 [0,1,0,1,0,0|1,0,0]=3 19466 B16R1.6935 CC(C)OC(=O)CCCCCN1CCSC1 2230a_100011215254_200010986244 [0,1,0,1,0,0|2,0,0]=4 19467 B16R1.6935 CC(C)OC(=O)CCCCCN1CCSC1 269982a_100011215254_200010986244 [0,1,0,1,0,0|2,0,0]=4 19468 B16R1.6935 CC(C)OC(=O)CCNCCC1CCCC1 2230a_100000739158_100000760027 [0,1,0,1,0,0|1,0,0]=3 19469 B16R1.6935 CC(C)OC(=O)CCOCCC1CCCC1 7a_100000749090_100000760027 [0,1,0,1,0,0|1,0,0]=3 19470 B16R1.6935 CC(C)OC(=O)CCSCCC1CCCC1 62a_100000760027_100000760354 [0,1,0,1,0,0|1,0,0]=3 19471 B16R1.6935 CC(C)OC(=O)CCSCCC1CCCC1 62a_100000760354_100000760027 [0,1,0,1,0,0|1,0,0]=3 19472 B16R1.6935 CC(C)OC(=O)CCSCCN1CCCC1 62a_100000700749_100000760027 [0,1,0,1,0,0|2,0,0]=4 19473 B16R1.6935 CC(C)OC(=O)CCSCCN1CCCC1 62a_100000760027_100000004467 [0,1,0,1,0,0|2,0,0]=4 19474 B16R1.6935 CC(C)OC(=O)CNCCCC1CCCC1 2230a_100000736752_100011215430 [0,1,0,1,0,0|1,0,0]=3 19475 B16R1.6935 CC(C)OC(=O)CNCCCC1CCCC1 34a_100000736752_100011215430 [0,1,0,1,0,0|1,0,0]=3 19476 B16R1.6935 CC(C)OC(=O)CNCCOC1CCCC1 34a_100000741755_100011215430 [0,1,0,1,0,0|2,0,0]=4 19477 B16R1.6935 CC(C)OC(=O)COCCCC1CCCC1 34a_100011215328_100011215430 [0,1,0,1,0,0|1,0,0]=3 19478 B16R1.6935 CC(C)OC(=O)COCCCC1CCCC1 7a_100011215328_100011215430 [0,1,0,1,0,0|1,0,0]=3 19479 B16R1.6935 CC(C)OC(=O)COCCNC1CCCC1 34a_200000200444_100011215430 [0,1,0,1,0,0|2,0,0]=4 19480 B16R1.6935 CC(C)OC(=O)COCCOC1CCCC1 34a_100000738311_100011215430 [0,1,0,1,0,0|2,0,0]=4 19481 B16R1.6935 CC(C)OC(=O)COCCOC1CCCC1 7a_100000738311_100011215430 [0,1,0,1,0,0|2,0,0]=4 19482 B16R1.6935 CC(C)OC(=O)CSCCCC1CCCC1 62a_100011215430_100011713738 [0,1,0,1,0,0|1,0,0]=3 19483 B16R1.6935 CC(C)OC(=O)CSCCCC1CCCC1 62a_100011713738_100011215430 [0,1,0,1,0,0|1,0,0]=3 19484 B16R1.6935 CC(C)OC(=O)CSCCCN1CCCC1 62a_100011215430_100011445909 [0,1,0,1,0,0|2,0,0]=4 19485 B16R1.6935 CC(C)OC(=O)CSCCCN1CCCC1 62a_100016991639_100011215430 [0,1,0,1,0,0|2,0,0]=4 19486 B16R1.6935 CC(C)OC(=O)OCSCCC1CCCC1 62a_100000003507_100000760354 [0,1,0,1,0,0|2,0,0]=4 19487 B16R1.6935 CC(C)OC(=O)OCSCCC1CCCC1 62a_100000760354_100000003507 [0,1,0,1,0,0|2,0,0]=4 19488 B16R1.7317 CC(C)OC(=O)CCCCCN1CCC1C 269982a_100000755817_200010986244 [0,1,0,1,0,0|1,0,0]=3 19489 B16R1.7317 CC(C)OC(=O)CCCCCN1CCC1C 34a_100000755817_200010986244 [0,1,0,1,0,0|1,0,0]=3 19490 B16R1.8666 CC(C)OC(=O)CCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_200010986244 [0,1,0,1,0,0|2,0,0]=4 19491 B16R1.8666 CC(C)OC(=O)CCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_200010986244 [0,1,0,1,0,0|2,0,0]=4 19492 B16R1.8666 CC(C)OC(=O)CCCCCN[C@@H]1C[C@H]1F 34a_100025746932_200010986244 [0,1,0,1,0,0|2,0,0]=4 19493 B16R1.10873 CC(=O)C1CCCCCCCCCCC1=O 1458a_100000070787_200009990614 [0,1,0,1,0,0|1,0,1]=4 19494 B16R1.10873 CN(C)C1CCCCCCCCCCC1=O 2230a_100102631434_200009990614 [0,1,0,1,0,0|2,0,0]=4 19495 B16R1.10873 CN(C)C1CCCCCCCCCCC1=O 269982a_100102631434_200009990614 [0,1,0,1,0,0|2,0,0]=4 19496 B16R1.12460 CC(C)OC(=O)CCCCCNC1CCC1 2230a_100000749019_200010986244 [0,1,0,1,0,0|1,0,0]=3 19497 B16R1.12460 CC(C)OC(=O)CCCCCNC1CCC1 34a_100000749019_200010986244 [0,1,0,1,0,0|1,0,0]=3 19498 B16R1.12460 CC(C)OC(=O)CCCCCNC1COC1 2230a_100016991112_200010986244 [0,1,0,1,0,0|2,0,0]=4 19499 B16R1.12460 CC(C)OC(=O)CCCCCOC1CCC1 34a_100000748187_200010986244 [0,1,0,1,0,0|1,0,0]=3 19500 B16R1.12460 CC(C)OC(=O)CCCCCOC1CSC1 7a_100000072292_200010986244 [0,1,0,1,0,0|2,0,0]=4 19501 B16R1.12460 CC(C)OC(=O)CCCCCSC1CCC1 62a_200010986244_100000749161 [0,1,0,1,0,0|1,0,0]=3 19502 B16R1.12460 CC(C)OC(=O)CCCCCSC1COC1 62a_200010986244_100009818527 [0,1,0,1,0,0|2,0,0]=4 19503 B16R1.12711 CCCCCN1CCC[C@@H]1C(=O)NC(C)C 2230a_100153395200_100000210326 [0,1,0,1,0,0|2,0,0]=4 19504 B16R1.12711 CCCCCN1CCC[C@@H]1C(=O)NC(C)C 269982a_100153395200_100000210215 [0,1,0,1,0,0|2,0,0]=4 19505 B16R1.12711 CCCCCN1CCC[C@@H]1C(=O)NC(C)C 34a_100153395200_100000718602 [0,1,0,1,0,0|2,0,0]=4 19506 B16R1.18044 CCCCCCCCCCC(=O)CC1CC1 1458a_100000210375_100000742324 [0,1,0,1,0,0|1,0,0]=3 19507 B16R1.18044 CCCCCCCCCCC(=O)CC1CC1 1458a_100000738066_100000210319 [0,1,0,1,0,0|1,0,0]=3 19508 B16R1.18044 CCCCCCCCCCC(=O)CC1CO1 1458a_100000210375_100011216344 [0,1,0,1,0,0|1,0,0]=3 19509 B16R1.18044 CCCCCCCCCCC(=O)CC1CS1 1458a_100000210375_100000031435 [0,1,0,1,0,0|1,0,0]=3 19510 B16R1.18044 CCCCCCCCCCC(=O)C[C@@H]1CO1 1458a_100000210375_100000745022 [0,1,0,1,0,0|1,0,0]=3 19511 B16R1.18044 CCCCCCCCCCC(=O)NC1CC1 1626a_100000212008_100000210375 [0,1,0,1,0,0|1,0,0]=3 19512 B16R1.18044 CCCCCCCCCCC(=O)NC1CC1 240690a_100000212008_100000210375 [0,1,0,1,0,0|1,0,0]=3 19513 B16R1.18044 CCCCCCCCCNC(=O)CC1CC1 11a_100000212291_100000738066 [0,1,0,1,0,0|2,0,0]=4 19514 B16R1.18044 CCCCCCCCCNC(=O)CC1CC1 1626a_100000212291_100000738066 [0,1,0,1,0,0|2,0,0]=4 19515 B16R1.18044 CCCCCCCCCNC(=O)CC1CC1 240690a_100000212291_100000738066 [0,1,0,1,0,0|2,0,0]=4 19516 B16R1.18044 CCCCCCCCCNC(=O)CC1CC1 527a_100000212291_100000738066 [0,1,0,1,0,0|2,0,0]=4 19517 B16R1.18044 CCCCCCCCCNC(=O)NC1CC1 2708a_100000212008_100000212291 [0,1,0,1,0,0|2,0,0]=4 19518 B16R1.18044 CCCCCCCCCNC(=O)NC1CC1 2708a_100000212291_100000212008 [0,1,0,1,0,0|2,0,0]=4 19519 B16R1.18044 CCCCCCCCCNC(=O)NC1CC1 273464a_100000212008_100000212291 [0,1,0,1,0,0|2,0,0]=4 19520 B16R1.18044 CCCCCCCCCNC(=O)NC1CC1 273464a_100000212291_100000212008 [0,1,0,1,0,0|2,0,0]=4 19521 B16R1.18044 CCCCCCCCCNC(=O)NC1CC1 512a_100000212008_100000212291 [0,1,0,1,0,0|2,0,0]=4 19522 B16R1.18044 CCCCCCCCNCC(=O)NC1CC1 2230a_100000229939_100000182950 [0,1,0,1,0,0|2,0,0]=4 19523 B16R1.18044 CCCCCCCCNCC(=O)NC1CC1 2230a_100000702991_100000210759 [0,1,0,1,0,0|2,0,0]=4 19524 B16R1.18044 CCCCCCCCNCC(=O)NC1CC1 34a_100000229939_100000182950 [0,1,0,1,0,0|2,0,0]=4 19525 B16R1.18044 CCCCCCCCOCC(=O)CC1CC1 1458a_100000759886_100000742324 [0,1,0,1,0,0|2,0,0]=4 19526 B16R1.18044 CCCCCCCCOCC(=O)CC1CO1 1458a_100000759886_100011216344 [0,1,0,1,0,0|2,0,0]=4 19527 B16R1.18044 CCCCCCCCOCC(=O)CC1CS1 1458a_100000759886_100000031435 [0,1,0,1,0,0|2,0,0]=4 19528 B16R1.18044 CCCCCCCCOCC(=O)C[C@@H]1CO1 1458a_100000759886_100000745022 [0,1,0,1,0,0|2,0,0]=4 19529 B16R1.18044 CCCCCCCCOCC(=O)NC1CC1 1626a_100000212008_100000759886 [0,1,0,1,0,0|2,0,0]=4 19530 B16R1.18044 CCCCCCCCOCC(=O)NC1CC1 240690a_100000212008_100000759886 [0,1,0,1,0,0|2,0,0]=4 19531 B16R1.18044 CCCCCCCCOCC(=O)NC1CC1 34a_100000210232_100000182950 [0,1,0,1,0,0|2,0,0]=4 19532 B16R1.18044 CCCCCCCCOCC(=O)NC1CC1 527a_100000212008_100000759886 [0,1,0,1,0,0|2,0,0]=4 19533 B16R1.18044 CCCCCCCCOCC(=O)NC1CC1 7a_100000210232_100000182950 [0,1,0,1,0,0|2,0,0]=4 19534 B16R1.18044 CCCCCCCCSCC(=O)NC1CC1 62a_100000182950_100000210317 [0,1,0,1,0,0|2,0,0]=4 19535 B16R1.18044 CCCCCCCCSCC(=O)NC1CC1 62a_100000210759_100000182950 [0,1,0,1,0,0|2,0,0]=4 19536 B16R1.18044 CCCCCCCNCCC(=O)NC1CC1 2230a_100000229938_100000737409 [0,1,0,1,0,0|2,0,0]=4 19537 B16R1.18044 CCCCCCCOCCC(=O)NC1CC1 34a_100000210272_100000737409 [0,1,0,1,0,0|2,0,0]=4 19538 B16R1.18044 CCCCCCCSCCC(=O)NC1CC1 62a_100000210614_100000737409 [0,1,0,1,0,0|2,0,0]=4 19539 B16R1.18044 CCCCCCCSCCC(=O)NC1CC1 62a_100000737409_100000210316 [0,1,0,1,0,0|2,0,0]=4 19540 B16R1.18044 O=C(CCCCCCCCCF)CC1CC1 1458a_200009909015_100000742324 [0,1,0,1,0,0|2,0,0]=4 19541 B16R1.18044 O=C(CCCCCCCCCF)CC1CO1 1458a_200009909015_100011216344 [0,1,0,1,0,0|2,0,0]=4 19542 B16R1.18044 O=C(CCCCCCCCCF)CC1CS1 1458a_200009909015_100000031435 [0,1,0,1,0,0|2,0,0]=4 19543 B16R1.18044 O=C(CCCCCCCCCF)C[C@@H]1CO1 1458a_200009909015_100000745022 [0,1,0,1,0,0|2,0,0]=4 19544 B16R1.18044 O=C(CCCCCCCCCF)NC1CC1 240690a_100000212008_200009909015 [0,1,0,1,0,0|2,0,0]=4 19545 B16R1.18044 O=C(CCCCCCCCCF)NC1CC1 527a_100000212008_200009909015 [0,1,0,1,0,0|2,0,0]=4 19546 B16R1.18044 O=C(CCCCCCCCCO)CC1CC1 1458a_100000738066_100009813782 [0,1,0,1,0,0|2,0,0]=4 19547 B16R1.18044 O=C(CCCCCCCCCO)NC1CC1 240690a_100000212008_100000032657 [0,1,0,1,0,0|2,0,0]=4 19548 B16R1.18218 CC(C)OC(=O)CCCCCNCC1CC1 2230a_100000735609_200010986244 [0,1,0,1,0,0|1,0,0]=3 19549 B16R1.18218 CC(C)OC(=O)CCCCCNCC1CC1 34a_100000735609_200010986244 [0,1,0,1,0,0|1,0,0]=3 19550 B16R1.18218 CC(C)OC(=O)CCCCCOCC1CC1 34a_100000211283_200010986244 [0,1,0,1,0,0|1,0,0]=3 19551 B16R1.18218 CC(C)OC(=O)CCCCCOC[C@@H]1CO1 34a_100000757423_200010986244 [0,1,0,1,0,0|2,0,0]=4 19552 B16R1.18218 CC(C)OC(=O)CCCCCSCC1CC1 62a_100000756562_200010986244 [0,1,0,1,0,0|1,0,0]=3 19553 B16R1.18218 CC(C)OC(=O)CCCCCSCC1CC1 62a_200010986244_100000742324 [0,1,0,1,0,0|1,0,0]=3 19554 B16R1.18218 CC(C)OC(=O)CCCCCSCC1CO1 62a_102125554688_200010986244 [0,1,0,1,0,0|2,0,0]=4 19555 B16R1.18218 CC(C)OC(=O)CCCCCSCC1CO1 62a_200010986244_102125554688 [0,1,0,1,0,0|2,0,0]=4 19556 B16R1.18218 CC(C)OC(=O)CCCCCSCC1CS1 62a_100000031435_200010986244 [0,1,0,1,0,0|2,0,0]=4 19557 B16R1.18218 CC(C)OC(=O)CCCCCSCC1CS1 62a_200010986244_100000031435 [0,1,0,1,0,0|2,0,0]=4 19558 B16R1.18218 CC(C)OC(=O)CCCCCSC[C@@H]1CO1 62a_100000745022_200010986244 [0,1,0,1,0,0|2,0,0]=4 19559 B16R1.18218 CC(C)OC(=O)CCCCCSC[C@@H]1CO1 62a_200010986244_100000745022 [0,1,0,1,0,0|2,0,0]=4 19560 B16R1.38000 CC(C)CC(=O)CCN1CCCCCCC1 1458a_200015187237_100000210624 [0,1,0,1,0,0|2,0,0]=4 19561 B16R1.38000 CC(C)NC(=O)CCN1CCCCCCC1 2230a_100000211400_100000737564 [0,1,0,1,0,0|2,0,0]=4 19562 B16R1.38000 CC(C)NC(=O)CCN1CCCCCCC1 240690a_100138425928_200015187237 [0,1,0,1,0,0|2,0,0]=4 19563 B16R1.38000 CC(C)NC(=O)CCN1CCCCCCC1 269982a_100000211400_100000737564 [0,1,0,1,0,0|2,0,0]=4 19564 B16R1.38000 CC(C)NC(=O)CNC1CCCCCCC1 2230a_100000211152_100000183996 [0,1,0,1,0,0|2,0,0]=4 19565 B16R1.38000 CC(C)NC(=O)CNC1CCCCCCC1 270004a_100000168517_100000210524 [0,1,0,1,0,0|2,0,0]=4 19566 B16R1.38000 CC(C)NC(=O)CNC1CCCCCCC1 34a_100000211152_100000183996 [0,1,0,1,0,0|2,0,0]=4 19567 B16R1.38000 CC(C)NC(=O)COC1CCCCCCC1 34a_100000210054_100000183996 [0,1,0,1,0,0|2,0,0]=4 19568 B16R1.38000 CC(C)NC(=O)COC1CCCCCCC1 7a_100000210054_100000183996 [0,1,0,1,0,0|2,0,0]=4 19569 B16R1.38000 CC(C)OC(=O)CCN1CCCCCCC1 2230a_100000211400_100000760027 [0,1,0,1,0,0|1,0,0]=3 19570 B16R1.38000 CC(C)OC(=O)CCN1CCCCCCC1 269982a_100000211400_100000760027 [0,1,0,1,0,0|1,0,0]=3 19571 B16R1.38000 CC(C)OC(=O)CNC1CCCCCCC1 2230a_100000211152_100011215430 [0,1,0,1,0,0|1,0,0]=3 19572 B16R1.38000 CC(C)OC(=O)CNC1CCCCCCC1 34a_100000211152_100011215430 [0,1,0,1,0,0|1,0,0]=3 19573 B16R1.38000 CC(C)OC(=O)COC1CCCCCCC1 34a_100000210054_100011215430 [0,1,0,1,0,0|1,0,0]=3 19574 B16R1.38000 CC(C)OC(=O)COC1CCCCCCC1 7a_100000210054_100011215430 [0,1,0,1,0,0|1,0,0]=3 19575 B16R1.38000 CC(C)OC(=O)OCN1CCCCCCC1 269982a_100000211400_100010125566 [0,1,0,1,0,0|2,0,0]=4 19576 B16R1.38000 CC(O)CC(=O)CCN1CCCCCCC1 1458a_200015187237_100011218427 [0,1,0,1,0,0|2,0,0]=4 19577 B16R1.38084 CC(C)NC(=O)CN1CCCCCCCC1 2230a_100000039187_100000183996 [0,1,0,1,0,0|2,0,0]=4 19578 B16R1.38084 CC(C)NC(=O)CN1CCCCCCCC1 269982a_100000039187_100000183996 [0,1,0,1,0,0|2,0,0]=4 19579 B16R1.38084 CC(C)NC(=O)CN1CCCCCCCC1 34a_100000039187_100000183996 [0,1,0,1,0,0|2,0,0]=4 19580 B16R1.38084 CC(C)OC(=O)CN1CCCCCCCC1 2230a_100000039187_100011215430 [0,1,0,1,0,0|1,0,0]=3 19581 B16R1.38084 CC(C)OC(=O)CN1CCCCCCCC1 269982a_100000039187_100011215430 [0,1,0,1,0,0|1,0,0]=3 19582 B16R1.38084 CC(C)OC(=O)CN1CCCCCCCC1 34a_100000039187_100011215430 [0,1,0,1,0,0|1,0,0]=3 19583 B16R1.58444 CC(C)CC(=O)NCCC1CCCCCC1 11a_100011532351_100000210554 [0,1,0,1,0,0|2,0,0]=4 19584 B16R1.58444 CC(C)CC(=O)NCCC1CCCCCC1 1626a_100011532351_100000210554 [0,1,0,1,0,0|2,0,0]=4 19585 B16R1.58444 CC(C)CC(=O)NCCC1CCCCCC1 240690a_100011532351_100000210554 [0,1,0,1,0,0|2,0,0]=4 19586 B16R1.58444 CC(C)CC(=O)NCCC1CCCCCC1 527a_100011532351_100000210554 [0,1,0,1,0,0|2,0,0]=4 19587 B16R1.58444 CC(C)NC(=O)CCNC1CCCCCC1 2230a_100000210984_100000737564 [0,1,0,1,0,0|2,0,0]=4 19588 B16R1.58444 CC(C)NC(=O)CCOC1CCCCCC1 7a_100000210887_100000737564 [0,1,0,1,0,0|2,0,0]=4 19589 B16R1.58444 CC(C)NC(=O)CCSC1CCCCCC1 62a_100000737564_100011217769 [0,1,0,1,0,0|2,0,0]=4 19590 B16R1.58444 CC(C)NC(=O)CCSC1CCCCCC1 62a_100011217769_100000737564 [0,1,0,1,0,0|2,0,0]=4 19591 B16R1.58444 CC(C)NC(=O)CNCC1CCCCCC1 2230a_100000168517_200000696569 [0,1,0,1,0,0|2,0,0]=4 19592 B16R1.58444 CC(C)NC(=O)CNCC1CCCCCC1 2230a_100015204231_100000183996 [0,1,0,1,0,0|2,0,0]=4 19593 B16R1.58444 CC(C)NC(=O)CNCC1CCCCCC1 269862a_100000168517_200000763224 [0,1,0,1,0,0|2,0,0]=4 19594 B16R1.58444 CC(C)NC(=O)CNCC1CCCCCC1 34a_100015204231_100000183996 [0,1,0,1,0,0|2,0,0]=4 19595 B16R1.58444 CC(C)NC(=O)COCC1CCCCCC1 34a_100000699130_100000183996 [0,1,0,1,0,0|2,0,0]=4 19596 B16R1.58444 CC(C)NC(=O)COCC1CCCCCC1 7a_100000699130_100000183996 [0,1,0,1,0,0|2,0,0]=4 19597 B16R1.58444 CC(C)NC(=O)CSCC1CCCCCC1 62a_100000183996_200000696569 [0,1,0,1,0,0|2,0,0]=4 19598 B16R1.58444 CC(C)NC(=O)CSCC1CCCCCC1 62a_200000696569_100000183996 [0,1,0,1,0,0|2,0,0]=4 19599 B16R1.58444 CC(C)NC(=O)NCCC1CCCCCC1 2708a_100011532351_100138425928 [0,1,0,1,0,0|2,0,0]=4 19600 B16R1.58444 CC(C)NC(=O)NCCC1CCCCCC1 2708a_100138425928_100011532351 [0,1,0,1,0,0|2,0,0]=4 19601 B16R1.58444 CC(C)NC(=O)NCCC1CCCCCC1 273464a_100138425928_100011532351 [0,1,0,1,0,0|2,0,0]=4 19602 B16R1.58444 CC(C)NC(=O)NCCC1CCCCCC1 512a_100138425928_100011532351 [0,1,0,1,0,0|2,0,0]=4 19603 B16R1.58444 CC(C)OC(=O)CCNC1CCCCCC1 2230a_100000210984_100000760027 [0,1,0,1,0,0|1,0,0]=3 19604 B16R1.58444 CC(C)OC(=O)CCOC1CCCCCC1 7a_100000210887_100000760027 [0,1,0,1,0,0|1,0,0]=3 19605 B16R1.58444 CC(C)OC(=O)CCSC1CCCCCC1 62a_100000760027_100011217769 [0,1,0,1,0,0|1,0,0]=3 19606 B16R1.58444 CC(C)OC(=O)CCSC1CCCCCC1 62a_100011217769_100000760027 [0,1,0,1,0,0|1,0,0]=3 19607 B16R1.58444 CC(C)OC(=O)CNCC1CCCCCC1 2230a_100015204231_100011215430 [0,1,0,1,0,0|1,0,0]=3 19608 B16R1.58444 CC(C)OC(=O)CNCC1CCCCCC1 34a_100015204231_100011215430 [0,1,0,1,0,0|1,0,0]=3 19609 B16R1.58444 CC(C)OC(=O)COCC1CCCCCC1 34a_100000699130_100011215430 [0,1,0,1,0,0|1,0,0]=3 19610 B16R1.58444 CC(C)OC(=O)COCC1CCCCCC1 7a_100000699130_100011215430 [0,1,0,1,0,0|1,0,0]=3 19611 B16R1.58444 CC(C)OC(=O)CSCC1CCCCCC1 62a_100011215430_200000696569 [0,1,0,1,0,0|1,0,0]=3 19612 B16R1.58444 CC(C)OC(=O)CSCC1CCCCCC1 62a_200000696569_100011215430 [0,1,0,1,0,0|1,0,0]=3 19613 B16R1.58444 CC(C)OC(=O)OCSC1CCCCCC1 62a_100000003507_100011217769 [0,1,0,1,0,0|2,0,0]=4 19614 B16R1.58444 CC(C)OC(=O)OCSC1CCCCCC1 62a_100011217769_100000003507 [0,1,0,1,0,0|2,0,0]=4 19615 B16R1.58444 C[C@@H](O)CC(=O)NCCC1CCCCCC1 240690a_100011532351_100011933948 [0,1,0,1,0,0|2,0,0]=4 19616 B16R1.88231 CC1CC1C(=O)CCCCCCCCCO 1458a_100000211227_100009813782 [0,1,0,1,0,0|2,0,0]=4 19617 B16R1.88231 CCCCCCCCCCC(=O)C1CC1C 1458a_100000211227_100000210319 [0,1,0,1,0,0|1,0,0]=3 19618 B16R1.88231 CCCCCCCCCCC(=O)[C@@H]1C[C@@H]1F 1458a_100015396687_100000210319 [0,1,0,1,0,0|1,0,0]=3 19619 B16R1.88231 CCCCCCCCCNC(=O)C1CC1C 11a_100000212291_100000211227 [0,1,0,1,0,0|2,0,0]=4 19620 B16R1.88231 CCCCCCCCCNC(=O)C1CC1C 1626a_100000212291_100000211227 [0,1,0,1,0,0|2,0,0]=4 19621 B16R1.88231 CCCCCCCCCNC(=O)C1CC1C 527a_100000212291_100000211227 [0,1,0,1,0,0|2,0,0]=4 19622 B16R1.88231 CCCCCCCCCNC(=O)[C@@H]1C[C@@H]1F 11a_100000212291_100015396687 [0,1,0,1,0,0|2,0,0]=4 19623 B16R1.88231 CCCCCCCCCNC(=O)[C@@H]1C[C@@H]1F 240690a_100000212291_100015396687 [0,1,0,1,0,0|2,0,0]=4 19624 B16R1.88231 CCCCCCCCCNC(=O)[C@@H]1C[C@@H]1F 527a_100000212291_100015396687 [0,1,0,1,0,0|2,0,0]=4 19625 B16R1.88231 O=C(CCCCCCCCCO)[C@@H]1C[C@@H]1F 1458a_100015396687_100009813782 [0,1,0,1,0,0|2,0,0]=4 19626 B16R1.83 CC(C)CCCCCNC1CCNC(=O)C1 2230a_100016994916_100000210682 [0,1,0,1,0,0|2,0,0]=4 19627 B16R1.83 CC(C)CCCCCNC1CCNC(=O)C1 34a_100016994916_100000210682 [0,1,0,1,0,0|2,0,0]=4 19628 B16R1.83 CC(C)CCCCCOC1CCCC(=O)C1 34a_100012613340_100000210682 [0,1,0,1,0,0|2,0,0]=4 19629 B16R1.83 CC(C)CCCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000210682 [0,1,0,1,0,0|2,0,0]=4 19630 B16R1.83 CC(C)CCCCOCC1CCNC(=O)C1 34a_100009886756_100011216152 [0,1,0,1,0,0|2,0,0]=4 19631 B16R1.394 CC(C)CCCCCCNC1CCCC1=O 2230a_100000211014_100000211823 [0,1,0,1,0,0|2,0,0]=4 19632 B16R1.394 CC(C)CCCCCCNC1CCCC1=O 34a_100000211014_100000709159 [0,1,0,1,0,0|2,0,0]=4 19633 B16R1.394 CC(C)CCCCCCNC1CCOC1=O 2230a_100000211014_100000211211 [0,1,0,1,0,0|1,0,0]=3 19634 B16R1.394 CC(C)CCCCCCNC1CCOC1=O 34a_100000211014_100000211211 [0,1,0,1,0,0|1,0,0]=3 19635 B16R1.394 CC(C)CCCCCOCC1CCNC1=O 34a_100000133458_100000210682 [0,1,0,1,0,0|2,0,0]=4 19636 B16R1.394 CC(C)NCCCCCOC1CCOC1=O 34a_100011629493_100000211211 [0,1,0,1,0,0|2,0,0]=4 19637 B16R1.905 CCNC(=O)CCNCC1CCCC(C1)O 2230a_100011254705_100000737597 [0,1,0,1,0,0|2,0,0]=4 19638 B16R1.905 CCOC(=O)CCCCN1CCCC(C1)F 2230a_100000697950_100000750268 [0,1,0,1,0,0|1,0,0]=3 19639 B16R1.905 CCOC(=O)CCCCN1CCCC(C1)F 269982a_100000697950_100000750268 [0,1,0,1,0,0|1,0,0]=3 19640 B16R1.905 CCOC(=O)CCCCN1CCCC(C1)F 34a_100000697950_100000750268 [0,1,0,1,0,0|1,0,0]=3 19641 B16R1.905 CCOC(=O)CCCCN1CCCC(C1)O 2230a_100000211013_100000750268 [0,1,0,1,0,0|1,0,0]=3 19642 B16R1.905 CCOC(=O)CCCCN1CCCC(C1)O 269982a_100000211013_100000750268 [0,1,0,1,0,0|1,0,0]=3 19643 B16R1.905 CCOC(=O)CCCCN1CCC[C@@H](C1)C 2230a_100000717927_100000750268 [0,1,0,1,0,0|1,0,0]=3 19644 B16R1.905 CCOC(=O)CCCCN1CCC[C@@H](C1)C 269982a_100000717927_100000750268 [0,1,0,1,0,0|1,0,0]=3 19645 B16R1.905 CCOC(=O)CCCCN1CCC[C@@H](C1)C 34a_100000717927_100000750268 [0,1,0,1,0,0|1,0,0]=3 19646 B16R1.905 CCOC(=O)CCCCN1CCOC(C1)C 2230a_100000729577_100000750268 [0,1,0,1,0,0|2,0,0]=4 19647 B16R1.905 CCOC(=O)CCCCN1CCOC(C1)C 269982a_100000729577_100000750268 [0,1,0,1,0,0|2,0,0]=4 19648 B16R1.905 CCOC(=O)CCCCN1CCOC(C1)C 34a_100000729577_100000750268 [0,1,0,1,0,0|2,0,0]=4 19649 B16R1.905 CCOC(=O)CCCCN1CCOC(C1)O 2230a_100000688207_100000750268 [0,1,0,1,0,0|2,0,0]=4 19650 B16R1.905 CCOC(=O)CCCCN1CCOC(C1)O 269982a_100000688207_100000750268 [0,1,0,1,0,0|2,0,0]=4 19651 B16R1.905 CCOC(=O)CCCNC1CCCC(C1)C 2230a_100011194320_100009991533 [0,1,0,1,0,0|1,0,0]=3 19652 B16R1.905 CCOC(=O)CCCNC1CCCC(C1)C 34a_100011194320_100009991533 [0,1,0,1,0,0|1,0,0]=3 19653 B16R1.905 CCOC(=O)CCCNC1CCCC(C1)O 2230a_100015190357_100009991533 [0,1,0,1,0,0|1,0,0]=3 19654 B16R1.905 CCOC(=O)CCCOC1C=C(CCC1)C 34a_100011218613_100009991533 [0,1,0,1,0,0|1,0,1]=4 19655 B16R1.905 CCOC(=O)CCCOC1CCCC(=O)C1 34a_100012613340_100009991533 [0,1,0,1,0,0|1,0,1]=4 19656 B16R1.905 CCOC(=O)CCCOC1CCCC(C1)C 34a_100000211399_100009991533 [0,1,0,1,0,0|1,0,0]=3 19657 B16R1.905 CCOC(=O)CCCOC1CCOC(C1)C 34a_100011986385_100009991533 [0,1,0,1,0,0|2,0,0]=4 19658 B16R1.905 CCOC(=O)CCCOC1CCOC(C1)C 7a_100011986385_100011215271 [0,1,0,1,0,0|2,0,0]=4 19659 B16R1.905 CCOC(=O)CCNCC1CCCC(C1)O 2230a_100011254705_100011206558 [0,1,0,1,0,0|1,0,0]=3 19660 B16R1.905 CCOC(=O)CCOCC1CNCC(C1)C 34a_200012821172_100000765890 [0,1,0,1,0,0|2,0,0]=4 19661 B16R1.905 CCOC(=O)CCSCC1CCCN(C1)C 62a_100000752043_100000765890 [0,1,0,1,0,0|2,0,0]=4 19662 B16R1.905 CCOC(=O)CCSCC1CCCN(C1)C 62a_100000765890_100000752043 [0,1,0,1,0,0|2,0,0]=4 19663 B16R1.905 CCOC(=O)CNCCN1CCCC(C1)C 2230a_100000739826_100000188475 [0,1,0,1,0,0|2,0,0]=4 19664 B16R1.905 CCOC(=O)COCCN1CCCC(C1)F 2230a_100000697950_100000088970 [0,1,0,1,0,0|2,0,0]=4 19665 B16R1.905 CCOC(=O)COCCN1CCCC(C1)F 269982a_100000697950_100000088970 [0,1,0,1,0,0|2,0,0]=4 19666 B16R1.905 CCOC(=O)COCCN1CCCC(C1)F 34a_100000697950_100000088970 [0,1,0,1,0,0|2,0,0]=4 19667 B16R1.905 CCOC(=O)COCCN1CCCC(C1)O 2230a_100000211013_100000088970 [0,1,0,1,0,0|2,0,0]=4 19668 B16R1.905 CCOC(=O)COCCN1CCCC(C1)O 269982a_100000211013_100000088970 [0,1,0,1,0,0|2,0,0]=4 19669 B16R1.905 CCOC(=O)COCCN1CCC[C@@H](C1)C 2230a_100000717927_100000088970 [0,1,0,1,0,0|2,0,0]=4 19670 B16R1.905 CCOC(=O)COCCN1CCC[C@@H](C1)C 269982a_100000717927_100000088970 [0,1,0,1,0,0|2,0,0]=4 19671 B16R1.905 CCOC(=O)COCCN1CCC[C@@H](C1)C 34a_100000717927_100000088970 [0,1,0,1,0,0|2,0,0]=4 19672 B16R1.905 CCOC(=O)CSCCN1CCCC(C1)C 62a_100000188475_100000766211 [0,1,0,1,0,0|2,0,0]=4 19673 B16R1.959 C=C(C)CCN1CCCCC1C(=O)OCC 2230a_100016990872_100000730704 [0,1,0,1,0,0|1,0,1]=4 19674 B16R1.959 C=C(C)CCN1CCCCC1C(=O)OCC 269982a_100016990872_100000730704 [0,1,0,1,0,0|1,0,1]=4 19675 B16R1.959 C=C(C)COC1CCCCC1C(=O)OCC 7a_100000038711_100000748629 [0,1,0,1,0,0|1,0,1]=4 19676 B16R1.959 CCOC(=O)C1CCCCC1OCC(C)C 7a_100000038711_100000210760 [0,1,0,1,0,0|1,0,0]=3 19677 B16R1.959 CCOC(=O)C1CCCCC1OCC(C)O 7a_100000038711_100011218427 [0,1,0,1,0,0|1,0,0]=3 19678 B16R1.959 CCOC(=O)C1CCCCC1OCC(F)F 7a_100000038711_100011934356 [0,1,0,1,0,0|2,0,0]=4 19679 B16R1.959 CCOC(=O)C1CCCCC1OC[C@@H](C)O 7a_100000038711_100009817552 [0,1,0,1,0,0|1,0,0]=3 19680 B16R1.959 CCOC(=O)C1CCCCN1CCC(=O)C 269982a_100016990872_100000053229 [0,1,0,1,0,0|1,0,1]=4 19681 B16R1.959 CCOC(=O)C1CCCCN1CCC(C)C 2230a_100016990872_100000210312 [0,1,0,1,0,0|1,0,0]=3 19682 B16R1.959 CCOC(=O)C1CCCCN1CCC(C)C 269982a_100016990872_100000210312 [0,1,0,1,0,0|1,0,0]=3 19683 B16R1.959 CCOC(=O)C1CCCCN1CCC(C)O 2230a_100016990872_100012276601 [0,1,0,1,0,0|1,0,0]=3 19684 B16R1.959 CCOC(=O)C1CCCCN1CCC(C)O 269982a_100016990872_100012276601 [0,1,0,1,0,0|1,0,0]=3 19685 B16R1.959 CCOC(=O)C1CCCCN1CCN(C)C 269982a_100016990872_100000755713 [0,1,0,1,0,0|2,0,0]=4 19686 B16R1.959 CCOC(=O)C1CCCCN1COC(C)C 2230a_100016990872_100000709892 [0,1,0,1,0,0|2,0,0]=4 19687 B16R1.959 CCOC(=O)C1CCCCN1COC(C)C 269982a_100016990872_100000709892 [0,1,0,1,0,0|2,0,0]=4 19688 B16R1.959 CCOC(=O)C1CSCCN1CCC(C)C 2230a_100000735462_100000210312 [0,1,0,1,0,0|2,0,0]=4 19689 B16R1.959 CCOC(=O)C1CSCCN1CCC(C)C 269982a_100000735462_100000210312 [0,1,0,1,0,0|2,0,0]=4 19690 B16R1.959 CCOC(=O)C1CSCCN1CCC(C)O 2230a_100000735462_100012276601 [0,1,0,1,0,0|2,0,0]=4 19691 B16R1.959 CCOC(=O)C1CSCCN1CCC(C)O 269982a_100000735462_100012276601 [0,1,0,1,0,0|2,0,0]=4 19692 B16R1.959 CCOC(=O)[C@@H]1COCCN1CCC(C)C 2230a_100015229691_100000210312 [0,1,0,1,0,0|2,0,0]=4 19693 B16R1.959 CCOC(=O)[C@@H]1COCCN1CCC(C)C 269982a_100015229691_100000210312 [0,1,0,1,0,0|2,0,0]=4 19694 B16R1.959 CCOC(=O)[C@@H]1COCCN1CCC(C)O 2230a_100015229691_100012276601 [0,1,0,1,0,0|2,0,0]=4 19695 B16R1.959 CCOC(=O)[C@@H]1COCCN1CCC(C)O 269982a_100015229691_100012276601 [0,1,0,1,0,0|2,0,0]=4 19696 B16R1.975 C=C(C)CCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100000730704 [0,1,0,1,0,0|1,0,1]=4 19697 B16R1.975 CCNC(=O)[C@@H]1CCCN1CCCC(C)C 2230a_100020641767_100011214892 [0,1,0,1,0,0|2,0,0]=4 19698 B16R1.975 CCNC(=O)[C@@H]1CCCN1CCCC(C)C 269982a_100020641767_100011214892 [0,1,0,1,0,0|2,0,0]=4 19699 B16R1.975 CCNC(=O)[C@@H]1CCCN1CCCC(C)C 34a_100020641767_100011214892 [0,1,0,1,0,0|2,0,0]=4 19700 B16R1.975 CCNC(=O)[C@@H]1CCCN1CCCC(C)O 2230a_100020641767_200000718107 [0,1,0,1,0,0|2,0,0]=4 19701 B16R1.975 CCNC(=O)[C@@H]1CCCN1CCCC(C)O 269982a_100020641767_200000718107 [0,1,0,1,0,0|2,0,0]=4 19702 B16R1.975 CCNC(=O)[C@@H]1CCCN1CCCC(C)O 34a_100020641767_200000718107 [0,1,0,1,0,0|2,0,0]=4 19703 B16R1.975 CCOC(=O)[C@@H]1CCCN1CCCC(=O)C 269982a_100000703725_100011215641 [0,1,0,1,0,0|1,0,1]=4 19704 B16R1.975 CCOC(=O)[C@@H]1CCCN1CCCC(C)C 2230a_100000703725_100011214892 [0,1,0,1,0,0|1,0,0]=3 19705 B16R1.975 CCOC(=O)[C@@H]1CCCN1CCCC(C)C 269982a_100000703725_100011214892 [0,1,0,1,0,0|1,0,0]=3 19706 B16R1.975 CCOC(=O)[C@@H]1CCCN1CCCC(C)O 2230a_100000703725_200000718107 [0,1,0,1,0,0|1,0,0]=3 19707 B16R1.975 CCOC(=O)[C@@H]1CCCN1CCCC(C)O 269982a_100000703725_200000718107 [0,1,0,1,0,0|1,0,0]=3 19708 B16R1.975 CCOC(=O)[C@@H]1CCCN1CCCN(C)C 269982a_100000703725_100000757444 [0,1,0,1,0,0|2,0,0]=4 19709 B16R1.975 CCOC(=O)[C@@H]1CCCN1CCOC(C)C 2230a_100000703725_100000211751 [0,1,0,1,0,0|2,0,0]=4 19710 B16R1.975 CCOC(=O)[C@@H]1CCCN1CCOC(C)C 269982a_100000703725_100000211751 [0,1,0,1,0,0|2,0,0]=4 19711 B16R1.975 CCOC(=O)[C@@H]1CCCN1CCSC(C)C 2230a_100000703725_100000730970 [0,1,0,1,0,0|2,0,0]=4 19712 B16R1.975 CCOC(=O)[C@@H]1CCCN1CCSC(C)C 269982a_100000703725_100000730970 [0,1,0,1,0,0|2,0,0]=4 19713 B16R1.975 CCOC(=O)[C@@H]1CCC[C@@H]1OCCC(=O)C 7a_200015395474_100000053229 [0,1,0,1,0,0|1,0,1]=4 19714 B16R1.975 CCOC(=O)[C@@H]1CCC[C@@H]1OCCC(C)C 7a_200015395474_100000210626 [0,1,0,1,0,0|1,0,0]=3 19715 B16R1.975 CCOC(=O)[C@@H]1CCC[C@@H]1OCCC(C)O 7a_200015395474_100012276601 [0,1,0,1,0,0|1,0,0]=3 19716 B16R1.975 CCOC(=O)[C@@H]1CCC[C@@H]1OCCN(C)C 7a_200015395474_100000755713 [0,1,0,1,0,0|2,0,0]=4 19717 B16R1.975 CCOC(=O)[C@@H]1CSCN1CCCC(C)C 269982a_100016989239_100011214892 [0,1,0,1,0,0|2,0,0]=4 19718 B16R1.975 CCOC(=O)[C@@H]1CSCN1CCCC(C)O 269982a_100016989239_200000718107 [0,1,0,1,0,0|2,0,0]=4 19719 B16R1.1534 C=C1CC(C1)CNCCCCC(=O)OCC 2230a_100102567296_100000750268 [0,1,0,1,0,0|1,0,1]=4 19720 B16R1.1534 C=C1CC(C1)CNCCCCC(=O)OCC 34a_100102567296_100000750268 [0,1,0,1,0,0|1,0,1]=4 19721 B16R1.1534 C=C1CC(C1)COCCCCC(=O)OCC 34a_100011011225_100000750268 [0,1,0,1,0,0|1,0,1]=4 19722 B16R1.1534 C=C1CC(C1)NCCCCCC(=O)OCC 2230a_100132301982_100000755133 [0,1,0,1,0,0|1,0,1]=4 19723 B16R1.1534 CCOC(=O)CCCCCCN1CC(C1)C 2230a_100000702820_100009814379 [0,1,0,1,0,0|1,0,0]=3 19724 B16R1.1534 CCOC(=O)CCCCCCN1CC(C1)C 269982a_100000702820_100009814379 [0,1,0,1,0,0|1,0,0]=3 19725 B16R1.1534 CCOC(=O)CCCCCCN1CC(C1)C 34a_100000702820_100009814379 [0,1,0,1,0,0|1,0,0]=3 19726 B16R1.1534 CCOC(=O)CCCCCCN1CC(C1)F 2230a_100000690557_100009814379 [0,1,0,1,0,0|1,0,0]=3 19727 B16R1.1534 CCOC(=O)CCCCCCN1CC(C1)F 269982a_100000690557_100009814379 [0,1,0,1,0,0|1,0,0]=3 19728 B16R1.1534 CCOC(=O)CCCCCCN1CC(C1)F 34a_100000690557_100009814379 [0,1,0,1,0,0|1,0,0]=3 19729 B16R1.1534 CCOC(=O)CCCCCCN1CC(C1)O 269982a_100000749847_100009814379 [0,1,0,1,0,0|1,0,0]=3 19730 B16R1.1534 CCOC(=O)CCCCCNC1CC(C1)F 2230a_100016993743_100000755133 [0,1,0,1,0,0|1,0,0]=3 19731 B16R1.1534 CCOC(=O)CCCCCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100000755133 [0,1,0,1,0,0|1,0,0]=3 19732 B16R1.1534 CCOC(=O)CCCCCSC1CC(=O)C1 62a_100009894365_100000755133 [0,1,0,1,0,0|1,0,1]=4 19733 B16R1.1534 CCOC(=O)CCCCNCC1CC(C1)O 2230a_100016992100_100000750268 [0,1,0,1,0,0|1,0,0]=3 19734 B16R1.1534 CCOC(=O)CCCCOCC1CC(=O)C1 34a_100000101936_100000750268 [0,1,0,1,0,0|1,0,1]=4 19735 B16R1.1534 CCOC(=O)CCCCOCC1CC(C1)Cl 34a_100009874164_100000750268 [0,1,0,1,0,0|1,0,0]=3 19736 B16R1.1534 CCOC(=O)CCCCSCC1CC(=O)C1 62a_100000750268_100009874392 [0,1,0,1,0,0|1,0,1]=4 19737 B16R1.1534 CCOC(=O)CCCCSCC1CC(=O)C1 62a_100009874392_100000750268 [0,1,0,1,0,0|1,0,1]=4 19738 B16R1.1534 CCOC(=O)COCCCNC1CC(C1)F 2230a_100016993743_100009893628 [0,1,0,1,0,0|2,0,0]=4 19739 B16R1.1534 CCOC(=O)COCCCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100009893628 [0,1,0,1,0,0|2,0,0]=4 19740 B16R1.1534 CCOC(=O)COCCNCC1CC(C1)O 2230a_100016992100_100000088970 [0,1,0,1,0,0|2,0,0]=4 19741 B16R1.1534 CCOC(=O)COCCOCC1CC(C1)Cl 34a_100009874164_100000088970 [0,1,0,1,0,0|2,0,0]=4 19742 B16R1.1554 C=C(C)CN1CCCCC1CC(=O)OCC 2230a_100116209990_100000748629 [0,1,0,1,0,0|1,0,1]=4 19743 B16R1.1554 C=C(C)CN1CCCCC1CC(=O)OCC 269982a_100116209990_100000748629 [0,1,0,1,0,0|1,0,1]=4 19744 B16R1.1554 CCOC(=O)CC1CCCCN1CC(C)C 2230a_100116209990_100000210760 [0,1,0,1,0,0|1,0,0]=3 19745 B16R1.1554 CCOC(=O)CC1CCCCN1CC(C)C 269982a_100116209990_100000210624 [0,1,0,1,0,0|1,0,0]=3 19746 B16R1.1554 CCOC(=O)CC1CCCCN1CC(C)O 2230a_100116209990_100011218427 [0,1,0,1,0,0|1,0,0]=3 19747 B16R1.1554 CCOC(=O)CC1CCCCN1CC(C)O 269982a_100116209990_100011218427 [0,1,0,1,0,0|1,0,0]=3 19748 B16R1.1554 CCOC(=O)CC1CCCCN1CC(F)F 2230a_100116209990_100011934356 [0,1,0,1,0,0|2,0,0]=4 19749 B16R1.1554 CCOC(=O)CC1CCCCN1CC(F)F 269982a_100116209990_100011934356 [0,1,0,1,0,0|2,0,0]=4 19750 B16R1.1554 CCOC(=O)CC1CCCCN1C[C@@H](C)O 2230a_100116209990_100009817552 [0,1,0,1,0,0|1,0,0]=3 19751 B16R1.1554 CCOC(=O)CC1CCCCN1C[C@@H](C)O 269982a_100116209990_100009817552 [0,1,0,1,0,0|1,0,0]=3 19752 B16R1.1554 CCOC(=O)CN1CCCCC1CN(C)C 2230a_100000746231_100000188475 [0,1,0,1,0,0|2,0,0]=4 19753 B16R1.1554 CCOC(=O)CN1CCCCC1CN(C)C 269982a_100000746231_100000188475 [0,1,0,1,0,0|2,0,0]=4 19754 B16R1.1554 CCOC(=O)CN1CCOCC1CC(C)C 2230a_100000755734_100000188475 [0,1,0,1,0,0|2,0,0]=4 19755 B16R1.1554 CCOC(=O)CN1CCOCC1CC(C)C 269982a_100000755734_100000188475 [0,1,0,1,0,0|2,0,0]=4 19756 B16R1.1554 CCOC(=O)CN1CCOCC1CC(C)C 34a_100000755734_100000188475 [0,1,0,1,0,0|2,0,0]=4 19757 B16R1.2080 CCOC(=O)CCCCCNC1CC1(F)F 2230a_100020610826_100000755133 [0,1,0,1,0,0|2,0,0]=4 19758 B16R1.2080 CCOC(=O)CCCCCNC1CC1(F)F 34a_100020610826_100000755133 [0,1,0,1,0,0|2,0,0]=4 19759 B16R1.2080 CCOC(=O)CCCCOCC1CC1(C)C 34a_100000728257_100000750268 [0,1,0,1,0,0|1,0,0]=3 19760 B16R1.2080 CCOC(=O)CCCCOCC1CC1(C)C 7a_100000728257_100000750268 [0,1,0,1,0,0|1,0,0]=3 19761 B16R1.2080 CCOC(=O)CCCCOCC1CC1(F)F 34a_100000056500_100000750268 [0,1,0,1,0,0|2,0,0]=4 19762 B16R1.2080 CCOC(=O)CCCCOCC1CC1(F)F 7a_100000056500_100000750268 [0,1,0,1,0,0|2,0,0]=4 19763 B16R1.2080 CCOC(=O)CCCCOCC1OC1(C)C 34a_200010283642_100000750268 [0,1,0,1,0,0|2,0,0]=4 19764 B16R1.2080 CCOC(=O)CCCCOCC1OC1(C)C 7a_200010283642_100000750268 [0,1,0,1,0,0|2,0,0]=4 19765 B16R1.2080 CCOC(=O)CCCCSCC1CC1(F)F 62a_100000750268_100009817841 [0,1,0,1,0,0|2,0,0]=4 19766 B16R1.2080 CCOC(=O)CCCCSCC1CC1(F)F 62a_100009817841_100000750268 [0,1,0,1,0,0|2,0,0]=4 19767 B16R1.2080 CCOC(=O)CCCOCCC1CC1(F)F 34a_100009864177_100009991533 [0,1,0,1,0,0|2,0,0]=4 19768 B16R1.2080 CCOC(=O)CCCOCCC1CC1(F)F 7a_100009864177_100011215271 [0,1,0,1,0,0|2,0,0]=4 19769 B16R1.2080 CCOC(=O)COCCOCC1CC1(C)C 34a_100000728257_100000088970 [0,1,0,1,0,0|2,0,0]=4 19770 B16R1.2080 CCOC(=O)COCCOCC1CC1(C)C 7a_100000728257_100000088970 [0,1,0,1,0,0|2,0,0]=4 19771 B16R1.4433 CCOC(=O)CCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100009814379 [0,1,0,1,0,0|1,0,0]=3 19772 B16R1.4433 CCOC(=O)CCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100009814379 [0,1,0,1,0,0|1,0,0]=3 19773 B16R1.4433 CCOC(=O)CCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100009814379 [0,1,0,1,0,0|1,0,0]=3 19774 B16R1.4433 CCOC(=O)CCCCCOCC1CC1C 34a_100000744939_100000755133 [0,1,0,1,0,0|0,0,0]=2 19775 B16R1.4433 CCOC(=O)CCCCCOCC1CC1C 7a_100000744939_100000755133 [0,1,0,1,0,0|0,0,0]=2 19776 B16R1.4433 CCOC(=O)COCCCOCC1CC1C 34a_100000744939_100009893628 [0,1,0,1,0,0|1,0,0]=3 19777 B16R1.4433 CCOC(=O)COCCCOCC1CC1C 7a_100000744939_100009893628 [0,1,0,1,0,0|1,0,0]=3 19778 B16R1.4440 CCCC(=O)COC1CCCCC1C(C)C 7a_100011709184_100000747444 [0,1,0,1,0,0|2,0,0]=4 19779 B16R1.4440 CCNC(=O)CCN1CCCCC1C(C)C 2230a_100000757267_100000737597 [0,1,0,1,0,0|2,0,0]=4 19780 B16R1.4440 CCNC(=O)CCN1CCCCC1C(C)C 269982a_100000757267_100000737597 [0,1,0,1,0,0|2,0,0]=4 19781 B16R1.4440 CCNC(=O)COC1CCCCC1C(C)C 34a_100011709184_100000183381 [0,1,0,1,0,0|2,0,0]=4 19782 B16R1.4440 CCNC(=O)COC1CCCCC1C(C)C 7a_100011709184_100000183381 [0,1,0,1,0,0|2,0,0]=4 19783 B16R1.4440 CCOC(=O)CCN1CCCCC1C(C)C 2230a_100000757267_100011206558 [0,1,0,1,0,0|1,0,0]=3 19784 B16R1.4440 CCOC(=O)CCN1CCCCC1C(C)C 269982a_100000757267_100011206558 [0,1,0,1,0,0|1,0,0]=3 19785 B16R1.4440 CCOC(=O)CCN1CCCCC1C(C)C 34a_100000757267_100000765890 [0,1,0,1,0,0|1,0,0]=3 19786 B16R1.4440 CCOC(=O)CCN1CCOC[C@@H]1C(C)C 2230a_100025712635_100011206558 [0,1,0,1,0,0|2,0,0]=4 19787 B16R1.4440 CCOC(=O)CCN1CCOC[C@@H]1C(C)C 269982a_100025712635_100011206558 [0,1,0,1,0,0|2,0,0]=4 19788 B16R1.4440 CCOC(=O)CCN1CCOC[C@@H]1C(C)C 34a_100025712635_100000765890 [0,1,0,1,0,0|2,0,0]=4 19789 B16R1.4440 CCOC(=O)COC1CCCCC1C(C)C 34a_100011709184_100000188475 [0,1,0,1,0,0|1,0,0]=3 19790 B16R1.4440 CCOC(=O)COC1CCCCC1C(C)C 7a_100011709184_100000188475 [0,1,0,1,0,0|1,0,0]=3 19791 B16R1.4444 CCNC(=O)CCN1CCCC1CC(C)C 2230a_100000748429_100000737597 [0,1,0,1,0,0|2,0,0]=4 19792 B16R1.4444 CCNC(=O)CCN1CCCC1CC(C)C 269982a_100000748429_100000737597 [0,1,0,1,0,0|2,0,0]=4 19793 B16R1.4444 CCOC(=O)CCN1CCCC1CC(C)C 2230a_100000748429_100011206558 [0,1,0,1,0,0|1,0,0]=3 19794 B16R1.4444 CCOC(=O)CCN1CCCC1CC(C)C 269982a_100000748429_100011206558 [0,1,0,1,0,0|1,0,0]=3 19795 B16R1.4444 CCOC(=O)CCN1CCCC1CC(C)C 34a_100000748429_100000765890 [0,1,0,1,0,0|1,0,0]=3 19796 B16R1.4444 CCOC(=O)CCN1CCC[C@@H]1CN(C)C 269982a_200020645772_100011206558 [0,1,0,1,0,0|2,0,0]=4 19797 B16R1.8794 CC(C)CCCCCN1CCNC(=O)CC1 2230a_100000698595_100000210682 [0,1,0,1,0,0|2,0,0]=4 19798 B16R1.8794 CC(C)CCCCCN1CCNC(=O)CC1 269982a_100000698595_100000210682 [0,1,0,1,0,0|2,0,0]=4 19799 B16R1.14019 CCNC(=O)CCNC1CCCCC1(C)C 269862a_100025743525_100000031690 [0,1,0,1,0,0|2,0,0]=4 19800 B16R1.14019 CCOC(=O)CCCN1CCOCC1(C)C 2230a_100000724681_100009991533 [0,1,0,1,0,0|2,0,0]=4 19801 B16R1.14019 CCOC(=O)CCCN1CCOCC1(C)C 269982a_100000724681_100009991533 [0,1,0,1,0,0|2,0,0]=4 19802 B16R1.14019 CCOC(=O)CCCN1CCOCC1(C)C 34a_100000724681_100009991533 [0,1,0,1,0,0|2,0,0]=4 19803 B16R1.14019 CCOC(=O)CCNC1CCCCC1(F)F 2230a_100000686509_100011206558 [0,1,0,1,0,0|2,0,0]=4 19804 B16R1.14019 CCOC(=O)CCNC1CCCCC1(F)F 34a_100000686509_100000765890 [0,1,0,1,0,0|2,0,0]=4 19805 B16R1.14019 CCOC(=O)CCOC1CCNCC1(C)C 34a_100000709803_100000765890 [0,1,0,1,0,0|2,0,0]=4 19806 B16R1.14019 CCOC(=O)CCSC1CCCCC1(F)F 62a_100000765890_200009832135 [0,1,0,1,0,0|2,0,0]=4 19807 B16R1.14019 CCOC(=O)CCSC1CCCCC1(F)F 62a_200009832135_100000765890 [0,1,0,1,0,0|2,0,0]=4 19808 B16R1.14020 CCOC(=O)CCCN1CCCC1C(C)C 2230a_100000762757_100009991533 [0,1,0,1,0,0|1,0,0]=3 19809 B16R1.14020 CCOC(=O)CCCN1CCCC1C(C)C 269982a_100000762757_100009991533 [0,1,0,1,0,0|1,0,0]=3 19810 B16R1.14020 CCOC(=O)CCCN1CCCC1C(C)C 34a_100000762757_100009991533 [0,1,0,1,0,0|1,0,0]=3 19811 B16R1.14020 CCOC(=O)NCCN1CCCC1C(C)C 269982a_100000762757_200011445536 [0,1,0,1,0,0|2,0,0]=4 19812 B16R1.14998 CCCC(=O)CN1CCCCCC1C(C)C 2230a_100000697956_100000747444 [0,1,0,1,0,0|2,0,0]=4 19813 B16R1.14998 CCCC(=O)CN1CCCCCC1C(C)C 269982a_100000697956_100000747444 [0,1,0,1,0,0|2,0,0]=4 19814 B16R1.14998 CCNC(=O)CN1CCCCCC1C(C)C 2230a_100000697956_100000183381 [0,1,0,1,0,0|2,0,0]=4 19815 B16R1.14998 CCNC(=O)CN1CCCCCC1C(C)C 269982a_100000697956_100000183381 [0,1,0,1,0,0|2,0,0]=4 19816 B16R1.14998 CCNC(=O)CN1CCCCCC1C(C)C 34a_100000697956_100000183381 [0,1,0,1,0,0|2,0,0]=4 19817 B16R1.14998 CCOC(=O)CN1CCCCCC1C(C)C 2230a_100000697956_100000188475 [0,1,0,1,0,0|1,0,0]=3 19818 B16R1.14998 CCOC(=O)CN1CCCCCC1C(C)C 269982a_100000697956_100000188475 [0,1,0,1,0,0|1,0,0]=3 19819 B16R1.14998 CCOC(=O)CN1CCCCCC1C(C)C 34a_100000697956_100000188475 [0,1,0,1,0,0|1,0,0]=3 19820 B16R1.15129 CCOC(=O)CCCCN1CCCC1(C)C 2230a_100000761399_100000750268 [0,1,0,1,0,0|1,0,0]=3 19821 B16R1.15129 CCOC(=O)CCCCN1CCCC1(C)C 269982a_100000761399_100000750268 [0,1,0,1,0,0|1,0,0]=3 19822 B16R1.15129 CCOC(=O)CCCCN1CCCC1(C)C 34a_100000761399_100000750268 [0,1,0,1,0,0|1,0,0]=3 19823 B16R1.15129 CCOC(=O)CCCCN1CCSC1(C)C 2230a_100011217261_100000750268 [0,1,0,1,0,0|2,0,0]=4 19824 B16R1.15129 CCOC(=O)CCCCN1CCSC1(C)C 269982a_100011217261_100000750268 [0,1,0,1,0,0|2,0,0]=4 19825 B16R1.15129 CCOC(=O)CCCCN1CCSC1(C)C 34a_100011217261_100000750268 [0,1,0,1,0,0|2,0,0]=4 19826 B16R1.15129 CCOC(=O)CCCCN1COCC1(C)C 2230a_100000043020_100000750268 [0,1,0,1,0,0|2,0,0]=4 19827 B16R1.15129 CCOC(=O)CCCCN1COCC1(C)C 269982a_100000043020_100000750268 [0,1,0,1,0,0|2,0,0]=4 19828 B16R1.15129 CCOC(=O)CCCNC1CCCC1(F)F 2230a_100000767123_100009991533 [0,1,0,1,0,0|2,0,0]=4 19829 B16R1.15129 CCOC(=O)CCCNC1CCCC1(F)F 34a_100000767123_100009991533 [0,1,0,1,0,0|2,0,0]=4 19830 B16R1.15129 CCOC(=O)CCCN[C@@H]1CCC[C@@]1(C)O 2230a_100015977457_100009991533 [0,1,0,1,0,0|1,0,0]=3 19831 B16R1.15129 CCOC(=O)CCCN[C@@H]1CCC[C@@]1(C)O 34a_100015977457_100009991533 [0,1,0,1,0,0|1,0,0]=3 19832 B16R1.15129 CCOC(=O)CCCOC1CCCC1(C)C 34a_100000726220_100009991533 [0,1,0,1,0,0|1,0,0]=3 19833 B16R1.15129 CCOC(=O)CCCOC1CCCC1(C)C 7a_100000726220_100011215271 [0,1,0,1,0,0|1,0,0]=3 19834 B16R1.15129 CCOC(=O)CCCSC1CCCC1(F)F 62a_100009991533_100119073726 [0,1,0,1,0,0|2,0,0]=4 19835 B16R1.15129 CCOC(=O)CCCSC1CCCC1(F)F 62a_100119073726_100009991533 [0,1,0,1,0,0|2,0,0]=4 19836 B16R1.15129 CCOC(=O)CNCCN1CCCC1(C)C 2230a_100015204988_100000188475 [0,1,0,1,0,0|2,0,0]=4 19837 B16R1.15129 CCOC(=O)COCCN1CCCC1(C)C 2230a_100000761399_100000088970 [0,1,0,1,0,0|2,0,0]=4 19838 B16R1.15129 CCOC(=O)COCCN1CCCC1(C)C 269982a_100000761399_100000088970 [0,1,0,1,0,0|2,0,0]=4 19839 B16R1.15129 CCOC(=O)COCCN1CCCC1(C)C 34a_100000761399_100000088970 [0,1,0,1,0,0|2,0,0]=4 19840 B16R1.15129 CCOC(=O)NCCOC1CCCC1(C)C 7a_100000726220_200011445536 [0,1,0,1,0,0|2,0,0]=4 19841 B16R1.15313 CCOC(=O)CCCCC=NNCC1CC1 4a_100000736359_100012182868 [0,1,0,1,0,0|1,0,1]=4 19842 B16R1.15313 CCOC(=O)CCCCCC=NNC1CC1 4a_100000701032_100000085164 [0,1,0,1,0,0|1,0,1]=4 19843 B16R1.15313 CCOC(=O)CCCCCCCNC1CC1 34a_100000212008_100009991516 [0,1,0,1,0,0|0,0,0]=2 19844 B16R1.15313 CCOC(=O)CCCCCCNCC1CC1 2230a_100000735609_100009814379 [0,1,0,1,0,0|0,0,0]=2 19845 B16R1.15313 CCOC(=O)CCCCCCNCC1CC1 34a_100000735609_100009814379 [0,1,0,1,0,0|0,0,0]=2 19846 B16R1.15313 CCOC(=O)CCCCCCOCC1CC1 34a_100000211283_100009814379 [0,1,0,1,0,0|0,0,0]=2 19847 B16R1.15313 CCOC(=O)CCCCCCOC[C@@H]1CO1 34a_100000757423_100009814379 [0,1,0,1,0,0|1,0,0]=3 19848 B16R1.15313 CCOC(=O)CCCCCCSCC1CC1 62a_100000756562_100009814379 [0,1,0,1,0,0|0,0,0]=2 19849 B16R1.15313 CCOC(=O)CCCCCCSCC1CO1 62a_102125554688_100009814379 [0,1,0,1,0,0|1,0,0]=3 19850 B16R1.15313 CCOC(=O)CCCCCCSCC1CS1 62a_100000031435_100009814379 [0,1,0,1,0,0|1,0,0]=3 19851 B16R1.15313 CCOC(=O)CCCCCCSC[C@@H]1CO1 62a_100000745022_100009814379 [0,1,0,1,0,0|1,0,0]=3 19852 B16R1.15313 CCOC(=O)CCCCCNCCC1CC1 34a_100000764129_100000755133 [0,1,0,1,0,0|0,0,0]=2 19853 B16R1.15313 CCOC(=O)CCCCCOCCC1CC1 34a_100000754188_100000755133 [0,1,0,1,0,0|0,0,0]=2 19854 B16R1.15313 CCOC(=O)CCCCCOCCC1CC1 7a_100000754188_100000755133 [0,1,0,1,0,0|0,0,0]=2 19855 B16R1.15313 CCOC(=O)CCCCCOCCC1CC1 7a_100011214988_100000764125 [0,1,0,1,0,0|0,0,0]=2 19856 B16R1.15313 CCOC(=O)CCCCCOCCC1CO1 7a_100011214988_100000732470 [0,1,0,1,0,0|1,0,0]=3 19857 B16R1.15313 CCOC(=O)CCCCCOCC[C@@H]1CO1 34a_100009820653_100000755133 [0,1,0,1,0,0|1,0,0]=3 19858 B16R1.15313 CCOC(=O)CCCCCSCCC1CC1 62a_100000755133_100000764125 [0,1,0,1,0,0|0,0,0]=2 19859 B16R1.15313 CCOC(=O)CCCCCSCCC1CC1 62a_100000764125_100000755133 [0,1,0,1,0,0|0,0,0]=2 19860 B16R1.15313 CCOC(=O)CCCCCSCCC1CO1 62a_100000732470_100000755133 [0,1,0,1,0,0|1,0,0]=3 19861 B16R1.15313 CCOC(=O)CCCCCSCCC1CO1 62a_100000755133_100000732470 [0,1,0,1,0,0|1,0,0]=3 19862 B16R1.15313 CCOC(=O)CCCCOCC#CC1CC1 34a_100000083941_100000750268 [0,1,0,1,0,0|0,0,2]=4 19863 B16R1.15313 CCOC(=O)CCCCOCC#CC1CC1 7a_100000083941_100000750268 [0,1,0,1,0,0|0,0,2]=4 19864 B16R1.15313 CCOC(=O)CCCCOCCNC1CC1 34a_100000738766_100000750268 [0,1,0,1,0,0|1,0,0]=3 19865 B16R1.15313 CCOC(=O)CCCCSCC#CC1CC1 62a_100000750268_100009895102 [0,1,0,1,0,0|0,0,2]=4 19866 B16R1.15313 CCOC(=O)CCCCSCC#CC1CC1 62a_100009895102_100000750268 [0,1,0,1,0,0|0,0,2]=4 19867 B16R1.15313 CCOC(=O)CCCCSCCCC1CO1 62a_100000733510_100000750268 [0,1,0,1,0,0|1,0,0]=3 19868 B16R1.15313 CCOC(=O)CCCCSCCCC1CO1 62a_100000750268_100000733510 [0,1,0,1,0,0|1,0,0]=3 19869 B16R1.15313 CCOC(=O)COCCCCOCC1CO1 34a_100010889290_100000188475 [0,1,0,1,0,0|2,0,0]=4 19870 B16R1.15313 CCOC(=O)COCCCCOCC1CO1 7a_100010889290_100000188475 [0,1,0,1,0,0|2,0,0]=4 19871 B16R1.15313 CCOC(=O)COCCCNCCC1CC1 34a_100000764129_100009893628 [0,1,0,1,0,0|1,0,0]=3 19872 B16R1.15313 CCOC(=O)COCCCOCCC1CC1 34a_100000754188_100009893628 [0,1,0,1,0,0|1,0,0]=3 19873 B16R1.15313 CCOC(=O)COCCCOCCC1CC1 7a_100000754188_100009893628 [0,1,0,1,0,0|1,0,0]=3 19874 B16R1.15313 CCOC(=O)COCCCOCC[C@@H]1CO1 34a_100009820653_100009893628 [0,1,0,1,0,0|2,0,0]=4 19875 B16R1.15313 CCOC(=O)COCCCSCCC1CC1 62a_100000764125_100009893628 [0,1,0,1,0,0|1,0,0]=3 19876 B16R1.15313 CCOC(=O)COCCCSCCC1CC1 62a_100009893628_100000764125 [0,1,0,1,0,0|1,0,0]=3 19877 B16R1.15313 CCOC(=O)COCCCSCCC1CO1 62a_100000732470_100009893628 [0,1,0,1,0,0|2,0,0]=4 19878 B16R1.15313 CCOC(=O)COCCCSCCC1CO1 62a_100009893628_100000732470 [0,1,0,1,0,0|2,0,0]=4 19879 B16R1.15313 CCOC(=O)COCCOCCNC1CC1 34a_100000738766_100000088970 [0,1,0,1,0,0|2,0,0]=4 19880 B16R1.15313 CCOC(=O)COCCSCCCC1CO1 62a_100000088970_100000733510 [0,1,0,1,0,0|2,0,0]=4 19881 B16R1.15313 CCOC(=O)COCCSCCCC1CO1 62a_100000733510_100000088970 [0,1,0,1,0,0|2,0,0]=4 19882 B16R1.15313 CCOC(=O)CSCCOCCCC1CO1 7a_200000230590_100000733510 [0,1,0,1,0,0|2,0,0]=4 19883 B16R1.15412 CCCC(=O)N1CCCCCC1CC(C)C 11a_100000759364_100000211992 [0,1,0,1,0,0|2,0,0]=4 19884 B16R1.15412 CCCC(=O)N1CCCCCC1CC(C)C 1626a_100000759364_100000211992 [0,1,0,1,0,0|2,0,0]=4 19885 B16R1.15412 CCCC(=O)N1CCCCCC1CC(C)C 240690a_100000759364_100000211992 [0,1,0,1,0,0|2,0,0]=4 19886 B16R1.15412 CCCC(=O)N1CCCCCC1CC(C)C 527a_100000759364_100000211992 [0,1,0,1,0,0|2,0,0]=4 19887 B16R1.15412 CCNC(=O)N1CCCCCC1CC(C)C 2708a_100015525214_100000759364 [0,1,0,1,0,0|2,0,0]=4 19888 B16R1.15412 CCNC(=O)N1CCCCCC1CC(C)C 273464a_100015525214_100000759364 [0,1,0,1,0,0|2,0,0]=4 19889 B16R1.40827 CC(C)CCCCCCNCC(=O)C1CC1 2230a_100000211014_100000746382 [0,1,0,1,0,0|2,0,0]=4 19890 B16R1.40827 CC(C)CCCCCCNCC(=O)C1CC1 34a_100000211014_100000746382 [0,1,0,1,0,0|2,0,0]=4 19891 B16R1.92 CCCCCCCC(=O)C1CCNC(=O)C1 1458a_100000132800_100000210614 [0,1,0,1,0,0|1,0,1]=4 19892 B16R1.92 CCCCCCCC(=O)N1CCOC(=O)C1 11a_100000131268_100000211969 [0,1,0,1,0,0|1,0,1]=4 19893 B16R1.92 CCCCCCCC(=O)N1CCOC(=O)C1 240690a_100000131268_100000211969 [0,1,0,1,0,0|1,0,1]=4 19894 B16R1.92 CCCCCCCC(=O)N1CCOC(=O)C1 527a_100000131268_100000211969 [0,1,0,1,0,0|1,0,1]=4 19895 B16R1.92 CCCCCCCC(C)N1CCNC(=O)C1 2230a_100000184651_200011218727 [0,1,0,1,0,0|2,0,0]=4 19896 B16R1.92 CCCCCCCC(C)N1CCNC(=O)C1 270004a_100000184651_100000210596 [0,1,0,1,0,0|2,0,0]=4 19897 B16R1.92 CCCCCCCC(C)N1CCOC(=O)C1 2230a_100000131268_200011218727 [0,1,0,1,0,0|1,0,0]=3 19898 B16R1.92 CCCCCCCC(C)N1CCOC(=O)C1 270004a_100000131268_100000210596 [0,1,0,1,0,0|1,0,0]=3 19899 B16R1.934 CCNC(=O)CCC(=O)CC1CCCCC1 1458a_100000199579_100000211423 [0,1,0,1,0,0|1,0,1]=4 19900 B16R1.934 CCNC(=O)CCN(C)CC1CCCCC1 2230a_100000736448_100000737597 [0,1,0,1,0,0|2,0,0]=4 19901 B16R1.934 CCNC(=O)CCN(C)CC1CCCCC1 269982a_100000736448_100000737597 [0,1,0,1,0,0|2,0,0]=4 19902 B16R1.934 CCNC(=O)CNC(C)CC1CCCCC1 270004a_100016988866_100011215996 [0,1,0,1,0,0|2,0,0]=4 19903 B16R1.934 CCOC(=O)CCC(=O)CC1CCCCC1 1458a_100000183558_100000211423 [0,1,0,1,0,0|0,0,1]=3 19904 B16R1.934 CCOC(=O)CCC(=O)CC1CCCCO1 1458a_100000183558_100000211543 [0,1,0,1,0,0|1,0,1]=4 19905 B16R1.934 CCOC(=O)CCC(=O)CC1CCCOC1 1458a_100000183558_100000741521 [0,1,0,1,0,0|1,0,1]=4 19906 B16R1.934 CCOC(=O)CCC(=O)CC1CCOCC1 1458a_100000183558_100000754603 [0,1,0,1,0,0|1,0,1]=4 19907 B16R1.934 CCOC(=O)CCC(=O)NC1CCCCC1 11a_100000182618_100000183558 [0,1,0,1,0,0|1,0,1]=4 19908 B16R1.934 CCOC(=O)CCC(=O)NC1CCCCC1 1626a_100000182618_100000183558 [0,1,0,1,0,0|1,0,1]=4 19909 B16R1.934 CCOC(=O)CCC(=O)NC1CCCCC1 240690a_100000182618_100000183558 [0,1,0,1,0,0|1,0,1]=4 19910 B16R1.934 CCOC(=O)CCC(C)NC1CCCCC1 2230a_100000182618_100000748298 [0,1,0,1,0,0|1,0,0]=3 19911 B16R1.934 CCOC(=O)CCC(C)NC1CCCCC1 34a_100000182618_100000748298 [0,1,0,1,0,0|1,0,0]=3 19912 B16R1.934 CCOC(=O)CCC(C)NC1CCCOC1 2230a_100000719290_100000748298 [0,1,0,1,0,0|2,0,0]=4 19913 B16R1.934 CCOC(=O)CCC(C)NC1CCCOC1 34a_100000719290_100000748298 [0,1,0,1,0,0|2,0,0]=4 19914 B16R1.934 CCOC(=O)CCC(C)NC1CCOCC1 2230a_100000741149_100000748298 [0,1,0,1,0,0|2,0,0]=4 19915 B16R1.934 CCOC(=O)CCC(C)NC1CCOCC1 34a_100000741149_100000748298 [0,1,0,1,0,0|2,0,0]=4 19916 B16R1.934 CCOC(=O)CCC(C)NC1CCSCC1 2230a_100000748639_100000748298 [0,1,0,1,0,0|2,0,0]=4 19917 B16R1.934 CCOC(=O)CCC(C)NC1CCSCC1 34a_100000748639_100000748298 [0,1,0,1,0,0|2,0,0]=4 19918 B16R1.934 CCOC(=O)CCC(C)OC1CCCCC1 34a_100000210231_100000748298 [0,1,0,1,0,0|1,0,0]=3 19919 B16R1.934 CCOC(=O)CCC(C)OC1CCCCC1 7a_100000210231_100000748298 [0,1,0,1,0,0|1,0,0]=3 19920 B16R1.934 CCOC(=O)CCC(C)OC1CCCCO1 34a_100000033831_100000748298 [0,1,0,1,0,0|2,0,0]=4 19921 B16R1.934 CCOC(=O)CCC(C)OC1CCCOC1 34a_100000754041_100000748298 [0,1,0,1,0,0|2,0,0]=4 19922 B16R1.934 CCOC(=O)CCC(C)OC1CCCSC1 7a_100015962668_100000748298 [0,1,0,1,0,0|2,0,0]=4 19923 B16R1.934 CCOC(=O)CCC(C)OC1CCOCC1 34a_100000744328_100000748298 [0,1,0,1,0,0|2,0,0]=4 19924 B16R1.934 CCOC(=O)CCC(C)OC1CCSCC1 34a_100000731022_100000748298 [0,1,0,1,0,0|2,0,0]=4 19925 B16R1.934 CCOC(=O)CCC(C)OC1CCSCC1 7a_100000731022_100000748298 [0,1,0,1,0,0|2,0,0]=4 19926 B16R1.934 CCOC(=O)CCC(C)SC1CCCCC1 62a_100000210327_100000748298 [0,1,0,1,0,0|1,0,0]=3 19927 B16R1.934 CCOC(=O)CCC(C)SC1CCCCC1 62a_100000748298_100000210327 [0,1,0,1,0,0|1,0,0]=3 19928 B16R1.934 CCOC(=O)CCC(C)SC1CCCOC1 62a_100000748298_100000693364 [0,1,0,1,0,0|2,0,0]=4 19929 B16R1.934 CCOC(=O)CCC(C)SC1CCOCC1 62a_100000748298_100011324220 [0,1,0,1,0,0|2,0,0]=4 19930 B16R1.934 CCOC(=O)CCC(C)SC1CCSCC1 62a_100000748298_100000069128 [0,1,0,1,0,0|2,0,0]=4 19931 B16R1.934 CCOC(=O)CCN(C)CC1CCCCC1 2230a_100000736448_100011206558 [0,1,0,1,0,0|1,0,0]=3 19932 B16R1.934 CCOC(=O)CCN(C)CC1CCCCC1 2230a_100000745921_100000211423 [0,1,0,1,0,0|1,0,0]=3 19933 B16R1.934 CCOC(=O)CCN(C)CC1CCCCC1 269982a_100000736448_100011206558 [0,1,0,1,0,0|1,0,0]=3 19934 B16R1.934 CCOC(=O)CCN(C)CC1CCCCC1 269982a_100000745921_100000211423 [0,1,0,1,0,0|1,0,0]=3 19935 B16R1.934 CCOC(=O)CCN(C)CC1CCCCC1 34a_100000736448_100000765890 [0,1,0,1,0,0|1,0,0]=3 19936 B16R1.934 CCOC(=O)CCN(C)CC1CCCCO1 2230a_100000225654_100011206558 [0,1,0,1,0,0|2,0,0]=4 19937 B16R1.934 CCOC(=O)CCN(C)CC1CCCCO1 2230a_100000745921_100000211543 [0,1,0,1,0,0|2,0,0]=4 19938 B16R1.934 CCOC(=O)CCN(C)CC1CCCCO1 269982a_100000225654_100011206558 [0,1,0,1,0,0|2,0,0]=4 19939 B16R1.934 CCOC(=O)CCN(C)CC1CCCCO1 269982a_100000745921_100000211543 [0,1,0,1,0,0|2,0,0]=4 19940 B16R1.934 CCOC(=O)CCN(C)CC1CCCCO1 34a_100000225654_100000765890 [0,1,0,1,0,0|2,0,0]=4 19941 B16R1.934 CCOC(=O)CCN(C)CC1CCCOC1 2230a_100000745921_100000741521 [0,1,0,1,0,0|2,0,0]=4 19942 B16R1.934 CCOC(=O)CCN(C)CC1CCCOC1 269982a_100000745921_100000741521 [0,1,0,1,0,0|2,0,0]=4 19943 B16R1.934 CCOC(=O)CCN(C)CC1CCOCC1 2230a_100000745921_100000754603 [0,1,0,1,0,0|2,0,0]=4 19944 B16R1.934 CCOC(=O)CCN(C)CC1CCOCC1 2230a_100025706683_100011206558 [0,1,0,1,0,0|2,0,0]=4 19945 B16R1.934 CCOC(=O)CCN(C)CC1CCOCC1 269982a_100000745921_100000754603 [0,1,0,1,0,0|2,0,0]=4 19946 B16R1.934 CCOC(=O)CCN(C)CC1CCOCC1 269982a_100025706683_100011206558 [0,1,0,1,0,0|2,0,0]=4 19947 B16R1.934 CCOC(=O)CCN(C)CC1CCOCC1 34a_100025706683_100000765890 [0,1,0,1,0,0|2,0,0]=4 19948 B16R1.934 CCOC(=O)CCN(C)CC1CCSCC1 2230a_100011935259_100011206558 [0,1,0,1,0,0|2,0,0]=4 19949 B16R1.934 CCOC(=O)CCN(C)CC1CCSCC1 269982a_100011935259_100011206558 [0,1,0,1,0,0|2,0,0]=4 19950 B16R1.934 CCOC(=O)CCN(C)CC1CCSCC1 34a_100011935259_100000765890 [0,1,0,1,0,0|2,0,0]=4 19951 B16R1.934 CCOC(=O)CNC(=O)CC1CCCCC1 188690a_100000741813_100000211666 [0,1,0,1,0,0|1,0,1]=4 19952 B16R1.934 CCOC(=O)CNC(C)CN1CCCCC1 2230a_100000738326_100000188475 [0,1,0,1,0,0|2,0,0]=4 19953 B16R1.934 CCOC(=O)CSC(C)CN1CCCCC1 62a_100000188475_100009831500 [0,1,0,1,0,0|2,0,0]=4 19954 B16R1.934 CCOC(=O)CSC(C)CN1CCCCC1 62a_100009831500_100000188475 [0,1,0,1,0,0|2,0,0]=4 19955 B16R1.934 CCOC(=O)NCC(=O)CC1CCCCC1 1458a_100000190774_100000211423 [0,1,0,1,0,0|1,0,1]=4 19956 B16R1.5015 CCCCCCCN1CC(C1)C(=O)OCC 269982a_100015188541_100000210681 [0,1,0,1,0,0|1,0,0]=3 19957 B16R1.5015 CCCCCCOC1CC(C1)C(=O)OCC 7a_100000093532_100000210314 [0,1,0,1,0,0|1,0,0]=3 19958 B16R1.5015 CCCCOCCN1CC(C1)C(=O)OCC 269982a_100015188541_100000743108 [0,1,0,1,0,0|2,0,0]=4 19959 B16R1.5015 CCCOCCOC1CC(C1)C(=O)OCC 7a_100000093532_100011215938 [0,1,0,1,0,0|2,0,0]=4 19960 B16R1.5015 CCOC(=O)C1CC(C1)OCCCCCF 7a_100000093532_100000729378 [0,1,0,1,0,0|2,0,0]=4 19961 B16R1.5015 CCOC(=O)C1CC(C1)OCCCCCO 7a_100000093532_100000746330 [0,1,0,1,0,0|2,0,0]=4 19962 B16R1.5015 CCOC(=O)C1CC(C1)OCCCCOC 7a_100000093532_100000730899 [0,1,0,1,0,0|2,0,0]=4 19963 B16R1.5015 CCOC(=O)C1CN(C1)CCCCCCF 269982a_100015188541_100015922095 [0,1,0,1,0,0|2,0,0]=4 19964 B16R1.5015 CCOC(=O)C1CN(C1)CCCCCCO 269982a_100015188541_100000766143 [0,1,0,1,0,0|2,0,0]=4 19965 B16R1.5015 CCOCCCOC1CC(C1)C(=O)OCC 7a_100000093532_100012232248 [0,1,0,1,0,0|2,0,0]=4 19966 B16R1.5166 CCCCN1CC[C@@H](C[C@H]1C(=O)OCC)C 2230a_200015568886_100000210211 [0,1,0,1,0,0|1,0,0]=3 19967 B16R1.5166 CCCCN1CC[C@@H](C[C@H]1C(=O)OCC)C 269982a_200015568886_100000210211 [0,1,0,1,0,0|1,0,0]=3 19968 B16R1.5166 CCOC(=O)[C@@H]1C[C@H](CCN1CCCF)C 2230a_200015568886_100011934791 [0,1,0,1,0,0|2,0,0]=4 19969 B16R1.5166 CCOC(=O)[C@@H]1C[C@H](CCN1CCCF)C 269982a_200015568886_100011934791 [0,1,0,1,0,0|2,0,0]=4 19970 B16R1.5166 CCOC(=O)[C@@H]1C[C@H](CCN1CCCO)C 2230a_200015568886_100000230001 [0,1,0,1,0,0|2,0,0]=4 19971 B16R1.5166 CCOC(=O)[C@@H]1C[C@H](CCN1CCCO)C 269982a_200015568886_100011215043 [0,1,0,1,0,0|2,0,0]=4 19972 B16R1.5166 CCOC(=O)[C@@H]1C[C@H](CCN1CCOC)C 2230a_200015568886_100011201679 [0,1,0,1,0,0|2,0,0]=4 19973 B16R1.5166 CCOC(=O)[C@@H]1C[C@H](CCN1CCOC)C 269982a_200015568886_100000233755 [0,1,0,1,0,0|2,0,0]=4 19974 B16R1.5166 CCOC(=O)[C@@H]1C[C@H](CCN1CCSC)C 2230a_200015568886_100000751147 [0,1,0,1,0,0|2,0,0]=4 19975 B16R1.5166 CCOC(=O)[C@@H]1C[C@H](CCN1CCSC)C 269982a_200015568886_100000212216 [0,1,0,1,0,0|2,0,0]=4 19976 B16R1.5166 CCOCN1CC[C@@H](C[C@H]1C(=O)OCC)C 269982a_200015568886_100000739092 [0,1,0,1,0,0|2,0,0]=4 19977 B16R1.5624 CCOC(=O)CCC(=O)N1CCCCC1C 11a_100000211376_100000183558 [0,1,0,1,0,0|1,0,1]=4 19978 B16R1.5624 CCOC(=O)CCC(=O)N1CCCCC1C 1626a_100000211376_100000183558 [0,1,0,1,0,0|1,0,1]=4 19979 B16R1.5624 CCOC(=O)CCC(=O)N1CCCCC1C 240690a_100000211376_100000183558 [0,1,0,1,0,0|1,0,1]=4 19980 B16R1.5624 CCOC(=O)CCC(C)N1CCCCC1C 2230a_100000211376_100000748298 [0,1,0,1,0,0|1,0,0]=3 19981 B16R1.5624 CCOC(=O)CCC(C)N1CCCCC1C 269982a_100000211376_100000748298 [0,1,0,1,0,0|1,0,0]=3 19982 B16R1.5624 CCOC(=O)CCC(C)N1CCCCC1C 34a_100000211376_100000748298 [0,1,0,1,0,0|1,0,0]=3 19983 B16R1.5624 CCOC(=O)CCC(C)N1CCOC[C@@H]1C 2230a_100009815349_100000748298 [0,1,0,1,0,0|2,0,0]=4 19984 B16R1.5624 CCOC(=O)CCC(C)N1CCOC[C@@H]1C 269982a_100009815349_100000748298 [0,1,0,1,0,0|2,0,0]=4 19985 B16R1.5624 CCOC(=O)CCC(C)N1CCOC[C@@H]1C 34a_100009815349_100000748298 [0,1,0,1,0,0|2,0,0]=4 19986 B16R1.5624 CCOC(=O)CCN(C)C1CCCCC1F 269982a_100000745921_100015423560 [0,1,0,1,0,0|2,0,0]=4 19987 B16R1.5624 CCOC(=O)CCN(C)C1CCCCC1O 269982a_100000745921_100000038908 [0,1,0,1,0,0|2,0,0]=4 19988 B16R1.5624 CCOC(=O)CCN(C)[C@@H]1CCCC[C@H]1O 269982a_100000708425_100011206558 [0,1,0,1,0,0|2,0,0]=4 19989 B16R1.5624 CCOC(=O)CNC(=O)C1CCCCC1C 188690a_100000741813_100011215568 [0,1,0,1,0,0|1,0,1]=4 19990 B16R1.5626 CCOC(=O)CCC(C)OCCNC1CC1 34a_100000738766_100000748298 [0,1,0,1,0,0|2,0,0]=4 19991 B16R1.5626 CCOC(=O)CCC(C)SCCCC1CO1 62a_100000733510_100000748298 [0,1,0,1,0,0|2,0,0]=4 19992 B16R1.5626 CCOC(=O)CCC(C)SCCCC1CO1 62a_100000748298_100000733510 [0,1,0,1,0,0|2,0,0]=4 19993 B16R1.5631 CCOC(=O)CCC(C)OCCC1COC1 34a_100009855314_100000748298 [0,1,0,1,0,0|2,0,0]=4 19994 B16R1.5632 CCOC(=O)CCC(=O)N1CCCC1CC 11a_100000754278_100000183558 [0,1,0,1,0,0|1,0,1]=4 19995 B16R1.5632 CCOC(=O)CCC(=O)N1CCCC1CC 1626a_100000754278_100000183558 [0,1,0,1,0,0|1,0,1]=4 19996 B16R1.5632 CCOC(=O)CCC(=O)N1CCCC1CC 240690a_100000754278_100000183558 [0,1,0,1,0,0|1,0,1]=4 19997 B16R1.5632 CCOC(=O)CCC(C)N1CCCC1CC 2230a_100000754278_100000748298 [0,1,0,1,0,0|1,0,0]=3 19998 B16R1.5632 CCOC(=O)CCC(C)N1CCCC1CC 269982a_100000754278_100000748298 [0,1,0,1,0,0|1,0,0]=3 19999 B16R1.5632 CCOC(=O)CCC(C)N1CCCC1CC 34a_100000754278_100000748298 [0,1,0,1,0,0|1,0,0]=3 20000 B16R1.5632 CCOC(=O)CCC(C)N1CCC[C@@H]1CO 2230a_100000745186_100000748298 [0,1,0,1,0,0|2,0,0]=4 20001 B16R1.5632 CCOC(=O)CCC(C)N1CCC[C@@H]1CO 269982a_100000745186_100000748298 [0,1,0,1,0,0|2,0,0]=4 20002 B16R1.5632 CCOC(=O)CCC(C)N1CCC[C@@H]1CO 34a_100000745186_100000748298 [0,1,0,1,0,0|2,0,0]=4 20003 B16R1.5634 CCOC(=O)CCC(C)OC1CCCC1C 34a_100011216460_100000748298 [0,1,0,1,0,0|1,0,0]=3 20004 B16R1.5634 CCOC(=O)CCC(C)OC1CCCC1C 7a_100011216460_100000748298 [0,1,0,1,0,0|1,0,0]=3 20005 B16R1.5634 CCOC(=O)CCC(C)O[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000748298 [0,1,0,1,0,0|2,0,0]=4 20006 B16R1.5634 CCOC(=O)CCC(C)O[C@H]1CCC[C@@H]1N 34a_100000748460_100000748298 [0,1,0,1,0,0|2,0,0]=4 20007 B16R1.5634 CCOC(=O)CCC(C)O[C@H]1CNC[C@H]1C 34a_200015306588_100000748298 [0,1,0,1,0,0|2,0,0]=4 20008 B16R1.5634 CCOC(=O)CCC(C)S[C@@H]1CCC[C@H]1O 62a_100000748298_200016002552 [0,1,0,1,0,0|2,0,0]=4 20009 B16R1.5634 CCOC(=O)CCC(C)S[C@@H]1CCC[C@H]1O 62a_200016002552_100000748298 [0,1,0,1,0,0|2,0,0]=4 20010 B16R1.7605 CCCCCCCC(=O)CN1CCOC1=O 1458a_100011227918_100000210614 [0,1,0,1,0,0|1,0,1]=4 20011 B16R1.7605 CCCCCCCC(C)NC1CCNC1=O 2230a_100016995588_200011218727 [0,1,0,1,0,0|2,0,0]=4 20012 B16R1.7605 CCCCCCCC(C)NC1CCNC1=O 270004a_100016995588_100000210596 [0,1,0,1,0,0|2,0,0]=4 20013 B16R1.7605 CCCCCCCC(C)NC1CCNC1=O 34a_100016995588_200011218727 [0,1,0,1,0,0|2,0,0]=4 20014 B16R1.7605 CCCCCCCC(C)OC1CCCC1=O 34a_200000719330_200011218727 [0,1,0,1,0,0|2,0,0]=4 20015 B16R1.7605 CCCCCCCC(C)OC1CCCC1=O 34a_200011215852_100000709159 [0,1,0,1,0,0|2,0,0]=4 20016 B16R1.7605 CCCCCCCC(C)OC1CCCC1=O 7a_200011215852_100000211823 [0,1,0,1,0,0|2,0,0]=4 20017 B16R1.7605 CCCCCCCC(C)OC1CCOC1=O 34a_200011215852_100000211211 [0,1,0,1,0,0|1,0,0]=3 20018 B16R1.7605 CCCCCCCC(C)OC1CCOC1=O 7a_200011215852_100000211211 [0,1,0,1,0,0|1,0,0]=3 20019 B16R1.7605 CCCCCCCC(C)O[C@H]1CCNC1=O 34a_100000688343_200011218727 [0,1,0,1,0,0|2,0,0]=4 20020 B16R1.7605 CCCCCCCC(C)SC1CCCC1=O 62a_100000211823_200011218727 [0,1,0,1,0,0|2,0,0]=4 20021 B16R1.7605 CCCCCCCC(C)SC1CCCC1=O 62a_200011218727_100000211823 [0,1,0,1,0,0|2,0,0]=4 20022 B16R1.7605 CCCCCCCC(C)SC1CCOC1=O 62a_100000211211_200011218727 [0,1,0,1,0,0|1,0,0]=3 20023 B16R1.7605 CCCCCCCC(C)SC1CCOC1=O 62a_200011218727_100000211211 [0,1,0,1,0,0|1,0,0]=3 20024 B16R1.8578 CCCCCCCC(C)OCC(=O)C1CC1 34a_100000686663_200011218727 [0,1,0,1,0,0|2,0,0]=4 20025 B16R1.8578 CCCCCCCC(C)OCC(=O)C1CC1 34a_200011215852_100000746382 [0,1,0,1,0,0|2,0,0]=4 20026 B16R1.8578 CCCCCCCC(C)OCC(=O)C1CC1 7a_200011215852_100000746382 [0,1,0,1,0,0|2,0,0]=4 20027 B16R1.8578 CCCCCCCC(C)SCC(=O)C1CC1 62a_100000746382_200011218727 [0,1,0,1,0,0|2,0,0]=4 20028 B16R1.8578 CCCCCCCC(C)SCC(=O)C1CC1 62a_200011218727_100000746382 [0,1,0,1,0,0|2,0,0]=4 20029 B16R1.9294 CCOC(=O)CCC(C)N1CCC1COC 2230a_100015195929_100000748298 [0,1,0,1,0,0|2,0,0]=4 20030 B16R1.9294 CCOC(=O)CCC(C)N1CCC1COC 269982a_100015195929_100000748298 [0,1,0,1,0,0|2,0,0]=4 20031 B16R1.9294 CCOC(=O)CCC(C)N1CCC1COC 34a_100015195929_100000748298 [0,1,0,1,0,0|2,0,0]=4 20032 B16R1.13209 CCCN1CCCC(C1)NCC(=O)OCC 2230a_100011435248_100000188475 [0,1,0,1,0,0|2,0,0]=4 20033 B16R1.13209 CCOC(=O)CCN1CCCC(C1)CCO 2230a_100000752241_100011206558 [0,1,0,1,0,0|2,0,0]=4 20034 B16R1.13209 CCOC(=O)CCN1CCCC(C1)CCO 269982a_100000752241_100011206558 [0,1,0,1,0,0|2,0,0]=4 20035 B16R1.13209 CCOC(=O)CCN1CCCC(C1)CCO 34a_100000752241_100000765890 [0,1,0,1,0,0|2,0,0]=4 20036 B16R1.13209 CCOC(=O)CCN1CCCC(C1)COC 2230a_100000755410_100011206558 [0,1,0,1,0,0|2,0,0]=4 20037 B16R1.13209 CCOC(=O)CCN1CCCC(C1)COC 269982a_100000755410_100011206558 [0,1,0,1,0,0|2,0,0]=4 20038 B16R1.13209 CCOC(=O)CCN1CCCC(C1)COC 34a_100000755410_100000765890 [0,1,0,1,0,0|2,0,0]=4 20039 B16R1.13209 CCOC(=O)CCN1CCCC(C1)OCC 2230a_100000745229_100011206558 [0,1,0,1,0,0|2,0,0]=4 20040 B16R1.13209 CCOC(=O)CCN1CCCC(C1)OCC 269982a_100000745229_100011206558 [0,1,0,1,0,0|2,0,0]=4 20041 B16R1.13209 CCOC(=O)CCN1CCCC(C1)OCC 34a_100000745229_100000765890 [0,1,0,1,0,0|2,0,0]=4 20042 B16R1.13680 CCNC(=O)CCC(=O)CCC1CCCC1 1458a_100000199579_100000760354 [0,1,0,1,0,0|1,0,1]=4 20043 B16R1.13680 CCOC(=O)CCC(=O)CCC1CCCC1 1458a_100000183558_100000760354 [0,1,0,1,0,0|0,0,1]=3 20044 B16R1.13680 CCOC(=O)CCC(=O)CCN1CCCC1 1458a_100000183558_100000004467 [0,1,0,1,0,0|1,0,1]=4 20045 B16R1.13680 CCOC(=O)CCC(=O)NCC1CCCC1 11a_100000737975_100000183558 [0,1,0,1,0,0|1,0,1]=4 20046 B16R1.13680 CCOC(=O)CCC(=O)NCC1CCCC1 1626a_100000737975_100000183558 [0,1,0,1,0,0|1,0,1]=4 20047 B16R1.13680 CCOC(=O)CCC(=O)NCC1CCCC1 240690a_100000737975_100000183558 [0,1,0,1,0,0|1,0,1]=4 20048 B16R1.13680 CCOC(=O)CCC(C)NCC1CCCC1 2230a_100000737975_100000748298 [0,1,0,1,0,0|1,0,0]=3 20049 B16R1.13680 CCOC(=O)CCC(C)NCC1CCCC1 34a_100000737975_100000748298 [0,1,0,1,0,0|1,0,0]=3 20050 B16R1.13680 CCOC(=O)CCC(C)NCC1CCOC1 2230a_100000737293_100000748298 [0,1,0,1,0,0|2,0,0]=4 20051 B16R1.13680 CCOC(=O)CCC(C)NCC1CCOC1 34a_100000737293_100000748298 [0,1,0,1,0,0|2,0,0]=4 20052 B16R1.13680 CCOC(=O)CCC(C)NC[C@@H]1CCCO1 2230a_100020590478_100000748298 [0,1,0,1,0,0|2,0,0]=4 20053 B16R1.13680 CCOC(=O)CCC(C)NC[C@@H]1CCCO1 34a_100020590478_100000748298 [0,1,0,1,0,0|2,0,0]=4 20054 B16R1.13680 CCOC(=O)CCC(C)OCC1CCCC1 34a_100000742336_100000748298 [0,1,0,1,0,0|1,0,0]=3 20055 B16R1.13680 CCOC(=O)CCC(C)OCC1CCCC1 7a_100000742336_100000748298 [0,1,0,1,0,0|1,0,0]=3 20056 B16R1.13680 CCOC(=O)CCC(C)OCC1CCCO1 34a_100000210270_100000748298 [0,1,0,1,0,0|2,0,0]=4 20057 B16R1.13680 CCOC(=O)CCC(C)OCC1CCCO1 7a_100000210270_100000748298 [0,1,0,1,0,0|2,0,0]=4 20058 B16R1.13680 CCOC(=O)CCC(C)OCC1CCNC1 34a_100000748654_100000748298 [0,1,0,1,0,0|2,0,0]=4 20059 B16R1.13680 CCOC(=O)CCC(C)OCC1CCOC1 34a_100000740260_100000748298 [0,1,0,1,0,0|2,0,0]=4 20060 B16R1.13680 CCOC(=O)CCC(C)OC[C@H]1CCCN1 34a_100000745186_100000748298 [0,1,0,1,0,0|2,0,0]=4 20061 B16R1.13680 CCOC(=O)CCC(C)SCC1CCCC1 62a_100000740388_100000748298 [0,1,0,1,0,0|1,0,0]=3 20062 B16R1.13680 CCOC(=O)CCC(C)SCC1CCCC1 62a_100000748298_100000740388 [0,1,0,1,0,0|1,0,0]=3 20063 B16R1.13680 CCOC(=O)CCC(C)SCC1CCCO1 62a_100000203698_100000748298 [0,1,0,1,0,0|2,0,0]=4 20064 B16R1.13680 CCOC(=O)CCC(C)SCC1CCCO1 62a_100000748298_100000203698 [0,1,0,1,0,0|2,0,0]=4 20065 B16R1.13680 CCOC(=O)CCC(C)SCC1CCOC1 62a_100000702531_100000748298 [0,1,0,1,0,0|2,0,0]=4 20066 B16R1.13680 CCOC(=O)CCC(C)SCC1CCOC1 62a_100000748298_100000702531 [0,1,0,1,0,0|2,0,0]=4 20067 B16R1.13680 CCOC(=O)CCN(C)CCC1CCCC1 2230a_100000745921_100000760354 [0,1,0,1,0,0|1,0,0]=3 20068 B16R1.13680 CCOC(=O)CCN(C)CCC1CCCC1 269982a_100000745921_100000760354 [0,1,0,1,0,0|1,0,0]=3 20069 B16R1.13680 CCOC(=O)CCN(C)CCN1CCCC1 2230a_100000225677_100011206558 [0,1,0,1,0,0|2,0,0]=4 20070 B16R1.13680 CCOC(=O)CCN(C)CCN1CCCC1 269982a_100000225677_100011206558 [0,1,0,1,0,0|2,0,0]=4 20071 B16R1.13680 CCOC(=O)CCN(C)CCN1CCCC1 269982a_100000745921_100000004467 [0,1,0,1,0,0|2,0,0]=4 20072 B16R1.13680 CCOC(=O)CNC(=O)CCC1CCCC1 188690a_100000741813_100000211120 [0,1,0,1,0,0|1,0,1]=4 20073 B16R1.13680 CCOC(=O)NCC(=O)CCC1CCCC1 1458a_100000190774_100000760354 [0,1,0,1,0,0|1,0,1]=4 20074 B16R1.15027 CCCC(=O)OCN1CCCCCCCC1 2230a_100000039187_100000034017 [0,1,0,1,0,0|2,0,0]=4 20075 B16R1.15027 CCCC(=O)OCN1CCCCCCCC1 269982a_100000039187_100000034017 [0,1,0,1,0,0|2,0,0]=4 20076 B16R1.15027 CCCC(=O)OCN1CCCCCCCC1 34a_100000039187_100000034017 [0,1,0,1,0,0|2,0,0]=4 20077 B16R1.15027 CCNC(=O)CCN1CCCCCCCC1 2230a_100000039187_100000737597 [0,1,0,1,0,0|1,0,0]=3 20078 B16R1.15027 CCNC(=O)CCN1CCCCCCCC1 269982a_100000039187_100000737597 [0,1,0,1,0,0|1,0,0]=3 20079 B16R1.15027 CCNC(=O)CNC1CCCCCCCC1 270004a_100016988866_100000038600 [0,1,0,1,0,0|1,0,0]=3 20080 B16R1.15027 CCOC(=O)CCN1CCCCCCCC1 2230a_100000039187_100011206558 [0,1,0,1,0,0|0,0,0]=2 20081 B16R1.15027 CCOC(=O)CCN1CCCCCCCC1 269982a_100000039187_100011206558 [0,1,0,1,0,0|0,0,0]=2 20082 B16R1.15027 CCOC(=O)CCN1CCCCCCCC1 34a_100000039187_100000765890 [0,1,0,1,0,0|0,0,0]=2 20083 B16R1.20360 CCCCCN1C[C@@H](C[C@H]1C(=O)OCC)O 2230a_100020626377_100000210326 [0,1,0,1,0,0|1,0,0]=3 20084 B16R1.20360 CCCCCN1C[C@@H](C[C@H]1C(=O)OCC)O 269982a_100020626377_100000210215 [0,1,0,1,0,0|1,0,0]=3 20085 B16R1.20360 CCOC(=O)[C@@H]1C[C@H](CN1CCCCF)O 2230a_100020626377_100000729493 [0,1,0,1,0,0|2,0,0]=4 20086 B16R1.20360 CCOC(=O)[C@@H]1C[C@H](CN1CCCCF)O 269982a_100020626377_100000729493 [0,1,0,1,0,0|2,0,0]=4 20087 B16R1.20360 CCOC(=O)[C@@H]1C[C@H](CN1CCCCO)O 2230a_100020626377_100000210776 [0,1,0,1,0,0|2,0,0]=4 20088 B16R1.20360 CCOC(=O)[C@@H]1C[C@H](CN1CCCCO)O 269982a_100020626377_100000210776 [0,1,0,1,0,0|2,0,0]=4 20089 B16R1.20360 CCOC(=O)[C@@H]1C[C@H](CN1CCCOC)O 2230a_100020626377_100000740836 [0,1,0,1,0,0|2,0,0]=4 20090 B16R1.20360 CCOC(=O)[C@@H]1C[C@H](CN1CCCOC)O 269982a_100020626377_100000740836 [0,1,0,1,0,0|2,0,0]=4 20091 B16R1.20360 CCOC(=O)[C@@H]1C[C@H](CN1CCSCC)O 2230a_100020626377_100000757381 [0,1,0,1,0,0|2,0,0]=4 20092 B16R1.20360 CCOC(=O)[C@@H]1C[C@H](CN1CCSCC)O 269982a_100020626377_100000757381 [0,1,0,1,0,0|2,0,0]=4 20093 B16R1.20360 CCOCCN1C[C@@H](C[C@H]1C(=O)OCC)O 2230a_100020626377_100011215890 [0,1,0,1,0,0|2,0,0]=4 20094 B16R1.20360 CCOCCN1C[C@@H](C[C@H]1C(=O)OCC)O 269982a_100020626377_100011215890 [0,1,0,1,0,0|2,0,0]=4 20095 B16R1.31952 CCNC(=O)CCC(=O)C1CCCCCC1 1458a_100000199579_100011217769 [0,1,0,1,0,0|1,0,1]=4 20096 B16R1.31952 CCNC(=O)CCN(C)C1CCCCCC1 2230a_100015185097_100000737597 [0,1,0,1,0,0|2,0,0]=4 20097 B16R1.31952 CCNC(=O)CCN(C)C1CCCCCC1 269982a_100015185097_100000737597 [0,1,0,1,0,0|2,0,0]=4 20098 B16R1.31952 CCOC(=O)CCC(=O)C1CCCCCC1 1458a_100000183558_100011217769 [0,1,0,1,0,0|0,0,1]=3 20099 B16R1.31952 CCOC(=O)CCC(=O)N1CCCCCC1 11a_100000185865_100000183558 [0,1,0,1,0,0|1,0,1]=4 20100 B16R1.31952 CCOC(=O)CCC(=O)N1CCCCCC1 1626a_100000185865_100000183558 [0,1,0,1,0,0|1,0,1]=4 20101 B16R1.31952 CCOC(=O)CCC(=O)N1CCCCCC1 240690a_100000185865_100000183558 [0,1,0,1,0,0|1,0,1]=4 20102 B16R1.31952 CCOC(=O)CCC(C)N1CCCCCC1 2230a_100000185865_100000748298 [0,1,0,1,0,0|1,0,0]=3 20103 B16R1.31952 CCOC(=O)CCC(C)N1CCCCCC1 269982a_100000185865_100000748298 [0,1,0,1,0,0|1,0,0]=3 20104 B16R1.31952 CCOC(=O)CCC(C)N1CCCCCC1 34a_100000185865_100000748298 [0,1,0,1,0,0|1,0,0]=3 20105 B16R1.31952 CCOC(=O)CCC(C)N1CCCOCC1 2230a_100000685342_100000748298 [0,1,0,1,0,0|2,0,0]=4 20106 B16R1.31952 CCOC(=O)CCC(C)N1CCCOCC1 269982a_100000685342_100000748298 [0,1,0,1,0,0|2,0,0]=4 20107 B16R1.31952 CCOC(=O)CCC(C)N1CCCOCC1 34a_100000685342_100000748298 [0,1,0,1,0,0|2,0,0]=4 20108 B16R1.31952 CCOC(=O)CCN(C)C1CCCCCC1 2230a_100015185097_100011206558 [0,1,0,1,0,0|1,0,0]=3 20109 B16R1.31952 CCOC(=O)CCN(C)C1CCCCCC1 269982a_100000745921_100011217769 [0,1,0,1,0,0|1,0,0]=3 20110 B16R1.31952 CCOC(=O)CCN(C)C1CCCCCC1 269982a_100015185097_100011206558 [0,1,0,1,0,0|1,0,0]=3 20111 B16R1.31952 CCOC(=O)CCN(C)C1CCCCCC1 34a_100015185097_100000765890 [0,1,0,1,0,0|1,0,0]=3 20112 B16R1.31952 CCOC(=O)CNC(=O)C1CCCCCC1 188690a_100000741813_100000749507 [0,1,0,1,0,0|1,0,1]=4 20113 B16R1.31952 CCOC(=O)NCC(=O)C1CCCCCC1 1458a_100000190774_100011217769 [0,1,0,1,0,0|1,0,1]=4 20114 B16R1.52 CCCCCC(C)OCC1CCNC(=O)C1 34a_100009886756_200011218191 [0,1,0,1,0,0|2,0,0]=4 20115 B16R1.916 CCOC(=O)CCCCC(=O)C1CCCC1 1458a_100000210718_100000750268 [0,1,0,1,0,0|0,0,1]=3 20116 B16R1.916 CCOC(=O)CCCCC(=O)C1CCCC1 1458a_100011217402_100000179811 [0,1,0,1,0,0|0,0,1]=3 20117 B16R1.916 CCOC(=O)CCCCC(=O)C1CCCS1 1458a_100012002731_100000750268 [0,1,0,1,0,0|1,0,1]=4 20118 B16R1.916 CCOC(=O)CCCCC(=O)C1CCOC1 1458a_100011217402_100000690089 [0,1,0,1,0,0|1,0,1]=4 20119 B16R1.916 CCOC(=O)CCCCC(=O)C1CCOC1 1458a_100011219752_100000750268 [0,1,0,1,0,0|1,0,1]=4 20120 B16R1.916 CCOC(=O)CCCCC(=O)N1CCCC1 240690a_100000188435_100011217402 [0,1,0,1,0,0|1,0,1]=4 20121 B16R1.916 CCOC(=O)CCCCC(=O)N1CCCC1 527a_100000188435_100011217402 [0,1,0,1,0,0|1,0,1]=4 20122 B16R1.916 CCOC(=O)CCCCC(=O)[C@@H]1CCCO1 1458a_100000686382_100000750268 [0,1,0,1,0,0|1,0,1]=4 20123 B16R1.916 CCOC(=O)CCCCN(C)C1CCCC1 2230a_100000207505_100000750268 [0,1,0,1,0,0|1,0,0]=3 20124 B16R1.916 CCOC(=O)CCCCN(C)C1CCCC1 269982a_100000207505_100000750268 [0,1,0,1,0,0|1,0,0]=3 20125 B16R1.916 CCOC(=O)CCCCN(C)C1CCCC1 34a_100000207505_100000750268 [0,1,0,1,0,0|1,0,0]=3 20126 B16R1.916 CCOC(=O)CCCCN(C)C1CCOC1 2230a_100016988252_100000750268 [0,1,0,1,0,0|2,0,0]=4 20127 B16R1.916 CCOC(=O)CCCCN(C)C1CCOC1 269982a_100016988252_100000750268 [0,1,0,1,0,0|2,0,0]=4 20128 B16R1.916 CCOC(=O)CCCCN(C)C1CCOC1 34a_100016988252_100000750268 [0,1,0,1,0,0|2,0,0]=4 20129 B16R1.916 CCOC(=O)CCCNC(=O)C1CCCC1 188690a_100000211256_100000210718 [0,1,0,1,0,0|1,0,1]=4 20130 B16R1.916 CCOC(=O)CCCNC(C)C1CCCC1 2230a_100015185923_100009991533 [0,1,0,1,0,0|1,0,0]=3 20131 B16R1.916 CCOC(=O)CCCNC(C)C1CCCC1 34a_100015185923_100009991533 [0,1,0,1,0,0|1,0,0]=3 20132 B16R1.916 CCOC(=O)CCCNC(C)C1CCCO1 2230a_100025754208_100009991533 [0,1,0,1,0,0|2,0,0]=4 20133 B16R1.916 CCOC(=O)CCCNC(C)C1CCCO1 34a_100025754208_100009991533 [0,1,0,1,0,0|2,0,0]=4 20134 B16R1.916 CCOC(=O)CCCOC(C)C1CCCC1 34a_100011216366_100009991533 [0,1,0,1,0,0|1,0,0]=3 20135 B16R1.916 CCOC(=O)CCCOC(C)C1CCCC1 7a_100011216366_100011215271 [0,1,0,1,0,0|1,0,0]=3 20136 B16R1.916 CCOC(=O)CCSCC(C)N1CCCC1 62a_100000765890_200015187269 [0,1,0,1,0,0|2,0,0]=4 20137 B16R1.916 CCOC(=O)CCSCC(C)N1CCCC1 62a_200015187269_100000765890 [0,1,0,1,0,0|2,0,0]=4 20138 B16R1.916 CCOC(=O)COCCC(=O)C1CCCC1 1458a_100000210718_100000088970 [0,1,0,1,0,0|1,0,1]=4 20139 B16R1.916 CCOC(=O)COCCC(C)N1CCCC1 34a_100011935070_100000188475 [0,1,0,1,0,0|2,0,0]=4 20140 B16R1.916 CCOC(=O)COCCC(C)N1CCCC1 7a_100011935070_100000188475 [0,1,0,1,0,0|2,0,0]=4 20141 B16R1.916 CCOC(=O)COCCN(C)C1CCCC1 2230a_100000207505_100000088970 [0,1,0,1,0,0|2,0,0]=4 20142 B16R1.916 CCOC(=O)COCCN(C)C1CCCC1 269982a_100000207505_100000088970 [0,1,0,1,0,0|2,0,0]=4 20143 B16R1.916 CCOC(=O)COCCN(C)C1CCCC1 34a_100000207505_100000088970 [0,1,0,1,0,0|2,0,0]=4 20144 B16R1.916 CCOC(=O)NCCOC(C)C1CCCC1 7a_100011216366_200011445536 [0,1,0,1,0,0|2,0,0]=4 20145 B16R1.947 CCOC(=O)CCSC1CCCCCC1=O 62a_100000243696_100000765890 [0,1,0,1,0,0|1,0,1]=4 20146 B16R1.947 CCOC(=O)CCSC1CCCCCC1=O 62a_100000765890_100000243696 [0,1,0,1,0,0|1,0,1]=4 20147 B16R1.1412 CCCCCN1CCC[C@@H](C1)C(=O)OCC 2230a_100000759086_100000210326 [0,1,0,1,0,0|1,0,0]=3 20148 B16R1.1412 CCCCCN1CCC[C@@H](C1)C(=O)OCC 269982a_100000759086_100000210215 [0,1,0,1,0,0|1,0,0]=3 20149 B16R1.1412 CCCCCN1CCOC(C1)C(=O)OCC 2230a_100016995033_100000210326 [0,1,0,1,0,0|2,0,0]=4 20150 B16R1.1412 CCCCCN1CCOC(C1)C(=O)OCC 269982a_100016995033_100000210215 [0,1,0,1,0,0|2,0,0]=4 20151 B16R1.1412 CCCCNC1CCOC(C1)C(=O)OCC 270004a_100000102301_100010274582 [0,1,0,1,0,0|2,0,0]=4 20152 B16R1.1412 CCCCOC1CCCC(C1)C(=O)OCC 7a_100011934014_100000210211 [0,1,0,1,0,0|1,0,0]=3 20153 B16R1.1412 CCOC(=O)C1CCCC(C1)OCCCF 7a_100011934014_100011934791 [0,1,0,1,0,0|2,0,0]=4 20154 B16R1.1412 CCOC(=O)C1CCCC(C1)OCCCO 7a_100011934014_100011215043 [0,1,0,1,0,0|2,0,0]=4 20155 B16R1.1412 CCOC(=O)C1CCCC(C1)OCCOC 7a_100011934014_100000233755 [0,1,0,1,0,0|2,0,0]=4 20156 B16R1.1412 CCOC(=O)C1CCCC(C1)OCCSC 7a_100011934014_100000212216 [0,1,0,1,0,0|2,0,0]=4 20157 B16R1.1412 CCOC(=O)[C@H]1CCCN(C1)CCCCF 2230a_100000759086_100000729493 [0,1,0,1,0,0|2,0,0]=4 20158 B16R1.1412 CCOC(=O)[C@H]1CCCN(C1)CCCCF 269982a_100000759086_100000729493 [0,1,0,1,0,0|2,0,0]=4 20159 B16R1.1412 CCOC(=O)[C@H]1CCCN(C1)CCCCO 2230a_100000759086_100000210776 [0,1,0,1,0,0|2,0,0]=4 20160 B16R1.1412 CCOC(=O)[C@H]1CCCN(C1)CCCCO 269982a_100000759086_100000210776 [0,1,0,1,0,0|2,0,0]=4 20161 B16R1.1412 CCOC(=O)[C@H]1CCCN(C1)CCCOC 2230a_100000759086_100000740836 [0,1,0,1,0,0|2,0,0]=4 20162 B16R1.1412 CCOC(=O)[C@H]1CCCN(C1)CCCOC 269982a_100000759086_100000740836 [0,1,0,1,0,0|2,0,0]=4 20163 B16R1.1412 CCOC(=O)[C@H]1CCCN(C1)CCSCC 2230a_100000759086_100000757381 [0,1,0,1,0,0|2,0,0]=4 20164 B16R1.1412 CCOC(=O)[C@H]1CCCN(C1)CCSCC 269982a_100000759086_100000757381 [0,1,0,1,0,0|2,0,0]=4 20165 B16R1.1412 CCOCCN1CCC[C@@H](C1)C(=O)OCC 2230a_100000759086_100011215890 [0,1,0,1,0,0|2,0,0]=4 20166 B16R1.1412 CCOCCN1CCC[C@@H](C1)C(=O)OCC 269982a_100000759086_100011215890 [0,1,0,1,0,0|2,0,0]=4 20167 B16R1.9716 CCOC(=O)CCCCN1CC(C1)COC 2230a_100016993750_100000750268 [0,1,0,1,0,0|2,0,0]=4 20168 B16R1.9716 CCOC(=O)CCCCN1CC(C1)COC 269982a_100016993750_100000750268 [0,1,0,1,0,0|2,0,0]=4 20169 B16R1.9716 CCOC(=O)CCCCN1CC(C1)COC 34a_100016993750_100000750268 [0,1,0,1,0,0|2,0,0]=4 20170 B16R1.9716 CCOC(=O)CCCCN1CC(C1)OCC 269982a_100000732654_100000750268 [0,1,0,1,0,0|2,0,0]=4 20171 B16R1.9716 CCOC(=O)CCCCN1CC(C1)OCC 34a_100000732654_100000750268 [0,1,0,1,0,0|2,0,0]=4 20172 B16R1.9716 CCOC(=O)CCCNC1CC(C1)COC 2230a_100012180050_100009991533 [0,1,0,1,0,0|2,0,0]=4 20173 B16R1.15047 C=COC(=O)CNCCC1CCCCCC1 2230a_100011532351_100000036128 [0,1,0,1,0,0|0,0,2]=4 20174 B16R1.15047 C=COC(=O)CNCCC1CCCCCC1 34a_100011532351_100000036128 [0,1,0,1,0,0|0,0,2]=4 20175 B16R1.15047 CCCC(=O)CNCCC1CCCCCC1 2230a_100011532351_100000747444 [0,1,0,1,0,0|1,0,0]=3 20176 B16R1.15047 CCCC(=O)CSCCN1CCCCCC1 62a_100000722644_100000747444 [0,1,0,1,0,0|2,0,0]=4 20177 B16R1.15047 CCCC(=O)CSCCN1CCCCCC1 62a_100000747444_100000722644 [0,1,0,1,0,0|2,0,0]=4 20178 B16R1.15047 CCCC(=O)NCCCN1CCCCCC1 11a_100000181460_100000211992 [0,1,0,1,0,0|2,0,0]=4 20179 B16R1.15047 CCCC(=O)NCCCN1CCCCCC1 240690a_100000181460_100000211992 [0,1,0,1,0,0|2,0,0]=4 20180 B16R1.15047 CCCC(=O)NCCCN1CCCCCC1 527a_100000181460_100000211992 [0,1,0,1,0,0|2,0,0]=4 20181 B16R1.15047 CCCC(=O)OCNCC1CCCCCC1 2230a_100015204231_100000034017 [0,1,0,1,0,0|2,0,0]=4 20182 B16R1.15047 CCCC(=O)OCNCC1CCCCCC1 34a_100015204231_100000034017 [0,1,0,1,0,0|2,0,0]=4 20183 B16R1.15047 CCCC(=O)OCOCC1CCCCCC1 34a_100000699130_100000034017 [0,1,0,1,0,0|2,0,0]=4 20184 B16R1.15047 CCCC(=O)OCSCC1CCCCCC1 62a_200000696569_100000034017 [0,1,0,1,0,0|2,0,0]=4 20185 B16R1.15047 CCNC(=O)CCNCC1CCCCCC1 2230a_100015204231_100000737597 [0,1,0,1,0,0|1,0,0]=3 20186 B16R1.15047 CCNC(=O)CCNCC1CCCCCC1 269862a_100025743525_200000763224 [0,1,0,1,0,0|1,0,0]=3 20187 B16R1.15047 CCNC(=O)CCNCC1CCCCCC1 34a_100025743525_200000696569 [0,1,0,1,0,0|1,0,0]=3 20188 B16R1.15047 CCNC(=O)CCOCC1CCCCCC1 7a_100000699130_100000737597 [0,1,0,1,0,0|1,0,0]=3 20189 B16R1.15047 CCNC(=O)CCSCC1CCCCCC1 62a_100000737597_200000696569 [0,1,0,1,0,0|1,0,0]=3 20190 B16R1.15047 CCNC(=O)CCSCC1CCCCCC1 62a_200000696569_100000737597 [0,1,0,1,0,0|1,0,0]=3 20191 B16R1.15047 CCNC(=O)CNCCC1CCCCCC1 2230a_100011532351_100000183381 [0,1,0,1,0,0|1,0,0]=3 20192 B16R1.15047 CCNC(=O)CNCCC1CCCCCC1 34a_100011532351_100000183381 [0,1,0,1,0,0|1,0,0]=3 20193 B16R1.15047 CCNC(=O)COCCN1CCCCCC1 34a_100000238007_100000183381 [0,1,0,1,0,0|2,0,0]=4 20194 B16R1.15047 CCNC(=O)CSCCN1CCCCCC1 62a_100000183381_100000722644 [0,1,0,1,0,0|2,0,0]=4 20195 B16R1.15047 CCNC(=O)CSCCN1CCCCCC1 62a_100000722644_100000183381 [0,1,0,1,0,0|2,0,0]=4 20196 B16R1.15047 CCNC(=O)NCCCN1CCCCCC1 2708a_100015525214_100000181460 [0,1,0,1,0,0|2,0,0]=4 20197 B16R1.15047 CCNC(=O)NCCCN1CCCCCC1 273464a_100000181460_100015525214 [0,1,0,1,0,0|2,0,0]=4 20198 B16R1.15047 CCNC(=O)NCCCN1CCCCCC1 273464a_100015525214_100000181460 [0,1,0,1,0,0|2,0,0]=4 20199 B16R1.15047 CCNC(=O)NCCCN1CCCCCC1 512a_100000181460_100015525214 [0,1,0,1,0,0|2,0,0]=4 20200 B16R1.15047 CCNC(=O)NCCCN1CCCCCC1 512a_100015525214_100000181460 [0,1,0,1,0,0|2,0,0]=4 20201 B16R1.15047 CCOC(=O)/C=C/CNC1CCCCCC1 2230a_100000210984_100016267167 [0,1,0,1,0,0|0,0,2]=4 20202 B16R1.15047 CCOC(=O)/C=C/CNC1CCCCCC1 34a_100000210984_100016267167 [0,1,0,1,0,0|0,0,2]=4 20203 B16R1.15047 CCOC(=O)/C=C/COC1CCCCCC1 34a_100000210887_100016267167 [0,1,0,1,0,0|0,0,2]=4 20204 B16R1.15047 CCOC(=O)/C=C/COC1CCCCCC1 7a_100000210887_100016267167 [0,1,0,1,0,0|0,0,2]=4 20205 B16R1.15047 CCOC(=O)/C=C/CSC1CCCCCC1 62a_100011217769_100016267167 [0,1,0,1,0,0|0,0,2]=4 20206 B16R1.15047 CCOC(=O)/C=C/CSC1CCCCCC1 62a_100016267167_100011217769 [0,1,0,1,0,0|0,0,2]=4 20207 B16R1.15047 CCOC(=O)CCCCN1CCCCCC1 2230a_100000185865_100000750268 [0,1,0,1,0,0|0,0,0]=2 20208 B16R1.15047 CCOC(=O)CCCCN1CCCCCC1 269982a_100000185865_100000750268 [0,1,0,1,0,0|0,0,0]=2 20209 B16R1.15047 CCOC(=O)CCCCN1CCCCCC1 34a_100000185865_100000750268 [0,1,0,1,0,0|0,0,0]=2 20210 B16R1.15047 CCOC(=O)CCCCN1CCCOCC1 2230a_100000685342_100000750268 [0,1,0,1,0,0|1,0,0]=3 20211 B16R1.15047 CCOC(=O)CCCCN1CCCOCC1 269982a_100000685342_100000750268 [0,1,0,1,0,0|1,0,0]=3 20212 B16R1.15047 CCOC(=O)CCCCN1CCCOCC1 34a_100000685342_100000750268 [0,1,0,1,0,0|1,0,0]=3 20213 B16R1.15047 CCOC(=O)CCCNC1CCCCCC1 2230a_100000210984_100009991533 [0,1,0,1,0,0|0,0,0]=2 20214 B16R1.15047 CCOC(=O)CCCNC1CCCCCC1 34a_100000210984_100009991533 [0,1,0,1,0,0|0,0,0]=2 20215 B16R1.15047 CCOC(=O)CCCOC1CCCCCC1 34a_100000210887_100009991533 [0,1,0,1,0,0|0,0,0]=2 20216 B16R1.15047 CCOC(=O)CCCOC1CCCCCC1 7a_100000210887_100011215271 [0,1,0,1,0,0|0,0,0]=2 20217 B16R1.15047 CCOC(=O)CCCSC1CCCCCC1 62a_100009991533_100011217769 [0,1,0,1,0,0|0,0,0]=2 20218 B16R1.15047 CCOC(=O)CCCSC1CCCCCC1 62a_100011217769_100009991533 [0,1,0,1,0,0|0,0,0]=2 20219 B16R1.15047 CCOC(=O)CCNCC1CCCCCC1 2230a_100015204231_100011206558 [0,1,0,1,0,0|0,0,0]=2 20220 B16R1.15047 CCOC(=O)CCNCC1CCCCCC1 34a_100015204231_100000765890 [0,1,0,1,0,0|0,0,0]=2 20221 B16R1.15047 CCOC(=O)CCOCC1CCCCCC1 34a_100000699130_100000765890 [0,1,0,1,0,0|0,0,0]=2 20222 B16R1.15047 CCOC(=O)CCOCC1CCCCCC1 7a_100000699130_100011206558 [0,1,0,1,0,0|0,0,0]=2 20223 B16R1.15047 CCOC(=O)CCOCC1CNCCOC1 34a_100103147999_100000765890 [0,1,0,1,0,0|2,0,0]=4 20224 B16R1.15047 CCOC(=O)CCSCC1CCCCCC1 62a_100000765890_200000696569 [0,1,0,1,0,0|0,0,0]=2 20225 B16R1.15047 CCOC(=O)CCSCC1CCCCCC1 62a_200000696569_100000765890 [0,1,0,1,0,0|0,0,0]=2 20226 B16R1.15047 CCOC(=O)CNCCC1CCCCCC1 2230a_100011532351_100000188475 [0,1,0,1,0,0|0,0,0]=2 20227 B16R1.15047 CCOC(=O)CNCCC1CCCCCC1 34a_100011532351_100000188475 [0,1,0,1,0,0|0,0,0]=2 20228 B16R1.15047 CCOC(=O)COCCN1CCCCCC1 2230a_100000185865_100000088970 [0,1,0,1,0,0|1,0,0]=3 20229 B16R1.15047 CCOC(=O)COCCN1CCCCCC1 269982a_100000185865_100000088970 [0,1,0,1,0,0|1,0,0]=3 20230 B16R1.15047 CCOC(=O)COCCN1CCCCCC1 34a_100000185865_100000088970 [0,1,0,1,0,0|1,0,0]=3 20231 B16R1.15047 CCOC(=O)COCCN1CCCCCC1 34a_100000238007_100000188475 [0,1,0,1,0,0|1,0,0]=3 20232 B16R1.15047 CCOC(=O)COCCN1CCCOCC1 2230a_100000685342_100000088970 [0,1,0,1,0,0|2,0,0]=4 20233 B16R1.15047 CCOC(=O)COCCN1CCCOCC1 269982a_100000685342_100000088970 [0,1,0,1,0,0|2,0,0]=4 20234 B16R1.15047 CCOC(=O)COCCN1CCCOCC1 34a_100000685342_100000088970 [0,1,0,1,0,0|2,0,0]=4 20235 B16R1.15047 CCOC(=O)CSCCN1CCCCCC1 62a_100000188475_100000722644 [0,1,0,1,0,0|1,0,0]=3 20236 B16R1.15047 CCOC(=O)CSCCN1CCCCCC1 62a_100000722644_100000188475 [0,1,0,1,0,0|1,0,0]=3 20237 B16R1.15047 CCOC(=O)NCCOC1CCCCCC1 34a_100000158857_100011217769 [0,1,0,1,0,0|1,0,0]=3 20238 B16R1.15047 CCOC(=O)NCCOC1CCCCCC1 7a_100000210887_200011445536 [0,1,0,1,0,0|1,0,0]=3 20239 B16R1.15047 CCOC(=O)NCCSC1CCCCCC1 62a_100011217769_200011445536 [0,1,0,1,0,0|1,0,0]=3 20240 B16R1.15047 CCOC(=O)OCSCC1CCCCCC1 62a_200000696569_100000075025 [0,1,0,1,0,0|1,0,0]=3 20241 B16R1.15047 O=C(CNCCC1CCCCCC1)NCO 2230a_100011532351_100000185155 [0,1,0,1,0,0|2,0,0]=4 20242 B16R1.15047 O=C(CNCCC1CCCCCC1)NCO 34a_100011532351_100000185155 [0,1,0,1,0,0|2,0,0]=4 20243 B16R1.15055 CCOC(=O)CCCCN1CCC(C1)CO 2230a_100000748654_100000750268 [0,1,0,1,0,0|2,0,0]=4 20244 B16R1.15055 CCOC(=O)CCCCN1CCC(C1)CO 269982a_100000748654_100000750268 [0,1,0,1,0,0|2,0,0]=4 20245 B16R1.15055 CCOC(=O)CCCCN1CCC(C1)CO 34a_100000748654_100000750268 [0,1,0,1,0,0|2,0,0]=4 20246 B16R1.15055 CCOC(=O)CCCCN1CC[C@H](C1)OC 2230a_100000766984_100000750268 [0,1,0,1,0,0|2,0,0]=4 20247 B16R1.15055 CCOC(=O)CCCCN1CC[C@H](C1)OC 269982a_100000766984_100000750268 [0,1,0,1,0,0|2,0,0]=4 20248 B16R1.15055 CCOC(=O)CCCNC1CCN(C1)CC 2230a_100015188829_100009991533 [0,1,0,1,0,0|2,0,0]=4 20249 B16R1.15055 CCOC(=O)CCCOC1CCN(C1)CC 7a_100012001163_200011861547 [0,1,0,1,0,0|2,0,0]=4 20250 B16R1.15055 CCOC(=O)CCCSC1CCN(C1)CC 62a_100009991533_200011861547 [0,1,0,1,0,0|2,0,0]=4 20251 B16R1.15055 CCOC(=O)CCNCC1CCN(C1)CC 2230a_100011224064_100011206558 [0,1,0,1,0,0|2,0,0]=4 20252 B16R1.15055 CCOC(=O)CCNC[C@@H]1CC[C@@H](C1)CO 34a_206354213956_100000765890 [0,1,0,1,0,0|2,0,0]=4 20253 B16R1.15055 CCOC(=O)CCOC[C@H]1CC[C@H](C1)CN 34a_206354213956_100000765890 [0,1,0,1,0,0|2,0,0]=4 20254 B16R1.15055 CCOC(=O)CCSCC1CCN(C1)CC 62a_100000765890_100015184589 [0,1,0,1,0,0|2,0,0]=4 20255 B16R1.15055 CCOC(=O)CCSCC1CCN(C1)CC 62a_100015184589_100000765890 [0,1,0,1,0,0|2,0,0]=4 20256 B16R1.15153 CCOC(=O)CCCCC(=O)C1CC1CC 1458a_200011661523_100000750268 [0,1,0,1,0,0|0,0,1]=3 20257 B16R1.15153 CCOC(=O)CCCNC(=O)C1CC1CC 188690a_100000211256_200011661523 [0,1,0,1,0,0|1,0,1]=4 20258 B16R1.15153 CCOC(=O)COCCC(=O)C1CC1CC 1458a_200011661523_100000088970 [0,1,0,1,0,0|1,0,1]=4 20259 B16R1.15155 CCOC(=O)CCCCC(=O)CC1CCC1 1458a_100000763092_100000750268 [0,1,0,1,0,0|0,0,1]=3 20260 B16R1.15155 CCOC(=O)CCCCC(=O)CC1CCC1 1458a_100011217402_100000763275 [0,1,0,1,0,0|0,0,1]=3 20261 B16R1.15155 CCOC(=O)CCCCC(=O)CC1CCO1 1458a_100011217402_100000103362 [0,1,0,1,0,0|1,0,1]=4 20262 B16R1.15155 CCOC(=O)CCCCC(=O)CC1COC1 1458a_100000687760_100000750268 [0,1,0,1,0,0|1,0,1]=4 20263 B16R1.15155 CCOC(=O)CCCCC(=O)CC1COC1 1458a_100011217402_100010264016 [0,1,0,1,0,0|1,0,1]=4 20264 B16R1.15155 CCOC(=O)CCCCC(=O)NC1CCC1 11a_100000749019_100011217402 [0,1,0,1,0,0|1,0,1]=4 20265 B16R1.15155 CCOC(=O)CCCCC(=O)NC1CCC1 1626a_100000749019_100011217402 [0,1,0,1,0,0|1,0,1]=4 20266 B16R1.15155 CCOC(=O)CCCCC(=O)NC1CCC1 240690a_100000749019_100011217402 [0,1,0,1,0,0|1,0,1]=4 20267 B16R1.15155 CCOC(=O)CCCCC(=O)NC1CCC1 527a_100000749019_100011217402 [0,1,0,1,0,0|1,0,1]=4 20268 B16R1.15155 CCOC(=O)CCCCN(C)CC1CCC1 2230a_200000750244_100000750268 [0,1,0,1,0,0|1,0,0]=3 20269 B16R1.15155 CCOC(=O)CCCCN(C)CC1CCC1 269982a_200000750244_100000750268 [0,1,0,1,0,0|1,0,0]=3 20270 B16R1.15155 CCOC(=O)CCCCN(C)CC1CCC1 34a_200000750244_100000750268 [0,1,0,1,0,0|1,0,0]=3 20271 B16R1.15155 CCOC(=O)CCCNC(=O)CC1CCC1 188690a_100000211256_100000763092 [0,1,0,1,0,0|1,0,1]=4 20272 B16R1.15155 CCOC(=O)COCCC(=O)CC1CCC1 1458a_100000763092_100000088970 [0,1,0,1,0,0|1,0,1]=4 20273 B16R1.15155 CCOC(=O)COCCN(C)CC1CCC1 2230a_200000750244_100000088970 [0,1,0,1,0,0|2,0,0]=4 20274 B16R1.15155 CCOC(=O)COCCN(C)CC1CCC1 269982a_200000750244_100000088970 [0,1,0,1,0,0|2,0,0]=4 20275 B16R1.15155 CCOC(=O)COCCN(C)CC1CCC1 34a_200000750244_100000088970 [0,1,0,1,0,0|2,0,0]=4 20276 B16R1.15156 CCOC(=O)CCCCC(=O)CCC1CC1 1458a_100000756386_100000750268 [0,1,0,1,0,0|0,0,1]=3 20277 B16R1.15156 CCOC(=O)CCCCC(=O)CCC1CC1 1458a_100011217402_100000694398 [0,1,0,1,0,0|0,0,1]=3 20278 B16R1.15156 CCOC(=O)CCCCC(=O)CCC1CO1 1458a_100011217402_100000732470 [0,1,0,1,0,0|1,0,1]=4 20279 B16R1.15156 CCOC(=O)CCCCC(=O)NCC1CC1 11a_100000735609_100011217402 [0,1,0,1,0,0|1,0,1]=4 20280 B16R1.15156 CCOC(=O)CCCCC(=O)NCC1CC1 1626a_100000735609_100011217402 [0,1,0,1,0,0|1,0,1]=4 20281 B16R1.15156 CCOC(=O)CCCCC(=O)NCC1CC1 240690a_100000735609_100011217402 [0,1,0,1,0,0|1,0,1]=4 20282 B16R1.15156 CCOC(=O)CCCCC(=O)NCC1CC1 527a_100000735609_100011217402 [0,1,0,1,0,0|1,0,1]=4 20283 B16R1.15156 CCOC(=O)CCCNC(=O)CCC1CC1 188690a_100000211256_100000756386 [0,1,0,1,0,0|1,0,1]=4 20284 B16R1.15156 CCOC(=O)COCCC(=O)CCC1CC1 1458a_100000756386_100000088970 [0,1,0,1,0,0|1,0,1]=4 20285 B16R1.15157 CCOC(=O)CCCCC(=O)N1CCC1C 11a_100000755817_100011217402 [0,1,0,1,0,0|1,0,1]=4 20286 B16R1.15157 CCOC(=O)CCCCC(=O)N1CCC1C 240690a_100000755817_100011217402 [0,1,0,1,0,0|1,0,1]=4 20287 B16R1.15157 CCOC(=O)CCCCC(=O)N1CCC1C 527a_100000755817_100011217402 [0,1,0,1,0,0|1,0,1]=4 20288 B16R1.20316 CCCCCN1CC[C@@H](C1)CC(=O)OCC 2230a_106256037354_100000210326 [0,1,0,1,0,0|1,0,0]=3 20289 B16R1.20316 CCCCCN1CC[C@@H](C1)CC(=O)OCC 269982a_106256037354_100000210215 [0,1,0,1,0,0|1,0,0]=3 20290 B16R1.20316 CCCOCC1CCN(C1)CC(=O)OCC 2230a_200011652792_100000188475 [0,1,0,1,0,0|2,0,0]=4 20291 B16R1.20316 CCCOCC1CCN(C1)CC(=O)OCC 269982a_200011652792_100000188475 [0,1,0,1,0,0|2,0,0]=4 20292 B16R1.20316 CCCOCC1CCN(C1)CC(=O)OCC 34a_200011652792_100000188475 [0,1,0,1,0,0|2,0,0]=4 20293 B16R1.20316 CCOC(=O)C[C@H]1CCN(C1)CCCCF 2230a_106256037354_100000729493 [0,1,0,1,0,0|2,0,0]=4 20294 B16R1.20316 CCOC(=O)C[C@H]1CCN(C1)CCCCF 269982a_106256037354_100000729493 [0,1,0,1,0,0|2,0,0]=4 20295 B16R1.20316 CCOC(=O)C[C@H]1CCN(C1)CCCCO 2230a_106256037354_100000210776 [0,1,0,1,0,0|2,0,0]=4 20296 B16R1.20316 CCOC(=O)C[C@H]1CCN(C1)CCCCO 269982a_106256037354_100000210776 [0,1,0,1,0,0|2,0,0]=4 20297 B16R1.20316 CCOC(=O)C[C@H]1CCN(C1)CCCOC 2230a_106256037354_100000740836 [0,1,0,1,0,0|2,0,0]=4 20298 B16R1.20316 CCOC(=O)C[C@H]1CCN(C1)CCCOC 269982a_106256037354_100000740836 [0,1,0,1,0,0|2,0,0]=4 20299 B16R1.20316 CCOC(=O)C[C@H]1CCN(C1)CCSCC 2230a_106256037354_100000757381 [0,1,0,1,0,0|2,0,0]=4 20300 B16R1.20316 CCOC(=O)C[C@H]1CCN(C1)CCSCC 269982a_106256037354_100000757381 [0,1,0,1,0,0|2,0,0]=4 20301 B16R1.20316 CCOCCN1CC[C@@H](C1)CC(=O)OCC 2230a_106256037354_100011215890 [0,1,0,1,0,0|2,0,0]=4 20302 B16R1.20316 CCOCCN1CC[C@@H](C1)CC(=O)OCC 269982a_106256037354_100011215890 [0,1,0,1,0,0|2,0,0]=4 20303 B16R1.69740 CCCC(=O)CNCCC1(CCCCC1)O 2230a_100102740465_100000747444 [0,1,0,1,0,0|2,0,0]=4 20304 B16R1.69740 CCNC(=O)CCNCC1(CCCCC1)C 2230a_100000706052_100000737597 [0,1,0,1,0,0|2,0,0]=4 20305 B16R1.69740 CCNC(=O)CCNCC1(CCCCC1)C 269862a_100025743525_100011935227 [0,1,0,1,0,0|2,0,0]=4 20306 B16R1.69740 CCNC(=O)CCNCC1(CCCCC1)O 2230a_100000748649_100000737597 [0,1,0,1,0,0|2,0,0]=4 20307 B16R1.69740 CCNC(=O)CCOCC1(CCCCC1)C 7a_100000688186_100000737597 [0,1,0,1,0,0|2,0,0]=4 20308 B16R1.69740 CCNC(=O)CCOCC1(CCCCC1)F 7a_100000090305_100000737597 [0,1,0,1,0,0|2,0,0]=4 20309 B16R1.69740 CCNC(=O)CNCCC1(CCCCC1)O 2230a_100102740465_100000183381 [0,1,0,1,0,0|2,0,0]=4 20310 B16R1.69740 CCNC(=O)CNCCC1(CCCCC1)O 34a_100102740465_100000183381 [0,1,0,1,0,0|2,0,0]=4 20311 B16R1.69740 CCOC(=O)CCCNC1(CCCCC1)C 2230a_100000741114_100009991533 [0,1,0,1,0,0|1,0,0]=3 20312 B16R1.69740 CCOC(=O)CCCNC1(CCCCC1)C 34a_100000741114_100009991533 [0,1,0,1,0,0|1,0,0]=3 20313 B16R1.69740 CCOC(=O)CCCNC1(CCOCC1)C 2230a_100000692449_100009991533 [0,1,0,1,0,0|2,0,0]=4 20314 B16R1.69740 CCOC(=O)CCCNC1(CCOCC1)C 34a_100000692449_100009991533 [0,1,0,1,0,0|2,0,0]=4 20315 B16R1.69740 CCOC(=O)CCCOC1(CCCCC1)C 34a_100011215885_100009991533 [0,1,0,1,0,0|1,0,0]=3 20316 B16R1.69740 CCOC(=O)CCCOC1(CCCCC1)C 7a_100011215885_100011215271 [0,1,0,1,0,0|1,0,0]=3 20317 B16R1.69740 CCOC(=O)CCCOC1(CCOCC1)C 34a_100011827762_100009991533 [0,1,0,1,0,0|2,0,0]=4 20318 B16R1.69740 CCOC(=O)CCCOC1(CCOCC1)C 7a_100011827762_100011215271 [0,1,0,1,0,0|2,0,0]=4 20319 B16R1.69740 CCOC(=O)CCCOC1(CCSCC1)C 34a_200011004327_100009991533 [0,1,0,1,0,0|2,0,0]=4 20320 B16R1.69740 CCOC(=O)CCCOC1(CCSCC1)C 7a_200011004327_100011215271 [0,1,0,1,0,0|2,0,0]=4 20321 B16R1.69740 CCOC(=O)CCNCC1(CCCCC1)C 2230a_100000706052_100011206558 [0,1,0,1,0,0|1,0,0]=3 20322 B16R1.69740 CCOC(=O)CCNCC1(CCCCC1)C 34a_100000706052_100000765890 [0,1,0,1,0,0|1,0,0]=3 20323 B16R1.69740 CCOC(=O)CCNCC1(CCCCC1)O 2230a_100000748649_100011206558 [0,1,0,1,0,0|1,0,0]=3 20324 B16R1.69740 CCOC(=O)CCNCC1(CCCCC1)O 34a_100000748649_100000765890 [0,1,0,1,0,0|1,0,0]=3 20325 B16R1.69740 CCOC(=O)CCNCC1(CCOCC1)C 2230a_100000695556_100011206558 [0,1,0,1,0,0|2,0,0]=4 20326 B16R1.69740 CCOC(=O)CCNCC1(CCOCC1)C 34a_100000695556_100000765890 [0,1,0,1,0,0|2,0,0]=4 20327 B16R1.69740 CCOC(=O)CCNCC1(CCOCC1)F 2230a_100016991512_100011206558 [0,1,0,1,0,0|2,0,0]=4 20328 B16R1.69740 CCOC(=O)CCNCC1(CCOCC1)F 34a_100016991512_100000765890 [0,1,0,1,0,0|2,0,0]=4 20329 B16R1.69740 CCOC(=O)CCNCC1(CCOCC1)O 2230a_100000704115_100011206558 [0,1,0,1,0,0|2,0,0]=4 20330 B16R1.69740 CCOC(=O)CCNCC1(CCOCC1)O 34a_100000704115_100000765890 [0,1,0,1,0,0|2,0,0]=4 20331 B16R1.69740 CCOC(=O)CCNCC1(CCSCC1)O 2230a_100000758141_100011206558 [0,1,0,1,0,0|2,0,0]=4 20332 B16R1.69740 CCOC(=O)CCOCC1(CCCCC1)C 34a_100000688186_100000765890 [0,1,0,1,0,0|1,0,0]=3 20333 B16R1.69740 CCOC(=O)CCOCC1(CCCCC1)C 7a_100000688186_100011206558 [0,1,0,1,0,0|1,0,0]=3 20334 B16R1.69740 CCOC(=O)CCOCC1(CCCCC1)F 34a_100000090305_100000765890 [0,1,0,1,0,0|1,0,0]=3 20335 B16R1.69740 CCOC(=O)CCOCC1(CCCCC1)F 7a_100000090305_100011206558 [0,1,0,1,0,0|1,0,0]=3 20336 B16R1.69740 CCOC(=O)CCOCC1(CCCCC1)N 34a_100000740034_100000765890 [0,1,0,1,0,0|1,0,0]=3 20337 B16R1.69740 CCOC(=O)CCOCC1(CCNCC1)F 34a_100016990393_100000765890 [0,1,0,1,0,0|2,0,0]=4 20338 B16R1.69740 CCOC(=O)CCOCC1(CCOCC1)C 34a_100000704393_100000765890 [0,1,0,1,0,0|2,0,0]=4 20339 B16R1.69740 CCOC(=O)CCOCC1(CCOCC1)C 7a_100000704393_100011206558 [0,1,0,1,0,0|2,0,0]=4 20340 B16R1.69740 CCOC(=O)CCOCC1(CCOCC1)N 34a_100000751404_100000765890 [0,1,0,1,0,0|2,0,0]=4 20341 B16R1.69740 CCOC(=O)CNCCC1(CCCCC1)O 2230a_100102740465_100000188475 [0,1,0,1,0,0|1,0,0]=3 20342 B16R1.69740 CCOC(=O)CNCCC1(CCCCC1)O 34a_100102740465_100000188475 [0,1,0,1,0,0|1,0,0]=3 20343 B16R1.69740 CCOC(=O)NCCOC1(CCCCC1)C 7a_100011215885_200011445536 [0,1,0,1,0,0|2,0,0]=4 20344 B16R1.91316 CCNC(=O)CCNC1C(CCCC1C)C 269862a_100025743525_100000211995 [0,1,0,1,0,0|2,0,0]=4 20345 B16R1.91316 CCNC(=O)CCOC1C(CCCC1C)C 7a_100011218088_100000737597 [0,1,0,1,0,0|2,0,0]=4 20346 B16R1.91316 CCOC(=O)CCCN1C(CCCC1C)C 2230a_100000210447_100009991533 [0,1,0,1,0,0|1,0,0]=3 20347 B16R1.91316 CCOC(=O)CCCN1C(CCCC1C)C 269982a_100000210447_100009991533 [0,1,0,1,0,0|1,0,0]=3 20348 B16R1.91316 CCOC(=O)CCCN1C(CCCC1C)C 34a_100000210447_100009991533 [0,1,0,1,0,0|1,0,0]=3 20349 B16R1.91316 CCOC(=O)CCCN1[C@@H](COC[C@@H]1C)C 2230a_100103153222_100009991533 [0,1,0,1,0,0|2,0,0]=4 20350 B16R1.91316 CCOC(=O)CCCN1[C@@H](COC[C@@H]1C)C 269982a_100103153222_100009991533 [0,1,0,1,0,0|2,0,0]=4 20351 B16R1.91316 CCOC(=O)CCCN1[C@@H](COC[C@@H]1C)C 34a_100103153222_100009991533 [0,1,0,1,0,0|2,0,0]=4 20352 B16R1.91316 CCOC(=O)CCOC1C(CCCC1C)C 34a_100011218088_100000765890 [0,1,0,1,0,0|1,0,0]=3 20353 B16R1.91316 CCOC(=O)CCOC1C(CCCC1C)C 7a_100011218088_100011206558 [0,1,0,1,0,0|1,0,0]=3 20354 B16R1.91316 CCOC(=O)NCCN1C(CCCC1C)C 269982a_100000210447_200011445536 [0,1,0,1,0,0|2,0,0]=4 20355 B16R1.105086 CCOC(=O)CCCO[C@@]1(CCC[C@H]1N)C 34a_100015977457_100009991533 [0,1,0,1,0,0|2,0,0]=4 20356 B16R1.295 CCCC1CCCCN1CC(=O)N(C)CC 2230a_100000701414_100000738999 [0,1,0,1,0,0|2,0,0]=4 20357 B16R1.295 CCCC1CCCCN1CC(=O)N(C)CC 269982a_100000701414_100000738999 [0,1,0,1,0,0|2,0,0]=4 20358 B16R1.295 CCCC1CCCCN1CC(=O)N(C)CC 34a_100000701414_100000738999 [0,1,0,1,0,0|2,0,0]=4 20359 B16R1.1368 CCC1CCCCC1OCC(=O)N(C)CC 34a_100000210738_100000738999 [0,1,0,1,0,0|2,0,0]=4 20360 B16R1.1368 CCC1CCCCC1OCC(=O)N(C)CC 7a_100000210738_100000738999 [0,1,0,1,0,0|2,0,0]=4 20361 B16R1.1635 CCC(C)C(=O)CCCCC1CCCCC1 1458a_200011215547_100000758301 [0,1,0,1,0,0|1,0,0]=3 20362 B16R1.1635 CCC(C)C(=O)CCCCN1CCCCC1 1458a_100000754417_100000758301 [0,1,0,1,0,0|2,0,0]=4 20363 B16R1.1635 CCC(C)C(=O)NCCCC1CCCCC1 11a_100011211642_100011192722 [0,1,0,1,0,0|2,0,0]=4 20364 B16R1.1635 CCC(C)C(=O)NCCCC1CCCCC1 1626a_100011211642_100011192722 [0,1,0,1,0,0|2,0,0]=4 20365 B16R1.1635 CCC(C)C(=O)NCCCC1CCCCC1 240690a_100011211642_100011192722 [0,1,0,1,0,0|2,0,0]=4 20366 B16R1.1635 CCC(C)C(=O)NCCCC1CCCCC1 527a_100011211642_100011192722 [0,1,0,1,0,0|2,0,0]=4 20367 B16R1.1635 CCC(O)C(=O)NCCCC1CCCCC1 240690a_100011211642_100011196387 [0,1,0,1,0,0|2,0,0]=4 20368 B16R1.1635 CCN(C)C(=O)CCCCC1CCCCC1 11a_100000225621_200011215547 [0,1,0,1,0,0|1,0,0]=3 20369 B16R1.1635 CCN(C)C(=O)CCCCC1CCCCC1 1626a_100000225621_200011215547 [0,1,0,1,0,0|1,0,0]=3 20370 B16R1.1635 CCN(C)C(=O)CCCCC1CCCCC1 240690a_100000225621_200011215547 [0,1,0,1,0,0|1,0,0]=3 20371 B16R1.1635 CCN(C)C(=O)CCCCC1CCCCC1 527a_100000225621_200011215547 [0,1,0,1,0,0|1,0,0]=3 20372 B16R1.1635 CCN(C)C(=O)CCCCN1CCCCC1 11a_100000225621_100000754417 [0,1,0,1,0,0|2,0,0]=4 20373 B16R1.1635 CCN(C)C(=O)CCCCN1CCCCC1 240690a_100000225621_100000754417 [0,1,0,1,0,0|2,0,0]=4 20374 B16R1.1635 CCN(C)C(=O)CNCCC1CCCCC1 2230a_100000738074_100000738999 [0,1,0,1,0,0|2,0,0]=4 20375 B16R1.1635 CCN(C)C(=O)CNCCC1CCCCC1 34a_100000738074_100000738999 [0,1,0,1,0,0|2,0,0]=4 20376 B16R1.1635 CCN(C)C(=O)COCCC1CCCCC1 34a_100011217863_100000738999 [0,1,0,1,0,0|2,0,0]=4 20377 B16R1.1635 CCN(C)C(=O)COCCC1CCCCC1 7a_100011217863_100000738999 [0,1,0,1,0,0|2,0,0]=4 20378 B16R1.1635 CCN(C)C(=O)CSCCC1CCCCC1 62a_100000738999_100012355289 [0,1,0,1,0,0|2,0,0]=4 20379 B16R1.1635 CCN(C)C(=O)CSCCC1CCCCC1 62a_100012355289_100000738999 [0,1,0,1,0,0|2,0,0]=4 20380 B16R1.1635 CCN(C)C(=O)NCCCC1CCCCC1 2708a_100011211642_100000225621 [0,1,0,1,0,0|2,0,0]=4 20381 B16R1.1635 CCN(C)C(=O)NCCCC1CCCCC1 273464a_100011211642_100000225621 [0,1,0,1,0,0|2,0,0]=4 20382 B16R1.1648 CCN(C)C(=O)CNCCCC1CCCC1 2230a_100000736752_100000738999 [0,1,0,1,0,0|2,0,0]=4 20383 B16R1.1648 CCN(C)C(=O)CNCCCC1CCCC1 34a_100000736752_100000738999 [0,1,0,1,0,0|2,0,0]=4 20384 B16R1.1648 CCN(C)C(=O)COCCCC1CCCC1 34a_100011215328_100000738999 [0,1,0,1,0,0|2,0,0]=4 20385 B16R1.1648 CCN(C)C(=O)COCCCC1CCCC1 7a_100011215328_100000738999 [0,1,0,1,0,0|2,0,0]=4 20386 B16R1.1648 CCN(C)C(=O)CSCCCC1CCCC1 62a_100000738999_100011713738 [0,1,0,1,0,0|2,0,0]=4 20387 B16R1.1648 CCN(C)C(=O)CSCCCC1CCCC1 62a_100011713738_100000738999 [0,1,0,1,0,0|2,0,0]=4 20388 B16R1.2611 CCC(C)C(=O)CCN1CCCCCCC1 1458a_200015187237_100000758301 [0,1,0,1,0,0|2,0,0]=4 20389 B16R1.2611 CCN(C)C(=O)CCN1CCCCCCC1 240690a_100000225621_200015187237 [0,1,0,1,0,0|2,0,0]=4 20390 B16R1.2611 CCN(C)C(=O)CNC1CCCCCCC1 2230a_100000211152_100000738999 [0,1,0,1,0,0|2,0,0]=4 20391 B16R1.2611 CCN(C)C(=O)CNC1CCCCCCC1 34a_100000211152_100000738999 [0,1,0,1,0,0|2,0,0]=4 20392 B16R1.2611 CCN(C)C(=O)COC1CCCCCCC1 34a_100000210054_100000738999 [0,1,0,1,0,0|2,0,0]=4 20393 B16R1.2611 CCN(C)C(=O)COC1CCCCCCC1 7a_100000210054_100000738999 [0,1,0,1,0,0|2,0,0]=4 20394 B16R1.2741 CCC(C)C(=O)NCCC1CCCCCC1 11a_100011532351_100011192722 [0,1,0,1,0,0|2,0,0]=4 20395 B16R1.2741 CCC(C)C(=O)NCCC1CCCCCC1 1626a_100011532351_100011192722 [0,1,0,1,0,0|2,0,0]=4 20396 B16R1.2741 CCC(C)C(=O)NCCC1CCCCCC1 240690a_100011532351_100011192722 [0,1,0,1,0,0|2,0,0]=4 20397 B16R1.2741 CCC(C)C(=O)NCCC1CCCCCC1 527a_100011532351_100011192722 [0,1,0,1,0,0|2,0,0]=4 20398 B16R1.2741 CCC(O)C(=O)NCCC1CCCCCC1 240690a_100011532351_100011196387 [0,1,0,1,0,0|2,0,0]=4 20399 B16R1.2741 CCN(C)C(=O)CNCC1CCCCCC1 2230a_100015204231_100000738999 [0,1,0,1,0,0|2,0,0]=4 20400 B16R1.2741 CCN(C)C(=O)CNCC1CCCCCC1 34a_100015204231_100000738999 [0,1,0,1,0,0|2,0,0]=4 20401 B16R1.2741 CCN(C)C(=O)COCC1CCCCCC1 34a_100000699130_100000738999 [0,1,0,1,0,0|2,0,0]=4 20402 B16R1.2741 CCN(C)C(=O)COCC1CCCCCC1 7a_100000699130_100000738999 [0,1,0,1,0,0|2,0,0]=4 20403 B16R1.2741 CCN(C)C(=O)CSCC1CCCCCC1 62a_100000738999_200000696569 [0,1,0,1,0,0|2,0,0]=4 20404 B16R1.2741 CCN(C)C(=O)CSCC1CCCCCC1 62a_200000696569_100000738999 [0,1,0,1,0,0|2,0,0]=4 20405 B16R1.2741 CCN(C)C(=O)NCCC1CCCCCC1 2708a_100011532351_100000225621 [0,1,0,1,0,0|2,0,0]=4 20406 B16R1.2741 CCN(C)C(=O)NCCC1CCCCCC1 273464a_100011532351_100000225621 [0,1,0,1,0,0|2,0,0]=4 20407 B16R1.2882 CCN(C)C(=O)CN1CCCCCCCC1 2230a_100000039187_100000738999 [0,1,0,1,0,0|2,0,0]=4 20408 B16R1.2882 CCN(C)C(=O)CN1CCCCCCCC1 269982a_100000039187_100000738999 [0,1,0,1,0,0|2,0,0]=4 20409 B16R1.2882 CCN(C)C(=O)CN1CCCCCCCC1 34a_100000039187_100000738999 [0,1,0,1,0,0|2,0,0]=4 20410 B16R1.6680 C#CCCCCCCCOC1CCOC1=O 34a_100000054614_100000211211 [0,1,0,1,0,0|0,0,2]=4 20411 B16R1.6680 C#CCCCCCCCOC1CCOC1=O 7a_100000054614_100000211211 [0,1,0,1,0,0|0,0,2]=4 20412 B16R1.6680 C#CCCCCCCCSC1CCOC1=O 62a_100000211211_100153394163 [0,1,0,1,0,0|0,0,2]=4 20413 B16R1.6680 C#CCCCCCCCSC1CCOC1=O 62a_100153394163_100000211211 [0,1,0,1,0,0|0,0,2]=4 20414 B16R1.6680 C=CCCCCCCCOC1CCOC1=O 34a_100000730831_100000211211 [0,1,0,1,0,0|0,0,2]=4 20415 B16R1.6680 C=CCCCCCCCOC1CCOC1=O 7a_100000730831_100000211211 [0,1,0,1,0,0|0,0,2]=4 20416 B16R1.6680 C=CCCCCCCCSC1CCOC1=O 62a_100000211211_100012355270 [0,1,0,1,0,0|0,0,2]=4 20417 B16R1.6680 C=CCCCCCCCSC1CCOC1=O 62a_100012355270_100000211211 [0,1,0,1,0,0|0,0,2]=4 20418 B16R1.6680 CC/C=C\CCCCCOC1CCOC1=O 34a_100016268722_100000211211 [0,1,0,1,0,0|0,0,2]=4 20419 B16R1.6680 CC/C=C\CCCCCOC1CCOC1=O 7a_100016268722_100000211211 [0,1,0,1,0,0|0,0,2]=4 20420 B16R1.6680 CCCCC#CCCCSC1CCOC1=O 62a_100000211211_200000047210 [0,1,0,1,0,0|0,0,2]=4 20421 B16R1.6680 CCCCC#CCCCSC1CCOC1=O 62a_200000047210_100000211211 [0,1,0,1,0,0|0,0,2]=4 20422 B16R1.6680 CCCCC/C=C\CCOC1CCOC1=O 34a_100016277358_100000211211 [0,1,0,1,0,0|0,0,2]=4 20423 B16R1.6680 CCCCC/C=C\CCOC1CCOC1=O 7a_100016277358_100000211211 [0,1,0,1,0,0|0,0,2]=4 20424 B16R1.6680 CCCCCC#CCCOC1CCOC1=O 34a_200000042877_100000211211 [0,1,0,1,0,0|0,0,2]=4 20425 B16R1.6680 CCCCCC#CCCOC1CCOC1=O 7a_200000042877_100000211211 [0,1,0,1,0,0|0,0,2]=4 20426 B16R1.6680 CCCCCC/C=C/COC1CCOC1=O 34a_200016276170_100000211211 [0,1,0,1,0,0|0,0,2]=4 20427 B16R1.6680 CCCCCC/C=C/COC1CCOC1=O 7a_200016276170_100000211211 [0,1,0,1,0,0|0,0,2]=4 20428 B16R1.6680 CCCCCCC#CCOC1CCOC1=O 34a_200000037284_100000211211 [0,1,0,1,0,0|0,0,2]=4 20429 B16R1.6680 CCCCCCC#CCOC1CCOC1=O 7a_200000037284_100000211211 [0,1,0,1,0,0|0,0,2]=4 20430 B16R1.6680 CCCCCCCCCNC1CCCC1=O 2230a_100000212291_100000211823 [0,1,0,1,0,0|1,0,0]=3 20431 B16R1.6680 CCCCCCCCCNC1CCCC1=O 34a_100000212291_100000709159 [0,1,0,1,0,0|1,0,0]=3 20432 B16R1.6680 CCCCCCCCCNC1CCNC1=O 2230a_100016995588_100011214924 [0,1,0,1,0,0|1,0,0]=3 20433 B16R1.6680 CCCCCCCCCNC1CCNC1=O 34a_100016995588_100011214924 [0,1,0,1,0,0|1,0,0]=3 20434 B16R1.6680 CCCCCCCCCNC1CCOC1=O 2230a_100000212291_100000211211 [0,1,0,1,0,0|0,0,0]=2 20435 B16R1.6680 CCCCCCCCCNC1CCOC1=O 34a_100000212291_100000211211 [0,1,0,1,0,0|0,0,0]=2 20436 B16R1.6680 CCCCCCCCCNC1CCOC1C 270004a_100000212291_100000691750 [0,1,0,1,0,0|1,0,1]=4 20437 B16R1.6680 CCCCCCCCCN[C@@H]1CONC1=O 2230a_100000765999_100011214924 [0,1,0,1,0,0|2,0,0]=4 20438 B16R1.6680 CCCCCCCCCN[C@@H]1CONC1=O 34a_100000765999_100011214924 [0,1,0,1,0,0|2,0,0]=4 20439 B16R1.6680 CCCCCCCCCOC1CCCC1=O 34a_100000210712_100000709159 [0,1,0,1,0,0|1,0,0]=3 20440 B16R1.6680 CCCCCCCCCOC1CCCC1=O 34a_200000719330_100011214924 [0,1,0,1,0,0|1,0,0]=3 20441 B16R1.6680 CCCCCCCCCOC1CCCC1=O 7a_100000210712_100000211823 [0,1,0,1,0,0|1,0,0]=3 20442 B16R1.6680 CCCCCCCCCOC1CCOC1=O 34a_100000210712_100000211211 [0,1,0,1,0,0|0,0,0]=2 20443 B16R1.6680 CCCCCCCCCOC1CCOC1=O 7a_100000210712_100000211211 [0,1,0,1,0,0|0,0,0]=2 20444 B16R1.6680 CCCCCCCCCO[C@H]1CCNC1=O 34a_100000688343_100011214924 [0,1,0,1,0,0|1,0,0]=3 20445 B16R1.6680 CCCCCCCCCSC1CCCC1=O 62a_100000211823_100000210670 [0,1,0,1,0,0|1,0,0]=3 20446 B16R1.6680 CCCCCCCCCSC1CCOC1=O 62a_100000211211_100000210670 [0,1,0,1,0,0|0,0,0]=2 20447 B16R1.6680 CCCCCCCCOCC1=CCCC1=O 34a_100000087531_100000210759 [0,1,0,1,0,0|2,0,0]=4 20448 B16R1.6680 CCCCCCCCOCC1CCNC1=O 34a_100000133458_100000210759 [0,1,0,1,0,0|1,0,0]=3 20449 B16R1.6680 CCCCCCCCSCN1CCCC1=O 62a_100000026320_100000210317 [0,1,0,1,0,0|2,0,0]=4 20450 B16R1.6680 CCCCCCCCSCN1CCCC1=O 62a_100000210759_100000026320 [0,1,0,1,0,0|2,0,0]=4 20451 B16R1.6680 CCCCCCCNCCN1CCCC1=O 2230a_100000229938_100000739059 [0,1,0,1,0,0|2,0,0]=4 20452 B16R1.6680 CCCCCCCNCCN1CCCC1=O 2230a_100011200922_100000210681 [0,1,0,1,0,0|2,0,0]=4 20453 B16R1.6680 CCCCCCCNCCN1CCNC1=O 2230a_100000229938_100000090651 [0,1,0,1,0,0|2,0,0]=4 20454 B16R1.6680 CCCCCCCNCCN1CCNC1=O 2230a_100011207550_100000210681 [0,1,0,1,0,0|2,0,0]=4 20455 B16R1.6680 CCCCCCCOCCN1CCCC1=O 34a_100000210272_100000739059 [0,1,0,1,0,0|2,0,0]=4 20456 B16R1.6680 CCCCCCCOCCN1CCCC1=O 34a_100000211209_100000210614 [0,1,0,1,0,0|2,0,0]=4 20457 B16R1.6680 CCCCCCCOCCN1CCCC1=O 7a_100000210272_100000739059 [0,1,0,1,0,0|2,0,0]=4 20458 B16R1.6680 CCCCCCCOCCN1CCCC1=O 7a_100000211209_100000210614 [0,1,0,1,0,0|2,0,0]=4 20459 B16R1.6680 CCCCCCCOCCN1CCNC1=O 34a_100000216532_100000210614 [0,1,0,1,0,0|2,0,0]=4 20460 B16R1.6680 CCCCCCCOCCN1CCNC1=O 7a_100000210272_100000090651 [0,1,0,1,0,0|2,0,0]=4 20461 B16R1.6680 CCCCCCCSCCN1CCCC1=O 62a_100000210614_100000739059 [0,1,0,1,0,0|2,0,0]=4 20462 B16R1.6680 CCCCCCCSCCN1CCCC1=O 62a_100000739059_100000210316 [0,1,0,1,0,0|2,0,0]=4 20463 B16R1.6680 CCCCCCCSCCN1CCNC1=O 62a_100000090651_100000210316 [0,1,0,1,0,0|2,0,0]=4 20464 B16R1.6680 CCCCCCCSCCN1CCNC1=O 62a_100000210614_100000090651 [0,1,0,1,0,0|2,0,0]=4 20465 B16R1.6680 CCCCCCNCCCN1CCCC1=O 2230a_100000210347_100000210314 [0,1,0,1,0,0|2,0,0]=4 20466 B16R1.6680 CCCCCCNCCCN1CCCC1=O 34a_100000210347_100000210314 [0,1,0,1,0,0|2,0,0]=4 20467 B16R1.6680 CCCCCCOCCCN1CCCC1=O 34a_100011216539_100000210314 [0,1,0,1,0,0|2,0,0]=4 20468 B16R1.6680 CCCCCCOCCCN1CCCC1=O 7a_100011216539_100000210314 [0,1,0,1,0,0|2,0,0]=4 20469 B16R1.6680 CCCCCCOCCOC1CCCC1=O 34a_100000691444_100000709159 [0,1,0,1,0,0|2,0,0]=4 20470 B16R1.6680 CCCCCCOCCOC1CCCC1=O 7a_100000691444_100000211823 [0,1,0,1,0,0|2,0,0]=4 20471 B16R1.6680 CCCCCCOCCOC1CCOC1=O 34a_100000691444_100000211211 [0,1,0,1,0,0|1,0,0]=3 20472 B16R1.6680 CCCCCCOCCOC1CCOC1=O 7a_100000691444_100000211211 [0,1,0,1,0,0|1,0,0]=3 20473 B16R1.6680 CCCCNCCCCOC1CCCC1=O 34a_200011216965_100000709159 [0,1,0,1,0,0|2,0,0]=4 20474 B16R1.6680 CCCCNCCCCOC1CCOC1=O 34a_200011216965_100000211211 [0,1,0,1,0,0|1,0,0]=3 20475 B16R1.6680 CCCCOCCCCOC1CCCC1=O 34a_200000760531_100000709159 [0,1,0,1,0,0|2,0,0]=4 20476 B16R1.6680 CCCCOCCCCOC1CCCC1=O 7a_200000760531_100000211823 [0,1,0,1,0,0|2,0,0]=4 20477 B16R1.6680 CCCCOCCCCOC1CCOC1=O 34a_200000760531_100000211211 [0,1,0,1,0,0|1,0,0]=3 20478 B16R1.6680 CCCCOCCCCOC1CCOC1=O 7a_200000760531_100000211211 [0,1,0,1,0,0|1,0,0]=3 20479 B16R1.6680 CCCOCCOCCNC1CCOC1=O 2230a_200011904461_100000211211 [0,1,0,1,0,0|2,0,0]=4 20480 B16R1.6680 CCCOCCOCCNC1CCOC1=O 34a_200011904461_100000211211 [0,1,0,1,0,0|2,0,0]=4 20481 B16R1.6680 COCCCCCCOCC1CCNC1=O 34a_100000133458_100011998445 [0,1,0,1,0,0|2,0,0]=4 20482 B16R1.6680 COCCCOCCCOC1CCOC1=O 34a_200011215475_100000211211 [0,1,0,1,0,0|2,0,0]=4 20483 B16R1.6680 COCCCOCCCOC1CCOC1=O 7a_200011215475_100000211211 [0,1,0,1,0,0|2,0,0]=4 20484 B16R1.6680 NCCCCCCCCOC1CCCC1=O 34a_102515433106_100000709159 [0,1,0,1,0,0|2,0,0]=4 20485 B16R1.6680 NCCCCCCCCOC1CCOC1=O 34a_102515433106_100000211211 [0,1,0,1,0,0|1,0,0]=3 20486 B16R1.6680 NCCNCCCCCOC1CCOC1=O 34a_103619048469_100000211211 [0,1,0,1,0,0|2,0,0]=4 20487 B16R1.6680 O=C1CCCC1NCCCCCCCCO 2230a_102515433106_100000211823 [0,1,0,1,0,0|2,0,0]=4 20488 B16R1.6680 O=C1CCCC1NCCCCCCCCO 34a_102515433106_100000709159 [0,1,0,1,0,0|2,0,0]=4 20489 B16R1.6680 O=C1CCCC1OCCCCCCCCBr 34a_100009813846_100000709159 [0,1,0,1,0,0|2,0,0]=4 20490 B16R1.6680 O=C1CCCC1OCCCCCCCCBr 7a_100009813846_100000211823 [0,1,0,1,0,0|2,0,0]=4 20491 B16R1.6680 O=C1CCCC1OCCCCCCCCCl 34a_100000033203_100000709159 [0,1,0,1,0,0|2,0,0]=4 20492 B16R1.6680 O=C1CCCC1OCCCCCCCCCl 7a_100000033203_100000211823 [0,1,0,1,0,0|2,0,0]=4 20493 B16R1.6680 O=C1CCCC1OCCCCCCCCO 34a_200000719330_100000033203 [0,1,0,1,0,0|2,0,0]=4 20494 B16R1.6680 O=C1CCCC1SCCCCCCCCO 62a_100000033203_100000211823 [0,1,0,1,0,0|2,0,0]=4 20495 B16R1.6680 O=C1CCCC1SCCCCCCCCO 62a_100000211823_100000033203 [0,1,0,1,0,0|2,0,0]=4 20496 B16R1.6680 O=C1NCCC1COCCCCCCCO 34a_100000133458_100000760002 [0,1,0,1,0,0|2,0,0]=4 20497 B16R1.6680 O=C1NCCC1NCCCCCCCCO 2230a_100016995588_100000033203 [0,1,0,1,0,0|2,0,0]=4 20498 B16R1.6680 O=C1NCCC1NCCCCCCCCO 34a_100016995588_100000033203 [0,1,0,1,0,0|2,0,0]=4 20499 B16R1.6680 O=C1NCC[C@@H]1OCCCCCCCCO 34a_100000688343_100000033203 [0,1,0,1,0,0|2,0,0]=4 20500 B16R1.6680 O=C1OCCC1NCCCCCCCCO 2230a_102515433106_100000211211 [0,1,0,1,0,0|1,0,0]=3 20501 B16R1.6680 O=C1OCCC1NCCCCCCCCO 34a_102515433106_100000211211 [0,1,0,1,0,0|1,0,0]=3 20502 B16R1.6680 O=C1OCCC1OCCCCCCCCBr 34a_100009813846_100000211211 [0,1,0,1,0,0|1,0,0]=3 20503 B16R1.6680 O=C1OCCC1OCCCCCCCCBr 7a_100009813846_100000211211 [0,1,0,1,0,0|1,0,0]=3 20504 B16R1.6680 O=C1OCCC1OCCCCCCCCCl 34a_100000033203_100000211211 [0,1,0,1,0,0|1,0,0]=3 20505 B16R1.6680 O=C1OCCC1OCCCCCCCCCl 7a_100000033203_100000211211 [0,1,0,1,0,0|1,0,0]=3 20506 B16R1.6680 O=C1OCCC1SCCCCCCCCO 62a_100000033203_100000211211 [0,1,0,1,0,0|1,0,0]=3 20507 B16R1.6680 O=C1OCCC1SCCCCCCCCO 62a_100000211211_100000033203 [0,1,0,1,0,0|1,0,0]=3 20508 B16R1.6686 CCCCCCCNC1CC(=O)N(C1)CC 2230a_100015184948_100000210681 [0,1,0,1,0,0|2,0,0]=4 20509 B16R1.6686 CCCCCCCNC1CC(=O)N(C1)CC 34a_100015184948_100000210614 [0,1,0,1,0,0|2,0,0]=4 20510 B16R1.6686 CCCCCCNCC1CC(=O)N(C1)CC 2230a_100011935115_100000210314 [0,1,0,1,0,0|2,0,0]=4 20511 B16R1.6686 CCCCCCNCC1CC(=O)N(C1)CC 34a_100011935115_100000210314 [0,1,0,1,0,0|2,0,0]=4 20512 B16R1.6686 CCCCCCOCC1CC(=O)N(C1)CC 34a_100000758270_100000210314 [0,1,0,1,0,0|2,0,0]=4 20513 B16R1.6686 CCCCCCOCC1CC(=O)N(C1)CC 7a_100000758270_100000210314 [0,1,0,1,0,0|2,0,0]=4 20514 B16R1.17547 CCCCCCCCNC1CCN(C1=O)C 2230a_100000229939_100000755940 [0,1,0,1,0,0|2,0,0]=4 20515 B16R1.17547 CCCCCCCCNC1CCN(C1=O)C 34a_100000229939_100000755940 [0,1,0,1,0,0|2,0,0]=4 20516 B16R1.17547 CCCCCCCCOC1CCN(C1=O)C 34a_100000210232_100000755940 [0,1,0,1,0,0|2,0,0]=4 20517 B16R1.17547 CCCCCCCCOC1CCN(C1=O)C 7a_100000210232_100000755940 [0,1,0,1,0,0|2,0,0]=4 20518 B16R1.17547 CCCCCCCCSC1CCN(C1=O)C 62a_100000210759_100000755940 [0,1,0,1,0,0|2,0,0]=4 20519 B16R1.17547 CCCCCCCCSC1CCN(C1=O)C 62a_100000755940_100000210317 [0,1,0,1,0,0|2,0,0]=4 20520 B16R1.17547 CCCCCCCOCC1CCN(C1=O)C 34a_100009823153_100000210614 [0,1,0,1,0,0|2,0,0]=4 20521 B16R1.18042 C=CCCCCCCCCC(=O)C1CCO1 1458a_100000089072_100011933949 [0,1,0,1,0,0|0,0,2]=4 20522 B16R1.18042 CCC#CCCCCCCC(=O)C1CCO1 1458a_100000089072_200000036426 [0,1,0,1,0,0|0,0,2]=4 20523 B16R1.18042 CCCCCCCCCCC(=O)C1CCC1 1458a_100000209988_100000210319 [0,1,0,1,0,0|1,0,0]=3 20524 B16R1.18042 CCCCCCCCCCC(=O)C1CCC1 1458a_100000210375_100000749161 [0,1,0,1,0,0|1,0,0]=3 20525 B16R1.18042 CCCCCCCCCCC(=O)C1CCO1 1458a_100000089072_100000210319 [0,1,0,1,0,0|0,0,0]=2 20526 B16R1.18042 CCCCCCCCCCC(=O)C1COC1 1458a_100000210375_100000687716 [0,1,0,1,0,0|1,0,0]=3 20527 B16R1.18042 CCCCCCCCCCC(=O)C1COC1 1458a_100000758290_100000210319 [0,1,0,1,0,0|1,0,0]=3 20528 B16R1.18042 CCCCCCCCCCC(=O)N1CCC1 11a_100000754969_100000210375 [0,1,0,1,0,0|1,0,0]=3 20529 B16R1.18042 CCCCCCCCCCC(=O)N1CCC1 240690a_100000754969_100000210375 [0,1,0,1,0,0|1,0,0]=3 20530 B16R1.18042 CCCCCCCCCNC(=O)C1CCC1 11a_100000212291_100000209988 [0,1,0,1,0,0|2,0,0]=4 20531 B16R1.18042 CCCCCCCCCNC(=O)C1CCC1 1626a_100000212291_100000209988 [0,1,0,1,0,0|2,0,0]=4 20532 B16R1.18042 CCCCCCCCCNC(=O)C1CCC1 240690a_100000212291_100000209988 [0,1,0,1,0,0|2,0,0]=4 20533 B16R1.18042 CCCCCCCCCNC(=O)C1CCC1 527a_100000212291_100000209988 [0,1,0,1,0,0|2,0,0]=4 20534 B16R1.18042 CCCCCCCCCNC(=O)C1CCO1 11a_100000212291_100000089072 [0,1,0,1,0,0|1,0,0]=3 20535 B16R1.18042 CCCCCCCCCNC(=O)C1CCO1 1626a_100000212291_100000089072 [0,1,0,1,0,0|1,0,0]=3 20536 B16R1.18042 CCCCCCCCCNC(=O)C1CCO1 240690a_100000212291_100000089072 [0,1,0,1,0,0|1,0,0]=3 20537 B16R1.18042 CCCCCCCCCNC(=O)C1CCO1 527a_100000212291_100000089072 [0,1,0,1,0,0|1,0,0]=3 20538 B16R1.18042 CCCCCCCCCNC(=O)C1COC1 11a_100000212291_100000758290 [0,1,0,1,0,0|2,0,0]=4 20539 B16R1.18042 CCCCCCCCCNC(=O)C1COC1 1626a_100000212291_100000758290 [0,1,0,1,0,0|2,0,0]=4 20540 B16R1.18042 CCCCCCCCCNC(=O)C1COC1 240690a_100000212291_100000758290 [0,1,0,1,0,0|2,0,0]=4 20541 B16R1.18042 CCCCCCCCCNC(=O)C1COC1 527a_100000212291_100000758290 [0,1,0,1,0,0|2,0,0]=4 20542 B16R1.18042 CCCCCCCCCNC(=O)N1CCC1 2708a_100000212291_100000754969 [0,1,0,1,0,0|2,0,0]=4 20543 B16R1.18042 CCCCCCCCCNC(=O)N1CCC1 273464a_100000212291_100000754969 [0,1,0,1,0,0|2,0,0]=4 20544 B16R1.18042 CCCCCCCCNCC(=O)C1CCC1 2230a_100000229939_100000686122 [0,1,0,1,0,0|2,0,0]=4 20545 B16R1.18042 CCCCCCCCNCC(=O)C1CCC1 34a_100000229939_100000686122 [0,1,0,1,0,0|2,0,0]=4 20546 B16R1.18042 CCCCCCCCNCC(=O)N1CCC1 2230a_100000229939_100000185095 [0,1,0,1,0,0|2,0,0]=4 20547 B16R1.18042 CCCCCCCCNCC(=O)N1CCC1 34a_100000229939_100000185095 [0,1,0,1,0,0|2,0,0]=4 20548 B16R1.18042 CCCCCCCCOCC(=O)C1CCC1 1458a_100000759886_100000749161 [0,1,0,1,0,0|2,0,0]=4 20549 B16R1.18042 CCCCCCCCOCC(=O)C1CCC1 34a_100000210232_100000686122 [0,1,0,1,0,0|2,0,0]=4 20550 B16R1.18042 CCCCCCCCOCC(=O)C1CCC1 7a_100000210232_100000686122 [0,1,0,1,0,0|2,0,0]=4 20551 B16R1.18042 CCCCCCCCOCC(=O)C1COC1 1458a_100000759886_100000687716 [0,1,0,1,0,0|2,0,0]=4 20552 B16R1.18042 CCCCCCCCOCC(=O)N1CCC1 11a_100000754969_100000759886 [0,1,0,1,0,0|2,0,0]=4 20553 B16R1.18042 CCCCCCCCOCC(=O)N1CCC1 240690a_100000754969_100000759886 [0,1,0,1,0,0|2,0,0]=4 20554 B16R1.18042 CCCCCCCCOCC(=O)N1CCC1 34a_100000210232_100000185095 [0,1,0,1,0,0|2,0,0]=4 20555 B16R1.18042 CCCCCCCCOCC(=O)N1CCC1 527a_100000754969_100000759886 [0,1,0,1,0,0|2,0,0]=4 20556 B16R1.18042 CCCCCCCCOCC(=O)N1CCC1 7a_100000210232_100000185095 [0,1,0,1,0,0|2,0,0]=4 20557 B16R1.18042 CCCCCCCCSCC(=O)C1CCC1 62a_100000210759_100000686122 [0,1,0,1,0,0|2,0,0]=4 20558 B16R1.18042 CCCCCCCCSCC(=O)C1CCC1 62a_100000686122_100000210317 [0,1,0,1,0,0|2,0,0]=4 20559 B16R1.18042 CCCCCCCCSCC(=O)N1CCC1 62a_100000185095_100000210317 [0,1,0,1,0,0|2,0,0]=4 20560 B16R1.18042 CCCCCCCCSCC(=O)N1CCC1 62a_100000210759_100000185095 [0,1,0,1,0,0|2,0,0]=4 20561 B16R1.18042 O=C(CCCCCCCCCF)C1CCC1 1458a_200009909015_100000749161 [0,1,0,1,0,0|2,0,0]=4 20562 B16R1.18042 O=C(CCCCCCCCCF)C1COC1 1458a_200009909015_100000687716 [0,1,0,1,0,0|2,0,0]=4 20563 B16R1.18042 O=C(CCCCCCCCCF)N1CCC1 11a_100000754969_200009909015 [0,1,0,1,0,0|2,0,0]=4 20564 B16R1.18042 O=C(CCCCCCCCCF)N1CCC1 240690a_100000754969_200009909015 [0,1,0,1,0,0|2,0,0]=4 20565 B16R1.18042 O=C(CCCCCCCCCF)N1CCC1 527a_100000754969_200009909015 [0,1,0,1,0,0|2,0,0]=4 20566 B16R1.18042 O=C(CCCCCCCCCO)C1CCC1 1458a_100000209988_100009813782 [0,1,0,1,0,0|2,0,0]=4 20567 B16R1.18042 O=C(CCCCCCCCCO)C1CCO1 1458a_100000089072_100009813782 [0,1,0,1,0,0|1,0,0]=3 20568 B16R1.18042 O=C(CCCCCCCCCO)C1COC1 1458a_100000758290_100009813782 [0,1,0,1,0,0|2,0,0]=4 20569 B16R1.18042 O=C(CCCCCCCCCO)N1CCC1 240690a_100000754969_100000032657 [0,1,0,1,0,0|2,0,0]=4 20570 B16R1.18042 O=C(NCCCCCCCCO)C1CCO1 240690a_102515433106_100000089072 [0,1,0,1,0,0|2,0,0]=4 20571 B16R1.18043 CC1(CC1)C(=O)CCCCCCCCCO 1458a_100000756474_100009813782 [0,1,0,1,0,0|2,0,0]=4 20572 B16R1.18043 CCCCCCCCCCC(=O)C1(CC1)C 1458a_100000756474_100000210319 [0,1,0,1,0,0|1,0,0]=3 20573 B16R1.18043 CCCCCCCCCCC(=O)C1(CC1)F 1458a_100000055089_100000210319 [0,1,0,1,0,0|1,0,0]=3 20574 B16R1.18043 CCCCCCCCCCC(=O)C1(CC1)O 1458a_100000241761_100000210319 [0,1,0,1,0,0|1,0,0]=3 20575 B16R1.18043 CCCCCCCCCNC(=O)C1(CC1)C 11a_100000212291_100000756474 [0,1,0,1,0,0|2,0,0]=4 20576 B16R1.18043 CCCCCCCCCNC(=O)C1(CC1)C 1626a_100000212291_100000756474 [0,1,0,1,0,0|2,0,0]=4 20577 B16R1.18043 CCCCCCCCCNC(=O)C1(CC1)C 240690a_100000212291_100000756474 [0,1,0,1,0,0|2,0,0]=4 20578 B16R1.18043 CCCCCCCCCNC(=O)C1(CC1)C 527a_100000212291_100000756474 [0,1,0,1,0,0|2,0,0]=4 20579 B16R1.18043 CCCCCCCCCNC(=O)C1(CC1)F 11a_100000212291_100000055089 [0,1,0,1,0,0|2,0,0]=4 20580 B16R1.18043 CCCCCCCCCNC(=O)C1(CC1)F 1626a_100000212291_100000055089 [0,1,0,1,0,0|2,0,0]=4 20581 B16R1.18043 CCCCCCCCCNC(=O)C1(CC1)F 240690a_100000212291_100000055089 [0,1,0,1,0,0|2,0,0]=4 20582 B16R1.18043 CCCCCCCCCNC(=O)C1(CC1)F 527a_100000212291_100000055089 [0,1,0,1,0,0|2,0,0]=4 20583 B16R1.18043 CCCCCCCCCNC(=O)C1(CC1)O 240690a_100000212291_100000241761 [0,1,0,1,0,0|2,0,0]=4 20584 B16R1.18043 O=C(CCCCCCCCCO)C1(CC1)F 1458a_100000055089_100009813782 [0,1,0,1,0,0|2,0,0]=4 20585 B16R1.18043 O=C(CCCCCCCCCO)C1(CC1)O 1458a_100000241761_100009813782 [0,1,0,1,0,0|2,0,0]=4 20586 B16R1.20497 CCCCCCCCN1CCN(C(=O)C1)C 2230a_100000187256_100000210759 [0,1,0,1,0,0|2,0,0]=4 20587 B16R1.20497 CCCCCCCCN1CCN(C(=O)C1)C 269982a_100000187256_100000210759 [0,1,0,1,0,0|2,0,0]=4 20588 B16R1.20497 CCCCCCCNC1CCN(C(=O)C1)C 2230a_100000126938_100000210681 [0,1,0,1,0,0|2,0,0]=4 20589 B16R1.20497 CCCCCCCNC1CCN(C(=O)C1)C 34a_100000126938_100000210614 [0,1,0,1,0,0|2,0,0]=4 20590 B16R1.28208 CCCCCCCN1CCC(=O)N(CC1)C 2230a_100020591582_100000210681 [0,1,0,1,0,0|2,0,0]=4 20591 B16R1.28208 CCCCCCCN1CCC(=O)N(CC1)C 269982a_100020591582_100000210681 [0,1,0,1,0,0|2,0,0]=4 20592 B16R1.28208 CCCCCCCN1CCC(=O)N(CC1)C 34a_100020591582_100000210614 [0,1,0,1,0,0|2,0,0]=4 20593 B16R1.27 C#CCCCCCCCN1CCOC(=O)C1 2230a_100000131268_100153394163 [0,1,0,1,0,0|0,0,2]=4 20594 B16R1.27 C=CCCCCCCCN1CCOC(=O)C1 2230a_100000131268_100012355270 [0,1,0,1,0,0|0,0,2]=4 20595 B16R1.27 CCCCC#CCCCN1CCOC(=O)C1 2230a_100000131268_200000047210 [0,1,0,1,0,0|0,0,2]=4 20596 B16R1.27 CCCCCCCCCN1CCC=C(C1)C 2230a_100000725631_100011214924 [0,1,0,1,0,0|2,0,0]=4 20597 B16R1.27 CCCCCCCCCN1CCC=C(C1)C 269982a_100000725631_100000210670 [0,1,0,1,0,0|2,0,0]=4 20598 B16R1.27 CCCCCCCCCN1CCC=C(C1)C 34a_100000725631_100011214924 [0,1,0,1,0,0|2,0,0]=4 20599 B16R1.27 CCCCCCCCCN1CCNC(=O)C1 2230a_100000184651_100011214924 [0,1,0,1,0,0|1,0,0]=3 20600 B16R1.27 CCCCCCCCCN1CCOC(=O)C1 2230a_100000131268_100011214924 [0,1,0,1,0,0|0,0,0]=2 20601 B16R1.27 CCCCCCCCCN1CCOC(C1)C 2230a_100000729577_100011214924 [0,1,0,1,0,0|1,0,1]=4 20602 B16R1.27 CCCCCCCCCN1CCOC(C1)C 269982a_100000729577_100000210670 [0,1,0,1,0,0|1,0,1]=4 20603 B16R1.27 CCCCCCCCCN1CCOC(C1)C 34a_100000729577_100011214924 [0,1,0,1,0,0|1,0,1]=4 20604 B16R1.27 CCCCCCCCCN1CCOC(C1)O 2230a_100000688207_100011214924 [0,1,0,1,0,0|0,0,2]=4 20605 B16R1.27 CCCCCCCCCN1CCOC(C1)O 269982a_100000688207_100000210670 [0,1,0,1,0,0|0,0,2]=4 20606 B16R1.27 CCCCCCCCNC1CCNC(=O)C1 2230a_100016994916_100000210759 [0,1,0,1,0,0|1,0,0]=3 20607 B16R1.27 CCCCCCCCNC1CCNC(=O)C1 34a_100016994916_100000210759 [0,1,0,1,0,0|1,0,0]=3 20608 B16R1.27 CCCCCCCCNC1CCOC(C1)C 270004a_100000229939_100000755752 [0,1,0,1,0,0|1,0,1]=4 20609 B16R1.27 CCCCCCCCOC1CCCC(=O)C1 34a_100012613340_100000210759 [0,1,0,1,0,0|1,0,0]=3 20610 B16R1.27 CCCCCCCCOC1CCOC(C1)C 34a_100011986385_100000210759 [0,1,0,1,0,0|1,0,1]=4 20611 B16R1.27 CCCCCCCCOC1CCOC(C1)C 7a_100011986385_100000210759 [0,1,0,1,0,0|1,0,1]=4 20612 B16R1.27 CCCCCCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100000210759 [0,1,0,1,0,0|1,0,0]=3 20613 B16R1.27 CCCCCCCOCC1CCCC(=O)N1 34a_200000102386_100000210614 [0,1,0,1,0,0|2,0,0]=4 20614 B16R1.27 CCCCCCCOCC1CCNC(=O)C1 34a_100009886756_100000210614 [0,1,0,1,0,0|1,0,0]=3 20615 B16R1.27 CCCCCNCCCN1CCNC(=O)C1 2230a_100000757908_100000210326 [0,1,0,1,0,0|2,0,0]=4 20616 B16R1.27 CCCCOCCOCC1CCNC(=O)C1 34a_100009886756_100000743108 [0,1,0,1,0,0|2,0,0]=4 20617 B16R1.27 COCCCCCCNC1CCNC(=O)C1 2230a_100016994916_100011998445 [0,1,0,1,0,0|2,0,0]=4 20618 B16R1.27 COCCCCCCNC1CCNC(=O)C1 34a_100016994916_100011998445 [0,1,0,1,0,0|2,0,0]=4 20619 B16R1.27 COCCCCCCOC1CCCC(=O)C1 34a_100012613340_100011998445 [0,1,0,1,0,0|2,0,0]=4 20620 B16R1.27 COCCCCCCO[C@@H]1CCNC(=O)C1 34a_100015189427_100011998445 [0,1,0,1,0,0|2,0,0]=4 20621 B16R1.27 O=C1CC(CCN1)COCCCCCCF 34a_100009886756_100015922095 [0,1,0,1,0,0|2,0,0]=4 20622 B16R1.27 O=C1CC(CCN1)COCCCCCCO 34a_100009886756_100000766143 [0,1,0,1,0,0|2,0,0]=4 20623 B16R1.27 O=C1CC(CCN1)NCCCCCCCO 2230a_100016994916_100000760002 [0,1,0,1,0,0|2,0,0]=4 20624 B16R1.27 O=C1CC(CCN1)NCCCCCCCO 34a_100016994916_100000760002 [0,1,0,1,0,0|2,0,0]=4 20625 B16R1.27 O=C1CCCC(C1)OCCCCCCCO 34a_100012613340_100000760002 [0,1,0,1,0,0|2,0,0]=4 20626 B16R1.27 O=C1CN(CCN1)CCCCCCCCO 2230a_100000184651_100000033203 [0,1,0,1,0,0|2,0,0]=4 20627 B16R1.27 O=C1CN(CCO1)CCCCCCCCO 2230a_100000131268_100000033203 [0,1,0,1,0,0|1,0,0]=3 20628 B16R1.27 O=C1C[C@@H](CCN1)OCCCCCCCO 34a_100015189427_100000760002 [0,1,0,1,0,0|2,0,0]=4 20629 B16R1.258 CCCCCCNCC1CCC(=CC1C)C 269862a_100000210581_100000075207 [0,1,0,1,0,0|2,0,0]=4 20630 B16R1.298 CCOC(=O)CCCCN1CCC1COC 2230a_100015195929_100000750268 [0,1,0,1,0,0|1,0,0]=3 20631 B16R1.298 CCOC(=O)CCCCN1CCC1COC 269982a_100015195929_100000750268 [0,1,0,1,0,0|1,0,0]=3 20632 B16R1.298 CCOC(=O)CCCCN1CCC1COC 34a_100015195929_100000750268 [0,1,0,1,0,0|1,0,0]=3 20633 B16R1.298 CCOC(=O)COCCN1CCC1COC 2230a_100015195929_100000088970 [0,1,0,1,0,0|2,0,0]=4 20634 B16R1.298 CCOC(=O)COCCN1CCC1COC 269982a_100015195929_100000088970 [0,1,0,1,0,0|2,0,0]=4 20635 B16R1.298 CCOC(=O)COCCN1CCC1COC 34a_100015195929_100000088970 [0,1,0,1,0,0|2,0,0]=4 20636 B16R1.694 C=COC(=O)COC1CCCCC1CCC 34a_100011217265_100000036128 [0,1,0,1,0,0|0,0,2]=4 20637 B16R1.694 CCCC(=O)COC1CCCCC1CCC 7a_100011217265_100000747444 [0,1,0,1,0,0|1,0,0]=3 20638 B16R1.694 CCCC(=O)OCN1CCCCC1CCC 2230a_100000701414_100000034017 [0,1,0,1,0,0|2,0,0]=4 20639 B16R1.694 CCCC(=O)OCN1CCCCC1CCC 269982a_100000701414_100000034017 [0,1,0,1,0,0|2,0,0]=4 20640 B16R1.694 CCCC(=O)OCN1CCCCC1CCC 34a_100000701414_100000034017 [0,1,0,1,0,0|2,0,0]=4 20641 B16R1.694 CCCC1CCCCC1NCC(=O)NCC 270004a_100016988866_100011218038 [0,1,0,1,0,0|1,0,0]=3 20642 B16R1.694 CCCC1CCCCC1OCC(=O)NCC 34a_100011217265_100000183381 [0,1,0,1,0,0|1,0,0]=3 20643 B16R1.694 CCCC1CCCCC1OCC(=O)NCC 7a_100011217265_100000183381 [0,1,0,1,0,0|1,0,0]=3 20644 B16R1.694 CCCC1CCCCC1OCC(=O)NCO 34a_100011217265_100000185155 [0,1,0,1,0,0|2,0,0]=4 20645 B16R1.694 CCCC1CCCCC1OCC(=O)NCO 7a_100011217265_100000185155 [0,1,0,1,0,0|2,0,0]=4 20646 B16R1.694 CCCC1CCCCC1OCC(=O)OCC 34a_100011217265_100000188475 [0,1,0,1,0,0|0,0,0]=2 20647 B16R1.694 CCCC1CCCCC1OCC(=O)OCC 7a_100011217265_100000188475 [0,1,0,1,0,0|0,0,0]=2 20648 B16R1.694 CCCC1CCCCN1CCC(=O)NCC 2230a_100000701414_100000737597 [0,1,0,1,0,0|1,0,0]=3 20649 B16R1.694 CCCC1CCCCN1CCC(=O)NCC 269982a_100000701414_100000737597 [0,1,0,1,0,0|1,0,0]=3 20650 B16R1.694 CCCC1CCCCN1CCC(=O)OCC 2230a_100000701414_100011206558 [0,1,0,1,0,0|0,0,0]=2 20651 B16R1.694 CCCC1CCCCN1CCC(=O)OCC 269982a_100000701414_100011206558 [0,1,0,1,0,0|0,0,0]=2 20652 B16R1.694 CCCC1CCCCN1CCC(=O)OCC 34a_100000701414_100000765890 [0,1,0,1,0,0|0,0,0]=2 20653 B16R1.694 CCCC1COCCN1CCC(=O)NCC 2230a_102495339903_100000737597 [0,1,0,1,0,0|2,0,0]=4 20654 B16R1.694 CCCC1COCCN1CCC(=O)NCC 269982a_102495339903_100000737597 [0,1,0,1,0,0|2,0,0]=4 20655 B16R1.694 CCCC1COCCN1CCC(=O)OCC 2230a_102495339903_100011206558 [0,1,0,1,0,0|1,0,0]=3 20656 B16R1.694 CCCC1COCCN1CCC(=O)OCC 269982a_102495339903_100011206558 [0,1,0,1,0,0|1,0,0]=3 20657 B16R1.694 CCCC1COCCN1CCC(=O)OCC 34a_102495339903_100000765890 [0,1,0,1,0,0|1,0,0]=3 20658 B16R1.694 CCNC(=O)CCN1CCCCC1CCO 2230a_100000211664_100000737597 [0,1,0,1,0,0|2,0,0]=4 20659 B16R1.694 CCNC(=O)CCN1CCCCC1CCO 269982a_100000211664_100000737597 [0,1,0,1,0,0|2,0,0]=4 20660 B16R1.694 CCNC(=O)CCN1CCCCC1COC 2230a_100015184032_100000737597 [0,1,0,1,0,0|2,0,0]=4 20661 B16R1.694 CCNC(=O)CCN1CCCCC1COC 269982a_100015184032_100000737597 [0,1,0,1,0,0|2,0,0]=4 20662 B16R1.694 CCNC(=O)CNC1CCCCC1OCC 270004a_100016988866_200000031474 [0,1,0,1,0,0|2,0,0]=4 20663 B16R1.694 CCOC(=O)CCN1CCCCC1CC#N 2230a_100000133382_100011206558 [0,1,0,1,0,0|1,0,1]=4 20664 B16R1.694 CCOC(=O)CCN1CCCCC1CC#N 34a_100000133382_100000765890 [0,1,0,1,0,0|1,0,1]=4 20665 B16R1.694 CCOC(=O)CCN1CCCCC1CCO 2230a_100000211664_100011206558 [0,1,0,1,0,0|1,0,0]=3 20666 B16R1.694 CCOC(=O)CCN1CCCCC1CCO 269982a_100000211664_100011206558 [0,1,0,1,0,0|1,0,0]=3 20667 B16R1.694 CCOC(=O)CCN1CCCCC1CCO 34a_100000211664_100000765890 [0,1,0,1,0,0|1,0,0]=3 20668 B16R1.694 CCOC(=O)CCN1CCCCC1COC 2230a_100015184032_100011206558 [0,1,0,1,0,0|1,0,0]=3 20669 B16R1.694 CCOC(=O)CCN1CCCCC1COC 269982a_100015184032_100011206558 [0,1,0,1,0,0|1,0,0]=3 20670 B16R1.694 CCOC(=O)CCN1CCCCC1COC 34a_100015184032_100000765890 [0,1,0,1,0,0|1,0,0]=3 20671 B16R1.694 CCOC(=O)CCN1CCOC[C@@H]1COC 2230a_100016989928_100011206558 [0,1,0,1,0,0|2,0,0]=4 20672 B16R1.694 CCOC(=O)CCN1CCOC[C@@H]1COC 269982a_100016989928_100011206558 [0,1,0,1,0,0|2,0,0]=4 20673 B16R1.694 CCOC(=O)CCN1CCOC[C@@H]1COC 34a_100016989928_100000765890 [0,1,0,1,0,0|2,0,0]=4 20674 B16R1.890 CCNC(=O)CCNCC1CCCN1CC 2230a_100000211693_100000737597 [0,1,0,1,0,0|2,0,0]=4 20675 B16R1.890 CCNC(=O)CCOC[C@H]1CCCN1CC 7a_100011739246_100000737597 [0,1,0,1,0,0|2,0,0]=4 20676 B16R1.890 CCOC(=O)CCCCN1CC=CC1CC 2230a_100000730860_100000750268 [0,1,0,1,0,0|0,0,2]=4 20677 B16R1.890 CCOC(=O)CCCCN1CC=CC1CC 269982a_100000730860_100000750268 [0,1,0,1,0,0|0,0,2]=4 20678 B16R1.890 CCOC(=O)CCCCN1CC=CC1CC 34a_100000730860_100000750268 [0,1,0,1,0,0|0,0,2]=4 20679 B16R1.890 CCOC(=O)CCCCN1CCCC1C#N 2230a_100000701862_100000750268 [0,1,0,1,0,0|1,0,1]=4 20680 B16R1.890 CCOC(=O)CCCCN1CCCC1CC 2230a_100000754278_100000750268 [0,1,0,1,0,0|0,0,0]=2 20681 B16R1.890 CCOC(=O)CCCCN1CCCC1CC 269982a_100000754278_100000750268 [0,1,0,1,0,0|0,0,0]=2 20682 B16R1.890 CCOC(=O)CCCCN1CCCC1CC 34a_100000754278_100000750268 [0,1,0,1,0,0|0,0,0]=2 20683 B16R1.890 CCOC(=O)CCCCN1CCC[C@@H]1C#N 2230a_106645074975_100000750268 [0,1,0,1,0,0|1,0,1]=4 20684 B16R1.890 CCOC(=O)CCCCN1CCC[C@@H]1C#N 269982a_106645074975_100000750268 [0,1,0,1,0,0|1,0,1]=4 20685 B16R1.890 CCOC(=O)CCCCN1CCC[C@@H]1CO 2230a_100000745186_100000750268 [0,1,0,1,0,0|1,0,0]=3 20686 B16R1.890 CCOC(=O)CCCCN1CCC[C@@H]1CO 269982a_100000745186_100000750268 [0,1,0,1,0,0|1,0,0]=3 20687 B16R1.890 CCOC(=O)CCCCN1CCC[C@@H]1CO 34a_100000745186_100000750268 [0,1,0,1,0,0|1,0,0]=3 20688 B16R1.890 CCOC(=O)CCCO[C@@H]1CCC[C@H]1C#N 34a_100011907464_100009991533 [0,1,0,1,0,0|1,0,1]=4 20689 B16R1.890 CCOC(=O)CCCO[C@@H]1CCC[C@H]1C#N 7a_100011907464_100011215271 [0,1,0,1,0,0|1,0,1]=4 20690 B16R1.890 CCOC(=O)CCNCC1CCCN1CC 2230a_100000211693_100011206558 [0,1,0,1,0,0|1,0,0]=3 20691 B16R1.890 CCOC(=O)CCOC[C@H]1CCCN1CC 34a_100011739246_100000765890 [0,1,0,1,0,0|1,0,0]=3 20692 B16R1.890 CCOC(=O)CCOC[C@H]1CCCN1CC 7a_100011739246_100011206558 [0,1,0,1,0,0|1,0,0]=3 20693 B16R1.890 CCOC(=O)COCCN1CCCC1CC 2230a_100000754278_100000088970 [0,1,0,1,0,0|1,0,0]=3 20694 B16R1.890 CCOC(=O)COCCN1CCCC1CC 269982a_100000754278_100000088970 [0,1,0,1,0,0|1,0,0]=3 20695 B16R1.890 CCOC(=O)COCCN1CCCC1CC 34a_100000754278_100000088970 [0,1,0,1,0,0|1,0,0]=3 20696 B16R1.890 CCOC(=O)COCCN1CCC[C@@H]1CO 2230a_100000745186_100000088970 [0,1,0,1,0,0|2,0,0]=4 20697 B16R1.890 CCOC(=O)COCCN1CCC[C@@H]1CO 269982a_100000745186_100000088970 [0,1,0,1,0,0|2,0,0]=4 20698 B16R1.890 CCOC(=O)COCCN1CCC[C@@H]1CO 34a_100000745186_100000088970 [0,1,0,1,0,0|2,0,0]=4 20699 B16R1.948 C#CC1CCCCN1CCCC(=O)OCC 2230a_200020621307_100009991533 [0,1,0,1,0,0|0,0,2]=4 20700 B16R1.948 C#CC1CCCCN1CCCC(=O)OCC 269982a_200020621307_100009991533 [0,1,0,1,0,0|0,0,2]=4 20701 B16R1.948 C#CC1CCCCN1CCCC(=O)OCC 34a_200020621307_100009991533 [0,1,0,1,0,0|0,0,2]=4 20702 B16R1.948 CCCC(=O)CNCC1CCCCN1CC 2230a_100000754393_100000747444 [0,1,0,1,0,0|2,0,0]=4 20703 B16R1.948 CCCC(=O)COCC1CCCCN1CC 7a_100000225091_100000747444 [0,1,0,1,0,0|2,0,0]=4 20704 B16R1.948 CCCC(=O)NCCN1CCCCC1CC 11a_100000755458_100000211992 [0,1,0,1,0,0|2,0,0]=4 20705 B16R1.948 CCCC(=O)NCCN1CCCCC1CC 1626a_100000755458_100000211992 [0,1,0,1,0,0|2,0,0]=4 20706 B16R1.948 CCCC(=O)NCCN1CCCCC1CC 240690a_100000755458_100000211992 [0,1,0,1,0,0|2,0,0]=4 20707 B16R1.948 CCCC(=O)NCCN1CCCCC1CC 527a_100000755458_100000211992 [0,1,0,1,0,0|2,0,0]=4 20708 B16R1.948 CCCC(=O)OCOC1CCCCC1CC 34a_100000210738_100000034017 [0,1,0,1,0,0|2,0,0]=4 20709 B16R1.948 CCNC(=O)CCNC1CCCCC1CC 269862a_100025743525_100000757040 [0,1,0,1,0,0|1,0,0]=3 20710 B16R1.948 CCNC(=O)CCNC1CCCCC1CC 270004a_100025743525_100000757040 [0,1,0,1,0,0|1,0,0]=3 20711 B16R1.948 CCNC(=O)CCNC1CCCCC1CO 270004a_100025743525_100009861125 [0,1,0,1,0,0|2,0,0]=4 20712 B16R1.948 CCNC(=O)CCNC1CCCCC1OC 270004a_100025743525_100000740605 [0,1,0,1,0,0|2,0,0]=4 20713 B16R1.948 CCNC(=O)CCOC1CCCCC1CC 7a_100000210738_100000737597 [0,1,0,1,0,0|1,0,0]=3 20714 B16R1.948 CCNC(=O)CCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000737597 [0,1,0,1,0,0|2,0,0]=4 20715 B16R1.948 CCNC(=O)CNCC1CCCCN1CC 2230a_100000754393_100000183381 [0,1,0,1,0,0|2,0,0]=4 20716 B16R1.948 CCNC(=O)CNCC1CCCCN1CC 34a_100000754393_100000183381 [0,1,0,1,0,0|2,0,0]=4 20717 B16R1.948 CCNC(=O)COCC1CCCCN1CC 34a_100000225091_100000183381 [0,1,0,1,0,0|2,0,0]=4 20718 B16R1.948 CCNC(=O)COCC1CCCCN1CC 7a_100000225091_100000183381 [0,1,0,1,0,0|2,0,0]=4 20719 B16R1.948 CCNC(=O)NCCN1CCCCC1CC 2708a_100000755458_100015525214 [0,1,0,1,0,0|2,0,0]=4 20720 B16R1.948 CCNC(=O)NCCN1CCCCC1CC 2708a_100015525214_100000755458 [0,1,0,1,0,0|2,0,0]=4 20721 B16R1.948 CCNC(=O)NCCN1CCCCC1CC 273464a_100000755458_100015525214 [0,1,0,1,0,0|2,0,0]=4 20722 B16R1.948 CCNC(=O)NCCN1CCCCC1CC 273464a_100015525214_100000755458 [0,1,0,1,0,0|2,0,0]=4 20723 B16R1.948 CCNC(=O)NCCN1CCCCC1CC 512a_100000755458_100015525214 [0,1,0,1,0,0|2,0,0]=4 20724 B16R1.948 CCNC(=O)NCCN1CCCCC1CC 512a_100015525214_100000755458 [0,1,0,1,0,0|2,0,0]=4 20725 B16R1.948 CCOC(=O)/C=C/CN1CCCCC1CC 2230a_100000210034_100016267167 [0,1,0,1,0,0|0,0,2]=4 20726 B16R1.948 CCOC(=O)/C=C/CN1CCCCC1CC 269982a_100000210034_100016267167 [0,1,0,1,0,0|0,0,2]=4 20727 B16R1.948 CCOC(=O)/C=C/CN1CCCCC1CC 34a_100000210034_100016267167 [0,1,0,1,0,0|0,0,2]=4 20728 B16R1.948 CCOC(=O)CCCN1CCCCC1C#N 34a_100016989756_100009991533 [0,1,0,1,0,0|1,0,1]=4 20729 B16R1.948 CCOC(=O)CCCN1CCCCC1CC 2230a_100000210034_100009991533 [0,1,0,1,0,0|0,0,0]=2 20730 B16R1.948 CCOC(=O)CCCN1CCCCC1CC 269982a_100000210034_100009991533 [0,1,0,1,0,0|0,0,0]=2 20731 B16R1.948 CCOC(=O)CCCN1CCCCC1CC 34a_100000210034_100009991533 [0,1,0,1,0,0|0,0,0]=2 20732 B16R1.948 CCOC(=O)CCCN1CCCCC1CO 2230a_100000210821_100009991533 [0,1,0,1,0,0|1,0,0]=3 20733 B16R1.948 CCOC(=O)CCCN1CCCCC1CO 269982a_100000210821_100009991533 [0,1,0,1,0,0|1,0,0]=3 20734 B16R1.948 CCOC(=O)CCCN1CCCCC1CO 34a_100000210821_100009991533 [0,1,0,1,0,0|1,0,0]=3 20735 B16R1.948 CCOC(=O)CCCN1CCOC[C@@H]1CC 2230a_100016988097_100009991533 [0,1,0,1,0,0|1,0,0]=3 20736 B16R1.948 CCOC(=O)CCCN1CCOC[C@@H]1CC 269982a_100016988097_100009991533 [0,1,0,1,0,0|1,0,0]=3 20737 B16R1.948 CCOC(=O)CCCN1CCOC[C@@H]1CC 34a_100016988097_100009991533 [0,1,0,1,0,0|1,0,0]=3 20738 B16R1.948 CCOC(=O)CCCN1CCOC[C@H]1CO 2230a_100000717676_100009991533 [0,1,0,1,0,0|2,0,0]=4 20739 B16R1.948 CCOC(=O)CCCN1CCOC[C@H]1CO 269982a_100000717676_100009991533 [0,1,0,1,0,0|2,0,0]=4 20740 B16R1.948 CCOC(=O)CCCN1CCOC[C@H]1CO 34a_100000717676_100009991533 [0,1,0,1,0,0|2,0,0]=4 20741 B16R1.948 CCOC(=O)CCNC1CCCCC1OC 34a_100011208099_100000765890 [0,1,0,1,0,0|1,0,0]=3 20742 B16R1.948 CCOC(=O)CCNC1CCOCC1CO 2230a_214813039666_100011206558 [0,1,0,1,0,0|2,0,0]=4 20743 B16R1.948 CCOC(=O)CCNC1CCOCC1CO 34a_214813039666_100000765890 [0,1,0,1,0,0|2,0,0]=4 20744 B16R1.948 CCOC(=O)CCOC1CCCCC1CC 34a_100000210738_100000765890 [0,1,0,1,0,0|0,0,0]=2 20745 B16R1.948 CCOC(=O)CCOC1CCCCC1CC 7a_100000210738_100011206558 [0,1,0,1,0,0|0,0,0]=2 20746 B16R1.948 CCOC(=O)CCOC1CCCCC1CN 34a_100011216029_100000765890 [0,1,0,1,0,0|1,0,0]=3 20747 B16R1.948 CCOC(=O)CCO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100000765890 [0,1,0,1,0,0|1,0,0]=3 20748 B16R1.948 CCOC(=O)CCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000765890 [0,1,0,1,0,0|1,0,0]=3 20749 B16R1.948 CCOC(=O)CCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100011206558 [0,1,0,1,0,0|1,0,0]=3 20750 B16R1.948 CCOC(=O)CNCC1CCCCN1CC 2230a_100000754393_100000188475 [0,1,0,1,0,0|1,0,0]=3 20751 B16R1.948 CCOC(=O)CNCC1CCCCN1CC 34a_100000754393_100000188475 [0,1,0,1,0,0|1,0,0]=3 20752 B16R1.948 CCOC(=O)COCC1CCCCN1CC 34a_100000225091_100000188475 [0,1,0,1,0,0|1,0,0]=3 20753 B16R1.948 CCOC(=O)COCC1CCCCN1CC 7a_100000225091_100000188475 [0,1,0,1,0,0|1,0,0]=3 20754 B16R1.948 CCOC(=O)NCCN1CCCCC1CC 269982a_100000210034_200011445536 [0,1,0,1,0,0|1,0,0]=3 20755 B16R1.948 CCOC(=O)NCCN1CCCCC1CO 269982a_100000210821_200011445536 [0,1,0,1,0,0|2,0,0]=4 20756 B16R1.948 CCOC(=O)NCCN1CCOC[C@@H]1CC 269982a_100016988097_200011445536 [0,1,0,1,0,0|2,0,0]=4 20757 B16R1.949 CCCC(=O)NCCCCCN1CCCC1 1626a_100011491779_100000211992 [0,1,0,1,0,0|2,0,0]=4 20758 B16R1.949 CCCC(=O)NCCCCCN1CCCC1 240690a_100011491779_100000211992 [0,1,0,1,0,0|2,0,0]=4 20759 B16R1.949 CCCC(=O)OCNCCCC1CCCC1 2230a_100000736752_100000034017 [0,1,0,1,0,0|2,0,0]=4 20760 B16R1.949 CCCC(=O)OCNCCCC1CCCC1 34a_100000736752_100000034017 [0,1,0,1,0,0|2,0,0]=4 20761 B16R1.949 CCCC(=O)OCOCCCC1CCCC1 34a_100011215328_100000034017 [0,1,0,1,0,0|2,0,0]=4 20762 B16R1.949 CCCC(=O)OCSCCCC1CCCC1 62a_100011713738_100000034017 [0,1,0,1,0,0|2,0,0]=4 20763 B16R1.949 CCNC(=O)CCNCCCC1CCCC1 2230a_100000736752_100000737597 [0,1,0,1,0,0|1,0,0]=3 20764 B16R1.949 CCNC(=O)CCNCCCC1CCCC1 34a_100025743525_100011713738 [0,1,0,1,0,0|1,0,0]=3 20765 B16R1.949 CCNC(=O)CCNCCCN1CCCC1 34a_100025743525_100016991639 [0,1,0,1,0,0|2,0,0]=4 20766 B16R1.949 CCNC(=O)CCOCCCC1CCCC1 7a_100011215328_100000737597 [0,1,0,1,0,0|1,0,0]=3 20767 B16R1.949 CCNC(=O)CCOCCOC1CCCC1 7a_100000738311_100000737597 [0,1,0,1,0,0|2,0,0]=4 20768 B16R1.949 CCNC(=O)CCSCCCC1CCCC1 62a_100000737597_100011713738 [0,1,0,1,0,0|1,0,0]=3 20769 B16R1.949 CCNC(=O)CCSCCCC1CCCC1 62a_100011713738_100000737597 [0,1,0,1,0,0|1,0,0]=3 20770 B16R1.949 CCNC(=O)CCSCCCN1CCCC1 62a_100000737597_100011445909 [0,1,0,1,0,0|2,0,0]=4 20771 B16R1.949 CCNC(=O)CCSCCCN1CCCC1 62a_100016991639_100000737597 [0,1,0,1,0,0|2,0,0]=4 20772 B16R1.949 CCNC(=O)CNCCCOC1CCCC1 34a_100000747560_100000183381 [0,1,0,1,0,0|2,0,0]=4 20773 B16R1.949 CCNC(=O)NCCCCCN1CCCC1 2708a_100011491779_100015525214 [0,1,0,1,0,0|2,0,0]=4 20774 B16R1.949 CCNC(=O)NCCCCCN1CCCC1 2708a_100015525214_100011491779 [0,1,0,1,0,0|2,0,0]=4 20775 B16R1.949 CCNC(=O)NCCCCCN1CCCC1 273464a_100011491779_100015525214 [0,1,0,1,0,0|2,0,0]=4 20776 B16R1.949 CCNC(=O)NCCCCCN1CCCC1 273464a_100015525214_100011491779 [0,1,0,1,0,0|2,0,0]=4 20777 B16R1.949 CCNC(=O)NCCCCCN1CCCC1 512a_100015525214_100011491779 [0,1,0,1,0,0|2,0,0]=4 20778 B16R1.949 CCOC(=O)/C=C/CNCCC1CCCC1 2230a_100000739158_100016267167 [0,1,0,1,0,0|0,0,2]=4 20779 B16R1.949 CCOC(=O)/C=C/CNCCC1CCCC1 34a_100000739158_100016267167 [0,1,0,1,0,0|0,0,2]=4 20780 B16R1.949 CCOC(=O)/C=C/COCCC1CCCC1 34a_100000749090_100016267167 [0,1,0,1,0,0|0,0,2]=4 20781 B16R1.949 CCOC(=O)/C=C/COCCC1CCCC1 7a_100000749090_100016267167 [0,1,0,1,0,0|0,0,2]=4 20782 B16R1.949 CCOC(=O)/C=C/CSCCC1CCCC1 62a_100000760354_100016267167 [0,1,0,1,0,0|0,0,2]=4 20783 B16R1.949 CCOC(=O)/C=C/CSCCC1CCCC1 62a_100016267167_100000760354 [0,1,0,1,0,0|0,0,2]=4 20784 B16R1.949 CCOC(=O)CCCCCCN1CC=CC1 269982a_100015195280_100009814379 [0,1,0,1,0,0|0,0,2]=4 20785 B16R1.949 CCOC(=O)CCCCCCN1CCCC1 2230a_100000188435_100009814379 [0,1,0,1,0,0|0,0,0]=2 20786 B16R1.949 CCOC(=O)CCCCCCN1CCCC1 269982a_100000188435_100009814379 [0,1,0,1,0,0|0,0,0]=2 20787 B16R1.949 CCOC(=O)CCCCCCN1CCSC1 2230a_100011215254_100009814379 [0,1,0,1,0,0|1,0,0]=3 20788 B16R1.949 CCOC(=O)CCCCCCN1CCSC1 269982a_100011215254_100009814379 [0,1,0,1,0,0|1,0,0]=3 20789 B16R1.949 CCOC(=O)CCCCCNC1CC=CC1 2230a_100015188752_100000755133 [0,1,0,1,0,0|0,0,2]=4 20790 B16R1.949 CCOC(=O)CCCCCNC1CCCC1 2230a_100000211070_100000755133 [0,1,0,1,0,0|0,0,0]=2 20791 B16R1.949 CCOC(=O)CCCCCNC1CCCC1 34a_100000211070_100000755133 [0,1,0,1,0,0|0,0,0]=2 20792 B16R1.949 CCOC(=O)CCCCCN[C@@H]1CCOC1 2230a_200015188469_100000755133 [0,1,0,1,0,0|1,0,0]=3 20793 B16R1.949 CCOC(=O)CCCCCN[C@H]1CCOC1 2230a_100015188467_100000755133 [0,1,0,1,0,0|1,0,0]=3 20794 B16R1.949 CCOC(=O)CCCCCN[C@H]1CCOC1 34a_100015188467_100000755133 [0,1,0,1,0,0|1,0,0]=3 20795 B16R1.949 CCOC(=O)CCCCCOC1CCCC1 34a_100000210269_100000755133 [0,1,0,1,0,0|0,0,0]=2 20796 B16R1.949 CCOC(=O)CCCCCOC1CCCC1 7a_100000210269_100000755133 [0,1,0,1,0,0|0,0,0]=2 20797 B16R1.949 CCOC(=O)CCCCCOC1CCCC1 7a_100011214988_100000179811 [0,1,0,1,0,0|0,0,0]=2 20798 B16R1.949 CCOC(=O)CCCCCOC1CCCO1 34a_100000085407_100000755133 [0,1,0,1,0,0|1,0,0]=3 20799 B16R1.949 CCOC(=O)CCCCCOC1CCOC1 7a_100011214988_100000731011 [0,1,0,1,0,0|1,0,0]=3 20800 B16R1.949 CCOC(=O)CCCCCOC1CCSC1 7a_100011232664_100000755133 [0,1,0,1,0,0|1,0,0]=3 20801 B16R1.949 CCOC(=O)CCCCCO[C@H]1CCOC1 34a_100000717292_100000755133 [0,1,0,1,0,0|1,0,0]=3 20802 B16R1.949 CCOC(=O)CCCCCSC1CCCC1 62a_100000755133_100000179811 [0,1,0,1,0,0|0,0,0]=2 20803 B16R1.949 CCOC(=O)CCCCCSC1CCCC1 62a_100011217020_100000755133 [0,1,0,1,0,0|0,0,0]=2 20804 B16R1.949 CCOC(=O)CCCCCSC1CCOC1 62a_100000755133_100000690089 [0,1,0,1,0,0|1,0,0]=3 20805 B16R1.949 CCOC(=O)CCCCNCC1CCCC1 2230a_100000737975_100000750268 [0,1,0,1,0,0|0,0,0]=2 20806 B16R1.949 CCOC(=O)CCCCNCC1CCCC1 34a_100000737975_100000750268 [0,1,0,1,0,0|0,0,0]=2 20807 B16R1.949 CCOC(=O)CCCCNCC1CCOC1 2230a_100000737293_100000750268 [0,1,0,1,0,0|1,0,0]=3 20808 B16R1.949 CCOC(=O)CCCCNCC1CCOC1 34a_100000737293_100000750268 [0,1,0,1,0,0|1,0,0]=3 20809 B16R1.949 CCOC(=O)CCCCNCC1OCCO1 2230a_100000036311_100000750268 [0,1,0,1,0,0|2,0,0]=4 20810 B16R1.949 CCOC(=O)CCCCNCC1OCCO1 34a_100000036311_100000750268 [0,1,0,1,0,0|2,0,0]=4 20811 B16R1.949 CCOC(=O)CCCCNC[C@@H]1CCCO1 2230a_100020590478_100000750268 [0,1,0,1,0,0|1,0,0]=3 20812 B16R1.949 CCOC(=O)CCCCNC[C@@H]1CCCO1 34a_100020590478_100000750268 [0,1,0,1,0,0|1,0,0]=3 20813 B16R1.949 CCOC(=O)CCCCOCC1CC=CC1 34a_100000688395_100000750268 [0,1,0,1,0,0|0,0,2]=4 20814 B16R1.949 CCOC(=O)CCCCOCC1CCCC1 34a_100000742336_100000750268 [0,1,0,1,0,0|0,0,0]=2 20815 B16R1.949 CCOC(=O)CCCCOCC1CCCC1 7a_100000742336_100000750268 [0,1,0,1,0,0|0,0,0]=2 20816 B16R1.949 CCOC(=O)CCCCOCC1CCCO1 34a_100000210270_100000750268 [0,1,0,1,0,0|1,0,0]=3 20817 B16R1.949 CCOC(=O)CCCCOCC1CCCO1 7a_100000210270_100000750268 [0,1,0,1,0,0|1,0,0]=3 20818 B16R1.949 CCOC(=O)CCCCOCC1CCNC1 34a_100000748654_100000750268 [0,1,0,1,0,0|1,0,0]=3 20819 B16R1.949 CCOC(=O)CCCCOCC1CCOC1 34a_100000740260_100000750268 [0,1,0,1,0,0|1,0,0]=3 20820 B16R1.949 CCOC(=O)CCCCOCC1COCO1 34a_100011216627_100000750268 [0,1,0,1,0,0|2,0,0]=4 20821 B16R1.949 CCOC(=O)CCCCOCC1OCCO1 34a_100000087154_100000750268 [0,1,0,1,0,0|2,0,0]=4 20822 B16R1.949 CCOC(=O)CCCCOC[C@H]1CCCN1 34a_100000745186_100000750268 [0,1,0,1,0,0|1,0,0]=3 20823 B16R1.949 CCOC(=O)CCCCSCC1CCCC1 62a_100000740388_100000750268 [0,1,0,1,0,0|0,0,0]=2 20824 B16R1.949 CCOC(=O)CCCCSCC1CCCC1 62a_100000750268_100000740388 [0,1,0,1,0,0|0,0,0]=2 20825 B16R1.949 CCOC(=O)CCCCSCC1CCCO1 62a_100000203698_100000750268 [0,1,0,1,0,0|1,0,0]=3 20826 B16R1.949 CCOC(=O)CCCCSCC1CCCO1 62a_100000750268_100000203698 [0,1,0,1,0,0|1,0,0]=3 20827 B16R1.949 CCOC(=O)CCCCSCC1CCOC1 62a_100000702531_100000750268 [0,1,0,1,0,0|1,0,0]=3 20828 B16R1.949 CCOC(=O)CCCCSCC1CCOC1 62a_100000750268_100000702531 [0,1,0,1,0,0|1,0,0]=3 20829 B16R1.949 CCOC(=O)CCCCSCC1OCCO1 62a_100000750268_100000755774 [0,1,0,1,0,0|2,0,0]=4 20830 B16R1.949 CCOC(=O)CCCCSCC1OCCO1 62a_100000755774_100000750268 [0,1,0,1,0,0|2,0,0]=4 20831 B16R1.949 CCOC(=O)CCCNCCC1CCCC1 2230a_100000739158_100009991533 [0,1,0,1,0,0|0,0,0]=2 20832 B16R1.949 CCOC(=O)CCCNCCC1CCCC1 34a_100000739158_100009991533 [0,1,0,1,0,0|0,0,0]=2 20833 B16R1.949 CCOC(=O)CCCNCCC1OCCO1 2230a_100000034215_100009991533 [0,1,0,1,0,0|2,0,0]=4 20834 B16R1.949 CCOC(=O)CCCNCCC1OCCO1 34a_100000034215_100009991533 [0,1,0,1,0,0|2,0,0]=4 20835 B16R1.949 CCOC(=O)CCCOCCC1CCCC1 34a_100000749090_100009991533 [0,1,0,1,0,0|0,0,0]=2 20836 B16R1.949 CCOC(=O)CCCOCCC1CCCC1 7a_100000749090_100011215271 [0,1,0,1,0,0|0,0,0]=2 20837 B16R1.949 CCOC(=O)CCCOCCC1CCCC1 7a_100012001163_100000760354 [0,1,0,1,0,0|0,0,0]=2 20838 B16R1.949 CCOC(=O)CCCOCCC1CCNC1 34a_100016987287_100009991533 [0,1,0,1,0,0|1,0,0]=3 20839 B16R1.949 CCOC(=O)CCCOCCC1CCOC1 34a_100011879284_100009991533 [0,1,0,1,0,0|1,0,0]=3 20840 B16R1.949 CCOC(=O)CCCOCCC1OCCO1 7a_100012001163_100000740749 [0,1,0,1,0,0|2,0,0]=4 20841 B16R1.949 CCOC(=O)CCCOCCN1CCCC1 7a_100012001163_100000004467 [0,1,0,1,0,0|1,0,0]=3 20842 B16R1.949 CCOC(=O)CCCSCCC1CCCC1 62a_100000760354_100009991533 [0,1,0,1,0,0|0,0,0]=2 20843 B16R1.949 CCOC(=O)CCCSCCC1CCCC1 62a_100009991533_100000760354 [0,1,0,1,0,0|0,0,0]=2 20844 B16R1.949 CCOC(=O)CCCSCCC1OCCO1 62a_100009991533_100000740749 [0,1,0,1,0,0|2,0,0]=4 20845 B16R1.949 CCOC(=O)CCCSCCN1CCCC1 62a_100000700749_100009991533 [0,1,0,1,0,0|1,0,0]=3 20846 B16R1.949 CCOC(=O)CCCSCCN1CCCC1 62a_100009991533_100000004467 [0,1,0,1,0,0|1,0,0]=3 20847 B16R1.949 CCOC(=O)CCNCCCC1CCCC1 2230a_100000736752_100011206558 [0,1,0,1,0,0|0,0,0]=2 20848 B16R1.949 CCOC(=O)CCNCCCC1CCCC1 34a_100000736752_100000765890 [0,1,0,1,0,0|0,0,0]=2 20849 B16R1.949 CCOC(=O)CCNCCOC1CCCC1 34a_100000741755_100000765890 [0,1,0,1,0,0|1,0,0]=3 20850 B16R1.949 CCOC(=O)CCOCCCC1CCCC1 34a_100011215328_100000765890 [0,1,0,1,0,0|0,0,0]=2 20851 B16R1.949 CCOC(=O)CCOCCCC1CCCC1 7a_100011215328_100011206558 [0,1,0,1,0,0|0,0,0]=2 20852 B16R1.949 CCOC(=O)CCOCCCC1OCCO1 34a_100009871617_100000765890 [0,1,0,1,0,0|2,0,0]=4 20853 B16R1.949 CCOC(=O)CCOCCCC1OCCO1 7a_100009871617_100011206558 [0,1,0,1,0,0|2,0,0]=4 20854 B16R1.949 CCOC(=O)CCOCCNC1CCCC1 34a_200000200444_100000765890 [0,1,0,1,0,0|1,0,0]=3 20855 B16R1.949 CCOC(=O)CCOCCOC1CCCC1 34a_100000738311_100000765890 [0,1,0,1,0,0|1,0,0]=3 20856 B16R1.949 CCOC(=O)CCOCCOC1CCCC1 7a_100000738311_100011206558 [0,1,0,1,0,0|1,0,0]=3 20857 B16R1.949 CCOC(=O)CCSCCCC1CCCC1 62a_100000765890_100011713738 [0,1,0,1,0,0|0,0,0]=2 20858 B16R1.949 CCOC(=O)CCSCCCC1CCCC1 62a_100011713738_100000765890 [0,1,0,1,0,0|0,0,0]=2 20859 B16R1.949 CCOC(=O)CCSCCCC1OCCO1 62a_100000765890_100000042513 [0,1,0,1,0,0|2,0,0]=4 20860 B16R1.949 CCOC(=O)CCSCCCN1CCCC1 62a_100000765890_100011445909 [0,1,0,1,0,0|1,0,0]=3 20861 B16R1.949 CCOC(=O)CCSCCCN1CCCC1 62a_100016991639_100000765890 [0,1,0,1,0,0|1,0,0]=3 20862 B16R1.949 CCOC(=O)CNCCCOC1CCCC1 34a_100000747560_100000188475 [0,1,0,1,0,0|1,0,0]=3 20863 B16R1.949 CCOC(=O)COCCCNC1CCCC1 2230a_100000211070_100009893628 [0,1,0,1,0,0|1,0,0]=3 20864 B16R1.949 CCOC(=O)COCCCNC1CCCC1 34a_100000211070_100009893628 [0,1,0,1,0,0|1,0,0]=3 20865 B16R1.949 CCOC(=O)COCCCN[C@@H]1CCOC1 2230a_200015188469_100009893628 [0,1,0,1,0,0|2,0,0]=4 20866 B16R1.949 CCOC(=O)COCCCN[C@H]1CCOC1 2230a_100015188467_100009893628 [0,1,0,1,0,0|2,0,0]=4 20867 B16R1.949 CCOC(=O)COCCCN[C@H]1CCOC1 34a_100015188467_100009893628 [0,1,0,1,0,0|2,0,0]=4 20868 B16R1.949 CCOC(=O)COCCCOC1CCCC1 34a_100000210269_100009893628 [0,1,0,1,0,0|1,0,0]=3 20869 B16R1.949 CCOC(=O)COCCCOC1CCCC1 7a_100000210269_100009893628 [0,1,0,1,0,0|1,0,0]=3 20870 B16R1.949 CCOC(=O)COCCCOC1CCCO1 34a_100000085407_100009893628 [0,1,0,1,0,0|2,0,0]=4 20871 B16R1.949 CCOC(=O)COCCCOC1CCSC1 7a_100011232664_100009893628 [0,1,0,1,0,0|2,0,0]=4 20872 B16R1.949 CCOC(=O)COCCCO[C@H]1CCOC1 34a_100000717292_100009893628 [0,1,0,1,0,0|2,0,0]=4 20873 B16R1.949 CCOC(=O)COCCCSC1CCCC1 62a_100009893628_100000179811 [0,1,0,1,0,0|1,0,0]=3 20874 B16R1.949 CCOC(=O)COCCCSC1CCCC1 62a_100011217020_100009893628 [0,1,0,1,0,0|1,0,0]=3 20875 B16R1.949 CCOC(=O)COCCCSC1CCOC1 62a_100009893628_100000690089 [0,1,0,1,0,0|2,0,0]=4 20876 B16R1.949 CCOC(=O)COCCNCC1CCCC1 2230a_100000737975_100000088970 [0,1,0,1,0,0|1,0,0]=3 20877 B16R1.949 CCOC(=O)COCCNCC1CCCC1 34a_100000737975_100000088970 [0,1,0,1,0,0|1,0,0]=3 20878 B16R1.949 CCOC(=O)COCCNCC1CCOC1 2230a_100000737293_100000088970 [0,1,0,1,0,0|2,0,0]=4 20879 B16R1.949 CCOC(=O)COCCNCC1CCOC1 34a_100000737293_100000088970 [0,1,0,1,0,0|2,0,0]=4 20880 B16R1.949 CCOC(=O)COCCNC[C@@H]1CCCO1 2230a_100020590478_100000088970 [0,1,0,1,0,0|2,0,0]=4 20881 B16R1.949 CCOC(=O)COCCNC[C@@H]1CCCO1 34a_100020590478_100000088970 [0,1,0,1,0,0|2,0,0]=4 20882 B16R1.949 CCOC(=O)COCCOCC1CCCC1 34a_100000742336_100000088970 [0,1,0,1,0,0|1,0,0]=3 20883 B16R1.949 CCOC(=O)COCCOCC1CCCC1 7a_100000742336_100000088970 [0,1,0,1,0,0|1,0,0]=3 20884 B16R1.949 CCOC(=O)COCCOCC1CCCO1 34a_100000210270_100000088970 [0,1,0,1,0,0|2,0,0]=4 20885 B16R1.949 CCOC(=O)COCCOCC1CCCO1 7a_100000210270_100000088970 [0,1,0,1,0,0|2,0,0]=4 20886 B16R1.949 CCOC(=O)COCCOCC1CCNC1 34a_100000748654_100000088970 [0,1,0,1,0,0|2,0,0]=4 20887 B16R1.949 CCOC(=O)COCCOCC1CCOC1 34a_100000740260_100000088970 [0,1,0,1,0,0|2,0,0]=4 20888 B16R1.949 CCOC(=O)COCCOC[C@H]1CCCN1 34a_100000745186_100000088970 [0,1,0,1,0,0|2,0,0]=4 20889 B16R1.949 CCOC(=O)COCCSCC1CCCC1 62a_100000088970_100000740388 [0,1,0,1,0,0|1,0,0]=3 20890 B16R1.949 CCOC(=O)COCCSCC1CCCC1 62a_100000740388_100000088970 [0,1,0,1,0,0|1,0,0]=3 20891 B16R1.949 CCOC(=O)COCCSCC1CCCO1 62a_100000088970_100000203698 [0,1,0,1,0,0|2,0,0]=4 20892 B16R1.949 CCOC(=O)COCCSCC1CCCO1 62a_100000203698_100000088970 [0,1,0,1,0,0|2,0,0]=4 20893 B16R1.949 CCOC(=O)COCCSCC1CCOC1 62a_100000088970_100000702531 [0,1,0,1,0,0|2,0,0]=4 20894 B16R1.949 CCOC(=O)COCCSCC1CCOC1 62a_100000702531_100000088970 [0,1,0,1,0,0|2,0,0]=4 20895 B16R1.949 CCOC(=O)CSCCCCC1OCCO1 62a_100000188475_100000034956 [0,1,0,1,0,0|2,0,0]=4 20896 B16R1.949 CCOC(=O)CSCCOCC1CCCC1 7a_200000230590_100000740388 [0,1,0,1,0,0|1,0,0]=3 20897 B16R1.949 CCOC(=O)CSCCOCC1CCCO1 7a_200000230590_100000203698 [0,1,0,1,0,0|2,0,0]=4 20898 B16R1.949 CCOC(=O)CSCCOCC1CCOC1 7a_200000230590_100000702531 [0,1,0,1,0,0|2,0,0]=4 20899 B16R1.949 CCOC(=O)NCCOCCC1CCCC1 34a_100000158857_100000760354 [0,1,0,1,0,0|1,0,0]=3 20900 B16R1.949 CCOC(=O)NCCOCCC1CCCC1 7a_100000749090_200011445536 [0,1,0,1,0,0|1,0,0]=3 20901 B16R1.949 CCOC(=O)NCCSCCC1CCCC1 62a_100000760354_200011445536 [0,1,0,1,0,0|1,0,0]=3 20902 B16R1.949 CCOC(=O)NCCSCCN1CCCC1 62a_100000700749_200011445536 [0,1,0,1,0,0|2,0,0]=4 20903 B16R1.949 CCOC(=O)OCSCCCC1CCCC1 62a_100011713738_100000075025 [0,1,0,1,0,0|1,0,0]=3 20904 B16R1.949 CCOC(=O)OCSCCCN1CCCC1 62a_100016991639_100000075025 [0,1,0,1,0,0|2,0,0]=4 20905 B16R1.1007 CCNN=C1CCCCCC1C(=O)OCC 4a_100000756455_100000740567 [0,1,0,1,0,0|1,0,1]=4 20906 B16R1.1193 CCCCCCCCCCOC1CCCO1 34a_100000085407_100000210320 [0,1,0,1,0,0|1,0,1]=4 20907 B16R1.1193 CCCCCCCCCNCC1=NCCN1 34a_100000212291_100000737910 [0,1,0,1,0,0|2,0,0]=4 20908 B16R1.1193 CCCCCCCCCNCC1CCCO1 2230a_100000212291_100000203698 [0,1,0,1,0,0|1,0,1]=4 20909 B16R1.1193 CCCCCCCCCNCC1OCCO1 2230a_100000036311_100011214924 [0,1,0,1,0,0|0,0,2]=4 20910 B16R1.1193 CCCCCCCCCNCC1OCCO1 2230a_100000212291_100000755774 [0,1,0,1,0,0|0,0,2]=4 20911 B16R1.1193 CCCCCCCCCNCC1OCCO1 34a_100000036311_100011214924 [0,1,0,1,0,0|0,0,2]=4 20912 B16R1.1193 CCCCCCCCCNCC1OCCO1 34a_100000212291_100000755774 [0,1,0,1,0,0|0,0,2]=4 20913 B16R1.1193 CCCCCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100011214924 [0,1,0,1,0,0|1,0,1]=4 20914 B16R1.1193 CCCCCCCCCNC[C@@H]1CCCO1 34a_100020590478_100011214924 [0,1,0,1,0,0|1,0,1]=4 20915 B16R1.1193 CCCCCCCCCOCC1=NCCN1 34a_100000210712_100000737910 [0,1,0,1,0,0|2,0,0]=4 20916 B16R1.1193 CCCCCCCCCOCC1=NCCN1 7a_100000210712_100000737910 [0,1,0,1,0,0|2,0,0]=4 20917 B16R1.1193 CCCCCCCCCOCC1CCCO1 34a_100000210270_100011214924 [0,1,0,1,0,0|1,0,1]=4 20918 B16R1.1193 CCCCCCCCCOCC1CCCO1 7a_100000210270_100000210328 [0,1,0,1,0,0|1,0,1]=4 20919 B16R1.1193 CCCCCCCCCOCC1CCCO1 7a_100000210712_100000203698 [0,1,0,1,0,0|1,0,1]=4 20920 B16R1.1193 CCCCCCCCCOCC1OCCO1 34a_100000087154_100011214924 [0,1,0,1,0,0|0,0,2]=4 20921 B16R1.1193 CCCCCCCCCOCC1OCCO1 34a_100000210712_100000755774 [0,1,0,1,0,0|0,0,2]=4 20922 B16R1.1193 CCCCCCCCCOCC1OCCO1 7a_100000210712_100000755774 [0,1,0,1,0,0|0,0,2]=4 20923 B16R1.1193 CCCCCCCCCSCC1=NCCN1 62a_100000737910_100000210670 [0,1,0,1,0,0|2,0,0]=4 20924 B16R1.1193 CCCCCCCCCSCC1CCCO1 62a_100000203698_100000210670 [0,1,0,1,0,0|1,0,1]=4 20925 B16R1.1193 CCCCCCCCCSCC1OCCO1 62a_100000755774_100000210670 [0,1,0,1,0,0|0,0,2]=4 20926 B16R1.1193 CCCCCCCCNCCC1OCCO1 2230a_100000034215_100000210759 [0,1,0,1,0,0|0,0,2]=4 20927 B16R1.1193 CCCCCCCCNCCC1OCCO1 2230a_100000229939_100000740749 [0,1,0,1,0,0|0,0,2]=4 20928 B16R1.1193 CCCCCCCCNCCC1OCCO1 34a_100000034215_100000210759 [0,1,0,1,0,0|0,0,2]=4 20929 B16R1.1193 CCCCCCCCNCCC1OCCO1 34a_100000229939_100000740749 [0,1,0,1,0,0|0,0,2]=4 20930 B16R1.1193 CCCCCCCCOCCC1OCCO1 34a_100000210232_100000740749 [0,1,0,1,0,0|0,0,2]=4 20931 B16R1.1193 CCCCCCCCOCCC1OCCO1 7a_100000210232_100000740749 [0,1,0,1,0,0|0,0,2]=4 20932 B16R1.1193 CCCCCCCCSCCC1OCCO1 62a_100000210759_100000740749 [0,1,0,1,0,0|0,0,2]=4 20933 B16R1.1193 CCCCCCCNCCCC1OCCO1 2230a_100000229938_100000042513 [0,1,0,1,0,0|0,0,2]=4 20934 B16R1.1193 CCCCCCCOCCCC1OCCO1 34a_100000210272_100009861162 [0,1,0,1,0,0|0,0,2]=4 20935 B16R1.1193 CCCCCCCOCCCC1OCCO1 34a_100009871617_100000210614 [0,1,0,1,0,0|0,0,2]=4 20936 B16R1.1193 CCCCCCCOCCCC1OCCO1 7a_100000210272_100000042513 [0,1,0,1,0,0|0,0,2]=4 20937 B16R1.1193 CCCCCCCOCCCC1OCCO1 7a_100009871617_100000210614 [0,1,0,1,0,0|0,0,2]=4 20938 B16R1.1193 CCCCCCCSCCCC1OCCO1 62a_100000210614_100000042513 [0,1,0,1,0,0|0,0,2]=4 20939 B16R1.1193 CCCCCCNCCCCC1OCCO1 2230a_100000210581_100000034956 [0,1,0,1,0,0|0,0,2]=4 20940 B16R1.1193 CCCCCCOCCCCC1OCCO1 34a_100000210259_200009813554 [0,1,0,1,0,0|0,0,2]=4 20941 B16R1.1193 CCCCCCOCCCCC1OCCO1 7a_100000210259_100000034956 [0,1,0,1,0,0|0,0,2]=4 20942 B16R1.1193 CCCCCCSCCCCC1OCCO1 62a_100000210314_100000034956 [0,1,0,1,0,0|0,0,2]=4 20943 B16R1.1193 CNCCCCCCCCCC1OCCO1 2230a_106832991635_103619048131 [0,1,0,1,0,0|0,0,2]=4 20944 B16R1.1193 CNCCCCCCCCCC1OCCO1 34a_100102657272_103619048131 [0,1,0,1,0,0|0,0,2]=4 20945 B16R1.1193 CNCCCCCCCCCC1OCCO1 7a_106832991635_103619048131 [0,1,0,1,0,0|0,0,2]=4 20946 B16R1.1193 COCCCCCCCCCC1OCCO1 34a_100138415774_103619048131 [0,1,0,1,0,0|0,0,2]=4 20947 B16R1.1193 CSCCCCCCCCCC1OCCO1 62a_200000210301_103619048131 [0,1,0,1,0,0|0,0,2]=4 20948 B16R1.1193 [13CH3]SCCCCCCCCCC1OCCO1 62a_200025704644_103619048131 [0,1,0,1,0,0|0,0,2]=4 20949 B16R1.1269 CCCCC1C=CCN1CCC(=O)OCC 2230a_100015184376_100011206558 [0,1,0,1,0,0|0,0,2]=4 20950 B16R1.1269 CCCCC1C=CCN1CCC(=O)OCC 269982a_100015184376_100011206558 [0,1,0,1,0,0|0,0,2]=4 20951 B16R1.1269 CCCCC1C=CCN1CCC(=O)OCC 34a_100015184376_100000765890 [0,1,0,1,0,0|0,0,2]=4 20952 B16R1.1269 CCCCC1CCCC1NCC(=O)NCC 270004a_100016988866_100000750825 [0,1,0,1,0,0|1,0,0]=3 20953 B16R1.4252 CCCNN=C1CCCC1CC(=O)OCC 4a_100000740057_100000033388 [0,1,0,1,0,0|1,0,1]=4 20954 B16R1.4434 CCOC(=O)CCCCC=NNC1CCC1 4a_100000736358_100012182868 [0,1,0,1,0,0|1,0,1]=4 20955 B16R1.4434 CCOC(=O)CCCCCCCN1CCC1 269982a_100000754969_100009991516 [0,1,0,1,0,0|0,0,0]=2 20956 B16R1.4434 CCOC(=O)CCCCCCNC1CCC1 2230a_100000749019_100009814379 [0,1,0,1,0,0|0,0,0]=2 20957 B16R1.4434 CCOC(=O)CCCCCCNC1CCC1 34a_100000749019_100009814379 [0,1,0,1,0,0|0,0,0]=2 20958 B16R1.4434 CCOC(=O)CCCCCCNC1COC1 2230a_100016991112_100009814379 [0,1,0,1,0,0|1,0,0]=3 20959 B16R1.4434 CCOC(=O)CCCCCCOC1CCC1 34a_100000748187_100009814379 [0,1,0,1,0,0|0,0,0]=2 20960 B16R1.4434 CCOC(=O)CCCCCCOC1CSC1 7a_100000072292_100009814379 [0,1,0,1,0,0|1,0,0]=3 20961 B16R1.4434 CCOC(=O)CCCCCNCC1CCC1 2230a_100000738700_100000755133 [0,1,0,1,0,0|0,0,0]=2 20962 B16R1.4434 CCOC(=O)CCCCCNCC1CCC1 34a_100000738700_100000755133 [0,1,0,1,0,0|0,0,0]=2 20963 B16R1.4434 CCOC(=O)CCCCCNCC1COC1 2230a_100015281925_100000755133 [0,1,0,1,0,0|1,0,0]=3 20964 B16R1.4434 CCOC(=O)CCCCCNCC1COC1 34a_100015281925_100000755133 [0,1,0,1,0,0|1,0,0]=3 20965 B16R1.4434 CCOC(=O)CCCCCNC[C@@H]1CCO1 2230a_100020831831_100000755133 [0,1,0,1,0,0|1,0,0]=3 20966 B16R1.4434 CCOC(=O)CCCCCNC[C@@H]1CCO1 34a_100020831831_100000755133 [0,1,0,1,0,0|1,0,0]=3 20967 B16R1.4434 CCOC(=O)CCCCCOCC1CCC1 34a_100000760304_100000755133 [0,1,0,1,0,0|0,0,0]=2 20968 B16R1.4434 CCOC(=O)CCCCCOCC1CCC1 7a_100011214988_100000763275 [0,1,0,1,0,0|0,0,0]=2 20969 B16R1.4434 CCOC(=O)CCCCCOCC1CCO1 34a_100000039022_100000755133 [0,1,0,1,0,0|1,0,0]=3 20970 B16R1.4434 CCOC(=O)CCCCCOCC1CCO1 7a_100011214988_100000103362 [0,1,0,1,0,0|1,0,0]=3 20971 B16R1.4434 CCOC(=O)CCCCCOCC1CNC1 34a_100016987283_100000755133 [0,1,0,1,0,0|1,0,0]=3 20972 B16R1.4434 CCOC(=O)CCCCCOCC1COC1 34a_100000060846_100000755133 [0,1,0,1,0,0|1,0,0]=3 20973 B16R1.4434 CCOC(=O)CCCCCOCC1COC1 7a_100011214988_100010264016 [0,1,0,1,0,0|1,0,0]=3 20974 B16R1.4434 CCOC(=O)CCCCCSCC1CCC1 62a_100000755133_100000763275 [0,1,0,1,0,0|0,0,0]=2 20975 B16R1.4434 CCOC(=O)CCCCCSCC1CCC1 62a_100000763275_100000755133 [0,1,0,1,0,0|0,0,0]=2 20976 B16R1.4434 CCOC(=O)CCCCCSCC1CCO1 62a_100000103362_100000755133 [0,1,0,1,0,0|1,0,0]=3 20977 B16R1.4434 CCOC(=O)CCCCCSCC1CCO1 62a_100000755133_100000103362 [0,1,0,1,0,0|1,0,0]=3 20978 B16R1.4434 CCOC(=O)CCCCCSCC1COC1 62a_100000755133_100010264016 [0,1,0,1,0,0|1,0,0]=3 20979 B16R1.4434 CCOC(=O)CCCCCSCC1COC1 62a_100010264016_100000755133 [0,1,0,1,0,0|1,0,0]=3 20980 B16R1.4434 CCOC(=O)CCCCOCCC1COC1 34a_100009855314_100000750268 [0,1,0,1,0,0|1,0,0]=3 20981 B16R1.4434 CCOC(=O)COCCCNCC1CCC1 2230a_100000738700_100009893628 [0,1,0,1,0,0|1,0,0]=3 20982 B16R1.4434 CCOC(=O)COCCCNCC1CCC1 34a_100000738700_100009893628 [0,1,0,1,0,0|1,0,0]=3 20983 B16R1.4434 CCOC(=O)COCCCNCC1COC1 2230a_100015281925_100009893628 [0,1,0,1,0,0|2,0,0]=4 20984 B16R1.4434 CCOC(=O)COCCCNCC1COC1 34a_100015281925_100009893628 [0,1,0,1,0,0|2,0,0]=4 20985 B16R1.4434 CCOC(=O)COCCCNC[C@@H]1CCO1 2230a_100020831831_100009893628 [0,1,0,1,0,0|2,0,0]=4 20986 B16R1.4434 CCOC(=O)COCCCNC[C@@H]1CCO1 34a_100020831831_100009893628 [0,1,0,1,0,0|2,0,0]=4 20987 B16R1.4434 CCOC(=O)COCCCOCC1CCC1 34a_100000760304_100009893628 [0,1,0,1,0,0|1,0,0]=3 20988 B16R1.4434 CCOC(=O)COCCCOCC1CCO1 34a_100000039022_100009893628 [0,1,0,1,0,0|2,0,0]=4 20989 B16R1.4434 CCOC(=O)COCCCOCC1CNC1 34a_100016987283_100009893628 [0,1,0,1,0,0|2,0,0]=4 20990 B16R1.4434 CCOC(=O)COCCCOCC1COC1 34a_100000060846_100009893628 [0,1,0,1,0,0|2,0,0]=4 20991 B16R1.4434 CCOC(=O)COCCCSCC1CCC1 62a_100000763275_100009893628 [0,1,0,1,0,0|1,0,0]=3 20992 B16R1.4434 CCOC(=O)COCCCSCC1CCC1 62a_100009893628_100000763275 [0,1,0,1,0,0|1,0,0]=3 20993 B16R1.4434 CCOC(=O)COCCCSCC1CCO1 62a_100000103362_100009893628 [0,1,0,1,0,0|2,0,0]=4 20994 B16R1.4434 CCOC(=O)COCCCSCC1CCO1 62a_100009893628_100000103362 [0,1,0,1,0,0|2,0,0]=4 20995 B16R1.4434 CCOC(=O)COCCCSCC1COC1 62a_100009893628_100010264016 [0,1,0,1,0,0|2,0,0]=4 20996 B16R1.4434 CCOC(=O)COCCCSCC1COC1 62a_100010264016_100009893628 [0,1,0,1,0,0|2,0,0]=4 20997 B16R1.4434 CCOC(=O)COCCOCCC1COC1 34a_100009855314_100000088970 [0,1,0,1,0,0|2,0,0]=4 20998 B16R1.6694 CCCC(=O)COCC1CCCN1CCC 7a_200000694710_100000747444 [0,1,0,1,0,0|2,0,0]=4 20999 B16R1.6694 CCCC1CCCC1NCCC(=O)NCC 269862a_100025743525_100000723119 [0,1,0,1,0,0|1,0,0]=3 21000 B16R1.6694 CCCC1CCCC1NCCC(=O)NCC 270004a_100025743525_100000723119 [0,1,0,1,0,0|1,0,0]=3 21001 B16R1.6694 CCCN1CCCC1COCC(=O)NCC 34a_200000694710_100000183381 [0,1,0,1,0,0|2,0,0]=4 21002 B16R1.6694 CCCN1CCCC1COCC(=O)NCC 7a_200000694710_100000183381 [0,1,0,1,0,0|2,0,0]=4 21003 B16R1.6694 CCCN1CCCC1COCC(=O)OCC 34a_200000694710_100000188475 [0,1,0,1,0,0|1,0,0]=3 21004 B16R1.6694 CCCN1CCCC1COCC(=O)OCC 7a_200000694710_100000188475 [0,1,0,1,0,0|1,0,0]=3 21005 B16R1.6694 CCOC(=O)CCCN1CCC[C@H]1COC 2230a_100020646714_100009991533 [0,1,0,1,0,0|1,0,0]=3 21006 B16R1.6694 CCOC(=O)CCCN1CCC[C@H]1COC 269982a_100020646714_100009991533 [0,1,0,1,0,0|1,0,0]=3 21007 B16R1.6694 CCOC(=O)CCCN1CCC[C@H]1COC 34a_100020646714_100009991533 [0,1,0,1,0,0|1,0,0]=3 21008 B16R1.6694 CCOC(=O)NCCN1CCC[C@H]1COC 269982a_100020646714_200011445536 [0,1,0,1,0,0|2,0,0]=4 21009 B16R1.7359 C#CCCN1CCCCC1CC(=O)OCC 2230a_100116209990_100000688953 [0,1,0,1,0,0|0,0,2]=4 21010 B16R1.7359 C#CCCN1CCCCC1CC(=O)OCC 269982a_100116209990_100000730999 [0,1,0,1,0,0|0,0,2]=4 21011 B16R1.7359 C/C=C/CN1CCCCC1CC(=O)OCC 269982a_100116209990_100102629194 [0,1,0,1,0,0|0,0,2]=4 21012 B16R1.7359 C=CCCN1CCCCC1CC(=O)OCC 2230a_100116209990_100000754431 [0,1,0,1,0,0|0,0,2]=4 21013 B16R1.7359 C=CCCN1CCCCC1CC(=O)OCC 269982a_100116209990_100000754431 [0,1,0,1,0,0|0,0,2]=4 21014 B16R1.7359 CC#CCN1CCCCC1CC(=O)OCC 2230a_100116209990_100000748600 [0,1,0,1,0,0|0,0,2]=4 21015 B16R1.7359 CC=CCN1CCCCC1CC(=O)OCC 2230a_100116209990_100000070051 [0,1,0,1,0,0|0,0,2]=4 21016 B16R1.7359 CCCC(=O)CN1CCCCC1CCCO 2230a_100011934581_100000747444 [0,1,0,1,0,0|2,0,0]=4 21017 B16R1.7359 CCCC(=O)CN1CCCCC1CCCO 269982a_100011934581_100000747444 [0,1,0,1,0,0|2,0,0]=4 21018 B16R1.7359 CCCC(=O)CN1CCCCC1CCOC 2230a_100015186528_100000747444 [0,1,0,1,0,0|2,0,0]=4 21019 B16R1.7359 CCCC(=O)CN1CCCCC1CCOC 269982a_100015186528_100000747444 [0,1,0,1,0,0|2,0,0]=4 21020 B16R1.7359 CCCCN1CCCCC1CC(=O)OCC 2230a_100116209990_100000210211 [0,1,0,1,0,0|0,0,0]=2 21021 B16R1.7359 CCCCN1CCCCC1CC(=O)OCC 269982a_100116209990_100000210211 [0,1,0,1,0,0|0,0,0]=2 21022 B16R1.7359 CCNC(=O)CN1CCCCC1CCCO 2230a_100011934581_100000183381 [0,1,0,1,0,0|2,0,0]=4 21023 B16R1.7359 CCNC(=O)CN1CCCCC1CCCO 269982a_100011934581_100000183381 [0,1,0,1,0,0|2,0,0]=4 21024 B16R1.7359 CCNC(=O)CN1CCCCC1CCCO 34a_100011934581_100000183381 [0,1,0,1,0,0|2,0,0]=4 21025 B16R1.7359 CCNC(=O)CN1CCCCC1CCOC 2230a_100015186528_100000183381 [0,1,0,1,0,0|2,0,0]=4 21026 B16R1.7359 CCNC(=O)CN1CCCCC1CCOC 269982a_100015186528_100000183381 [0,1,0,1,0,0|2,0,0]=4 21027 B16R1.7359 CCNC(=O)CN1CCCCC1CCOC 34a_100015186528_100000183381 [0,1,0,1,0,0|2,0,0]=4 21028 B16R1.7359 CCNN=C1CCCCC1CC(=O)OCC 4a_100000756455_100000719526 [0,1,0,1,0,0|1,0,1]=4 21029 B16R1.7359 CCOC(=O)CC1CCCCN1CCC#N 2230a_100116209990_100011215226 [0,1,0,1,0,0|1,0,1]=4 21030 B16R1.7359 CCOC(=O)CC1CCCCN1CCC#N 269982a_100116209990_100011215226 [0,1,0,1,0,0|1,0,1]=4 21031 B16R1.7359 CCOC(=O)CC1CCCCN1CCCF 2230a_100116209990_100011934791 [0,1,0,1,0,0|1,0,0]=3 21032 B16R1.7359 CCOC(=O)CC1CCCCN1CCCF 269982a_100116209990_100011934791 [0,1,0,1,0,0|1,0,0]=3 21033 B16R1.7359 CCOC(=O)CC1CCCCN1CCCO 2230a_100116209990_100000230001 [0,1,0,1,0,0|1,0,0]=3 21034 B16R1.7359 CCOC(=O)CC1CCCCN1CCCO 269982a_100116209990_100011215043 [0,1,0,1,0,0|1,0,0]=3 21035 B16R1.7359 CCOC(=O)CC1CCCCN1CCOC 2230a_100116209990_100011201679 [0,1,0,1,0,0|1,0,0]=3 21036 B16R1.7359 CCOC(=O)CC1CCCCN1CCOC 269982a_100116209990_100000233755 [0,1,0,1,0,0|1,0,0]=3 21037 B16R1.7359 CCOC(=O)CC1CCCCN1CCSC 2230a_100116209990_100000751147 [0,1,0,1,0,0|1,0,0]=3 21038 B16R1.7359 CCOC(=O)CC1CCCCN1CCSC 269982a_100116209990_100000212216 [0,1,0,1,0,0|1,0,0]=3 21039 B16R1.7359 CCOC(=O)CN1CCCCC1CCCO 2230a_100011934581_100000188475 [0,1,0,1,0,0|1,0,0]=3 21040 B16R1.7359 CCOC(=O)CN1CCCCC1CCCO 269982a_100011934581_100000188475 [0,1,0,1,0,0|1,0,0]=3 21041 B16R1.7359 CCOC(=O)CN1CCCCC1CCCO 34a_100011934581_100000188475 [0,1,0,1,0,0|1,0,0]=3 21042 B16R1.7359 CCOC(=O)CN1CCCCC1CCOC 2230a_100015186528_100000188475 [0,1,0,1,0,0|1,0,0]=3 21043 B16R1.7359 CCOC(=O)CN1CCCCC1CCOC 269982a_100015186528_100000188475 [0,1,0,1,0,0|1,0,0]=3 21044 B16R1.7359 CCOC(=O)CN1CCCCC1CCOC 34a_100015186528_100000188475 [0,1,0,1,0,0|1,0,0]=3 21045 B16R1.7359 CCOCN1CCCCC1CC(=O)OCC 269982a_100116209990_100000739092 [0,1,0,1,0,0|1,0,0]=3 21046 B16R1.8378 CCCCCCCCN1CCNC(=O)CC1 2230a_100000698595_100000210759 [0,1,0,1,0,0|1,0,0]=3 21047 B16R1.8378 CCCCCCCCN1CCNC(=O)CC1 269982a_100000698595_100000210759 [0,1,0,1,0,0|1,0,0]=3 21048 B16R1.8378 COCCCCCCN1CCNC(=O)CC1 2230a_100000698595_100011998445 [0,1,0,1,0,0|2,0,0]=4 21049 B16R1.8378 COCCCCCCN1CCNC(=O)CC1 269982a_100000698595_100011998445 [0,1,0,1,0,0|2,0,0]=4 21050 B16R1.8378 O=C1CCN(CCN1)CCCCCCCO 2230a_100000698595_100000760002 [0,1,0,1,0,0|2,0,0]=4 21051 B16R1.8378 O=C1CCN(CCN1)CCCCCCCO 269982a_100000698595_100000760002 [0,1,0,1,0,0|2,0,0]=4 21052 B16R1.12723 C#CCCCN1CCCCC1C(=O)OCC 2230a_100016990872_100000731252 [0,1,0,1,0,0|0,0,2]=4 21053 B16R1.12723 C#CCCCN1CCCCC1C(=O)OCC 269982a_100016990872_100011215417 [0,1,0,1,0,0|0,0,2]=4 21054 B16R1.12723 C#CCCOC1CCCCC1C(=O)OCC 7a_100000038711_100000688953 [0,1,0,1,0,0|0,0,2]=4 21055 B16R1.12723 C/C=C/COC1CCCCC1C(=O)OCC 7a_100000038711_100102629194 [0,1,0,1,0,0|0,0,2]=4 21056 B16R1.12723 C=CCCCN1CCCCC1C(=O)OCC 2230a_100016990872_100011713584 [0,1,0,1,0,0|0,0,2]=4 21057 B16R1.12723 C=CCCCN1CCCCC1C(=O)OCC 269982a_100016990872_100000757094 [0,1,0,1,0,0|0,0,2]=4 21058 B16R1.12723 C=CCCOC1CCCCC1C(=O)OCC 7a_100000038711_100000754431 [0,1,0,1,0,0|0,0,2]=4 21059 B16R1.12723 CC#CCOC1CCCCC1C(=O)OCC 7a_100000038711_100000748600 [0,1,0,1,0,0|0,0,2]=4 21060 B16R1.12723 CC/C=C\CN1CCCCC1C(=O)OCC 2230a_100016990872_100103147603 [0,1,0,1,0,0|0,0,2]=4 21061 B16R1.12723 CC/C=C\CN1CCCCC1C(=O)OCC 269982a_100016990872_100103147603 [0,1,0,1,0,0|0,0,2]=4 21062 B16R1.12723 CC=CCOC1CCCCC1C(=O)OCC 7a_100000038711_100000070051 [0,1,0,1,0,0|0,0,2]=4 21063 B16R1.12723 CCC#CCN1CCCCC1C(=O)OCC 2230a_100016990872_100009813939 [0,1,0,1,0,0|0,0,2]=4 21064 B16R1.12723 CCCC(=O)N1CCCCC1CCCOC 11a_100011804088_100000211992 [0,1,0,1,0,0|2,0,0]=4 21065 B16R1.12723 CCCC(=O)N1CCCCC1CCCOC 1626a_100011804088_100000211992 [0,1,0,1,0,0|2,0,0]=4 21066 B16R1.12723 CCCC(=O)N1CCCCC1CCCOC 240690a_100011804088_100000211992 [0,1,0,1,0,0|2,0,0]=4 21067 B16R1.12723 CCCC(=O)N1CCCCC1CCCOC 527a_100011804088_100000211992 [0,1,0,1,0,0|2,0,0]=4 21068 B16R1.12723 CCCCCN1CCCCC1C(=O)OCC 2230a_100016990872_100000210326 [0,1,0,1,0,0|0,0,0]=2 21069 B16R1.12723 CCCCCN1CCCCC1C(=O)OCC 269982a_100016990872_100000210215 [0,1,0,1,0,0|0,0,0]=2 21070 B16R1.12723 CCCCCN1CCOC[C@H]1C(=O)OCC 2230a_100015229691_100000210326 [0,1,0,1,0,0|1,0,0]=3 21071 B16R1.12723 CCCCCN1CCOC[C@H]1C(=O)OCC 269982a_100015229691_100000210215 [0,1,0,1,0,0|1,0,0]=3 21072 B16R1.12723 CCCCCN1CCSCC1C(=O)OCC 2230a_100000735462_100000210326 [0,1,0,1,0,0|1,0,0]=3 21073 B16R1.12723 CCCCCN1CCSCC1C(=O)OCC 269982a_100000735462_100000210215 [0,1,0,1,0,0|1,0,0]=3 21074 B16R1.12723 CCCCOC1CCCCC1C(=O)OCC 7a_100000038711_100000210211 [0,1,0,1,0,0|0,0,0]=2 21075 B16R1.12723 CCCNN=C1CCCCC1C(=O)OCC 4a_100000740057_100000211989 [0,1,0,1,0,0|1,0,1]=4 21076 B16R1.12723 CCNC(=O)N1CCCCC1CCCOC 2708a_100015525214_100011804088 [0,1,0,1,0,0|2,0,0]=4 21077 B16R1.12723 CCNC(=O)N1CCCCC1CCCOC 273464a_100015525214_100011804088 [0,1,0,1,0,0|2,0,0]=4 21078 B16R1.12723 CCOC(=O)C1CCCCC1OCCC#N 7a_100000038711_100000184422 [0,1,0,1,0,0|1,0,1]=4 21079 B16R1.12723 CCOC(=O)C1CCCCC1OCCCF 7a_100000038711_100011934791 [0,1,0,1,0,0|1,0,0]=3 21080 B16R1.12723 CCOC(=O)C1CCCCC1OCCCO 7a_100000038711_100011215043 [0,1,0,1,0,0|1,0,0]=3 21081 B16R1.12723 CCOC(=O)C1CCCCC1OCCOC 7a_100000038711_100000233755 [0,1,0,1,0,0|1,0,0]=3 21082 B16R1.12723 CCOC(=O)C1CCCCC1OCCSC 7a_100000038711_100000212216 [0,1,0,1,0,0|1,0,0]=3 21083 B16R1.12723 CCOC(=O)C1CCCCN1CCCC#N 2230a_100016990872_100000687738 [0,1,0,1,0,0|1,0,1]=4 21084 B16R1.12723 CCOC(=O)C1CCCCN1CCCC#N 269982a_100016990872_100000687738 [0,1,0,1,0,0|1,0,1]=4 21085 B16R1.12723 CCOC(=O)C1CCCCN1CCCC=O 2230a_100016990872_200011292268 [0,1,0,1,0,0|1,0,1]=4 21086 B16R1.12723 CCOC(=O)C1CCCCN1CCCC=O 269982a_100016990872_200011292268 [0,1,0,1,0,0|1,0,1]=4 21087 B16R1.12723 CCOC(=O)C1CCCCN1CCCCF 2230a_100016990872_100000729493 [0,1,0,1,0,0|1,0,0]=3 21088 B16R1.12723 CCOC(=O)C1CCCCN1CCCCF 269982a_100016990872_100000729493 [0,1,0,1,0,0|1,0,0]=3 21089 B16R1.12723 CCOC(=O)C1CCCCN1CCCCO 2230a_100016990872_100000210776 [0,1,0,1,0,0|1,0,0]=3 21090 B16R1.12723 CCOC(=O)C1CCCCN1CCCCO 269982a_100016990872_100000210776 [0,1,0,1,0,0|1,0,0]=3 21091 B16R1.12723 CCOC(=O)C1CCCCN1CCCOC 2230a_100016990872_100000740836 [0,1,0,1,0,0|1,0,0]=3 21092 B16R1.12723 CCOC(=O)C1CCCCN1CCCOC 269982a_100016990872_100000740836 [0,1,0,1,0,0|1,0,0]=3 21093 B16R1.12723 CCOC(=O)C1CCCCN1CCSCC 2230a_100016990872_100000757381 [0,1,0,1,0,0|1,0,0]=3 21094 B16R1.12723 CCOC(=O)C1CCCCN1CCSCC 269982a_100016990872_100000757381 [0,1,0,1,0,0|1,0,0]=3 21095 B16R1.12723 CCOC(=O)C1CSCCN1CCCCF 2230a_100000735462_100000729493 [0,1,0,1,0,0|2,0,0]=4 21096 B16R1.12723 CCOC(=O)C1CSCCN1CCCCF 269982a_100000735462_100000729493 [0,1,0,1,0,0|2,0,0]=4 21097 B16R1.12723 CCOC(=O)C1CSCCN1CCCCO 2230a_100000735462_100000210776 [0,1,0,1,0,0|2,0,0]=4 21098 B16R1.12723 CCOC(=O)C1CSCCN1CCCCO 269982a_100000735462_100000210776 [0,1,0,1,0,0|2,0,0]=4 21099 B16R1.12723 CCOC(=O)C1CSCCN1CCCOC 2230a_100000735462_100000740836 [0,1,0,1,0,0|2,0,0]=4 21100 B16R1.12723 CCOC(=O)C1CSCCN1CCCOC 269982a_100000735462_100000740836 [0,1,0,1,0,0|2,0,0]=4 21101 B16R1.12723 CCOC(=O)C1CSCCN1CCSCC 2230a_100000735462_100000757381 [0,1,0,1,0,0|2,0,0]=4 21102 B16R1.12723 CCOC(=O)C1CSCCN1CCSCC 269982a_100000735462_100000757381 [0,1,0,1,0,0|2,0,0]=4 21103 B16R1.12723 CCOC(=O)[C@@H]1COCCN1CCCCF 2230a_100015229691_100000729493 [0,1,0,1,0,0|2,0,0]=4 21104 B16R1.12723 CCOC(=O)[C@@H]1COCCN1CCCCF 269982a_100015229691_100000729493 [0,1,0,1,0,0|2,0,0]=4 21105 B16R1.12723 CCOC(=O)[C@@H]1COCCN1CCCCO 2230a_100015229691_100000210776 [0,1,0,1,0,0|2,0,0]=4 21106 B16R1.12723 CCOC(=O)[C@@H]1COCCN1CCCCO 269982a_100015229691_100000210776 [0,1,0,1,0,0|2,0,0]=4 21107 B16R1.12723 CCOC(=O)[C@@H]1COCCN1CCCOC 2230a_100015229691_100000740836 [0,1,0,1,0,0|2,0,0]=4 21108 B16R1.12723 CCOC(=O)[C@@H]1COCCN1CCCOC 269982a_100015229691_100000740836 [0,1,0,1,0,0|2,0,0]=4 21109 B16R1.12723 CCOC(=O)[C@@H]1COCCN1CCSCC 2230a_100015229691_100000757381 [0,1,0,1,0,0|2,0,0]=4 21110 B16R1.12723 CCOC(=O)[C@@H]1COCCN1CCSCC 269982a_100015229691_100000757381 [0,1,0,1,0,0|2,0,0]=4 21111 B16R1.12723 CCOCCN1CCCCC1C(=O)OCC 2230a_100016990872_100011215890 [0,1,0,1,0,0|1,0,0]=3 21112 B16R1.12723 CCOCCN1CCCCC1C(=O)OCC 269982a_100016990872_100011215890 [0,1,0,1,0,0|1,0,0]=3 21113 B16R1.12723 CCOCCN1CCOC[C@H]1C(=O)OCC 2230a_100015229691_100011215890 [0,1,0,1,0,0|2,0,0]=4 21114 B16R1.12723 CCOCCN1CCOC[C@H]1C(=O)OCC 269982a_100015229691_100011215890 [0,1,0,1,0,0|2,0,0]=4 21115 B16R1.12723 CCOCCN1CCSCC1C(=O)OCC 2230a_100000735462_100011215890 [0,1,0,1,0,0|2,0,0]=4 21116 B16R1.12723 CCOCCN1CCSCC1C(=O)OCC 269982a_100000735462_100011215890 [0,1,0,1,0,0|2,0,0]=4 21117 B16R1.12880 CCCCCCCCN1CC[C@@H](C1)OCC 2230a_100011787710_100000210759 [0,1,0,1,0,0|1,0,1]=4 21118 B16R1.12880 CCCCCCCCN1CC[C@@H](C1)OCC 269982a_100011787710_100000210759 [0,1,0,1,0,0|1,0,1]=4 21119 B16R1.12880 CCCCCCCCN1CC[C@@H](C1)OCC 34a_100011787710_100000210759 [0,1,0,1,0,0|1,0,1]=4 21120 B16R1.14009 CCNC(=O)CCNCCC1CCCN1C 34a_100025743525_100000005710 [0,1,0,1,0,0|2,0,0]=4 21121 B16R1.14009 CCNC(=O)CCOCCC1CCCN1C 7a_100011215177_100000737597 [0,1,0,1,0,0|2,0,0]=4 21122 B16R1.14009 CCNC(=O)CCSCCC1CCCN1C 62a_100000005710_100000737597 [0,1,0,1,0,0|2,0,0]=4 21123 B16R1.14009 CCNC(=O)CCSCCC1CCCN1C 62a_100000737597_100000005710 [0,1,0,1,0,0|2,0,0]=4 21124 B16R1.14009 CCOC(=O)CCCCCN1CCC[C@@H]1C 2230a_100020605311_100000755133 [0,1,0,1,0,0|0,0,0]=2 21125 B16R1.14009 CCOC(=O)CCCCCN1CCC[C@@H]1C 269982a_100020605311_100000755133 [0,1,0,1,0,0|0,0,0]=2 21126 B16R1.14009 CCOC(=O)CCCCCN1CCC[C@H]1C 2230a_100015189458_100000755133 [0,1,0,1,0,0|0,0,0]=2 21127 B16R1.14009 CCOC(=O)CCCCCN1CCC[C@H]1C 269982a_100015189458_100000755133 [0,1,0,1,0,0|0,0,0]=2 21128 B16R1.14009 CCOC(=O)CCCCCN1CCC[C@H]1C 34a_100015189458_100000755133 [0,1,0,1,0,0|0,0,0]=2 21129 B16R1.14009 CCOC(=O)CCCCCN1CCSC1C 2230a_200011216479_100000755133 [0,1,0,1,0,0|1,0,0]=3 21130 B16R1.14009 CCOC(=O)CCCCCN1CCSC1C 269982a_200011216479_100000755133 [0,1,0,1,0,0|1,0,0]=3 21131 B16R1.14009 CCOC(=O)CCCCCN1CCSC1C 34a_200011216479_100000755133 [0,1,0,1,0,0|1,0,0]=3 21132 B16R1.14009 CCOC(=O)CCCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000750268 [0,1,0,1,0,0|2,0,0]=4 21133 B16R1.14009 CCOC(=O)CCCCOC1CCCC1=O 34a_200000719330_100000750268 [0,1,0,1,0,0|1,0,1]=4 21134 B16R1.14009 CCOC(=O)CCCCOC1CCCC1C 34a_100011216460_100000750268 [0,1,0,1,0,0|0,0,0]=2 21135 B16R1.14009 CCOC(=O)CCCCOC1CCCC1C 7a_100011216460_100000750268 [0,1,0,1,0,0|0,0,0]=2 21136 B16R1.14009 CCOC(=O)CCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000750268 [0,1,0,1,0,0|1,0,0]=3 21137 B16R1.14009 CCOC(=O)CCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000750268 [0,1,0,1,0,0|1,0,0]=3 21138 B16R1.14009 CCOC(=O)CCCCO[C@H]1CNC[C@H]1C 34a_200015306588_100000750268 [0,1,0,1,0,0|1,0,0]=3 21139 B16R1.14009 CCOC(=O)CCCCO[C@H]1COC[C@@H]1N 34a_100015191717_100000750268 [0,1,0,1,0,0|2,0,0]=4 21140 B16R1.14009 CCOC(=O)CCCCSC1CCCC1=O 62a_100000211823_100000750268 [0,1,0,1,0,0|1,0,1]=4 21141 B16R1.14009 CCOC(=O)CCCCSC1CCCC1=O 62a_100000750268_100000211823 [0,1,0,1,0,0|1,0,1]=4 21142 B16R1.14009 CCOC(=O)CCCCSC1COCC1O 62a_100000750268_200000725654 [0,1,0,1,0,0|2,0,0]=4 21143 B16R1.14009 CCOC(=O)CCCCSC1COCC1O 62a_200000725654_100000750268 [0,1,0,1,0,0|2,0,0]=4 21144 B16R1.14009 CCOC(=O)CCCCS[C@@H]1CCC[C@H]1O 62a_100000750268_200016002552 [0,1,0,1,0,0|1,0,0]=3 21145 B16R1.14009 CCOC(=O)CCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000750268 [0,1,0,1,0,0|1,0,0]=3 21146 B16R1.14009 CCOC(=O)CCCOCC1CCCN1C 34a_100000743107_100009991533 [0,1,0,1,0,0|1,0,0]=3 21147 B16R1.14009 CCOC(=O)CCOCCC1CCCN1C 34a_100011215177_100000765890 [0,1,0,1,0,0|1,0,0]=3 21148 B16R1.14009 CCOC(=O)CCOCCC1CCCN1C 7a_100011215177_100011206558 [0,1,0,1,0,0|1,0,0]=3 21149 B16R1.14009 CCOC(=O)CCSCCC1CCCN1C 62a_100000005710_100000765890 [0,1,0,1,0,0|1,0,0]=3 21150 B16R1.14009 CCOC(=O)CCSCCC1CCCN1C 62a_100000765890_100000005710 [0,1,0,1,0,0|1,0,0]=3 21151 B16R1.14009 CCOC(=O)COCCCN1CCC[C@@H]1C 2230a_100020605311_100009893628 [0,1,0,1,0,0|1,0,0]=3 21152 B16R1.14009 CCOC(=O)COCCCN1CCC[C@@H]1C 269982a_100020605311_100009893628 [0,1,0,1,0,0|1,0,0]=3 21153 B16R1.14009 CCOC(=O)COCCCN1CCC[C@H]1C 2230a_100015189458_100009893628 [0,1,0,1,0,0|1,0,0]=3 21154 B16R1.14009 CCOC(=O)COCCCN1CCC[C@H]1C 269982a_100015189458_100009893628 [0,1,0,1,0,0|1,0,0]=3 21155 B16R1.14009 CCOC(=O)COCCCN1CCC[C@H]1C 34a_100015189458_100009893628 [0,1,0,1,0,0|1,0,0]=3 21156 B16R1.14009 CCOC(=O)COCCCN1CCSC1C 2230a_200011216479_100009893628 [0,1,0,1,0,0|2,0,0]=4 21157 B16R1.14009 CCOC(=O)COCCCN1CCSC1C 269982a_200011216479_100009893628 [0,1,0,1,0,0|2,0,0]=4 21158 B16R1.14009 CCOC(=O)COCCCN1CCSC1C 34a_200011216479_100009893628 [0,1,0,1,0,0|2,0,0]=4 21159 B16R1.14009 CCOC(=O)COCCOC1CCCC1C 34a_100011216460_100000088970 [0,1,0,1,0,0|1,0,0]=3 21160 B16R1.14009 CCOC(=O)COCCOC1CCCC1C 7a_100011216460_100000088970 [0,1,0,1,0,0|1,0,0]=3 21161 B16R1.14009 CCOC(=O)COCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000088970 [0,1,0,1,0,0|2,0,0]=4 21162 B16R1.14009 CCOC(=O)COCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000088970 [0,1,0,1,0,0|2,0,0]=4 21163 B16R1.14009 CCOC(=O)COCCO[C@H]1CNC[C@H]1C 34a_200015306588_100000088970 [0,1,0,1,0,0|2,0,0]=4 21164 B16R1.14009 CCOC(=O)COCCS[C@@H]1CCC[C@H]1O 62a_100000088970_200016002552 [0,1,0,1,0,0|2,0,0]=4 21165 B16R1.14009 CCOC(=O)COCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000088970 [0,1,0,1,0,0|2,0,0]=4 21166 B16R1.14009 CCOC(=O)OCSCCC1CCCN1C 62a_100000005710_100000075025 [0,1,0,1,0,0|2,0,0]=4 21167 B16R1.14018 CCOC(=O)CCCCCCN1CCC1C 269982a_100000755817_100009814379 [0,1,0,1,0,0|0,0,0]=2 21168 B16R1.14018 CCOC(=O)CCCCCCN1CCC1C 34a_100000755817_100009814379 [0,1,0,1,0,0|0,0,0]=2 21169 B16R1.14018 CCOC(=O)CCCCCOC1CCC1=O 7a_100011214988_100009892977 [0,1,0,1,0,0|1,0,1]=4 21170 B16R1.14018 CCOC(=O)CCCCCSC1CCC1=O 62a_100000755133_100009892977 [0,1,0,1,0,0|1,0,1]=4 21171 B16R1.14018 CCOC(=O)CCCCCSC1CCC1=O 62a_100009892977_100000755133 [0,1,0,1,0,0|1,0,1]=4 21172 B16R1.14018 CCOC(=O)CCCOCCC1CCC1=O 7a_100012001163_200016118888 [0,1,0,1,0,0|1,0,1]=4 21173 B16R1.14018 CCOC(=O)CCCSCCC1CCC1=O 62a_100009991533_200016118888 [0,1,0,1,0,0|1,0,1]=4 21174 B16R1.14018 CCOC(=O)CCCSCCC1CCC1=O 62a_200016118888_100009991533 [0,1,0,1,0,0|1,0,1]=4 21175 B16R1.17465 C#CCCCCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100010269958 [0,1,0,1,0,0|0,0,2]=4 21176 B16R1.17465 C#CCCCCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100010269958 [0,1,0,1,0,0|0,0,2]=4 21177 B16R1.17465 C#CCCCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100011215417 [0,1,0,1,0,0|0,0,2]=4 21178 B16R1.17465 C=CCCCCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100011215482 [0,1,0,1,0,0|0,0,2]=4 21179 B16R1.17465 C=CCCCCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100011215482 [0,1,0,1,0,0|0,0,2]=4 21180 B16R1.17465 C=CCCCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100000757094 [0,1,0,1,0,0|0,0,2]=4 21181 B16R1.17465 CC/C=C\CCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100015370543 [0,1,0,1,0,0|0,0,2]=4 21182 B16R1.17465 CC/C=C\CCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100015370543 [0,1,0,1,0,0|0,0,2]=4 21183 B16R1.17465 CC/C=C\CO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100103147603 [0,1,0,1,0,0|0,0,2]=4 21184 B16R1.17465 CCC#CCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100009813939 [0,1,0,1,0,0|0,0,2]=4 21185 B16R1.17465 CCCCCCN1CCC[C@H]1C(=O)NCC 2230a_100020641767_100000210314 [0,1,0,1,0,0|1,0,0]=3 21186 B16R1.17465 CCCCCCN1CCC[C@H]1C(=O)NCC 269982a_100020641767_100000210757 [0,1,0,1,0,0|1,0,0]=3 21187 B16R1.17465 CCCCCCN1CCC[C@H]1C(=O)NCC 34a_100020641767_100000210314 [0,1,0,1,0,0|1,0,0]=3 21188 B16R1.17465 CCCCCCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100000210314 [0,1,0,1,0,0|0,0,0]=2 21189 B16R1.17465 CCCCCCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100000210757 [0,1,0,1,0,0|0,0,0]=2 21190 B16R1.17465 CCCCCCN1CSC[C@H]1C(=O)OCC 269982a_100016989239_100000210757 [0,1,0,1,0,0|1,0,0]=3 21191 B16R1.17465 CCCCCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100000210326 [0,1,0,1,0,0|0,0,0]=2 21192 B16R1.17465 CCCCNN=C1CCCC1C(=O)OCC 4a_100025702795_100000183750 [0,1,0,1,0,0|1,0,1]=4 21193 B16R1.17465 CCCCOCN1CCC[C@H]1C(=O)NCC 2230a_100020641767_100011995733 [0,1,0,1,0,0|2,0,0]=4 21194 B16R1.17465 CCCCOCN1CCC[C@H]1C(=O)NCC 269982a_100020641767_100011995733 [0,1,0,1,0,0|2,0,0]=4 21195 B16R1.17465 CCCCOCN1CCC[C@H]1C(=O)NCC 34a_100020641767_100011995733 [0,1,0,1,0,0|2,0,0]=4 21196 B16R1.17465 CCCCOCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100011995733 [0,1,0,1,0,0|1,0,0]=3 21197 B16R1.17465 CCCCOCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100011995733 [0,1,0,1,0,0|1,0,0]=3 21198 B16R1.17465 CCCCOCN1CSC[C@H]1C(=O)OCC 269982a_100016989239_100011995733 [0,1,0,1,0,0|2,0,0]=4 21199 B16R1.17465 CCCOCCN1CCC[C@H]1C(=O)NCC 2230a_100020641767_100011215938 [0,1,0,1,0,0|2,0,0]=4 21200 B16R1.17465 CCCOCCN1CCC[C@H]1C(=O)NCC 269982a_100020641767_100011215938 [0,1,0,1,0,0|2,0,0]=4 21201 B16R1.17465 CCCOCCN1CCC[C@H]1C(=O)NCC 34a_100020641767_100011215938 [0,1,0,1,0,0|2,0,0]=4 21202 B16R1.17465 CCCOCCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100011215938 [0,1,0,1,0,0|1,0,0]=3 21203 B16R1.17465 CCCOCCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100011215938 [0,1,0,1,0,0|1,0,0]=3 21204 B16R1.17465 CCCOCCN1CSC[C@H]1C(=O)OCC 269982a_100016989239_100011215938 [0,1,0,1,0,0|2,0,0]=4 21205 B16R1.17465 CCNC(=O)[C@@H]1CCCN1CCCCCF 2230a_100020641767_100000729378 [0,1,0,1,0,0|2,0,0]=4 21206 B16R1.17465 CCNC(=O)[C@@H]1CCCN1CCCCCF 269982a_100020641767_100000729378 [0,1,0,1,0,0|2,0,0]=4 21207 B16R1.17465 CCNC(=O)[C@@H]1CCCN1CCCCCF 34a_100020641767_100000729378 [0,1,0,1,0,0|2,0,0]=4 21208 B16R1.17465 CCNC(=O)[C@@H]1CCCN1CCCCCO 2230a_100020641767_100000746330 [0,1,0,1,0,0|2,0,0]=4 21209 B16R1.17465 CCNC(=O)[C@@H]1CCCN1CCCCCO 269982a_100020641767_100000746330 [0,1,0,1,0,0|2,0,0]=4 21210 B16R1.17465 CCNC(=O)[C@@H]1CCCN1CCCCCO 34a_100020641767_100000746330 [0,1,0,1,0,0|2,0,0]=4 21211 B16R1.17465 CCNC(=O)[C@@H]1CCCN1CCCCOC 2230a_100020641767_100000730899 [0,1,0,1,0,0|2,0,0]=4 21212 B16R1.17465 CCNC(=O)[C@@H]1CCCN1CCCCOC 269982a_100020641767_100000730899 [0,1,0,1,0,0|2,0,0]=4 21213 B16R1.17465 CCNC(=O)[C@@H]1CCCN1CCCCOC 34a_100020641767_100000755781 [0,1,0,1,0,0|2,0,0]=4 21214 B16R1.17465 CCNC(=O)[C@@H]1CCCN1CCCOCC 2230a_100020641767_100012232248 [0,1,0,1,0,0|2,0,0]=4 21215 B16R1.17465 CCNC(=O)[C@@H]1CCCN1CCCOCC 269982a_100020641767_100012232248 [0,1,0,1,0,0|2,0,0]=4 21216 B16R1.17465 CCNC(=O)[C@@H]1CCCN1CCCOCC 34a_100020641767_100012232248 [0,1,0,1,0,0|2,0,0]=4 21217 B16R1.17465 CCOC(=O)[C@@H]1CCCN1CCCCC#N 2230a_100000703725_100000211819 [0,1,0,1,0,0|1,0,1]=4 21218 B16R1.17465 CCOC(=O)[C@@H]1CCCN1CCCCC#N 269982a_100000703725_100011219923 [0,1,0,1,0,0|1,0,1]=4 21219 B16R1.17465 CCOC(=O)[C@@H]1CCCN1CCCCC=O 2230a_100000703725_100000139335 [0,1,0,1,0,0|1,0,1]=4 21220 B16R1.17465 CCOC(=O)[C@@H]1CCCN1CCCCC=O 269982a_100000703725_100000139335 [0,1,0,1,0,0|1,0,1]=4 21221 B16R1.17465 CCOC(=O)[C@@H]1CCCN1CCCCCF 2230a_100000703725_100000729378 [0,1,0,1,0,0|1,0,0]=3 21222 B16R1.17465 CCOC(=O)[C@@H]1CCCN1CCCCCF 269982a_100000703725_100000729378 [0,1,0,1,0,0|1,0,0]=3 21223 B16R1.17465 CCOC(=O)[C@@H]1CCCN1CCCCCO 2230a_100000703725_100000746330 [0,1,0,1,0,0|1,0,0]=3 21224 B16R1.17465 CCOC(=O)[C@@H]1CCCN1CCCCCO 269982a_100000703725_100000746330 [0,1,0,1,0,0|1,0,0]=3 21225 B16R1.17465 CCOC(=O)[C@@H]1CCCN1CCCCOC 2230a_100000703725_100000730899 [0,1,0,1,0,0|1,0,0]=3 21226 B16R1.17465 CCOC(=O)[C@@H]1CCCN1CCCCOC 269982a_100000703725_100000730899 [0,1,0,1,0,0|1,0,0]=3 21227 B16R1.17465 CCOC(=O)[C@@H]1CCCN1CCOCCO 2230a_100000703725_100011215305 [0,1,0,1,0,0|2,0,0]=4 21228 B16R1.17465 CCOC(=O)[C@@H]1CCCN1CCOCCO 269982a_100000703725_100011215305 [0,1,0,1,0,0|2,0,0]=4 21229 B16R1.17465 CCOC(=O)[C@@H]1CCCN1COCCOC 2230a_100000703725_100000231047 [0,1,0,1,0,0|2,0,0]=4 21230 B16R1.17465 CCOC(=O)[C@@H]1CCCN1COCCOC 269982a_100000703725_100000231047 [0,1,0,1,0,0|2,0,0]=4 21231 B16R1.17465 CCOC(=O)[C@@H]1CCC[C@@H]1OCCCC#N 7a_200015395474_100000687738 [0,1,0,1,0,0|1,0,1]=4 21232 B16R1.17465 CCOC(=O)[C@@H]1CCC[C@@H]1OCCCC=O 7a_200015395474_200011292268 [0,1,0,1,0,0|1,0,1]=4 21233 B16R1.17465 CCOC(=O)[C@@H]1CCC[C@@H]1OCCCCF 7a_200015395474_100000729493 [0,1,0,1,0,0|1,0,0]=3 21234 B16R1.17465 CCOC(=O)[C@@H]1CCC[C@@H]1OCCCCO 7a_200015395474_100000210776 [0,1,0,1,0,0|1,0,0]=3 21235 B16R1.17465 CCOC(=O)[C@@H]1CCC[C@@H]1OCCCOC 7a_200015395474_100000740836 [0,1,0,1,0,0|1,0,0]=3 21236 B16R1.17465 CCOC(=O)[C@@H]1CCC[C@@H]1OCCSCC 7a_200015395474_100000757381 [0,1,0,1,0,0|1,0,0]=3 21237 B16R1.17465 CCOC(=O)[C@@H]1CSCN1CCCCCF 269982a_100016989239_100000729378 [0,1,0,1,0,0|2,0,0]=4 21238 B16R1.17465 CCOC(=O)[C@@H]1CSCN1CCCCCO 269982a_100016989239_100000746330 [0,1,0,1,0,0|2,0,0]=4 21239 B16R1.17465 CCOC(=O)[C@@H]1CSCN1CCCCOC 269982a_100016989239_100000730899 [0,1,0,1,0,0|2,0,0]=4 21240 B16R1.17465 CCOCCCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100012232248 [0,1,0,1,0,0|1,0,0]=3 21241 B16R1.17465 CCOCCCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100012232248 [0,1,0,1,0,0|1,0,0]=3 21242 B16R1.17465 CCOCCCN1CSC[C@H]1C(=O)OCC 269982a_100016989239_100012232248 [0,1,0,1,0,0|2,0,0]=4 21243 B16R1.17465 CCOCCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100011215890 [0,1,0,1,0,0|1,0,0]=3 21244 B16R1.17545 CCCCCCCCCN1CC(C1)OCC 269982a_100000732654_100000210670 [0,1,0,1,0,0|1,0,1]=4 21245 B16R1.17545 CCCCCCCCCN1CC(C1)OCC 34a_100000732654_100011214924 [0,1,0,1,0,0|1,0,1]=4 21246 B16R1.17792 CCCCCCCN1CCNC(=O)C1CC 2230a_100000187962_100000210681 [0,1,0,1,0,0|2,0,0]=4 21247 B16R1.17792 CCCCCCCN1CCNC(=O)C1CC 269982a_100000187962_100000210681 [0,1,0,1,0,0|2,0,0]=4 21248 B16R1.17792 CCCCCCCN1CCNC(=O)C1CC 34a_100000187962_100000210614 [0,1,0,1,0,0|2,0,0]=4 21249 B16R1.17796 CCCCCCCN1CCCC(C1)OCC 2230a_100000745229_100000210681 [0,1,0,1,0,0|1,0,1]=4 21250 B16R1.17796 CCCCCCCN1CCCC(C1)OCC 269982a_100000745229_100000210681 [0,1,0,1,0,0|1,0,1]=4 21251 B16R1.17796 CCCCCCCN1CCCC(C1)OCC 34a_100000745229_100000210614 [0,1,0,1,0,0|1,0,1]=4 21252 B16R1.20656 C=CCCCCCCCCCC(=O)C1CC1 1458a_100000210395_100009814027 [0,1,0,1,0,0|1,0,1]=4 21253 B16R1.20656 CCCCCCCCCCCC(=O)C1CC1 1458a_100000210395_100011215454 [0,1,0,1,0,0|1,0,0]=3 21254 B16R1.20656 CCCCCCCCCCCC(=O)C1CO1 1458a_100000701028_100011215454 [0,1,0,1,0,0|2,0,0]=4 21255 B16R1.20656 CCCCCCCCCCNC(=O)C1CC1 11a_100000684558_100000210395 [0,1,0,1,0,0|1,0,0]=3 21256 B16R1.20656 CCCCCCCCCCNC(=O)C1CC1 1626a_100000684558_100000210395 [0,1,0,1,0,0|1,0,0]=3 21257 B16R1.20656 CCCCCCCCCCNC(=O)C1CC1 240690a_100000684558_100000210395 [0,1,0,1,0,0|1,0,0]=3 21258 B16R1.20656 CCCCCCCCCCNC(=O)C1CC1 527a_100000684558_100000210395 [0,1,0,1,0,0|1,0,0]=3 21259 B16R1.20656 CCCCCCCCCCNC(=O)C1CO1 11a_100000684558_100000701028 [0,1,0,1,0,0|2,0,0]=4 21260 B16R1.20656 CCCCCCCCCCNC(=O)C1CO1 1626a_100000684558_100000701028 [0,1,0,1,0,0|2,0,0]=4 21261 B16R1.20656 CCCCCCCCCCNC(=O)C1CO1 240690a_100000684558_100000701028 [0,1,0,1,0,0|2,0,0]=4 21262 B16R1.20656 CCCCCCCCCCNC(=O)C1CO1 527a_100000684558_100000701028 [0,1,0,1,0,0|2,0,0]=4 21263 B16R1.20656 CCCCCCCCCNCC(=O)C1CC1 2230a_100000212291_100000746382 [0,1,0,1,0,0|1,0,0]=3 21264 B16R1.20656 CCCCCCCCCNCC(=O)C1CC1 34a_100000212291_100000746382 [0,1,0,1,0,0|1,0,0]=3 21265 B16R1.20656 CCCCCCCCCOCC(=O)C1CC1 34a_100000210712_100000746382 [0,1,0,1,0,0|1,0,0]=3 21266 B16R1.20656 CCCCCCCCCOCC(=O)C1CC1 34a_100000686663_100011214924 [0,1,0,1,0,0|1,0,0]=3 21267 B16R1.20656 CCCCCCCCCOCC(=O)C1CC1 7a_100000210712_100000746382 [0,1,0,1,0,0|1,0,0]=3 21268 B16R1.20656 CCCCCCCCCSCC(=O)C1CC1 62a_100000746382_100000210670 [0,1,0,1,0,0|1,0,0]=3 21269 B16R1.20656 CCCCCCCCNCOC(=O)C1CC1 2230a_100000229939_100000140896 [0,1,0,1,0,0|2,0,0]=4 21270 B16R1.20656 CCCCCCCCNCOC(=O)C1CC1 34a_100000229939_100000140896 [0,1,0,1,0,0|2,0,0]=4 21271 B16R1.20656 CCCCCCCCOCOC(=O)C1CC1 34a_100000210232_100000140896 [0,1,0,1,0,0|2,0,0]=4 21272 B16R1.20656 CCCCCCCCSCOC(=O)C1CC1 62a_100000140896_100000210317 [0,1,0,1,0,0|2,0,0]=4 21273 B16R1.20656 CCCCCCCCSCOC(=O)C1CC1 62a_100000210759_100000140896 [0,1,0,1,0,0|2,0,0]=4 21274 B16R1.20656 CCCCCCOCCOCC(=O)C1CC1 34a_100000691444_100000746382 [0,1,0,1,0,0|2,0,0]=4 21275 B16R1.20656 CCCCCCOCCOCC(=O)C1CC1 7a_100000691444_100000746382 [0,1,0,1,0,0|2,0,0]=4 21276 B16R1.20656 CCCCNCCCCOCC(=O)C1CC1 34a_200011216965_100000746382 [0,1,0,1,0,0|2,0,0]=4 21277 B16R1.20656 CCCCOCCCCOCC(=O)C1CC1 34a_200000760531_100000746382 [0,1,0,1,0,0|2,0,0]=4 21278 B16R1.20656 CCCCOCCCCOCC(=O)C1CC1 7a_200000760531_100000746382 [0,1,0,1,0,0|2,0,0]=4 21279 B16R1.20656 NCCCCCCCCOCC(=O)C1CC1 34a_102515433106_100000746382 [0,1,0,1,0,0|2,0,0]=4 21280 B16R1.20656 O=C(CCCCCCCCCCO)C1CC1 1458a_100000210395_100009813290 [0,1,0,1,0,0|1,0,0]=3 21281 B16R1.20656 O=C(CCCCCCCCCCO)C1CO1 1458a_100000701028_100009813290 [0,1,0,1,0,0|2,0,0]=4 21282 B16R1.20656 O=C(CNCCCCCCCCO)C1CC1 2230a_102515433106_100000746382 [0,1,0,1,0,0|2,0,0]=4 21283 B16R1.20656 O=C(CNCCCCCCCCO)C1CC1 34a_102515433106_100000746382 [0,1,0,1,0,0|2,0,0]=4 21284 B16R1.20656 O=C(COCCCCCCCCBr)C1CC1 34a_100009813846_100000746382 [0,1,0,1,0,0|2,0,0]=4 21285 B16R1.20656 O=C(COCCCCCCCCBr)C1CC1 7a_100009813846_100000746382 [0,1,0,1,0,0|2,0,0]=4 21286 B16R1.20656 O=C(COCCCCCCCCCl)C1CC1 34a_100000033203_100000746382 [0,1,0,1,0,0|2,0,0]=4 21287 B16R1.20656 O=C(COCCCCCCCCCl)C1CC1 7a_100000033203_100000746382 [0,1,0,1,0,0|2,0,0]=4 21288 B16R1.20656 O=C(COCCCCCCCCO)C1CC1 34a_100000686663_100000033203 [0,1,0,1,0,0|2,0,0]=4 21289 B16R1.20656 O=C(CSCCCCCCCCO)C1CC1 62a_100000033203_100000746382 [0,1,0,1,0,0|2,0,0]=4 21290 B16R1.20656 O=C(CSCCCCCCCCO)C1CC1 62a_100000746382_100000033203 [0,1,0,1,0,0|2,0,0]=4 21291 B16R1.20656 O=C(NCCCCCCCCCO)C1CC1 240690a_100000078944_100000210395 [0,1,0,1,0,0|2,0,0]=4 21292 B16R1.1570 CCCC(=O)CC(=O)CCC1CCCCC1 1458a_100000211375_100000747444 [0,1,0,1,0,0|1,0,1]=4 21293 B16R1.1570 CCNC(=O)CC(=O)CCC1CCCCC1 1458a_100000211375_100000183381 [0,1,0,1,0,0|1,0,1]=4 21294 B16R1.1570 CCNC(=O)CN(C)CCC1CCCCC1 2230a_100000741943_100012355289 [0,1,0,1,0,0|2,0,0]=4 21295 B16R1.1570 CCNC(=O)CN(C)CCC1CCCCC1 269982a_100000741943_100011273959 [0,1,0,1,0,0|2,0,0]=4 21296 B16R1.1570 CCNC(=O)CN(C)CCC1CCCCC1 270004a_100000741943_100011713444 [0,1,0,1,0,0|2,0,0]=4 21297 B16R1.1570 CCOC(=O)CC(=O)CCC1CCCCC1 1458a_100000211375_100000188475 [0,1,0,1,0,0|0,0,1]=3 21298 B16R1.1570 CCOC(=O)CC(=O)CCC1CCCCC1 1458a_100000243816_100011273959 [0,1,0,1,0,0|0,0,1]=3 21299 B16R1.1570 CCOC(=O)CC(=O)CCC1CCOCC1 1458a_100000243816_100011934994 [0,1,0,1,0,0|1,0,1]=4 21300 B16R1.1570 CCOC(=O)CC(=O)CCN1CCCCC1 1458a_100000243816_100000739454 [0,1,0,1,0,0|1,0,1]=4 21301 B16R1.1570 CCOC(=O)CC(=O)CCN1CCCCC1 1458a_100000743487_100000188475 [0,1,0,1,0,0|1,0,1]=4 21302 B16R1.1570 CCOC(=O)CC(=O)COC1CCCCC1 1458a_100000243816_100011935260 [0,1,0,1,0,0|1,0,1]=4 21303 B16R1.1570 CCOC(=O)CC(=O)COC1CCCCC1 1458a_100011223303_100000188475 [0,1,0,1,0,0|1,0,1]=4 21304 B16R1.1570 CCOC(=O)CC(=O)CSC1CCCCC1 62a_100000210311_100000210327 [0,1,0,1,0,0|1,0,1]=4 21305 B16R1.1570 CCOC(=O)CC(=O)CSC1CCCCC1 62a_100000210327_100000210311 [0,1,0,1,0,0|1,0,1]=4 21306 B16R1.1570 CCOC(=O)CC(=O)NCC1CCCCC1 240690a_100000210473_100000243816 [0,1,0,1,0,0|1,0,1]=4 21307 B16R1.1570 CCOC(=O)CC(C)NCC1CCCCC1 2230a_100000210473_100009817359 [0,1,0,1,0,0|1,0,0]=3 21308 B16R1.1570 CCOC(=O)CC(C)NCC1CCCCO1 2230a_100000174945_100009817359 [0,1,0,1,0,0|2,0,0]=4 21309 B16R1.1570 CCOC(=O)CC(C)NCC1CCCOC1 2230a_100000720124_100009817359 [0,1,0,1,0,0|2,0,0]=4 21310 B16R1.1570 CCOC(=O)CC(C)NCC1CCOCC1 2230a_100000746373_100009817359 [0,1,0,1,0,0|2,0,0]=4 21311 B16R1.1570 CCOC(=O)CC(C)NCC1CCSCC1 2230a_100015188806_100009817359 [0,1,0,1,0,0|2,0,0]=4 21312 B16R1.1570 CCOC(=O)CC(C)OCC1CCCCC1 7a_100000212181_100009817359 [0,1,0,1,0,0|1,0,0]=3 21313 B16R1.1570 CCOC(=O)CC(C)OCC1CCCCO1 7a_100000211370_100009817359 [0,1,0,1,0,0|2,0,0]=4 21314 B16R1.1570 CCOC(=O)CC(C)OCC1CCSCC1 7a_100000070558_100009817359 [0,1,0,1,0,0|2,0,0]=4 21315 B16R1.1570 CCOC(=O)CC(C)SCC1CCCCC1 62a_100000211423_100009817359 [0,1,0,1,0,0|1,0,0]=3 21316 B16R1.1570 CCOC(=O)CC(C)SCC1CCCCC1 62a_100009817359_100000211423 [0,1,0,1,0,0|1,0,0]=3 21317 B16R1.1570 CCOC(=O)CC(C)SCC1CCCCO1 62a_100000211543_100009817359 [0,1,0,1,0,0|2,0,0]=4 21318 B16R1.1570 CCOC(=O)CC(C)SCC1CCCCO1 62a_100009817359_100000211543 [0,1,0,1,0,0|2,0,0]=4 21319 B16R1.1570 CCOC(=O)CC(C)SCC1CCCOC1 62a_100000741521_100009817359 [0,1,0,1,0,0|2,0,0]=4 21320 B16R1.1570 CCOC(=O)CC(C)SCC1CCCOC1 62a_100009817359_100000741521 [0,1,0,1,0,0|2,0,0]=4 21321 B16R1.1570 CCOC(=O)CC(C)SCC1CCOCC1 62a_100000754603_100009817359 [0,1,0,1,0,0|2,0,0]=4 21322 B16R1.1570 CCOC(=O)CC(C)SCC1CCOCC1 62a_100009817359_100000749018 [0,1,0,1,0,0|2,0,0]=4 21323 B16R1.1570 CCOC(=O)CN(C)CCC1CCCCC1 2230a_100000220588_100012355289 [0,1,0,1,0,0|1,0,0]=3 21324 B16R1.1570 CCOC(=O)CN(C)CCC1CCCCC1 270004a_100000220588_100011713444 [0,1,0,1,0,0|1,0,0]=3 21325 B16R1.1570 CCOC(=O)CN(C)CCC1CCCCO1 2230a_100015183322_100000188475 [0,1,0,1,0,0|2,0,0]=4 21326 B16R1.1570 CCOC(=O)CN(C)CCC1CCCCO1 269982a_100015183322_100000188475 [0,1,0,1,0,0|2,0,0]=4 21327 B16R1.1570 CCOC(=O)CN(C)CCC1CCCCO1 34a_100015183322_100000188475 [0,1,0,1,0,0|2,0,0]=4 21328 B16R1.1570 CCOC(=O)CN(C)CCC1CCOCC1 2230a_100000220588_100011934994 [0,1,0,1,0,0|2,0,0]=4 21329 B16R1.1570 CCOC(=O)CN(C)CCN1CCCCC1 2230a_100000220588_100000739454 [0,1,0,1,0,0|2,0,0]=4 21330 B16R1.1570 CCOC(=O)CN(C)COC1CCCCC1 2230a_100000220588_100011935260 [0,1,0,1,0,0|2,0,0]=4 21331 B16R1.1570 CCOC(=O)C[C@@H](C)OCC1CCCCC1 7a_100009816390_100000211423 [0,1,0,1,0,0|1,0,0]=3 21332 B16R1.1570 CCOC(=O)C[C@@H](C)OCC1CCCCO1 7a_100009816390_100000211543 [0,1,0,1,0,0|2,0,0]=4 21333 B16R1.1570 CCOC(=O)C[C@@H](C)OCC1CCCOC1 7a_100009816390_100000741521 [0,1,0,1,0,0|2,0,0]=4 21334 B16R1.1570 CCOC(=O)C[C@@H](C)OCC1CCOCC1 7a_100009816390_100000754603 [0,1,0,1,0,0|2,0,0]=4 21335 B16R1.1570 CCOC(=O)C[C@H](O)CNC1CCCCC1 34a_100000182618_100000688340 [0,1,0,1,0,0|1,0,0]=3 21336 B16R1.1570 CCOC(=O)C[C@H](O)CNC1CCCOC1 34a_100000719290_100000688340 [0,1,0,1,0,0|2,0,0]=4 21337 B16R1.1570 CCOC(=O)C[C@H](O)CNC1CCOCC1 34a_100000741149_100000688340 [0,1,0,1,0,0|2,0,0]=4 21338 B16R1.1570 CCOC(=O)C[C@H](O)CNC1CCSCC1 34a_100000748639_100000688340 [0,1,0,1,0,0|2,0,0]=4 21339 B16R1.1570 CCOC(=O)C[C@H](O)COC1CCCCC1 34a_100000210231_100000688340 [0,1,0,1,0,0|1,0,0]=3 21340 B16R1.1570 CCOC(=O)C[C@H](O)COC1CCCCC1 7a_100000210231_100000688340 [0,1,0,1,0,0|1,0,0]=3 21341 B16R1.1570 CCOC(=O)C[C@H](O)COC1CCCCO1 34a_100000033831_100000688340 [0,1,0,1,0,0|2,0,0]=4 21342 B16R1.1570 CCOC(=O)C[C@H](O)COC1CCCOC1 34a_100000754041_100000688340 [0,1,0,1,0,0|2,0,0]=4 21343 B16R1.1570 CCOC(=O)C[C@H](O)COC1CCCSC1 7a_100015962668_100000688340 [0,1,0,1,0,0|2,0,0]=4 21344 B16R1.1570 CCOC(=O)C[C@H](O)COC1CCOCC1 34a_100000744328_100000688340 [0,1,0,1,0,0|2,0,0]=4 21345 B16R1.1570 CCOC(=O)C[C@H](O)COC1CCSCC1 34a_100000731022_100000688340 [0,1,0,1,0,0|2,0,0]=4 21346 B16R1.1570 CCOC(=O)C[C@H](O)COC1CCSCC1 7a_100000731022_100000688340 [0,1,0,1,0,0|2,0,0]=4 21347 B16R1.1570 CCOC(=O)C[C@H](O)CSC1CCCCC1 62a_100000210327_100000688340 [0,1,0,1,0,0|1,0,0]=3 21348 B16R1.1570 CCOC(=O)C[C@H](O)CSC1CCCCC1 62a_100000688340_100000210327 [0,1,0,1,0,0|1,0,0]=3 21349 B16R1.1570 CCOC(=O)C[C@H](O)CSC1CCCOC1 62a_100000688340_100000693364 [0,1,0,1,0,0|2,0,0]=4 21350 B16R1.1570 CCOC(=O)C[C@H](O)CSC1CCOCC1 62a_100000688340_100011324220 [0,1,0,1,0,0|2,0,0]=4 21351 B16R1.1570 CCOC(=O)C[C@H](O)CSC1CCSCC1 62a_100000688340_100000069128 [0,1,0,1,0,0|2,0,0]=4 21352 B16R1.1570 CCOC(=O)OC(C)SCC1CCCCC1 62a_100000036008_100000211423 [0,1,0,1,0,0|2,0,0]=4 21353 B16R1.1570 CCOC(=O)OC(C)SCC1CCCCC1 62a_100000211423_100000036008 [0,1,0,1,0,0|2,0,0]=4 21354 B16R1.4209 CCOC(=O)CC(=O)CN1CCCC1CC 269982a_100000754278_100000210311 [0,1,0,1,0,0|1,0,1]=4 21355 B16R1.4209 CCOC(=O)C[C@H](O)CN1CCCC1CC 269982a_100000754278_100000688340 [0,1,0,1,0,0|1,0,0]=3 21356 B16R1.4209 CCOC(=O)C[C@H](O)CN1CCCC1CC 34a_100000754278_100000688340 [0,1,0,1,0,0|1,0,0]=3 21357 B16R1.4209 CCOC(=O)C[C@H](O)CN1CCC[C@@H]1CO 269982a_100000745186_100000688340 [0,1,0,1,0,0|2,0,0]=4 21358 B16R1.4209 CCOC(=O)C[C@H](O)CN1CCC[C@@H]1CO 34a_100000745186_100000688340 [0,1,0,1,0,0|2,0,0]=4 21359 B16R1.4210 CCOC(=O)CC(=O)CCC1CCCN1C 1458a_100000243816_100000005710 [0,1,0,1,0,0|1,0,1]=4 21360 B16R1.4210 CCOC(=O)CN(C)CCC1CCCN1C 2230a_100000220588_100000005710 [0,1,0,1,0,0|2,0,0]=4 21361 B16R1.4210 CCOC(=O)C[C@H](O)COC1CCCC1C 34a_100011216460_100000688340 [0,1,0,1,0,0|1,0,0]=3 21362 B16R1.4210 CCOC(=O)C[C@H](O)COC1CCCC1C 7a_100011216460_100000688340 [0,1,0,1,0,0|1,0,0]=3 21363 B16R1.4210 CCOC(=O)C[C@H](O)CO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000688340 [0,1,0,1,0,0|2,0,0]=4 21364 B16R1.4210 CCOC(=O)C[C@H](O)CO[C@H]1CCC[C@@H]1N 34a_100000748460_100000688340 [0,1,0,1,0,0|2,0,0]=4 21365 B16R1.4210 CCOC(=O)C[C@H](O)CO[C@H]1CNC[C@H]1C 34a_200015306588_100000688340 [0,1,0,1,0,0|2,0,0]=4 21366 B16R1.4210 CCOC(=O)C[C@H](O)CS[C@@H]1CCC[C@H]1O 62a_100000688340_200016002552 [0,1,0,1,0,0|2,0,0]=4 21367 B16R1.4210 CCOC(=O)C[C@H](O)CS[C@@H]1CCC[C@H]1O 62a_200016002552_100000688340 [0,1,0,1,0,0|2,0,0]=4 21368 B16R1.4214 CCOC(=O)C[C@H](O)COCCC1COC1 34a_100009855314_100000688340 [0,1,0,1,0,0|2,0,0]=4 21369 B16R1.4219 CCOC(=O)C[C@H](O)COCCNC1CC1 34a_100000738766_100000688340 [0,1,0,1,0,0|2,0,0]=4 21370 B16R1.4219 CCOC(=O)C[C@H](O)CSCCCC1CO1 62a_100000688340_100000733510 [0,1,0,1,0,0|2,0,0]=4 21371 B16R1.4219 CCOC(=O)C[C@H](O)CSCCCC1CO1 62a_100000733510_100000688340 [0,1,0,1,0,0|2,0,0]=4 21372 B16R1.4228 CCOC(=O)CC(=O)C1CCCCCN1C 1458a_100015187800_100000188475 [0,1,0,1,0,0|1,0,1]=4 21373 B16R1.4229 CCNC(=O)CN(C)C1CCCCC1CC 270004a_100000741943_100000757040 [0,1,0,1,0,0|2,0,0]=4 21374 B16R1.4229 CCOC(=O)CC(=O)C1CCCCN1CC 1458a_100000743832_100000188475 [0,1,0,1,0,0|1,0,1]=4 21375 B16R1.4229 CCOC(=O)CC(=O)N1CCCCC1CC 240690a_100000210034_100000243816 [0,1,0,1,0,0|1,0,1]=4 21376 B16R1.4229 CCOC(=O)CC(C)N1CCCCC1CC 2230a_100000210034_100009817359 [0,1,0,1,0,0|1,0,0]=3 21377 B16R1.4229 CCOC(=O)CC(C)N1CCCCC1CC 269982a_100000210034_100009817359 [0,1,0,1,0,0|1,0,0]=3 21378 B16R1.4229 CCOC(=O)CC(C)N1CCCCC1CO 2230a_100000210821_100009817359 [0,1,0,1,0,0|2,0,0]=4 21379 B16R1.4229 CCOC(=O)CC(C)N1CCCCC1CO 269982a_100000210821_100009817359 [0,1,0,1,0,0|2,0,0]=4 21380 B16R1.4229 CCOC(=O)CC(C)N1CCOC[C@@H]1CC 2230a_100016988097_100009817359 [0,1,0,1,0,0|2,0,0]=4 21381 B16R1.4229 CCOC(=O)CC(C)N1CCOC[C@@H]1CC 269982a_100016988097_100009817359 [0,1,0,1,0,0|2,0,0]=4 21382 B16R1.4229 CCOC(=O)CN(C)C1CCCCC1CC 270004a_100000220588_100000757040 [0,1,0,1,0,0|1,0,0]=3 21383 B16R1.4229 CCOC(=O)CN(C)C1CCCCC1CO 270004a_100000220588_100009861125 [0,1,0,1,0,0|2,0,0]=4 21384 B16R1.4229 CCOC(=O)CN(C)C1CCCCC1OC 270004a_100000220588_100000740605 [0,1,0,1,0,0|2,0,0]=4 21385 B16R1.4229 CCOC(=O)OC(C)N1CCCCC1CC 269982a_100000210034_100000036008 [0,1,0,1,0,0|2,0,0]=4 21386 B16R1.4235 CCOC(=O)CC(=O)CC1CCCCN1C 1458a_100000243816_100015185383 [0,1,0,1,0,0|1,0,1]=4 21387 B16R1.4235 CCOC(=O)CC(=O)CN1CCCCC1C 269982a_100000211376_100000210311 [0,1,0,1,0,0|1,0,1]=4 21388 B16R1.4235 CCOC(=O)CC(=O)NC1CCCCC1C 240690a_100000211402_100000243816 [0,1,0,1,0,0|1,0,1]=4 21389 B16R1.4235 CCOC(=O)CC(C)NC1CCCCC1C 2230a_100000211402_100009817359 [0,1,0,1,0,0|1,0,0]=3 21390 B16R1.4235 CCOC(=O)CC(C)N[C@@H]1CCCC[C@H]1F 2230a_100015195156_100009817359 [0,1,0,1,0,0|2,0,0]=4 21391 B16R1.4235 CCOC(=O)CC(C)OC1CCCCC1C 7a_100000211207_100009817359 [0,1,0,1,0,0|1,0,0]=3 21392 B16R1.4235 CCOC(=O)CC(C)OC1CCCCC1Cl 7a_100000038908_100009817359 [0,1,0,1,0,0|2,0,0]=4 21393 B16R1.4235 CCOC(=O)CC(C)O[C@@H]1CCCC[C@H]1F 7a_100009816020_100009817359 [0,1,0,1,0,0|2,0,0]=4 21394 B16R1.4235 CCOC(=O)CC(C)SC1CCCCC1F 62a_100009817359_100015423560 [0,1,0,1,0,0|2,0,0]=4 21395 B16R1.4235 CCOC(=O)CC(C)SC1CCCCC1F 62a_100015423560_100009817359 [0,1,0,1,0,0|2,0,0]=4 21396 B16R1.4235 CCOC(=O)CC(C)SC1CCCCC1O 62a_100000038908_100009817359 [0,1,0,1,0,0|2,0,0]=4 21397 B16R1.4235 CCOC(=O)CC(C)SC1CCCCC1O 62a_100009817359_100000038908 [0,1,0,1,0,0|2,0,0]=4 21398 B16R1.4235 CCOC(=O)CN(C)CC1CCCCN1C 2230a_100015185953_100000188475 [0,1,0,1,0,0|2,0,0]=4 21399 B16R1.4235 CCOC(=O)CN(C)CC1CCCCN1C 269982a_100015185953_100000188475 [0,1,0,1,0,0|2,0,0]=4 21400 B16R1.4235 CCOC(=O)C[C@H](O)CN1CCCCC1C 269982a_100000211376_100000688340 [0,1,0,1,0,0|1,0,0]=3 21401 B16R1.4235 CCOC(=O)C[C@H](O)CN1CCCCC1C 34a_100000211376_100000688340 [0,1,0,1,0,0|1,0,0]=3 21402 B16R1.4235 CCOC(=O)C[C@H](O)CN1CCOC[C@@H]1C 269982a_100009815349_100000688340 [0,1,0,1,0,0|2,0,0]=4 21403 B16R1.4235 CCOC(=O)C[C@H](O)CN1CCOC[C@@H]1C 34a_100009815349_100000688340 [0,1,0,1,0,0|2,0,0]=4 21404 B16R1.5833 CCCCCCCCC(=O)C1CCCC1=O 1458a_100000210188_100000211823 [0,1,0,1,0,0|1,0,1]=4 21405 B16R1.5833 CCCCCCCCC(=O)C1CCOC1=O 1458a_100000210188_100000211211 [0,1,0,1,0,0|0,0,1]=3 21406 B16R1.5833 CCCCCCCCN(C)C1CCCC1=O 2230a_100000207567_100000211823 [0,1,0,1,0,0|2,0,0]=4 21407 B16R1.5833 CCCCCCCCN(C)C1CCCC1=O 269982a_100000207567_100000211823 [0,1,0,1,0,0|2,0,0]=4 21408 B16R1.5833 CCCCCCCCN(C)C1CCOC1=O 2230a_100000207567_100000211211 [0,1,0,1,0,0|1,0,0]=3 21409 B16R1.5833 CCCCCCCCN(C)C1CCOC1=O 269982a_100000207567_100000211211 [0,1,0,1,0,0|1,0,0]=3 21410 B16R1.5833 O=C(CCCCCCCO)C1CCOC1=O 1458a_100011219782_100000211211 [0,1,0,1,0,0|1,0,1]=4 21411 B16R1.8377 CCCCCCCCN1CCCNC(=O)C1 2230a_100015190381_100000210759 [0,1,0,1,0,0|2,0,0]=4 21412 B16R1.9257 CCOC(=O)C[C@H](O)CN1CCC1COC 269982a_100015195929_100000688340 [0,1,0,1,0,0|2,0,0]=4 21413 B16R1.9257 CCOC(=O)C[C@H](O)CN1CCC1COC 34a_100015195929_100000688340 [0,1,0,1,0,0|2,0,0]=4 21414 B16R1.13636 CCCC1CCCC1N(C)CC(=O)NCC 270004a_100000741943_100000723119 [0,1,0,1,0,0|2,0,0]=4 21415 B16R1.13636 CCCC1CCCC1N(C)CC(=O)OCC 270004a_100000220588_100000723119 [0,1,0,1,0,0|1,0,0]=3 21416 B16R1.13636 CCOC(=O)CC(C)N1CCC[C@H]1COC 2230a_100020646714_100009817359 [0,1,0,1,0,0|2,0,0]=4 21417 B16R1.13636 CCOC(=O)CC(C)N1CCC[C@H]1COC 269982a_100020646714_100009817359 [0,1,0,1,0,0|2,0,0]=4 21418 B16R1.15561 CCCC(=O)CN(C)CCCC1CCCC1 2230a_100015186261_100000747444 [0,1,0,1,0,0|2,0,0]=4 21419 B16R1.15561 CCCC(=O)CN(C)CCCC1CCCC1 269982a_100015186261_100000747444 [0,1,0,1,0,0|2,0,0]=4 21420 B16R1.15561 CCNC(=O)CN(C)CCCC1CCCC1 2230a_100000741943_100011713738 [0,1,0,1,0,0|2,0,0]=4 21421 B16R1.15561 CCNC(=O)CN(C)CCCC1CCCC1 2230a_100015186261_100000183381 [0,1,0,1,0,0|2,0,0]=4 21422 B16R1.15561 CCNC(=O)CN(C)CCCC1CCCC1 269982a_100000741943_100011713738 [0,1,0,1,0,0|2,0,0]=4 21423 B16R1.15561 CCNC(=O)CN(C)CCCC1CCCC1 269982a_100015186261_100000183381 [0,1,0,1,0,0|2,0,0]=4 21424 B16R1.15561 CCNC(=O)CN(C)CCCC1CCCC1 34a_100015186261_100000183381 [0,1,0,1,0,0|2,0,0]=4 21425 B16R1.15561 CCOC(=O)CC(=O)CCCC1CCCC1 1458a_100000243816_100011713738 [0,1,0,1,0,0|0,0,1]=3 21426 B16R1.15561 CCOC(=O)CC(=O)CCCN1CCCC1 1458a_100000243816_100011445909 [0,1,0,1,0,0|1,0,1]=4 21427 B16R1.15561 CCOC(=O)CC(=O)CCCN1CCCC1 1458a_100000743284_100000188475 [0,1,0,1,0,0|1,0,1]=4 21428 B16R1.15561 CCOC(=O)CC(=O)CSCC1CCCC1 62a_100000210311_100000740388 [0,1,0,1,0,0|1,0,1]=4 21429 B16R1.15561 CCOC(=O)CC(=O)CSCC1CCCC1 62a_100000740388_100000210311 [0,1,0,1,0,0|1,0,1]=4 21430 B16R1.15561 CCOC(=O)CC(=O)NCCC1CCCC1 240690a_100000739158_100000243816 [0,1,0,1,0,0|1,0,1]=4 21431 B16R1.15561 CCOC(=O)CC(C)NCCC1CCCC1 2230a_100000739158_100009817359 [0,1,0,1,0,0|1,0,0]=3 21432 B16R1.15561 CCOC(=O)CC(C)OCCC1CCCC1 7a_100000749090_100009817359 [0,1,0,1,0,0|1,0,0]=3 21433 B16R1.15561 CCOC(=O)CC(C)SCCC1CCCC1 62a_100000760354_100009817359 [0,1,0,1,0,0|1,0,0]=3 21434 B16R1.15561 CCOC(=O)CC(C)SCCC1CCCC1 62a_100009817359_100000760354 [0,1,0,1,0,0|1,0,0]=3 21435 B16R1.15561 CCOC(=O)CC(C)SCCN1CCCC1 62a_100000700749_100009817359 [0,1,0,1,0,0|2,0,0]=4 21436 B16R1.15561 CCOC(=O)CC(C)SCCN1CCCC1 62a_100009817359_100000004467 [0,1,0,1,0,0|2,0,0]=4 21437 B16R1.15561 CCOC(=O)CN(C)CCCC1CCCC1 2230a_100000220588_100011713738 [0,1,0,1,0,0|1,0,0]=3 21438 B16R1.15561 CCOC(=O)CN(C)CCCC1CCCC1 2230a_100015186261_100000188475 [0,1,0,1,0,0|1,0,0]=3 21439 B16R1.15561 CCOC(=O)CN(C)CCCC1CCCC1 269982a_100015186261_100000188475 [0,1,0,1,0,0|1,0,0]=3 21440 B16R1.15561 CCOC(=O)CN(C)CCCC1CCCC1 34a_100015186261_100000188475 [0,1,0,1,0,0|1,0,0]=3 21441 B16R1.15561 CCOC(=O)CN(C)CCCC1CCCO1 2230a_100011698863_100000188475 [0,1,0,1,0,0|2,0,0]=4 21442 B16R1.15561 CCOC(=O)CN(C)CCCC1CCCO1 269982a_100011698863_100000188475 [0,1,0,1,0,0|2,0,0]=4 21443 B16R1.15561 CCOC(=O)CN(C)CCCC1CCCO1 34a_100011698863_100000188475 [0,1,0,1,0,0|2,0,0]=4 21444 B16R1.15561 CCOC(=O)CN(C)CCCN1CCCC1 2230a_100000220588_100011445909 [0,1,0,1,0,0|2,0,0]=4 21445 B16R1.15561 CCOC(=O)CN(C)CCCN1CCCC1 269982a_100000233079_100000188475 [0,1,0,1,0,0|2,0,0]=4 21446 B16R1.15561 CCOC(=O)C[C@@H](C)OCCC1CCCC1 7a_100009816390_100000760354 [0,1,0,1,0,0|1,0,0]=3 21447 B16R1.15561 CCOC(=O)C[C@@H](C)OCCN1CCCC1 7a_100009816390_100000004467 [0,1,0,1,0,0|2,0,0]=4 21448 B16R1.15561 CCOC(=O)C[C@H](O)CNCC1CCCC1 34a_100000737975_100000688340 [0,1,0,1,0,0|1,0,0]=3 21449 B16R1.15561 CCOC(=O)C[C@H](O)CNCC1CCOC1 34a_100000737293_100000688340 [0,1,0,1,0,0|2,0,0]=4 21450 B16R1.15561 CCOC(=O)C[C@H](O)CNC[C@@H]1CCCO1 34a_100020590478_100000688340 [0,1,0,1,0,0|2,0,0]=4 21451 B16R1.15561 CCOC(=O)C[C@H](O)COCC1CCCC1 34a_100000742336_100000688340 [0,1,0,1,0,0|1,0,0]=3 21452 B16R1.15561 CCOC(=O)C[C@H](O)COCC1CCCC1 7a_100000742336_100000688340 [0,1,0,1,0,0|1,0,0]=3 21453 B16R1.15561 CCOC(=O)C[C@H](O)COCC1CCCO1 34a_100000210270_100000688340 [0,1,0,1,0,0|2,0,0]=4 21454 B16R1.15561 CCOC(=O)C[C@H](O)COCC1CCCO1 7a_100000210270_100000688340 [0,1,0,1,0,0|2,0,0]=4 21455 B16R1.15561 CCOC(=O)C[C@H](O)COCC1CCNC1 34a_100000748654_100000688340 [0,1,0,1,0,0|2,0,0]=4 21456 B16R1.15561 CCOC(=O)C[C@H](O)COCC1CCOC1 34a_100000740260_100000688340 [0,1,0,1,0,0|2,0,0]=4 21457 B16R1.15561 CCOC(=O)C[C@H](O)COC[C@H]1CCCN1 34a_100000745186_100000688340 [0,1,0,1,0,0|2,0,0]=4 21458 B16R1.15561 CCOC(=O)C[C@H](O)CSCC1CCCC1 62a_100000688340_100000740388 [0,1,0,1,0,0|1,0,0]=3 21459 B16R1.15561 CCOC(=O)C[C@H](O)CSCC1CCCC1 62a_100000740388_100000688340 [0,1,0,1,0,0|1,0,0]=3 21460 B16R1.15561 CCOC(=O)C[C@H](O)CSCC1CCCO1 62a_100000203698_100000688340 [0,1,0,1,0,0|2,0,0]=4 21461 B16R1.15561 CCOC(=O)C[C@H](O)CSCC1CCCO1 62a_100000688340_100000203698 [0,1,0,1,0,0|2,0,0]=4 21462 B16R1.15561 CCOC(=O)C[C@H](O)CSCC1CCOC1 62a_100000688340_100000702531 [0,1,0,1,0,0|2,0,0]=4 21463 B16R1.15561 CCOC(=O)C[C@H](O)CSCC1CCOC1 62a_100000702531_100000688340 [0,1,0,1,0,0|2,0,0]=4 21464 B16R1.15561 CCOC(=O)OC(C)SCCC1CCCC1 62a_100000036008_100000760354 [0,1,0,1,0,0|2,0,0]=4 21465 B16R1.15561 CCOC(=O)OC(C)SCCC1CCCC1 62a_100000760354_100000036008 [0,1,0,1,0,0|2,0,0]=4 21466 B16R1.20333 CCCCCCCCC(=O)CC(=O)C1CC1 1458a_100000210188_100000746382 [0,1,0,1,0,0|1,0,1]=4 21467 B16R1.20333 CCCCCCCCN(C)CC(=O)C1CC1 2230a_100000207567_100000746382 [0,1,0,1,0,0|2,0,0]=4 21468 B16R1.20333 CCCCCCCCN(C)CC(=O)C1CC1 269982a_100000207567_100000746382 [0,1,0,1,0,0|2,0,0]=4 21469 B16R1.24710 CCNC(=O)CN(C)C1CCCCCCC1 270004a_100000741943_100000210524 [0,1,0,1,0,0|2,0,0]=4 21470 B16R1.24710 CCOC(=O)CC(=O)N1CCCCCCC1 240690a_100000211400_100000243816 [0,1,0,1,0,0|1,0,1]=4 21471 B16R1.24710 CCOC(=O)CC(C)N1CCCCCCC1 2230a_100000211400_100009817359 [0,1,0,1,0,0|1,0,0]=3 21472 B16R1.24710 CCOC(=O)CC(C)N1CCCCCCC1 269982a_100000211400_100009817359 [0,1,0,1,0,0|1,0,0]=3 21473 B16R1.24710 CCOC(=O)CN(C)C1CCCCCCC1 270004a_100000220588_100000210524 [0,1,0,1,0,0|1,0,0]=3 21474 B16R1.24710 CCOC(=O)OC(C)N1CCCCCCC1 269982a_100000211400_100000036008 [0,1,0,1,0,0|2,0,0]=4 21475 B16R1.24818 CCCC(=O)CC(=O)CC1CCCCCC1 1458a_100000685095_100000747444 [0,1,0,1,0,0|1,0,1]=4 21476 B16R1.24818 CCNC(=O)CC(=O)CC1CCCCCC1 1458a_100000685095_100000183381 [0,1,0,1,0,0|1,0,1]=4 21477 B16R1.24818 CCNC(=O)CN(C)CC1CCCCCC1 2230a_100000741943_200000696569 [0,1,0,1,0,0|2,0,0]=4 21478 B16R1.24818 CCNC(=O)CN(C)CC1CCCCCC1 269982a_100000741943_200000696569 [0,1,0,1,0,0|2,0,0]=4 21479 B16R1.24818 CCOC(=O)CC(=O)CC1CCCCCC1 1458a_100000243816_200000696569 [0,1,0,1,0,0|0,0,1]=3 21480 B16R1.24818 CCOC(=O)CC(=O)CC1CCCCCC1 1458a_100000685095_100000188475 [0,1,0,1,0,0|0,0,1]=3 21481 B16R1.24818 CCOC(=O)CC(=O)CN1CCCCCC1 1458a_100000740298_100000188475 [0,1,0,1,0,0|1,0,1]=4 21482 B16R1.24818 CCOC(=O)CC(=O)CN1CCCCCC1 269982a_100000185865_100000210311 [0,1,0,1,0,0|1,0,1]=4 21483 B16R1.24818 CCOC(=O)CC(=O)NC1CCCCCC1 240690a_100000210984_100000243816 [0,1,0,1,0,0|1,0,1]=4 21484 B16R1.24818 CCOC(=O)CC(C)NC1CCCCCC1 2230a_100000210984_100009817359 [0,1,0,1,0,0|1,0,0]=3 21485 B16R1.24818 CCOC(=O)CC(C)OC1CCCCCC1 7a_100000210887_100009817359 [0,1,0,1,0,0|1,0,0]=3 21486 B16R1.24818 CCOC(=O)CC(C)SC1CCCCCC1 62a_100009817359_100011217769 [0,1,0,1,0,0|1,0,0]=3 21487 B16R1.24818 CCOC(=O)CC(C)SC1CCCCCC1 62a_100011217769_100009817359 [0,1,0,1,0,0|1,0,0]=3 21488 B16R1.24818 CCOC(=O)CN(C)CC1CCCCCC1 2230a_100000220588_200000696569 [0,1,0,1,0,0|1,0,0]=3 21489 B16R1.24818 CCOC(=O)C[C@H](O)CN1CCCCCC1 269982a_100000185865_100000688340 [0,1,0,1,0,0|1,0,0]=3 21490 B16R1.24818 CCOC(=O)C[C@H](O)CN1CCCCCC1 34a_100000185865_100000688340 [0,1,0,1,0,0|1,0,0]=3 21491 B16R1.24818 CCOC(=O)C[C@H](O)CN1CCCOCC1 269982a_100000685342_100000688340 [0,1,0,1,0,0|2,0,0]=4 21492 B16R1.24818 CCOC(=O)C[C@H](O)CN1CCCOCC1 34a_100000685342_100000688340 [0,1,0,1,0,0|2,0,0]=4 21493 B16R1.24818 CCOC(=O)OC(C)SC1CCCCCC1 62a_100000036008_100011217769 [0,1,0,1,0,0|2,0,0]=4 21494 B16R1.24818 CCOC(=O)OC(C)SC1CCCCCC1 62a_100011217769_100000036008 [0,1,0,1,0,0|2,0,0]=4 21495 B16R1.9 C=C1CCC(CC1)COCCC(=O)OCC 34a_100000074039_100000765890 [0,1,0,1,0,0|1,0,1]=4 21496 B16R1.9 C=C1CCN(CC1)CCCCC(=O)OCC 2230a_100000752442_100000750268 [0,1,0,1,0,0|1,0,1]=4 21497 B16R1.9 C=C1CCN(CC1)CCCCC(=O)OCC 269982a_100000752442_100000750268 [0,1,0,1,0,0|1,0,1]=4 21498 B16R1.9 C=C1CCN(CC1)CCCCC(=O)OCC 34a_100000752442_100000750268 [0,1,0,1,0,0|1,0,1]=4 21499 B16R1.9 CCNC(=O)CCNCC1CCC(CC1)C 2230a_103436935547_100000737597 [0,1,0,1,0,0|2,0,0]=4 21500 B16R1.9 CCNC(=O)CNCCC1CCC(CC1)O 34a_200011935226_100000183381 [0,1,0,1,0,0|2,0,0]=4 21501 B16R1.9 CCNC(=O)COCCC1CCC(CC1)N 34a_100000070672_100000183381 [0,1,0,1,0,0|2,0,0]=4 21502 B16R1.9 CCOC(=O)CCCCN1CCC(CC1)C 2230a_100000188429_100000750268 [0,1,0,1,0,0|1,0,0]=3 21503 B16R1.9 CCOC(=O)CCCCN1CCC(CC1)C 269982a_100000188429_100000750268 [0,1,0,1,0,0|1,0,0]=3 21504 B16R1.9 CCOC(=O)CCCCN1CCC(CC1)C 34a_100000188429_100000750268 [0,1,0,1,0,0|1,0,0]=3 21505 B16R1.9 CCOC(=O)CCCCN1CCC(CC1)F 2230a_100015193889_100000750268 [0,1,0,1,0,0|1,0,0]=3 21506 B16R1.9 CCOC(=O)CCCCN1CCC(CC1)F 269982a_100015193889_100000750268 [0,1,0,1,0,0|1,0,0]=3 21507 B16R1.9 CCOC(=O)CCCCN1CCC(CC1)F 34a_100015193889_100000750268 [0,1,0,1,0,0|1,0,0]=3 21508 B16R1.9 CCOC(=O)CCCCN1CCC(CC1)O 2230a_100025773856_100000750268 [0,1,0,1,0,0|1,0,0]=3 21509 B16R1.9 CCOC(=O)CCCCN1CCC(CC1)O 269982a_100025773856_100000750268 [0,1,0,1,0,0|1,0,0]=3 21510 B16R1.9 CCOC(=O)CCCCN1CCN(CC1)C 2230a_100000188432_100000750268 [0,1,0,1,0,0|2,0,0]=4 21511 B16R1.9 CCOC(=O)CCCCN1CCN(CC1)C 269982a_100000188432_100000750268 [0,1,0,1,0,0|2,0,0]=4 21512 B16R1.9 CCOC(=O)CCCCN1CCS(=O)CC1 2230a_100000752083_100000750268 [0,1,0,1,0,0|2,0,0]=4 21513 B16R1.9 CCOC(=O)CCCCN1CCS(=O)CC1 269982a_100000752083_100000750268 [0,1,0,1,0,0|2,0,0]=4 21514 B16R1.9 CCOC(=O)CCCN[C@H]1CC[C@@H](CC1)C 2230a_100020625639_100009991533 [0,1,0,1,0,0|1,0,0]=3 21515 B16R1.9 CCOC(=O)CCCN[C@H]1CC[C@@H](CC1)C 34a_100020625639_100009991533 [0,1,0,1,0,0|1,0,0]=3 21516 B16R1.9 CCOC(=O)CCCOC1CCC(=O)CC1 34a_100000764474_100009991533 [0,1,0,1,0,0|1,0,1]=4 21517 B16R1.9 CCOC(=O)CCCOC1CCC(=O)CC1 7a_100000764474_100011215271 [0,1,0,1,0,0|1,0,1]=4 21518 B16R1.9 CCOC(=O)CCCOC1CCC(CC1)C 34a_100000210714_100009991533 [0,1,0,1,0,0|1,0,0]=3 21519 B16R1.9 CCOC(=O)CCCOC1CCC(CC1)C 7a_100000210714_100011215271 [0,1,0,1,0,0|1,0,0]=3 21520 B16R1.9 CCOC(=O)CCCO[C@H]1CC[C@H](CC1)N 34a_100020628982_100009991533 [0,1,0,1,0,0|1,0,0]=3 21521 B16R1.9 CCOC(=O)CCCSC1CCC(CC1)C 62a_100009991533_200011216234 [0,1,0,1,0,0|1,0,0]=3 21522 B16R1.9 CCOC(=O)CCCSC1CCN(CC1)C 62a_100009991533_100011215917 [0,1,0,1,0,0|2,0,0]=4 21523 B16R1.9 CCOC(=O)CCNCC1CCC(CC1)C 2230a_103436935547_100011206558 [0,1,0,1,0,0|1,0,0]=3 21524 B16R1.9 CCOC(=O)CCNCC1CCC(CC1)C 34a_103436935547_100000765890 [0,1,0,1,0,0|1,0,0]=3 21525 B16R1.9 CCOC(=O)CCOCC1CCC(=O)CC1 34a_100000062911_100000765890 [0,1,0,1,0,0|1,0,1]=4 21526 B16R1.9 CCOC(=O)CCOCC1CCC(CC1)C 34a_100000701341_100000765890 [0,1,0,1,0,0|1,0,0]=3 21527 B16R1.9 CCOC(=O)CCOC[C@H]1CC[C@@H](CC1)N 34a_100009821084_100000765890 [0,1,0,1,0,0|1,0,0]=3 21528 B16R1.9 CCOC(=O)CCSCC1CCN(CC1)C 62a_100000765890_100015183002 [0,1,0,1,0,0|2,0,0]=4 21529 B16R1.9 CCOC(=O)CCSCC1CCN(CC1)C 62a_100015183002_100000765890 [0,1,0,1,0,0|2,0,0]=4 21530 B16R1.9 CCOC(=O)CNCCC1CCC(CC1)O 34a_200011935226_100000188475 [0,1,0,1,0,0|1,0,0]=3 21531 B16R1.9 CCOC(=O)COCCC1CCC(CC1)N 34a_100000070672_100000188475 [0,1,0,1,0,0|1,0,0]=3 21532 B16R1.9 CCOC(=O)COCCN1CCC(CC1)C 2230a_100000188429_100000088970 [0,1,0,1,0,0|2,0,0]=4 21533 B16R1.9 CCOC(=O)COCCN1CCC(CC1)C 269982a_100000188429_100000088970 [0,1,0,1,0,0|2,0,0]=4 21534 B16R1.9 CCOC(=O)COCCN1CCC(CC1)C 34a_100000188429_100000088970 [0,1,0,1,0,0|2,0,0]=4 21535 B16R1.9 CCOC(=O)COCCN1CCC(CC1)F 2230a_100015193889_100000088970 [0,1,0,1,0,0|2,0,0]=4 21536 B16R1.9 CCOC(=O)COCCN1CCC(CC1)F 269982a_100015193889_100000088970 [0,1,0,1,0,0|2,0,0]=4 21537 B16R1.9 CCOC(=O)COCCN1CCC(CC1)F 34a_100015193889_100000088970 [0,1,0,1,0,0|2,0,0]=4 21538 B16R1.9 CCOC(=O)COCCN1CCC(CC1)O 2230a_100025773856_100000088970 [0,1,0,1,0,0|2,0,0]=4 21539 B16R1.9 CCOC(=O)COCCN1CCC(CC1)O 269982a_100025773856_100000088970 [0,1,0,1,0,0|2,0,0]=4 21540 B16R1.9 CCOC(=O)NCCOC1CCC(CC1)C 34a_100000158857_200011216234 [0,1,0,1,0,0|2,0,0]=4 21541 B16R1.9 CCOC(=O)NCCOC1CCC(CC1)C 7a_100000210714_200011445536 [0,1,0,1,0,0|2,0,0]=4 21542 B16R1.738 CCNC(=O)CCNC1CCCC(C1C)C 2230a_100000211273_100000737597 [0,1,0,1,0,0|2,0,0]=4 21543 B16R1.738 CCNC(=O)CCOC1CCCC(C1C)C 7a_100011217532_100000737597 [0,1,0,1,0,0|2,0,0]=4 21544 B16R1.738 CCOC(=O)CCNC1CCCC(C1C)C 2230a_100000211273_100011206558 [0,1,0,1,0,0|1,0,0]=3 21545 B16R1.738 CCOC(=O)CCNC1CCCC(C1C)C 34a_100000211273_100000765890 [0,1,0,1,0,0|1,0,0]=3 21546 B16R1.738 CCOC(=O)CCOC1CCCC(C1C)C 34a_100011217532_100000765890 [0,1,0,1,0,0|1,0,0]=3 21547 B16R1.738 CCOC(=O)CCOC1CCCC(C1C)C 7a_100011217532_100011206558 [0,1,0,1,0,0|1,0,0]=3 21548 B16R1.960 CCOC(=O)C1CCCCC1OC(C)CC 7a_100000038711_100000758301 [0,1,0,1,0,0|1,0,0]=3 21549 B16R1.960 CCOC(=O)C1CCCCC1OC(C)CO 7a_100000038711_100012180447 [0,1,0,1,0,0|2,0,0]=4 21550 B16R1.960 CCOC(=O)C1CCCCN1CC(=O)CC 269982a_100016990872_100000747405 [0,1,0,1,0,0|1,0,1]=4 21551 B16R1.960 CCOC(=O)C1CCCCN1CC(C)CC 2230a_100016990872_100000748023 [0,1,0,1,0,0|1,0,0]=3 21552 B16R1.960 CCOC(=O)C1CCCCN1CC(C)CC 269982a_100016990872_100000748023 [0,1,0,1,0,0|1,0,0]=3 21553 B16R1.960 CCOC(=O)C1CCCCN1CC(C)CC 270004a_100016990872_100000243153 [0,1,0,1,0,0|1,0,0]=3 21554 B16R1.960 CCOC(=O)C1CCCCN1CC(O)CC 2230a_100016990872_100011218378 [0,1,0,1,0,0|1,0,0]=3 21555 B16R1.960 CCOC(=O)C1CCCCN1CC(O)CC 269982a_100016990872_100011218378 [0,1,0,1,0,0|1,0,0]=3 21556 B16R1.960 CCOC(=O)C1CCCCN1CC(O)CO 2230a_100016990872_100011219619 [0,1,0,1,0,0|2,0,0]=4 21557 B16R1.960 CCOC(=O)C1CCCCN1C[C@@H](C)CC 2230a_100016990872_100009816398 [0,1,0,1,0,0|1,0,0]=3 21558 B16R1.960 CCOC(=O)C1CCCCN1C[C@@H](C)CC 269982a_100016990872_100009816398 [0,1,0,1,0,0|1,0,0]=3 21559 B16R1.960 CCOC(=O)C1CCCCN1C[C@@H](C)CO 2230a_100016990872_100000059175 [0,1,0,1,0,0|2,0,0]=4 21560 B16R1.960 CCOC(=O)C1CCCCN1C[C@@H](C)CO 269982a_100016990872_100000059175 [0,1,0,1,0,0|2,0,0]=4 21561 B16R1.960 CCOC(=O)C1CCCCN1C[C@@H](O)CF 2230a_100016990872_100015614560 [0,1,0,1,0,0|2,0,0]=4 21562 B16R1.960 CCOC(=O)C1CCCCN1C[C@@H](O)CO 2230a_100016990872_100009815848 [0,1,0,1,0,0|2,0,0]=4 21563 B16R1.960 CCOC(=O)C1CSCCN1CC(C)CC 2230a_100000735462_100000748023 [0,1,0,1,0,0|2,0,0]=4 21564 B16R1.960 CCOC(=O)C1CSCCN1CC(C)CC 269982a_100000735462_100000748023 [0,1,0,1,0,0|2,0,0]=4 21565 B16R1.960 CCOC(=O)C1CSCCN1CC(C)CC 270004a_100000735462_100000243153 [0,1,0,1,0,0|2,0,0]=4 21566 B16R1.960 CCOC(=O)C1CSCCN1CC(O)CC 2230a_100000735462_100011218378 [0,1,0,1,0,0|2,0,0]=4 21567 B16R1.960 CCOC(=O)C1CSCCN1CC(O)CC 269982a_100000735462_100011218378 [0,1,0,1,0,0|2,0,0]=4 21568 B16R1.960 CCOC(=O)C1CSCCN1C[C@@H](C)CC 2230a_100000735462_100009816398 [0,1,0,1,0,0|2,0,0]=4 21569 B16R1.960 CCOC(=O)C1CSCCN1C[C@@H](C)CC 269982a_100000735462_100009816398 [0,1,0,1,0,0|2,0,0]=4 21570 B16R1.960 CCOC(=O)[C@@H]1COCCN1CC(C)CC 2230a_100015229691_100000748023 [0,1,0,1,0,0|2,0,0]=4 21571 B16R1.960 CCOC(=O)[C@@H]1COCCN1CC(C)CC 269982a_100015229691_100000748023 [0,1,0,1,0,0|2,0,0]=4 21572 B16R1.960 CCOC(=O)[C@@H]1COCCN1CC(C)CC 270004a_100015229691_100000243153 [0,1,0,1,0,0|2,0,0]=4 21573 B16R1.960 CCOC(=O)[C@@H]1COCCN1CC(O)CC 2230a_100015229691_100011218378 [0,1,0,1,0,0|2,0,0]=4 21574 B16R1.960 CCOC(=O)[C@@H]1COCCN1CC(O)CC 269982a_100015229691_100011218378 [0,1,0,1,0,0|2,0,0]=4 21575 B16R1.960 CCOC(=O)[C@@H]1COCCN1C[C@@H](C)CC 2230a_100015229691_100009816398 [0,1,0,1,0,0|2,0,0]=4 21576 B16R1.960 CCOC(=O)[C@@H]1COCCN1C[C@@H](C)CC 269982a_100015229691_100009816398 [0,1,0,1,0,0|2,0,0]=4 21577 B16R1.1556 CCOC(=O)CC1CCCCN1C(=O)CC 11a_100116209990_100000210414 [0,1,0,1,0,0|1,0,1]=4 21578 B16R1.1556 CCOC(=O)CC1CCCCN1C(=O)CC 1626a_100116209990_100000210414 [0,1,0,1,0,0|1,0,1]=4 21579 B16R1.1556 CCOC(=O)CC1CCCCN1C(=O)CC 240690a_100116209990_100000210414 [0,1,0,1,0,0|1,0,1]=4 21580 B16R1.1556 CCOC(=O)CC1CCCCN1C(=O)CC 527a_100116209990_100000210414 [0,1,0,1,0,0|1,0,1]=4 21581 B16R1.1556 CCOC(=O)CC1CCCCN1C(C)CC 2230a_100116209990_100000758301 [0,1,0,1,0,0|1,0,0]=3 21582 B16R1.1556 CCOC(=O)CC1CCCCN1C(C)CC 269982a_100116209990_100000758301 [0,1,0,1,0,0|1,0,0]=3 21583 B16R1.1556 CCOC(=O)CC1CCCCN1C(C)CO 2230a_100116209990_100012180447 [0,1,0,1,0,0|2,0,0]=4 21584 B16R1.1556 CCOC(=O)CC1CCCCN1C(C)OC 269982a_100116209990_100009879195 [0,1,0,1,0,0|2,0,0]=4 21585 B16R1.1556 CCOC(=O)CC1CCCCN1[C@H](C)CO 269982a_100116209990_100016084084 [0,1,0,1,0,0|2,0,0]=4 21586 B16R1.2033 CCOC(=O)CCCN1CCCC(CC1)C 2230a_100025706717_100009991533 [0,1,0,1,0,0|1,0,0]=3 21587 B16R1.2033 CCOC(=O)CCCN1CCCC(CC1)C 269982a_100025706717_100009991533 [0,1,0,1,0,0|1,0,0]=3 21588 B16R1.2033 CCOC(=O)CCCN1CCCC(CC1)C 34a_100025706717_100009991533 [0,1,0,1,0,0|1,0,0]=3 21589 B16R1.2033 CCOC(=O)CCCN1CCCC(CC1)O 2230a_100015186869_100009991533 [0,1,0,1,0,0|1,0,0]=3 21590 B16R1.2033 CCOC(=O)CCCN1CCCC(CC1)O 269982a_100015186869_100009991533 [0,1,0,1,0,0|1,0,0]=3 21591 B16R1.2033 CCOC(=O)CCCN1CCCN(CC1)C 2230a_100000211313_100009991533 [0,1,0,1,0,0|2,0,0]=4 21592 B16R1.2033 CCOC(=O)CCCN1CCCN(CC1)C 269982a_100000211313_100009991533 [0,1,0,1,0,0|2,0,0]=4 21593 B16R1.2033 CCOC(=O)NCCN1CCCC(CC1)C 269982a_100025706717_200011445536 [0,1,0,1,0,0|2,0,0]=4 21594 B16R1.2033 CCOC(=O)NCCN1CCCC(CC1)O 269982a_100015186869_200011445536 [0,1,0,1,0,0|2,0,0]=4 21595 B16R1.14021 CCOC(=O)CCCN1CCC[C@@]1(C)CO 2230a_100016195882_100009991533 [0,1,0,1,0,0|2,0,0]=4 21596 B16R1.14021 CCOC(=O)CCCN1CCC[C@@]1(C)CO 269982a_100016195882_100009991533 [0,1,0,1,0,0|2,0,0]=4 21597 B16R1.14021 CCOC(=O)CCCN1CCC[C@@]1(C)CO 34a_100016195882_100009991533 [0,1,0,1,0,0|2,0,0]=4 21598 B16R1.14953 CCOC(=O)[C@@H]1CCC[C@@H]1OCC(=O)CC 7a_200015395474_100000747405 [0,1,0,1,0,0|1,0,1]=4 21599 B16R1.14953 CCOC(=O)[C@@H]1CCC[C@@H]1OCC(C)CC 7a_200015395474_100000748023 [0,1,0,1,0,0|1,0,0]=3 21600 B16R1.14953 CCOC(=O)[C@@H]1CCC[C@@H]1OCC(O)CC 7a_200015395474_100011218378 [0,1,0,1,0,0|1,0,0]=3 21601 B16R1.14953 CCOC(=O)[C@@H]1CCC[C@@H]1OCC(O)CO 7a_200015395474_100011219619 [0,1,0,1,0,0|2,0,0]=4 21602 B16R1.14953 CCOC(=O)[C@@H]1CCC[C@@H]1OC[C@@H](C)CC 7a_200015395474_100009816398 [0,1,0,1,0,0|1,0,0]=3 21603 B16R1.14953 CCOC(=O)[C@@H]1CCC[C@@H]1OC[C@@H](C)CO 7a_200015395474_100000059175 [0,1,0,1,0,0|2,0,0]=4 21604 B16R1.14953 CCOC(=O)[C@@H]1CCC[C@@H]1OC[C@@H](O)CF 7a_200015395474_100015614560 [0,1,0,1,0,0|2,0,0]=4 21605 B16R1.14953 CCOC(=O)[C@@H]1CCC[C@@H]1OC[C@@H](O)CO 7a_200015395474_100009815848 [0,1,0,1,0,0|2,0,0]=4 21606 B16R1.15016 CCOC(=O)CCCCCCNC1(CC1)C 2230a_100000757604_100009814379 [0,1,0,1,0,0|1,0,0]=3 21607 B16R1.15016 CCOC(=O)CCCCCCOC1(CC1)C 7a_100011725673_100009814379 [0,1,0,1,0,0|1,0,0]=3 21608 B16R1.15016 CCOC(=O)CCCCCNCC1(CC1)C 2230a_100000766693_100000755133 [0,1,0,1,0,0|1,0,0]=3 21609 B16R1.15016 CCOC(=O)CCCCCNCC1(CC1)O 2230a_100011936951_100000755133 [0,1,0,1,0,0|1,0,0]=3 21610 B16R1.15016 CCOC(=O)CCCCCOCC1(CC1)C 7a_100000698024_100000755133 [0,1,0,1,0,0|1,0,0]=3 21611 B16R1.15016 CCOC(=O)CCCCCOCC1(CC1)F 34a_200000703853_100000755133 [0,1,0,1,0,0|1,0,0]=3 21612 B16R1.15016 CCOC(=O)CCCCCOCC1(CC1)F 7a_200000703853_100000755133 [0,1,0,1,0,0|1,0,0]=3 21613 B16R1.15016 CCOC(=O)CCCCCSCC1(CO1)C 62a_100000755133_100000760498 [0,1,0,1,0,0|2,0,0]=4 21614 B16R1.15016 CCOC(=O)CCCCCSCC1(CO1)C 62a_100000760498_100000755133 [0,1,0,1,0,0|2,0,0]=4 21615 B16R1.15016 CCOC(=O)COCCCNCC1(CC1)C 2230a_100000766693_100009893628 [0,1,0,1,0,0|2,0,0]=4 21616 B16R1.15016 CCOC(=O)COCCCNCC1(CC1)O 2230a_100011936951_100009893628 [0,1,0,1,0,0|2,0,0]=4 21617 B16R1.15016 CCOC(=O)COCCCOCC1(CC1)C 7a_100000698024_100009893628 [0,1,0,1,0,0|2,0,0]=4 21618 B16R1.15016 CCOC(=O)COCCCOCC1(CC1)F 34a_200000703853_100009893628 [0,1,0,1,0,0|2,0,0]=4 21619 B16R1.15016 CCOC(=O)COCCCOCC1(CC1)F 7a_200000703853_100009893628 [0,1,0,1,0,0|2,0,0]=4 21620 B16R1.16885 CCC(C)CCCCCOC1CCCC1=O 7a_200000035636_100000211823 [0,1,0,1,0,0|2,0,0]=4 21621 B16R1.16885 CCC(C)CCCCCOC1CCOC1=O 7a_200000035636_100000211211 [0,1,0,1,0,0|1,0,0]=3 21622 B16R1.18403 CCC(C)CCCCCOCC(=O)C1CC1 7a_200000035636_100000746382 [0,1,0,1,0,0|2,0,0]=4 21623 B16R1.66072 CCOC(=O)CCCCCN1C[C@@H]([C@@H]1C)O 2230a_206633788156_100000755133 [0,1,0,1,0,0|1,0,0]=3 21624 B16R1.66072 CCOC(=O)CCCCCN1C[C@@H]([C@@H]1C)O 269982a_206633788156_100000755133 [0,1,0,1,0,0|1,0,0]=3 21625 B16R1.66072 CCOC(=O)COCCCN1C[C@@H]([C@@H]1C)O 2230a_206633788156_100009893628 [0,1,0,1,0,0|2,0,0]=4 21626 B16R1.66072 CCOC(=O)COCCCN1C[C@@H]([C@@H]1C)O 269982a_206633788156_100009893628 [0,1,0,1,0,0|2,0,0]=4 21627 B16R1.1541 CCNC(=O)CCOC1CCC(CC1C)C 7a_100011539931_100000737597 [0,1,0,1,0,0|2,0,0]=4 21628 B16R1.1541 CCOC(=O)CCCN1CCN(C[C@@H]1C)C 2230a_100012002466_100009991533 [0,1,0,1,0,0|2,0,0]=4 21629 B16R1.1541 CCOC(=O)CCCN1CCN(C[C@@H]1C)C 269982a_100012002466_100009991533 [0,1,0,1,0,0|2,0,0]=4 21630 B16R1.1541 CCOC(=O)CCOC1CCC(CC1C)C 34a_100011539931_100000765890 [0,1,0,1,0,0|1,0,0]=3 21631 B16R1.1541 CCOC(=O)CCOC1CCC(CC1C)C 7a_100011539931_100011206558 [0,1,0,1,0,0|1,0,0]=3 21632 B16R1.14964 CCCC(=O)N1CCCCC1C(=O)OCC 11a_100016990872_100000211992 [0,1,0,1,0,0|1,0,1]=4 21633 B16R1.14964 CCCC(=O)N1CCCCC1C(=O)OCC 1626a_100016990872_100000211992 [0,1,0,1,0,0|1,0,1]=4 21634 B16R1.14964 CCCC(=O)N1CCCCC1C(=O)OCC 240690a_100016990872_100000211992 [0,1,0,1,0,0|1,0,1]=4 21635 B16R1.14964 CCCC(=O)N1CCCCC1C(=O)OCC 527a_100016990872_100000211992 [0,1,0,1,0,0|1,0,1]=4 21636 B16R1.14964 CCCC(C)N1CCCCC1C(=O)OCC 2230a_100016990872_100000766640 [0,1,0,1,0,0|1,0,0]=3 21637 B16R1.14964 CCCC(C)N1CCCCC1C(=O)OCC 269982a_100016990872_100000766640 [0,1,0,1,0,0|1,0,0]=3 21638 B16R1.14964 CCCC(C)N1CCCCC1C(=O)OCC 270004a_100016990872_100000211909 [0,1,0,1,0,0|1,0,0]=3 21639 B16R1.14964 CCCC(C)N1CCOC[C@H]1C(=O)OCC 2230a_100015229691_100000766640 [0,1,0,1,0,0|2,0,0]=4 21640 B16R1.14964 CCCC(C)N1CCOC[C@H]1C(=O)OCC 269982a_100015229691_100000766640 [0,1,0,1,0,0|2,0,0]=4 21641 B16R1.14964 CCCC(C)N1CCOC[C@H]1C(=O)OCC 270004a_100015229691_100000211909 [0,1,0,1,0,0|2,0,0]=4 21642 B16R1.14964 CCCC(C)N1CCSCC1C(=O)OCC 2230a_100000735462_100000766640 [0,1,0,1,0,0|2,0,0]=4 21643 B16R1.14964 CCCC(C)N1CCSCC1C(=O)OCC 269982a_100000735462_100000766640 [0,1,0,1,0,0|2,0,0]=4 21644 B16R1.14964 CCCC(C)N1CCSCC1C(=O)OCC 270004a_100000735462_100000211909 [0,1,0,1,0,0|2,0,0]=4 21645 B16R1.14964 CCOC(=O)C1CCCCN1C(C)CCO 2230a_100016990872_100009893172 [0,1,0,1,0,0|2,0,0]=4 21646 B16R1.14964 CCOC(=O)C1CCCCN1C(C)CCO 269982a_100016990872_100009893172 [0,1,0,1,0,0|2,0,0]=4 21647 B16R1.14964 CCOC(=O)C1CCCCN1C(C)COC 2230a_100016990872_100000765312 [0,1,0,1,0,0|2,0,0]=4 21648 B16R1.14964 CCOC(=O)C1CCCCN1C(C)COC 269982a_100016990872_100000765312 [0,1,0,1,0,0|2,0,0]=4 21649 B16R1.14964 CCOC(=O)C1CCCCN1C(C)COC 270004a_100016990872_100000749346 [0,1,0,1,0,0|2,0,0]=4 21650 B16R1.14964 CCOC(=O)C1CCCCN1C(C)CSC 270004a_100016990872_100011216314 [0,1,0,1,0,0|2,0,0]=4 21651 B16R1.15543 CCCC(=O)CN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100000747444 [0,1,0,1,0,0|1,0,1]=4 21652 B16R1.15543 CCCC(=O)CN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100000747444 [0,1,0,1,0,0|1,0,1]=4 21653 B16R1.15543 CCCC(=O)NC1CCCC1C(=O)OCC 188690a_200020588403_100000211992 [0,1,0,1,0,0|1,0,1]=4 21654 B16R1.15543 CCCC(C)CN1CCC[C@H]1C(=O)NCC 2230a_100020641767_100011216630 [0,1,0,1,0,0|2,0,0]=4 21655 B16R1.15543 CCCC(C)CN1CCC[C@H]1C(=O)NCC 269982a_100020641767_100011216630 [0,1,0,1,0,0|2,0,0]=4 21656 B16R1.15543 CCCC(C)CN1CCC[C@H]1C(=O)NCC 270004a_100020641767_100000243154 [0,1,0,1,0,0|2,0,0]=4 21657 B16R1.15543 CCCC(C)CN1CCC[C@H]1C(=O)NCC 34a_100020641767_100011216630 [0,1,0,1,0,0|2,0,0]=4 21658 B16R1.15543 CCCC(C)CN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100011216630 [0,1,0,1,0,0|1,0,0]=3 21659 B16R1.15543 CCCC(C)CN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100011216630 [0,1,0,1,0,0|1,0,0]=3 21660 B16R1.15543 CCCC(C)CN1CCC[C@H]1C(=O)OCC 270004a_100000703725_100000243154 [0,1,0,1,0,0|1,0,0]=3 21661 B16R1.15543 CCCC(C)CN1CSC[C@H]1C(=O)OCC 269982a_100016989239_100011216630 [0,1,0,1,0,0|2,0,0]=4 21662 B16R1.15543 CCCC(C)CN1CSC[C@H]1C(=O)OCC 270004a_100016989239_100000243154 [0,1,0,1,0,0|2,0,0]=4 21663 B16R1.15543 CCCC(C)O[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100000766640 [0,1,0,1,0,0|1,0,0]=3 21664 B16R1.15543 CCOC(=O)[C@@H]1CCC[C@@H]1OC(C)CCO 7a_200015395474_100009893172 [0,1,0,1,0,0|2,0,0]=4 21665 B16R1.15543 CCOC(=O)[C@@H]1CCC[C@@H]1OC(C)COC 7a_200015395474_100000765312 [0,1,0,1,0,0|2,0,0]=4 21666 B16R1.15555 CCOC(=O)CCCCCCC(=O)C1CC1 1458a_100000210395_100009814379 [0,1,0,1,0,0|0,0,1]=3 21667 B16R1.15555 CCOC(=O)CCCCCCC(=O)C1CO1 1458a_100000701028_100009814379 [0,1,0,1,0,0|1,0,1]=4 21668 B16R1.15555 CCOC(=O)CCCCCCN(C)C1CC1 2230a_100000226674_100009814379 [0,1,0,1,0,0|1,0,0]=3 21669 B16R1.15555 CCOC(=O)CCCCCCN(C)C1CC1 269982a_100000226674_100009814379 [0,1,0,1,0,0|1,0,0]=3 21670 B16R1.15555 CCOC(=O)CCCCCNC(=O)C1CC1 188690a_100000062434_100000210395 [0,1,0,1,0,0|1,0,1]=4 21671 B16R1.15555 CCOC(=O)CCCCCNC(C)C1CC1 2230a_100000700016_100000755133 [0,1,0,1,0,0|1,0,0]=3 21672 B16R1.15555 CCOC(=O)CCCCCNC(C)C1CC1 34a_100000700016_100000755133 [0,1,0,1,0,0|1,0,0]=3 21673 B16R1.15555 CCOC(=O)CCCCCOC(C)C1CC1 34a_100000744524_100000755133 [0,1,0,1,0,0|1,0,0]=3 21674 B16R1.15555 CCOC(=O)CCCCCOC(C)C1CC1 7a_100000744524_100000755133 [0,1,0,1,0,0|1,0,0]=3 21675 B16R1.15555 CCOC(=O)CCCCNCC(O)C1CC1 2230a_100000751198_100000750268 [0,1,0,1,0,0|1,0,0]=3 21676 B16R1.15555 CCOC(=O)CCCCNCC(O)C1CC1 34a_100000751198_100000750268 [0,1,0,1,0,0|1,0,0]=3 21677 B16R1.15555 CCOC(=O)CCCCOCC(=O)C1CC1 34a_100000686663_100000750268 [0,1,0,1,0,0|1,0,1]=4 21678 B16R1.15555 CCOC(=O)CCCCOC[C@H](N)C1CC1 34a_100020623730_100000750268 [0,1,0,1,0,0|1,0,0]=3 21679 B16R1.15555 CCOC(=O)CCCCSCC(=O)C1CC1 62a_100000746382_100000750268 [0,1,0,1,0,0|1,0,1]=4 21680 B16R1.15555 CCOC(=O)CCCCSCC(=O)C1CC1 62a_100000750268_100000746382 [0,1,0,1,0,0|1,0,1]=4 21681 B16R1.15555 CCOC(=O)COCCCNC(C)C1CC1 2230a_100000700016_100009893628 [0,1,0,1,0,0|2,0,0]=4 21682 B16R1.15555 CCOC(=O)COCCCNC(C)C1CC1 34a_100000700016_100009893628 [0,1,0,1,0,0|2,0,0]=4 21683 B16R1.15555 CCOC(=O)COCCCOC(C)C1CC1 34a_100000744524_100009893628 [0,1,0,1,0,0|2,0,0]=4 21684 B16R1.15555 CCOC(=O)COCCCOC(C)C1CC1 7a_100000744524_100009893628 [0,1,0,1,0,0|2,0,0]=4 21685 B16R1.15555 CCOC(=O)COCCNCC(O)C1CC1 2230a_100000751198_100000088970 [0,1,0,1,0,0|2,0,0]=4 21686 B16R1.15555 CCOC(=O)COCCNCC(O)C1CC1 34a_100000751198_100000088970 [0,1,0,1,0,0|2,0,0]=4 21687 B16R1.15555 CCOC(=O)COCCOC[C@H](N)C1CC1 34a_100020623730_100000088970 [0,1,0,1,0,0|2,0,0]=4 21688 B16R1.69452 CCOC(=O)CCN1CCCN(CC1C)C 269982a_100011935175_100011206558 [0,1,0,1,0,0|2,0,0]=4 21689 B16R1.69739 CCOC(=O)CCCCCNC1(CCC1)C 2230a_100000692455_100000755133 [0,1,0,1,0,0|1,0,0]=3 21690 B16R1.69739 CCOC(=O)CCCCCNC1(CCC1)C 34a_100000692455_100000755133 [0,1,0,1,0,0|1,0,0]=3 21691 B16R1.69739 CCOC(=O)CCCCCNC1(COC1)C 2230a_100000732644_100000755133 [0,1,0,1,0,0|2,0,0]=4 21692 B16R1.69739 CCOC(=O)CCCCCOC1(CCC1)C 34a_100000759064_100000755133 [0,1,0,1,0,0|1,0,0]=3 21693 B16R1.69739 CCOC(=O)CCCCCOC1(CCC1)C 7a_100000759064_100000755133 [0,1,0,1,0,0|1,0,0]=3 21694 B16R1.69739 CCOC(=O)CCCCCOC1(CSC1)C 7a_100016018533_100000755133 [0,1,0,1,0,0|2,0,0]=4 21695 B16R1.69739 CCOC(=O)CCCCNCC1(CCC1)C 2230a_100000706607_100000750268 [0,1,0,1,0,0|1,0,0]=3 21696 B16R1.69739 CCOC(=O)CCCCNCC1(CCC1)O 2230a_100000752638_100000750268 [0,1,0,1,0,0|1,0,0]=3 21697 B16R1.69739 CCOC(=O)CCCCNCC1(COC1)C 2230a_100020631278_100000750268 [0,1,0,1,0,0|2,0,0]=4 21698 B16R1.69739 CCOC(=O)CCCCNCC1(COC1)O 2230a_100010264505_100000750268 [0,1,0,1,0,0|2,0,0]=4 21699 B16R1.69739 CCOC(=O)CCCCOCC1(CSC1)C 34a_100000732658_100000750268 [0,1,0,1,0,0|2,0,0]=4 21700 B16R1.69739 CCOC(=O)CCCCOCC1(CSC1)C 7a_100000732658_100000750268 [0,1,0,1,0,0|2,0,0]=4 21701 B16R1.69739 CCOC(=O)CCCCSCC1(CCC1)C 62a_100000726658_100000750268 [0,1,0,1,0,0|1,0,0]=3 21702 B16R1.69739 CCOC(=O)CCCCSCC1(CCC1)C 62a_100000750268_100000726658 [0,1,0,1,0,0|1,0,0]=3 21703 B16R1.69739 CCOC(=O)CCCCSCC1(COC1)C 62a_100000750268_100009817586 [0,1,0,1,0,0|2,0,0]=4 21704 B16R1.69739 CCOC(=O)CCCCSCC1(COC1)C 62a_100009817586_100000750268 [0,1,0,1,0,0|2,0,0]=4 21705 B16R1.69739 CCOC(=O)COCCCNC1(CCC1)C 2230a_100000692455_100009893628 [0,1,0,1,0,0|2,0,0]=4 21706 B16R1.69739 CCOC(=O)COCCCNC1(CCC1)C 34a_100000692455_100009893628 [0,1,0,1,0,0|2,0,0]=4 21707 B16R1.69739 CCOC(=O)COCCCOC1(CCC1)C 34a_100000759064_100009893628 [0,1,0,1,0,0|2,0,0]=4 21708 B16R1.69739 CCOC(=O)COCCCOC1(CCC1)C 7a_100000759064_100009893628 [0,1,0,1,0,0|2,0,0]=4 21709 B16R1.69739 CCOC(=O)COCCNCC1(CCC1)C 2230a_100000706607_100000088970 [0,1,0,1,0,0|2,0,0]=4 21710 B16R1.69739 CCOC(=O)COCCNCC1(CCC1)O 2230a_100000752638_100000088970 [0,1,0,1,0,0|2,0,0]=4 21711 B16R1.69739 CCOC(=O)COCCSCC1(CCC1)C 62a_100000088970_100000726658 [0,1,0,1,0,0|2,0,0]=4 21712 B16R1.69739 CCOC(=O)COCCSCC1(CCC1)C 62a_100000726658_100000088970 [0,1,0,1,0,0|2,0,0]=4 21713 B16R1.69739 CCOC(=O)CSCCOCC1(CCC1)C 7a_200000230590_100000726658 [0,1,0,1,0,0|2,0,0]=4 21714 B16R1.310 CCNC1CCCCCCCCCCC1=O 2230a_100015525214_200009990614 [0,1,0,1,0,0|1,0,0]=3 21715 B16R1.310 CCOC1CCCCCCCCCCC1=O 34a_100121572206_200009990614 [0,1,0,1,0,0|0,0,0]=2 21716 B16R1.310 CCSC1CCCCCCCCCCC1=O 62a_100000210202_200009990614 [0,1,0,1,0,0|0,1,0]=3 21717 B16R1.310 CCSC1CCCCCCCCCCC1=O 62a_200009990614_100000210202 [0,1,0,1,0,0|0,1,0]=3 21718 B16R1.310 O=C1CCCCCCCCCCC1SCF 62a_100015361967_200009990614 [0,1,0,1,0,0|1,1,0]=4 21719 B16R1.310 O=C1CCCCCCCCCCC1SCF 62a_200009990614_100015361967 [0,1,0,1,0,0|1,1,0]=4 21720 B16R1.643 CCCCCCCCCCN1CCCOC1 2230a_100000131196_100000210320 [0,1,0,1,0,0|2,0,0]=4 21721 B16R1.643 CCCCCCCCCCN1CCCOC1 269982a_100000131196_100000210320 [0,1,0,1,0,0|2,0,0]=4 21722 B16R1.643 CCCCCCCCCCN1CCCOC1 34a_100000131196_100000210320 [0,1,0,1,0,0|2,0,0]=4 21723 B16R1.1218 CCCCCCCCNC1CCCCC1=O 34a_100000229939_100000754470 [0,1,0,1,0,0|2,0,0]=4 21724 B16R1.1218 CCCCCCCCNC1CCCNC1=O 2230a_100000229939_100000687798 [0,1,0,1,0,0|2,0,0]=4 21725 B16R1.1218 CCCCCCCCNC1CCCNC1=O 2230a_100000747585_100000210759 [0,1,0,1,0,0|2,0,0]=4 21726 B16R1.1218 CCCCCCCCNC1CCCNC1=O 34a_100000229939_100000687798 [0,1,0,1,0,0|2,0,0]=4 21727 B16R1.1218 CCCCCCCCNC1CCCNC1=O 34a_100000747585_100000210759 [0,1,0,1,0,0|2,0,0]=4 21728 B16R1.1218 CCCCCCCCNC1COCCC1=O 34a_100000229939_100012180262 [0,1,0,1,0,0|2,0,0]=4 21729 B16R1.1218 CCCCCCCCOC1CCCCC1=O 34a_100000210232_100000754470 [0,1,0,1,0,0|2,0,0]=4 21730 B16R1.1218 CCCCCCCCOC1CCCCC1=O 34a_100011214950_100000210759 [0,1,0,1,0,0|2,0,0]=4 21731 B16R1.1218 CCCCCCCCOC1CCCCC1=O 7a_100000210232_100000204591 [0,1,0,1,0,0|2,0,0]=4 21732 B16R1.1218 CCCCCCCCOC1CCCNC1=O 34a_100000073722_100000210759 [0,1,0,1,0,0|2,0,0]=4 21733 B16R1.1218 CCCCCCCCOC1CCCNC1=O 34a_100000210232_100000687798 [0,1,0,1,0,0|2,0,0]=4 21734 B16R1.1218 CCCCCCCCOC1CCCNC1=O 7a_100000210232_100000687798 [0,1,0,1,0,0|2,0,0]=4 21735 B16R1.1218 CCCCCCCCOC1COCCC1=O 34a_100000210232_100012180262 [0,1,0,1,0,0|2,0,0]=4 21736 B16R1.1218 CCCCCCCCOC1COCCC1=O 7a_100000210232_100012180262 [0,1,0,1,0,0|2,0,0]=4 21737 B16R1.1218 CCCCCCCCSC1CCCCC1=O 62a_100000204591_100000210317 [0,1,0,1,0,0|2,0,0]=4 21738 B16R1.1218 CCCCCCCCSC1CCCCC1=O 62a_100000210759_100000204591 [0,1,0,1,0,0|2,0,0]=4 21739 B16R1.1218 CCCCCCCCSC1CCCNC1=O 62a_100000210759_100000687798 [0,1,0,1,0,0|2,0,0]=4 21740 B16R1.1218 CCCCCCCCSC1CCCNC1=O 62a_100000687798_100000210317 [0,1,0,1,0,0|2,0,0]=4 21741 B16R1.1218 CCCCCCCCSC1COCCC1=O 62a_100000210759_100012180262 [0,1,0,1,0,0|2,0,0]=4 21742 B16R1.1218 CCCCCCCCSC1COCCC1=O 62a_100012180262_100000210317 [0,1,0,1,0,0|2,0,0]=4 21743 B16R1.1218 CCCCCCCOCC1CCCCC1=O 34a_100009861125_100000210614 [0,1,0,1,0,0|2,0,0]=4 21744 B16R1.1218 CCCCCCCOCC1CCCCC1=O 7a_100009861125_100000210614 [0,1,0,1,0,0|2,0,0]=4 21745 B16R1.1218 CCCCCCOCCC1NCCNC1=O 34a_100000044719_100000210314 [0,1,0,1,0,0|2,0,0]=4 21746 B16R1.1454 C=C(COC1CCCCC1CC)OCOC 34a_100000210738_100000042856 [0,1,0,1,0,0|2,0,0]=4 21747 B16R1.1454 C=CCOC(=O)COC1CCCCC1CC 34a_100000210738_100000033060 [0,1,0,1,0,0|1,0,1]=4 21748 B16R1.1454 C=CCOC(=O)COC1CCCCC1CC 7a_100000210738_100000033060 [0,1,0,1,0,0|1,0,1]=4 21749 B16R1.1454 CCC1CCCCC1NCC(=O)NCCF 270004a_100000725713_100000757040 [0,1,0,1,0,0|2,0,0]=4 21750 B16R1.1454 CCCNC(=O)CNC1CCCCC1CC 269862a_100000174927_100000757040 [0,1,0,1,0,0|2,0,0]=4 21751 B16R1.1454 CCCNC(=O)CNC1CCCCC1CC 270004a_100000174927_100000757040 [0,1,0,1,0,0|2,0,0]=4 21752 B16R1.1454 CCCNC(=O)COC1CCCCC1CC 34a_100000210738_100000183358 [0,1,0,1,0,0|2,0,0]=4 21753 B16R1.1454 CCCNC(=O)COC1CCCCC1CC 7a_100000210738_100000183358 [0,1,0,1,0,0|2,0,0]=4 21754 B16R1.1454 CCCOC(=O)CNC1CCCCC1OC 34a_100011208099_200011215008 [0,1,0,1,0,0|2,0,0]=4 21755 B16R1.1454 CCCOC(=O)COC1CCCCC1CC 34a_100000210738_200011215008 [0,1,0,1,0,0|1,0,0]=3 21756 B16R1.1454 CCCOC(=O)COC1CCCCC1CC 7a_100000210738_200011215008 [0,1,0,1,0,0|1,0,0]=3 21757 B16R1.1454 CCCOC(=O)COC1CCCCC1CN 34a_100011216029_200011215008 [0,1,0,1,0,0|2,0,0]=4 21758 B16R1.1454 CCCOC(=O)CO[C@@H]1CCCC[C@H]1NC 34a_100000708425_200011215008 [0,1,0,1,0,0|2,0,0]=4 21759 B16R1.1454 CCCOC(=O)CO[C@H]1CCCC[C@@H]1OC 34a_200009815850_200011215008 [0,1,0,1,0,0|2,0,0]=4 21760 B16R1.1454 CCCOC(=O)CO[C@H]1CCCC[C@@H]1OC 7a_200009815850_200011215008 [0,1,0,1,0,0|2,0,0]=4 21761 B16R1.1454 CCCOC(=O)OCN1CCCCC1CC 269982a_100000210034_200000139673 [0,1,0,1,0,0|2,0,0]=4 21762 B16R1.1454 CCCOC(=O)OCN1CCCCC1CC 34a_100000210034_200000139673 [0,1,0,1,0,0|2,0,0]=4 21763 B16R1.1454 CCOCC(=O)NCC1CCCCN1CC 11a_100000754393_100000211967 [0,1,0,1,0,0|2,0,0]=4 21764 B16R1.1454 CCOCC(=O)NCC1CCCCN1CC 1626a_100000754393_100000211967 [0,1,0,1,0,0|2,0,0]=4 21765 B16R1.1454 CCOCC(=O)NCC1CCCCN1CC 240690a_100000754393_100000211967 [0,1,0,1,0,0|2,0,0]=4 21766 B16R1.1454 CCOCC(=O)NCC1CCCCN1CC 527a_100000754393_100000211967 [0,1,0,1,0,0|2,0,0]=4 21767 B16R1.1465 C#CCCC(=O)CCCCC1CCCCC1 1458a_200011215547_100000753159 [0,1,0,1,0,0|1,0,1]=4 21768 B16R1.1465 C#CCNC(=O)CCCCC1CCCCC1 11a_100000212058_200011215547 [0,1,0,1,0,0|1,0,1]=4 21769 B16R1.1465 C#CCNC(=O)CCCCC1CCCCC1 1626a_100000212058_200011215547 [0,1,0,1,0,0|1,0,1]=4 21770 B16R1.1465 C#CCNC(=O)CCCCC1CCCCC1 240690a_100000212058_200011215547 [0,1,0,1,0,0|1,0,1]=4 21771 B16R1.1465 C#CCNC(=O)CCCCC1CCCCC1 527a_100000212058_200011215547 [0,1,0,1,0,0|1,0,1]=4 21772 B16R1.1465 C/C=C/CC(=O)CCCCC1CCCCC1 1458a_200011215547_100102629194 [0,1,0,1,0,0|1,0,1]=4 21773 B16R1.1465 C=C(CNCCC1CCCCC1)OCOC 34a_100000738074_100000042856 [0,1,0,1,0,0|2,0,0]=4 21774 B16R1.1465 C=C(COCCC1CCCCC1)OCOC 34a_100011217863_100000042856 [0,1,0,1,0,0|2,0,0]=4 21775 B16R1.1465 C=C(CSCCC1CCCCC1)OCOC 62a_100000042856_100012355289 [0,1,0,1,0,0|2,0,0]=4 21776 B16R1.1465 C=C(CSCCC1CCCCC1)OCOC 62a_100012355289_100000042856 [0,1,0,1,0,0|2,0,0]=4 21777 B16R1.1465 C=CCCC(=O)CCCCC1CCCCC1 1458a_200011215547_100000754431 [0,1,0,1,0,0|1,0,1]=4 21778 B16R1.1465 C=CCNC(=O)CCCCC1CCCCC1 1626a_100020586998_200011215547 [0,1,0,1,0,0|1,0,1]=4 21779 B16R1.1465 C=CCNC(=O)CCCCC1CCCCC1 240690a_100020586998_200011215547 [0,1,0,1,0,0|1,0,1]=4 21780 B16R1.1465 C=CCNC(=O)CCCCC1CCCCC1 527a_100020586998_200011215547 [0,1,0,1,0,0|1,0,1]=4 21781 B16R1.1465 C=CCOC(=O)CNCCC1CCCCC1 2230a_100000738074_100000033060 [0,1,0,1,0,0|1,0,1]=4 21782 B16R1.1465 C=CCOC(=O)CNCCC1CCCCC1 34a_100000738074_100000033060 [0,1,0,1,0,0|1,0,1]=4 21783 B16R1.1465 C=CCOC(=O)COCCC1CCCCC1 34a_100011217863_100000033060 [0,1,0,1,0,0|1,0,1]=4 21784 B16R1.1465 C=CCOC(=O)COCCC1CCCCC1 7a_100011217863_100000033060 [0,1,0,1,0,0|1,0,1]=4 21785 B16R1.1465 C=CCOC(=O)CSCCC1CCCCC1 62a_100000033060_100012355289 [0,1,0,1,0,0|1,0,1]=4 21786 B16R1.1465 C=CCOC(=O)CSCCC1CCCCC1 62a_100012355289_100000033060 [0,1,0,1,0,0|1,0,1]=4 21787 B16R1.1465 CC#CCC(=O)CCCCC1CCCCC1 1458a_200011215547_100000748600 [0,1,0,1,0,0|1,0,1]=4 21788 B16R1.1465 CC=CCC(=O)CCCCC1CCCCC1 1458a_200011215547_100000070051 [0,1,0,1,0,0|1,0,1]=4 21789 B16R1.1465 CCC=CC(=O)NCCCC1CCCCC1 11a_100011211642_100000212282 [0,1,0,1,0,0|2,0,0]=4 21790 B16R1.1465 CCC=CC(=O)NCCCC1CCCCC1 1626a_100011211642_100000212282 [0,1,0,1,0,0|2,0,0]=4 21791 B16R1.1465 CCC=CC(=O)NCCCC1CCCCC1 240690a_100011211642_100000212282 [0,1,0,1,0,0|2,0,0]=4 21792 B16R1.1465 CCCCC(=O)CCCCC1CCCCC1 1458a_200011215547_100000210211 [0,1,0,1,0,0|1,0,0]=3 21793 B16R1.1465 CCCCC(=O)CCCCN1CCCCC1 1458a_100000754417_100000210211 [0,1,0,1,0,0|2,0,0]=4 21794 B16R1.1465 CCCCC(=O)NCCCC1CCCCC1 11a_100011211642_100000210183 [0,1,0,1,0,0|2,0,0]=4 21795 B16R1.1465 CCCCC(=O)NCCCC1CCCCC1 1626a_100011211642_100000210183 [0,1,0,1,0,0|2,0,0]=4 21796 B16R1.1465 CCCCC(=O)NCCCC1CCCCC1 240690a_100011211642_100000210183 [0,1,0,1,0,0|2,0,0]=4 21797 B16R1.1465 CCCCC(=O)NCCCC1CCCCC1 527a_100011211642_100000210183 [0,1,0,1,0,0|2,0,0]=4 21798 B16R1.1465 CCCNC(=O)CCCCC1CCCCC1 11a_100020643023_200011215547 [0,1,0,1,0,0|1,0,0]=3 21799 B16R1.1465 CCCNC(=O)CCCCC1CCCCC1 1626a_100020643023_200011215547 [0,1,0,1,0,0|1,0,0]=3 21800 B16R1.1465 CCCNC(=O)CCCCC1CCCCC1 240690a_100020643023_200011215547 [0,1,0,1,0,0|1,0,0]=3 21801 B16R1.1465 CCCNC(=O)CCCCC1CCCCC1 527a_100020643023_200011215547 [0,1,0,1,0,0|1,0,0]=3 21802 B16R1.1465 CCCNC(=O)CCCCN1CCCCC1 11a_100020643023_100000754417 [0,1,0,1,0,0|2,0,0]=4 21803 B16R1.1465 CCCNC(=O)CCCCN1CCCCC1 240690a_100020643023_100000754417 [0,1,0,1,0,0|2,0,0]=4 21804 B16R1.1465 CCCNC(=O)CCCNC1CCCCC1 2230a_100000182618_100011194427 [0,1,0,1,0,0|2,0,0]=4 21805 B16R1.1465 CCCNC(=O)CCCOC1CCCCC1 7a_100000210231_100011194427 [0,1,0,1,0,0|2,0,0]=4 21806 B16R1.1465 CCCNC(=O)CCCSC1CCCCC1 62a_100000210327_100011194427 [0,1,0,1,0,0|2,0,0]=4 21807 B16R1.1465 CCCNC(=O)CCCSC1CCCCC1 62a_100011194427_100000210327 [0,1,0,1,0,0|2,0,0]=4 21808 B16R1.1465 CCCNC(=O)CNCCC1CCCCC1 2230a_100000174927_100012355289 [0,1,0,1,0,0|2,0,0]=4 21809 B16R1.1465 CCCNC(=O)CNCCC1CCCCC1 2230a_100000738074_100000183358 [0,1,0,1,0,0|2,0,0]=4 21810 B16R1.1465 CCCNC(=O)CNCCC1CCCCC1 270004a_100000174927_100011713444 [0,1,0,1,0,0|2,0,0]=4 21811 B16R1.1465 CCCNC(=O)CNCCC1CCCCC1 34a_100000738074_100000183358 [0,1,0,1,0,0|2,0,0]=4 21812 B16R1.1465 CCCNC(=O)COCCC1CCCCC1 34a_100011217863_100000183358 [0,1,0,1,0,0|2,0,0]=4 21813 B16R1.1465 CCCNC(=O)COCCC1CCCCC1 7a_100011217863_100000183358 [0,1,0,1,0,0|2,0,0]=4 21814 B16R1.1465 CCCNC(=O)CSCCC1CCCCC1 62a_100000183358_100012355289 [0,1,0,1,0,0|2,0,0]=4 21815 B16R1.1465 CCCNC(=O)CSCCC1CCCCC1 62a_100012355289_100000183358 [0,1,0,1,0,0|2,0,0]=4 21816 B16R1.1465 CCCNC(=O)NCCCC1CCCCC1 2708a_100011211642_100020643023 [0,1,0,1,0,0|2,0,0]=4 21817 B16R1.1465 CCCNC(=O)NCCCC1CCCCC1 2708a_100020643023_100011211642 [0,1,0,1,0,0|2,0,0]=4 21818 B16R1.1465 CCCNC(=O)NCCCC1CCCCC1 273464a_100011211642_100020643023 [0,1,0,1,0,0|2,0,0]=4 21819 B16R1.1465 CCCNC(=O)NCCCC1CCCCC1 273464a_100020643023_100011211642 [0,1,0,1,0,0|2,0,0]=4 21820 B16R1.1465 CCCNC(=O)NCCCC1CCCCC1 512a_100011211642_100020643023 [0,1,0,1,0,0|2,0,0]=4 21821 B16R1.1465 CCCNC(=O)NCCCC1CCCCC1 512a_100020643023_100011211642 [0,1,0,1,0,0|2,0,0]=4 21822 B16R1.1465 CCCOC(=O)CNCCC1CCCCC1 2230a_100000738074_200011215008 [0,1,0,1,0,0|1,0,0]=3 21823 B16R1.1465 CCCOC(=O)CNCCC1CCCCC1 34a_100000738074_200011215008 [0,1,0,1,0,0|1,0,0]=3 21824 B16R1.1465 CCCOC(=O)CNCCC1CCCCO1 2230a_100015183643_200011215008 [0,1,0,1,0,0|2,0,0]=4 21825 B16R1.1465 CCCOC(=O)CNCCC1CCCCO1 34a_100015183643_200011215008 [0,1,0,1,0,0|2,0,0]=4 21826 B16R1.1465 CCCOC(=O)CNCCC1CCOCC1 2230a_100000755988_200011215008 [0,1,0,1,0,0|2,0,0]=4 21827 B16R1.1465 CCCOC(=O)CNCCC1CCOCC1 34a_100000755988_200011215008 [0,1,0,1,0,0|2,0,0]=4 21828 B16R1.1465 CCCOC(=O)COCCC1CCCCC1 34a_100011217863_200011215008 [0,1,0,1,0,0|1,0,0]=3 21829 B16R1.1465 CCCOC(=O)COCCC1CCCCC1 7a_100011217863_200011215008 [0,1,0,1,0,0|1,0,0]=3 21830 B16R1.1465 CCCOC(=O)COCCC1CCCCN1 34a_100000211664_200011215008 [0,1,0,1,0,0|2,0,0]=4 21831 B16R1.1465 CCCOC(=O)COCCC1CCCNC1 34a_100000752241_200011215008 [0,1,0,1,0,0|2,0,0]=4 21832 B16R1.1465 CCCOC(=O)COCCC1CCNCC1 34a_100015190746_200011215008 [0,1,0,1,0,0|2,0,0]=4 21833 B16R1.1465 CCCOC(=O)COCCC1CCOCC1 34a_100011933979_200011215008 [0,1,0,1,0,0|2,0,0]=4 21834 B16R1.1465 CCCOC(=O)COCCC1CCOCC1 7a_100011933979_200011215008 [0,1,0,1,0,0|2,0,0]=4 21835 B16R1.1465 CCCOC(=O)CSCCC1CCCCC1 62a_100012355289_200011215008 [0,1,0,1,0,0|1,0,0]=3 21836 B16R1.1465 CCCOC(=O)CSCCC1CCCCC1 62a_200011215008_100012355289 [0,1,0,1,0,0|1,0,0]=3 21837 B16R1.1465 CCCOC(=O)CSCCC1CCOCC1 62a_100011934994_200011215008 [0,1,0,1,0,0|2,0,0]=4 21838 B16R1.1465 CCCOC(=O)CSCCC1CCOCC1 62a_200011215008_100011934994 [0,1,0,1,0,0|2,0,0]=4 21839 B16R1.1465 CCCOC(=O)CSCCN1CCCCC1 62a_100000739454_200011215008 [0,1,0,1,0,0|2,0,0]=4 21840 B16R1.1465 CCCOC(=O)CSCCN1CCCCC1 62a_200011215008_100000739454 [0,1,0,1,0,0|2,0,0]=4 21841 B16R1.1465 CCCOC(=O)CSCOC1CCCCC1 62a_100011935260_200011215008 [0,1,0,1,0,0|2,0,0]=4 21842 B16R1.1465 CCCOC(=O)CSCOC1CCCCC1 62a_200011215008_100011935260 [0,1,0,1,0,0|2,0,0]=4 21843 B16R1.1465 CCCOC(=O)OCNCC1CCCCC1 34a_100000210473_200000139673 [0,1,0,1,0,0|2,0,0]=4 21844 B16R1.1465 CCCOC(=O)OCOCC1CCCCC1 34a_100000212181_200000139673 [0,1,0,1,0,0|2,0,0]=4 21845 B16R1.1465 CCCOC(=O)OCOCC1CCCCC1 7a_100000212181_200000139673 [0,1,0,1,0,0|2,0,0]=4 21846 B16R1.1465 CCCOC(=O)OCSCC1CCCCC1 62a_100000211423_200000139673 [0,1,0,1,0,0|2,0,0]=4 21847 B16R1.1465 CCNCC(=O)NCCCC1CCCCC1 2230a_100015525214_200000048884 [0,1,0,1,0,0|2,0,0]=4 21848 B16R1.1465 CCNNC(=O)CCCCC1CCCCC1 22a_100000756455_200011215547 [0,1,0,1,0,0|1,0,0]=3 21849 B16R1.1465 CCNNC(=O)CCCCN1CCCCC1 22a_100000756455_100000754417 [0,1,0,1,0,0|2,0,0]=4 21850 B16R1.1465 CCNNC(=O)NCCCC1CCCCC1 273464a_100011211642_100000756455 [0,1,0,1,0,0|2,0,0]=4 21851 B16R1.1465 CCNNC(=O)NCCCC1CCCCC1 512a_100000756455_100011211642 [0,1,0,1,0,0|2,0,0]=4 21852 B16R1.1465 CCNNC(=O)NCCCC1CCCCC1 512a_100011211642_100000756455 [0,1,0,1,0,0|2,0,0]=4 21853 B16R1.1465 CCOCC(=O)CCCOC1CCCCO1 1458a_100000211967_100000700653 [0,1,0,1,0,0|2,0,0]=4 21854 B16R1.1465 CCOCC(=O)NCCCC1CCCCC1 11a_100011211642_100000211967 [0,1,0,1,0,0|1,0,0]=3 21855 B16R1.1465 CCOCC(=O)NCCCC1CCCCC1 1626a_100011211642_100000211967 [0,1,0,1,0,0|1,0,0]=3 21856 B16R1.1465 CCOCC(=O)NCCCC1CCCCC1 240690a_100011211642_100000211967 [0,1,0,1,0,0|1,0,0]=3 21857 B16R1.1465 CCOCC(=O)NCCCC1CCCCC1 34a_100121572206_200000048884 [0,1,0,1,0,0|1,0,0]=3 21858 B16R1.1465 CCOCC(=O)NCCCC1CCCCC1 527a_100011211642_100000211967 [0,1,0,1,0,0|1,0,0]=3 21859 B16R1.1465 CCOCC(=O)NCCCN1CCCCC1 240690a_100000204581_100000211967 [0,1,0,1,0,0|2,0,0]=4 21860 B16R1.1465 CCOCC(=O)NCCCN1CCCCC1 527a_100000204581_100000211967 [0,1,0,1,0,0|2,0,0]=4 21861 B16R1.1465 CCOCC(=O)NCCOC1CCCCC1 11a_100015206981_100000211967 [0,1,0,1,0,0|2,0,0]=4 21862 B16R1.1465 CCOCC(=O)NCCOC1CCCCC1 1626a_100015206981_100000211967 [0,1,0,1,0,0|2,0,0]=4 21863 B16R1.1465 CCOCC(=O)NCCOC1CCCCC1 240690a_100015206981_100000211967 [0,1,0,1,0,0|2,0,0]=4 21864 B16R1.1465 CCOCC(=O)NCCOC1CCCCC1 527a_100015206981_100000211967 [0,1,0,1,0,0|2,0,0]=4 21865 B16R1.1465 CCSCC(=O)NCCCC1CCCCC1 11a_100011211642_100000230394 [0,1,0,1,0,0|1,1,0]=4 21866 B16R1.1465 CCSCC(=O)NCCCC1CCCCC1 1626a_100011211642_100000230394 [0,1,0,1,0,0|1,1,0]=4 21867 B16R1.1465 CCSCC(=O)NCCCC1CCCCC1 240690a_100011211642_100000230394 [0,1,0,1,0,0|1,1,0]=4 21868 B16R1.1465 CCSCC(=O)NCCCC1CCCCC1 527a_100011211642_100000230394 [0,1,0,1,0,0|1,1,0]=4 21869 B16R1.1465 CCSCC(=O)NCCCC1CCCCC1 62a_100000210202_200000048884 [0,1,0,1,0,0|1,1,0]=4 21870 B16R1.1465 CCSCC(=O)NCCCC1CCCCC1 62a_200000048884_100000210202 [0,1,0,1,0,0|1,1,0]=4 21871 B16R1.1465 COCCC(=O)CCCCC1CCCCC1 1458a_200011215547_100000233755 [0,1,0,1,0,0|1,0,0]=3 21872 B16R1.1465 COCCC(=O)CCCCN1CCCCC1 1458a_100000754417_100000233755 [0,1,0,1,0,0|2,0,0]=4 21873 B16R1.1465 COCCC(=O)NCCCC1CCCCC1 11a_100011211642_100000749529 [0,1,0,1,0,0|2,0,0]=4 21874 B16R1.1465 COCCC(=O)NCCCC1CCCCC1 1626a_100011211642_100000749529 [0,1,0,1,0,0|2,0,0]=4 21875 B16R1.1465 COCCC(=O)NCCCC1CCCCC1 240690a_100011211642_100000749529 [0,1,0,1,0,0|2,0,0]=4 21876 B16R1.1465 COCCC(=O)NCCCC1CCCCC1 527a_100011211642_100000749529 [0,1,0,1,0,0|2,0,0]=4 21877 B16R1.1465 CSCCC(=O)CCCCC1CCCCC1 1458a_200011215547_100000751147 [0,1,0,1,0,0|1,0,0]=3 21878 B16R1.1465 CSCCC(=O)CCCCN1CCCCC1 1458a_100000754417_100000751147 [0,1,0,1,0,0|2,0,0]=4 21879 B16R1.1465 CSCCC(=O)NCCCC1CCCCC1 11a_100011211642_100000174002 [0,1,0,1,0,0|2,0,0]=4 21880 B16R1.1465 CSCCC(=O)NCCCC1CCCCC1 1626a_100011211642_100000174002 [0,1,0,1,0,0|2,0,0]=4 21881 B16R1.1465 CSCCC(=O)NCCCC1CCCCC1 240690a_100011211642_100000174002 [0,1,0,1,0,0|2,0,0]=4 21882 B16R1.1465 CSCCC(=O)NCCCC1CCCCC1 527a_100011211642_100000174002 [0,1,0,1,0,0|2,0,0]=4 21883 B16R1.1465 N#CCCC(=O)CCCCC1CCCCC1 1458a_200011215547_100011215226 [0,1,0,1,0,0|1,0,1]=4 21884 B16R1.1465 N#CCNC(=O)CCCCC1CCCCC1 1626a_100000734998_200011215547 [0,1,0,1,0,0|1,0,1]=4 21885 B16R1.1465 N#CCNC(=O)CCCCC1CCCCC1 527a_100000734998_200011215547 [0,1,0,1,0,0|1,0,1]=4 21886 B16R1.1465 O=C(CCCCC1CCCCC1)NCCF 11a_100000724931_200011215547 [0,1,0,1,0,0|1,0,0]=3 21887 B16R1.1465 O=C(CCCCC1CCCCC1)NCCF 1626a_100000724931_200011215547 [0,1,0,1,0,0|1,0,0]=3 21888 B16R1.1465 O=C(CCCCC1CCCCC1)NCCF 240690a_100000724931_200011215547 [0,1,0,1,0,0|1,0,0]=3 21889 B16R1.1465 O=C(CCCCC1CCCCC1)NCCF 527a_100000724931_200011215547 [0,1,0,1,0,0|1,0,0]=3 21890 B16R1.1465 O=C(CCCCC1CCCCC1)NCCO 240690a_100000210304_200011215547 [0,1,0,1,0,0|1,0,0]=3 21891 B16R1.1465 O=C(CCCCC1CCCCC1)NCCO 527a_100000210304_200011215547 [0,1,0,1,0,0|1,0,0]=3 21892 B16R1.1465 O=C(CCCCN1CCCCC1)NCCF 11a_100000724931_100000754417 [0,1,0,1,0,0|2,0,0]=4 21893 B16R1.1465 O=C(CCCCN1CCCCC1)NCCF 240690a_100000724931_100000754417 [0,1,0,1,0,0|2,0,0]=4 21894 B16R1.1465 O=C(CCCCN1CCCCC1)NCCO 240690a_100000210304_100000754417 [0,1,0,1,0,0|2,0,0]=4 21895 B16R1.1465 O=C(CCCF)CCCCC1CCCCC1 1458a_200011215547_100011934791 [0,1,0,1,0,0|1,0,0]=3 21896 B16R1.1465 O=C(CCCF)CCCCN1CCCCC1 1458a_100000754417_100011934791 [0,1,0,1,0,0|2,0,0]=4 21897 B16R1.1465 O=C(CCCO)CCCCC1CCCCC1 1458a_200011215547_100011215043 [0,1,0,1,0,0|1,0,0]=3 21898 B16R1.1465 O=C(CCCO)CCCCN1CCCCC1 1458a_100000754417_100011215043 [0,1,0,1,0,0|2,0,0]=4 21899 B16R1.1465 O=C(CNCCC1CCCCC1)NCCF 2230a_100000725713_100012355289 [0,1,0,1,0,0|2,0,0]=4 21900 B16R1.1465 O=C(CNCCC1CCCCC1)NCCF 270004a_100000725713_100011713444 [0,1,0,1,0,0|2,0,0]=4 21901 B16R1.1465 O=C(NCCF)NCCCC1CCCCC1 2708a_100011211642_100000724931 [0,1,0,1,0,0|2,0,0]=4 21902 B16R1.1465 O=C(NCCF)NCCCC1CCCCC1 273464a_100000724931_100011211642 [0,1,0,1,0,0|2,0,0]=4 21903 B16R1.1465 O=C(NCCF)NCCCC1CCCCC1 273464a_100011211642_100000724931 [0,1,0,1,0,0|2,0,0]=4 21904 B16R1.1465 O=C(NCCF)NCCCC1CCCCC1 512a_100011211642_100000724931 [0,1,0,1,0,0|2,0,0]=4 21905 B16R1.1465 O=C(NCCO)NCCCC1CCCCC1 2708a_100011211642_100000210304 [0,1,0,1,0,0|2,0,0]=4 21906 B16R1.1465 O=C(NCCO)NCCCC1CCCCC1 273464a_100000210304_100011211642 [0,1,0,1,0,0|2,0,0]=4 21907 B16R1.1465 O=C(NCCO)NCCCC1CCCCC1 273464a_100011211642_100000210304 [0,1,0,1,0,0|2,0,0]=4 21908 B16R1.1465 O=C(NCCO)NCCCC1CCCCC1 512a_100011211642_100000210304 [0,1,0,1,0,0|2,0,0]=4 21909 B16R1.1492 CCCNC(=O)CCCN1CCCC1CC 2230a_100000754278_100011194427 [0,1,0,1,0,0|2,0,0]=4 21910 B16R1.1492 CCCNC(=O)CCCN1CCCC1CC 269982a_100000754278_100011194427 [0,1,0,1,0,0|2,0,0]=4 21911 B16R1.1492 CCCOC(=O)CNCC1CCCN1CC 2230a_100000211693_200011215008 [0,1,0,1,0,0|2,0,0]=4 21912 B16R1.1492 CCCOC(=O)COC[C@H]1CCCN1CC 34a_100011739246_200011215008 [0,1,0,1,0,0|2,0,0]=4 21913 B16R1.1492 CCCOC(=O)COC[C@H]1CCCN1CC 7a_100011739246_200011215008 [0,1,0,1,0,0|2,0,0]=4 21914 B16R1.1973 C=C(CN1CCCCC1CCC)OCOC 269982a_100000701414_100000042856 [0,1,0,1,0,0|2,0,0]=4 21915 B16R1.1973 C=C(CN1CCCCC1CCC)OCOC 34a_100000701414_100000042856 [0,1,0,1,0,0|2,0,0]=4 21916 B16R1.1973 C=CCOC(=O)CN1CCCCC1CCC 2230a_100000701414_100000033060 [0,1,0,1,0,0|1,0,1]=4 21917 B16R1.1973 C=CCOC(=O)CN1CCCCC1CCC 269982a_100000701414_100000033060 [0,1,0,1,0,0|1,0,1]=4 21918 B16R1.1973 C=CCOC(=O)CN1CCCCC1CCC 34a_100000701414_100000033060 [0,1,0,1,0,0|1,0,1]=4 21919 B16R1.1973 CCCNC(=O)CN1CCCCC1CCC 2230a_100000701414_100000183358 [0,1,0,1,0,0|2,0,0]=4 21920 B16R1.1973 CCCNC(=O)CN1CCCCC1CCC 269982a_100000701414_100000183358 [0,1,0,1,0,0|2,0,0]=4 21921 B16R1.1973 CCCNC(=O)CN1CCCCC1CCC 34a_100000701414_100000183358 [0,1,0,1,0,0|2,0,0]=4 21922 B16R1.1973 CCCOC(=O)CN1CCCCC1CCC 2230a_100000701414_200011215008 [0,1,0,1,0,0|1,0,0]=3 21923 B16R1.1973 CCCOC(=O)CN1CCCCC1CCC 269982a_100000701414_200011215008 [0,1,0,1,0,0|1,0,0]=3 21924 B16R1.1973 CCCOC(=O)CN1CCCCC1CCC 34a_100000701414_200011215008 [0,1,0,1,0,0|1,0,0]=3 21925 B16R1.1973 CCCOC(=O)CN1CCCCC1CCO 2230a_100000211664_200011215008 [0,1,0,1,0,0|2,0,0]=4 21926 B16R1.1973 CCCOC(=O)CN1CCCCC1CCO 269982a_100000211664_200011215008 [0,1,0,1,0,0|2,0,0]=4 21927 B16R1.1973 CCCOC(=O)CN1CCCCC1CCO 34a_100000211664_200011215008 [0,1,0,1,0,0|2,0,0]=4 21928 B16R1.1973 CCCOC(=O)CN1CCCCC1COC 2230a_100015184032_200011215008 [0,1,0,1,0,0|2,0,0]=4 21929 B16R1.1973 CCCOC(=O)CN1CCCCC1COC 269982a_100015184032_200011215008 [0,1,0,1,0,0|2,0,0]=4 21930 B16R1.1973 CCCOC(=O)CN1CCCCC1COC 34a_100015184032_200011215008 [0,1,0,1,0,0|2,0,0]=4 21931 B16R1.1973 CCCOC(=O)CN1CCOCC1CCC 2230a_102495339903_200011215008 [0,1,0,1,0,0|2,0,0]=4 21932 B16R1.1973 CCCOC(=O)CN1CCOCC1CCC 269982a_102495339903_200011215008 [0,1,0,1,0,0|2,0,0]=4 21933 B16R1.1973 CCCOC(=O)CN1CCOCC1CCC 34a_102495339903_200011215008 [0,1,0,1,0,0|2,0,0]=4 21934 B16R1.1976 C=C(CN1CCCCCCCC1)OCOC 269982a_100000039187_100000042856 [0,1,0,1,0,0|2,0,0]=4 21935 B16R1.1976 C=C(CN1CCCCCCCC1)OCOC 34a_100000039187_100000042856 [0,1,0,1,0,0|2,0,0]=4 21936 B16R1.1976 C=CCOC(=O)CN1CCCCCCCC1 2230a_100000039187_100000033060 [0,1,0,1,0,0|1,0,1]=4 21937 B16R1.1976 C=CCOC(=O)CN1CCCCCCCC1 269982a_100000039187_100000033060 [0,1,0,1,0,0|1,0,1]=4 21938 B16R1.1976 C=CCOC(=O)CN1CCCCCCCC1 34a_100000039187_100000033060 [0,1,0,1,0,0|1,0,1]=4 21939 B16R1.1976 CCCNC(=O)CN1CCCCCCCC1 2230a_100000039187_100000183358 [0,1,0,1,0,0|2,0,0]=4 21940 B16R1.1976 CCCNC(=O)CN1CCCCCCCC1 269982a_100000039187_100000183358 [0,1,0,1,0,0|2,0,0]=4 21941 B16R1.1976 CCCNC(=O)CN1CCCCCCCC1 34a_100000039187_100000183358 [0,1,0,1,0,0|2,0,0]=4 21942 B16R1.1976 CCCOC(=O)CN1CCCCCCCC1 2230a_100000039187_200011215008 [0,1,0,1,0,0|1,0,0]=3 21943 B16R1.1976 CCCOC(=O)CN1CCCCCCCC1 269982a_100000039187_200011215008 [0,1,0,1,0,0|1,0,0]=3 21944 B16R1.1976 CCCOC(=O)CN1CCCCCCCC1 34a_100000039187_200011215008 [0,1,0,1,0,0|1,0,0]=3 21945 B16R1.4473 CCCNC(=O)CCCN1CCCCC1C 2230a_100000211376_100011194427 [0,1,0,1,0,0|2,0,0]=4 21946 B16R1.4473 CCCNC(=O)CCCN1CCCCC1C 269982a_100000211376_100011194427 [0,1,0,1,0,0|2,0,0]=4 21947 B16R1.4473 CCCOC(=O)CNCC1CCCCC1O 34a_100011216029_200011215008 [0,1,0,1,0,0|2,0,0]=4 21948 B16R1.4473 CCCOC(=O)CNCC1CCCCN1C 34a_100011228421_200011215008 [0,1,0,1,0,0|2,0,0]=4 21949 B16R1.4473 CCCOC(=O)COCC1CCCCN1C 34a_100000225079_200011215008 [0,1,0,1,0,0|2,0,0]=4 21950 B16R1.4473 CCCOC(=O)CSCC1CCCCN1C 62a_100015185383_200011215008 [0,1,0,1,0,0|2,0,0]=4 21951 B16R1.4473 CCCOC(=O)CSCC1CCCCN1C 62a_200011215008_100015185383 [0,1,0,1,0,0|2,0,0]=4 21952 B16R1.4473 CCCOC(=O)OCNC1CCCCC1C 34a_100000211402_200000139673 [0,1,0,1,0,0|2,0,0]=4 21953 B16R1.4473 CCCOC(=O)OCOC1CCCCC1C 34a_100000211207_200000139673 [0,1,0,1,0,0|2,0,0]=4 21954 B16R1.4473 CCCOC(=O)OCOC1CCCCC1C 7a_100000211207_200000139673 [0,1,0,1,0,0|2,0,0]=4 21955 B16R1.4473 CCOCC(=O)NCCN1CCCCC1C 240690a_100000739827_100000211967 [0,1,0,1,0,0|2,0,0]=4 21956 B16R1.4473 CCOCC(=O)NCCN1CCCCC1C 527a_100000739827_100000211967 [0,1,0,1,0,0|2,0,0]=4 21957 B16R1.7348 CCOCC(=O)N1CCCCC1CCCO 240690a_100011934581_100000211967 [0,1,0,1,0,0|2,0,0]=4 21958 B16R1.7348 CCOCC(=O)N1CCCCC1CCOC 11a_100015186528_100000211967 [0,1,0,1,0,0|2,0,0]=4 21959 B16R1.7348 CCOCC(=O)N1CCCCC1CCOC 1626a_100015186528_100000211967 [0,1,0,1,0,0|2,0,0]=4 21960 B16R1.7348 CCOCC(=O)N1CCCCC1CCOC 240690a_100015186528_100000211967 [0,1,0,1,0,0|2,0,0]=4 21961 B16R1.7348 CCOCC(=O)N1CCCCC1CCOC 527a_100015186528_100000211967 [0,1,0,1,0,0|2,0,0]=4 21962 B16R1.7352 CCNN=C1CCCCCCCCCCC1 4a_100000756455_100000210130 [0,1,0,1,0,0|2,0,0]=4 21963 B16R1.7352 FCCOC1CCCCCCCCCCC1 34a_100000211378_100011217306 [0,1,0,1,0,0|1,0,1]=4 21964 B16R1.7352 FCCOC1CCCCCCCCCCC1 7a_100000211378_100011217306 [0,1,0,1,0,0|1,0,1]=4 21965 B16R1.7352 OCCOC1CCCCCCCCCCC1 34a_100000211378_100000211926 [0,1,0,1,0,0|1,0,1]=4 21966 B16R1.7352 OCCOC1CCCCCCCCCCC1 7a_100000211378_100000211926 [0,1,0,1,0,0|1,0,1]=4 21967 B16R1.8360 CCCCCCCCNC1C(=O)COC1=O 34a_100000229939_100000032967 [0,1,0,1,0,0|1,0,1]=4 21968 B16R1.8360 CCCCCCCCOC1C(=O)COC1=O 34a_100000210232_100000032967 [0,1,0,1,0,0|1,0,1]=4 21969 B16R1.8360 CCCCCCCCSC1C(=O)COC1=O 62a_100000210759_100000032967 [0,1,0,1,0,0|1,0,1]=4 21970 B16R1.20724 CCCC1CCCC1NCC(=O)NCCF 270004a_100000725713_100000723119 [0,1,0,1,0,0|2,0,0]=4 21971 B16R1.20724 CCCNC(=O)CNC1CCCC1CCC 269862a_100000174927_100000723119 [0,1,0,1,0,0|2,0,0]=4 21972 B16R1.20724 CCCNC(=O)CNC1CCCC1CCC 270004a_100000174927_100000723119 [0,1,0,1,0,0|2,0,0]=4 21973 B16R1.20727 C=C(CNC1CCCCCCC1)OCOC 34a_100000211152_100000042856 [0,1,0,1,0,0|2,0,0]=4 21974 B16R1.20727 C=C(COC1CCCCCCC1)OCOC 34a_100000210054_100000042856 [0,1,0,1,0,0|2,0,0]=4 21975 B16R1.20727 C=CCOC(=O)CNC1CCCCCCC1 2230a_100000211152_100000033060 [0,1,0,1,0,0|1,0,1]=4 21976 B16R1.20727 C=CCOC(=O)CNC1CCCCCCC1 34a_100000211152_100000033060 [0,1,0,1,0,0|1,0,1]=4 21977 B16R1.20727 C=CCOC(=O)COC1CCCCCCC1 34a_100000210054_100000033060 [0,1,0,1,0,0|1,0,1]=4 21978 B16R1.20727 C=CCOC(=O)COC1CCCCCCC1 7a_100000210054_100000033060 [0,1,0,1,0,0|1,0,1]=4 21979 B16R1.20727 CCCCC(=O)CCN1CCCCCCC1 1458a_200015187237_100000210211 [0,1,0,1,0,0|2,0,0]=4 21980 B16R1.20727 CCCNC(=O)CCN1CCCCCCC1 240690a_100020643023_200015187237 [0,1,0,1,0,0|2,0,0]=4 21981 B16R1.20727 CCCNC(=O)CNC1CCCCCCC1 2230a_100000211152_100000183358 [0,1,0,1,0,0|2,0,0]=4 21982 B16R1.20727 CCCNC(=O)CNC1CCCCCCC1 270004a_100000174927_100000210524 [0,1,0,1,0,0|2,0,0]=4 21983 B16R1.20727 CCCNC(=O)CNC1CCCCCCC1 34a_100000211152_100000183358 [0,1,0,1,0,0|2,0,0]=4 21984 B16R1.20727 CCCNC(=O)COC1CCCCCCC1 34a_100000210054_100000183358 [0,1,0,1,0,0|2,0,0]=4 21985 B16R1.20727 CCCNC(=O)COC1CCCCCCC1 7a_100000210054_100000183358 [0,1,0,1,0,0|2,0,0]=4 21986 B16R1.20727 CCCOC(=O)CNC1CCCCCCC1 2230a_100000211152_200011215008 [0,1,0,1,0,0|1,0,0]=3 21987 B16R1.20727 CCCOC(=O)CNC1CCCCCCC1 34a_100000211152_200011215008 [0,1,0,1,0,0|1,0,0]=3 21988 B16R1.20727 CCCOC(=O)COC1CCCCCCC1 34a_100000210054_200011215008 [0,1,0,1,0,0|1,0,0]=3 21989 B16R1.20727 CCCOC(=O)COC1CCCCCCC1 7a_100000210054_200011215008 [0,1,0,1,0,0|1,0,0]=3 21990 B16R1.20727 CCCOC(=O)OCN1CCCCCCC1 269982a_100000211400_200000139673 [0,1,0,1,0,0|2,0,0]=4 21991 B16R1.20727 CCCOC(=O)OCN1CCCCCCC1 34a_100000211400_200000139673 [0,1,0,1,0,0|2,0,0]=4 21992 B16R1.20727 CCNNC(=O)CCN1CCCCCCC1 22a_100000756455_200015187237 [0,1,0,1,0,0|2,0,0]=4 21993 B16R1.20727 COCCC(=O)CCN1CCCCCCC1 1458a_200015187237_100000233755 [0,1,0,1,0,0|2,0,0]=4 21994 B16R1.20727 CSCCC(=O)CCN1CCCCCCC1 1458a_200015187237_100000751147 [0,1,0,1,0,0|2,0,0]=4 21995 B16R1.20727 O=C(CCCF)CCN1CCCCCCC1 1458a_200015187237_100011934791 [0,1,0,1,0,0|2,0,0]=4 21996 B16R1.20727 O=C(CCCO)CCN1CCCCCCC1 1458a_200015187237_100011215043 [0,1,0,1,0,0|2,0,0]=4 21997 B16R1.20727 O=C(CCN1CCCCCCC1)NCCF 240690a_100000724931_200015187237 [0,1,0,1,0,0|2,0,0]=4 21998 B16R1.20727 O=C(CCN1CCCCCCC1)NCCO 240690a_100000210304_200015187237 [0,1,0,1,0,0|2,0,0]=4 21999 B16R1.20727 O=C(CNC1CCCCCCC1)NCCF 270004a_100000725713_100000210524 [0,1,0,1,0,0|2,0,0]=4 22000 B16R1.20903 C=C(CNCC1CCCCCC1)OCOC 34a_100015204231_100000042856 [0,1,0,1,0,0|2,0,0]=4 22001 B16R1.20903 C=C(COCC1CCCCCC1)OCOC 34a_100000699130_100000042856 [0,1,0,1,0,0|2,0,0]=4 22002 B16R1.20903 C=C(CSCC1CCCCCC1)OCOC 62a_100000042856_200000696569 [0,1,0,1,0,0|2,0,0]=4 22003 B16R1.20903 C=C(CSCC1CCCCCC1)OCOC 62a_200000696569_100000042856 [0,1,0,1,0,0|2,0,0]=4 22004 B16R1.20903 C=CCOC(=O)CNCC1CCCCCC1 2230a_100015204231_100000033060 [0,1,0,1,0,0|1,0,1]=4 22005 B16R1.20903 C=CCOC(=O)CNCC1CCCCCC1 34a_100015204231_100000033060 [0,1,0,1,0,0|1,0,1]=4 22006 B16R1.20903 C=CCOC(=O)COCC1CCCCCC1 34a_100000699130_100000033060 [0,1,0,1,0,0|1,0,1]=4 22007 B16R1.20903 C=CCOC(=O)COCC1CCCCCC1 7a_100000699130_100000033060 [0,1,0,1,0,0|1,0,1]=4 22008 B16R1.20903 C=CCOC(=O)CSCC1CCCCCC1 62a_100000033060_200000696569 [0,1,0,1,0,0|1,0,1]=4 22009 B16R1.20903 C=CCOC(=O)CSCC1CCCCCC1 62a_200000696569_100000033060 [0,1,0,1,0,0|1,0,1]=4 22010 B16R1.20903 CCC=CC(=O)NCCC1CCCCCC1 11a_100011532351_100000212282 [0,1,0,1,0,0|2,0,0]=4 22011 B16R1.20903 CCC=CC(=O)NCCC1CCCCCC1 1626a_100011532351_100000212282 [0,1,0,1,0,0|2,0,0]=4 22012 B16R1.20903 CCC=CC(=O)NCCC1CCCCCC1 240690a_100011532351_100000212282 [0,1,0,1,0,0|2,0,0]=4 22013 B16R1.20903 CCCCC(=O)NCCC1CCCCCC1 11a_100011532351_100000210183 [0,1,0,1,0,0|2,0,0]=4 22014 B16R1.20903 CCCCC(=O)NCCC1CCCCCC1 1626a_100011532351_100000210183 [0,1,0,1,0,0|2,0,0]=4 22015 B16R1.20903 CCCCC(=O)NCCC1CCCCCC1 240690a_100011532351_100000210183 [0,1,0,1,0,0|2,0,0]=4 22016 B16R1.20903 CCCCC(=O)NCCC1CCCCCC1 527a_100011532351_100000210183 [0,1,0,1,0,0|2,0,0]=4 22017 B16R1.20903 CCCNC(=O)CCCN1CCCCCC1 2230a_100000185865_100011194427 [0,1,0,1,0,0|2,0,0]=4 22018 B16R1.20903 CCCNC(=O)CCCN1CCCCCC1 269982a_100000185865_100011194427 [0,1,0,1,0,0|2,0,0]=4 22019 B16R1.20903 CCCNC(=O)CNCC1CCCCCC1 2230a_100000174927_200000696569 [0,1,0,1,0,0|2,0,0]=4 22020 B16R1.20903 CCCNC(=O)CNCC1CCCCCC1 2230a_100015204231_100000183358 [0,1,0,1,0,0|2,0,0]=4 22021 B16R1.20903 CCCNC(=O)CNCC1CCCCCC1 269862a_100000174927_200000763224 [0,1,0,1,0,0|2,0,0]=4 22022 B16R1.20903 CCCNC(=O)CNCC1CCCCCC1 34a_100015204231_100000183358 [0,1,0,1,0,0|2,0,0]=4 22023 B16R1.20903 CCCNC(=O)COCC1CCCCCC1 34a_100000699130_100000183358 [0,1,0,1,0,0|2,0,0]=4 22024 B16R1.20903 CCCNC(=O)COCC1CCCCCC1 7a_100000699130_100000183358 [0,1,0,1,0,0|2,0,0]=4 22025 B16R1.20903 CCCNC(=O)CSCC1CCCCCC1 62a_100000183358_200000696569 [0,1,0,1,0,0|2,0,0]=4 22026 B16R1.20903 CCCNC(=O)CSCC1CCCCCC1 62a_200000696569_100000183358 [0,1,0,1,0,0|2,0,0]=4 22027 B16R1.20903 CCCNC(=O)NCCC1CCCCCC1 2708a_100011532351_100020643023 [0,1,0,1,0,0|2,0,0]=4 22028 B16R1.20903 CCCNC(=O)NCCC1CCCCCC1 2708a_100020643023_100011532351 [0,1,0,1,0,0|2,0,0]=4 22029 B16R1.20903 CCCNC(=O)NCCC1CCCCCC1 273464a_100011532351_100020643023 [0,1,0,1,0,0|2,0,0]=4 22030 B16R1.20903 CCCNC(=O)NCCC1CCCCCC1 273464a_100020643023_100011532351 [0,1,0,1,0,0|2,0,0]=4 22031 B16R1.20903 CCCNC(=O)NCCC1CCCCCC1 512a_100020643023_100011532351 [0,1,0,1,0,0|2,0,0]=4 22032 B16R1.20903 CCCOC(=O)CNCC1CCCCCC1 2230a_100015204231_200011215008 [0,1,0,1,0,0|1,0,0]=3 22033 B16R1.20903 CCCOC(=O)CNCC1CCCCCC1 34a_100015204231_200011215008 [0,1,0,1,0,0|1,0,0]=3 22034 B16R1.20903 CCCOC(=O)COCC1CCCCCC1 34a_100000699130_200011215008 [0,1,0,1,0,0|1,0,0]=3 22035 B16R1.20903 CCCOC(=O)COCC1CCCCCC1 7a_100000699130_200011215008 [0,1,0,1,0,0|1,0,0]=3 22036 B16R1.20903 CCCOC(=O)CSCC1CCCCCC1 62a_200000696569_200011215008 [0,1,0,1,0,0|1,0,0]=3 22037 B16R1.20903 CCCOC(=O)CSCC1CCCCCC1 62a_200011215008_200000696569 [0,1,0,1,0,0|1,0,0]=3 22038 B16R1.20903 CCCOC(=O)OCNC1CCCCCC1 34a_100000210984_200000139673 [0,1,0,1,0,0|2,0,0]=4 22039 B16R1.20903 CCCOC(=O)OCOC1CCCCCC1 34a_100000210887_200000139673 [0,1,0,1,0,0|2,0,0]=4 22040 B16R1.20903 CCCOC(=O)OCOC1CCCCCC1 7a_100000210887_200000139673 [0,1,0,1,0,0|2,0,0]=4 22041 B16R1.20903 CCCOC(=O)OCSC1CCCCCC1 62a_100011217769_200000139673 [0,1,0,1,0,0|2,0,0]=4 22042 B16R1.20903 CCNNC(=O)NCCC1CCCCCC1 273464a_100011532351_100000756455 [0,1,0,1,0,0|2,0,0]=4 22043 B16R1.20903 CCNNC(=O)NCCC1CCCCCC1 512a_100000756455_100011532351 [0,1,0,1,0,0|2,0,0]=4 22044 B16R1.20903 CCOCC(=O)NCCC1CCCCCC1 11a_100011532351_100000211967 [0,1,0,1,0,0|1,0,0]=3 22045 B16R1.20903 CCOCC(=O)NCCC1CCCCCC1 1626a_100011532351_100000211967 [0,1,0,1,0,0|1,0,0]=3 22046 B16R1.20903 CCOCC(=O)NCCC1CCCCCC1 240690a_100011532351_100000211967 [0,1,0,1,0,0|1,0,0]=3 22047 B16R1.20903 CCOCC(=O)NCCC1CCCCCC1 527a_100011532351_100000211967 [0,1,0,1,0,0|1,0,0]=3 22048 B16R1.20903 CCOCC(=O)NCCN1CCCCCC1 11a_100000738142_100000211967 [0,1,0,1,0,0|2,0,0]=4 22049 B16R1.20903 CCOCC(=O)NCCN1CCCCCC1 240690a_100000738142_100000211967 [0,1,0,1,0,0|2,0,0]=4 22050 B16R1.20903 CCOCC(=O)NCCN1CCCCCC1 527a_100000738142_100000211967 [0,1,0,1,0,0|2,0,0]=4 22051 B16R1.20903 CCSCC(=O)NCCC1CCCCCC1 11a_100011532351_100000230394 [0,1,0,1,0,0|1,1,0]=4 22052 B16R1.20903 CCSCC(=O)NCCC1CCCCCC1 1626a_100011532351_100000230394 [0,1,0,1,0,0|1,1,0]=4 22053 B16R1.20903 CCSCC(=O)NCCC1CCCCCC1 240690a_100011532351_100000230394 [0,1,0,1,0,0|1,1,0]=4 22054 B16R1.20903 CCSCC(=O)NCCC1CCCCCC1 527a_100011532351_100000230394 [0,1,0,1,0,0|1,1,0]=4 22055 B16R1.20903 COCCC(=O)NCCC1CCCCCC1 11a_100011532351_100000749529 [0,1,0,1,0,0|2,0,0]=4 22056 B16R1.20903 COCCC(=O)NCCC1CCCCCC1 1626a_100011532351_100000749529 [0,1,0,1,0,0|2,0,0]=4 22057 B16R1.20903 COCCC(=O)NCCC1CCCCCC1 240690a_100011532351_100000749529 [0,1,0,1,0,0|2,0,0]=4 22058 B16R1.20903 COCCC(=O)NCCC1CCCCCC1 527a_100011532351_100000749529 [0,1,0,1,0,0|2,0,0]=4 22059 B16R1.20903 CSCCC(=O)NCCC1CCCCCC1 11a_100011532351_100000174002 [0,1,0,1,0,0|2,0,0]=4 22060 B16R1.20903 CSCCC(=O)NCCC1CCCCCC1 1626a_100011532351_100000174002 [0,1,0,1,0,0|2,0,0]=4 22061 B16R1.20903 CSCCC(=O)NCCC1CCCCCC1 240690a_100011532351_100000174002 [0,1,0,1,0,0|2,0,0]=4 22062 B16R1.20903 CSCCC(=O)NCCC1CCCCCC1 527a_100011532351_100000174002 [0,1,0,1,0,0|2,0,0]=4 22063 B16R1.20903 O=C(CNCC1CCCCCC1)NCCF 2230a_100000725713_200000696569 [0,1,0,1,0,0|2,0,0]=4 22064 B16R1.20903 O=C(NCCF)NCCC1CCCCCC1 2708a_100011532351_100000724931 [0,1,0,1,0,0|2,0,0]=4 22065 B16R1.20903 O=C(NCCF)NCCC1CCCCCC1 273464a_100000724931_100011532351 [0,1,0,1,0,0|2,0,0]=4 22066 B16R1.20903 O=C(NCCF)NCCC1CCCCCC1 273464a_100011532351_100000724931 [0,1,0,1,0,0|2,0,0]=4 22067 B16R1.20903 O=C(NCCO)NCCC1CCCCCC1 2708a_100011532351_100000210304 [0,1,0,1,0,0|2,0,0]=4 22068 B16R1.20903 O=C(NCCO)NCCC1CCCCCC1 273464a_100000210304_100011532351 [0,1,0,1,0,0|2,0,0]=4 22069 B16R1.20903 O=C(NCCO)NCCC1CCCCCC1 273464a_100011532351_100000210304 [0,1,0,1,0,0|2,0,0]=4 22070 B16R1.23409 CCCCCCCN1CCC(=O)NC[C@@H]1C 2230a_102125656889_100000210681 [0,1,0,1,0,0|2,0,0]=4 22071 B16R1.23409 CCCCCCCN1CCC(=O)NC[C@@H]1C 269982a_102125656889_100000210681 [0,1,0,1,0,0|2,0,0]=4 22072 B16R1.23409 CCCCCCCN1CCC(=O)NC[C@@H]1C 34a_102125656889_100000210614 [0,1,0,1,0,0|2,0,0]=4 22073 B16R1.75 CCCCCCCCN1CCNC(=O)C1C 2230a_100000750721_100000210759 [0,1,0,1,0,0|2,0,0]=4 22074 B16R1.75 CCCCCCCCN1CCNC(=O)C1C 269982a_100000750721_100000210759 [0,1,0,1,0,0|2,0,0]=4 22075 B16R1.75 CCCCCCCCN1CCNC(=O)C1C 34a_100000750721_100000210759 [0,1,0,1,0,0|2,0,0]=4 22076 B16R1.4553 C=C(CNC1CCCCC1C)C(=O)OCC 34a_100000211402_100000755967 [0,1,0,1,0,0|1,0,1]=4 22077 B16R1.4553 C=C(COC1CCCCC1C)C(=O)OCC 34a_100000211207_100000755967 [0,1,0,1,0,0|1,0,1]=4 22078 B16R1.4553 C=C(COC1CCCCC1C)C(=O)OCC 7a_100000211207_100000755967 [0,1,0,1,0,0|1,0,1]=4 22079 B16R1.4553 CCOC(=O)C(C)NCC1CCCCC1O 34a_100011216029_100011216346 [0,1,0,1,0,0|2,0,0]=4 22080 B16R1.4553 CCOC(=O)C(C)NCC1CCCCN1C 34a_100011228421_100011216346 [0,1,0,1,0,0|2,0,0]=4 22081 B16R1.4553 CCOC(=O)C(C)OCC1CCCCN1C 34a_100000225079_100011216346 [0,1,0,1,0,0|2,0,0]=4 22082 B16R1.4553 CCOC(=O)C(C)SCC1CCCCN1C 62a_100011216346_100015185383 [0,1,0,1,0,0|2,0,0]=4 22083 B16R1.4553 CCOC(=O)C(C)SCC1CCCCN1C 62a_100015185383_100011216346 [0,1,0,1,0,0|2,0,0]=4 22084 B16R1.4553 CCOC(=O)C(F)NCC1CCCCC1O 34a_100011216029_100000760018 [0,1,0,1,0,0|2,0,0]=4 22085 B16R1.4553 CCOC(=O)C(F)NCC1CCCCN1C 34a_100011228421_100000760018 [0,1,0,1,0,0|2,0,0]=4 22086 B16R1.4553 CCOC(=O)C(F)OCC1CCCCN1C 34a_100000225079_100000760018 [0,1,0,1,0,0|2,0,0]=4 22087 B16R1.4553 CCOC(=O)C(F)SCC1CCCCN1C 62a_100000760018_100015185383 [0,1,0,1,0,0|2,0,0]=4 22088 B16R1.4553 CCOC(=O)C(F)SCC1CCCCN1C 62a_100015185383_100000760018 [0,1,0,1,0,0|2,0,0]=4 22089 B16R1.4553 CCOC(=O)[C@H](C)OCC1CCCCN1C 7a_100000751109_100015185383 [0,1,0,1,0,0|2,0,0]=4 22090 B16R1.4564 C=C(CNCCC1CCCC1)C(=O)OCC 34a_100000739158_100000755967 [0,1,0,1,0,0|1,0,1]=4 22091 B16R1.4564 C=C(COCCC1CCCC1)C(=O)OCC 34a_100000749090_100000755967 [0,1,0,1,0,0|1,0,1]=4 22092 B16R1.4564 C=C(COCCC1CCCC1)C(=O)OCC 7a_100000749090_100000755967 [0,1,0,1,0,0|1,0,1]=4 22093 B16R1.4564 C=C(CSCCC1CCCC1)C(=O)OCC 62a_100000755967_100000760354 [0,1,0,1,0,0|1,0,1]=4 22094 B16R1.4564 C=C(CSCCC1CCCC1)C(=O)OCC 62a_100000760354_100000755967 [0,1,0,1,0,0|1,0,1]=4 22095 B16R1.4564 CCNC(=O)C(C)NCCCC1CCCC1 2230a_100000736553_100011713738 [0,1,0,1,0,0|2,0,0]=4 22096 B16R1.4564 CCNC(=O)C(C)NCCCC1CCCC1 2230a_100000736752_100000230173 [0,1,0,1,0,0|2,0,0]=4 22097 B16R1.4564 CCNC(=O)C(C)NCCCC1CCCC1 34a_100000736553_100011713738 [0,1,0,1,0,0|2,0,0]=4 22098 B16R1.4564 CCNC(=O)C(C)NCCCC1CCCC1 34a_100000736752_100000230173 [0,1,0,1,0,0|2,0,0]=4 22099 B16R1.4564 CCNC(=O)C(C)OCCCC1CCCC1 34a_100011215328_100000230173 [0,1,0,1,0,0|2,0,0]=4 22100 B16R1.4564 CCNC(=O)C(C)OCCCC1CCCC1 7a_100011215328_100000230173 [0,1,0,1,0,0|2,0,0]=4 22101 B16R1.4564 CCNC(=O)C(C)SCCCC1CCCC1 62a_100000230173_100011713738 [0,1,0,1,0,0|2,0,0]=4 22102 B16R1.4564 CCNC(=O)C(C)SCCCC1CCCC1 62a_100011713738_100000230173 [0,1,0,1,0,0|2,0,0]=4 22103 B16R1.4564 CCOC(=O)C(=O)CSCCC1CCCC1 62a_100000211299_100000760354 [0,1,0,1,0,0|1,0,1]=4 22104 B16R1.4564 CCOC(=O)C(=O)CSCCC1CCCC1 62a_100000760354_100000211299 [0,1,0,1,0,0|1,0,1]=4 22105 B16R1.4564 CCOC(=O)C(=O)NCCCC1CCCC1 11a_100000736752_100014798877 [0,1,0,1,0,0|1,0,1]=4 22106 B16R1.4564 CCOC(=O)C(=O)NCCCC1CCCC1 1626a_100000736752_100014798877 [0,1,0,1,0,0|1,0,1]=4 22107 B16R1.4564 CCOC(=O)C(=O)NCCCC1CCCC1 240690a_100000736752_100014798877 [0,1,0,1,0,0|1,0,1]=4 22108 B16R1.4564 CCOC(=O)C(C)NCCCC1CCCC1 2230a_100000736752_100011215307 [0,1,0,1,0,0|1,0,0]=3 22109 B16R1.4564 CCOC(=O)C(C)NCCCC1CCCC1 34a_100000736752_100011216346 [0,1,0,1,0,0|1,0,0]=3 22110 B16R1.4564 CCOC(=O)C(C)NCCOC1CCCC1 34a_100000741755_100011216346 [0,1,0,1,0,0|2,0,0]=4 22111 B16R1.4564 CCOC(=O)C(C)OCCCC1CCCC1 34a_100011215328_100011216346 [0,1,0,1,0,0|1,0,0]=3 22112 B16R1.4564 CCOC(=O)C(C)OCCCC1CCCC1 7a_100011215328_100011216346 [0,1,0,1,0,0|1,0,0]=3 22113 B16R1.4564 CCOC(=O)C(C)OCCNC1CCCC1 34a_200000200444_100011216346 [0,1,0,1,0,0|2,0,0]=4 22114 B16R1.4564 CCOC(=O)C(C)OCCOC1CCCC1 34a_100000738311_100011216346 [0,1,0,1,0,0|2,0,0]=4 22115 B16R1.4564 CCOC(=O)C(C)OCCOC1CCCC1 7a_100000738311_100011216346 [0,1,0,1,0,0|2,0,0]=4 22116 B16R1.4564 CCOC(=O)C(C)SCCCC1CCCC1 62a_100011216346_100011713738 [0,1,0,1,0,0|1,0,0]=3 22117 B16R1.4564 CCOC(=O)C(C)SCCCC1CCCC1 62a_100011713738_100011216346 [0,1,0,1,0,0|1,0,0]=3 22118 B16R1.4564 CCOC(=O)C(C)SCCCN1CCCC1 62a_100011216346_100011445909 [0,1,0,1,0,0|2,0,0]=4 22119 B16R1.4564 CCOC(=O)C(C)SCCCN1CCCC1 62a_100016991639_100011216346 [0,1,0,1,0,0|2,0,0]=4 22120 B16R1.4564 CCOC(=O)C(F)NCCCC1CCCC1 2230a_100000736752_100000760018 [0,1,0,1,0,0|1,0,0]=3 22121 B16R1.4564 CCOC(=O)C(F)NCCCC1CCCC1 34a_100000736752_100000760018 [0,1,0,1,0,0|1,0,0]=3 22122 B16R1.4564 CCOC(=O)C(F)NCCOC1CCCC1 34a_100000741755_100000760018 [0,1,0,1,0,0|2,0,0]=4 22123 B16R1.4564 CCOC(=O)C(F)OCCCC1CCCC1 34a_100011215328_100000760018 [0,1,0,1,0,0|1,0,0]=3 22124 B16R1.4564 CCOC(=O)C(F)OCCCC1CCCC1 7a_100011215328_100000040065 [0,1,0,1,0,0|1,0,0]=3 22125 B16R1.4564 CCOC(=O)C(F)OCCNC1CCCC1 34a_200000200444_100000760018 [0,1,0,1,0,0|2,0,0]=4 22126 B16R1.4564 CCOC(=O)C(F)OCCOC1CCCC1 34a_100000738311_100000760018 [0,1,0,1,0,0|2,0,0]=4 22127 B16R1.4564 CCOC(=O)C(F)OCCOC1CCCC1 7a_100000738311_100000040065 [0,1,0,1,0,0|2,0,0]=4 22128 B16R1.4564 CCOC(=O)C(F)SCCCC1CCCC1 62a_100000760018_100011713738 [0,1,0,1,0,0|1,0,0]=3 22129 B16R1.4564 CCOC(=O)C(F)SCCCC1CCCC1 62a_100011713738_100000760018 [0,1,0,1,0,0|1,0,0]=3 22130 B16R1.4564 CCOC(=O)C(F)SCCCN1CCCC1 62a_100000760018_100011445909 [0,1,0,1,0,0|2,0,0]=4 22131 B16R1.4564 CCOC(=O)C(F)SCCCN1CCCC1 62a_100016991639_100000760018 [0,1,0,1,0,0|2,0,0]=4 22132 B16R1.4564 CCOC(=O)[C@H](C)OCCCC1CCCC1 7a_100000751109_100011713738 [0,1,0,1,0,0|1,0,0]=3 22133 B16R1.4564 CCOC(=O)[C@H](C)OCCCN1CCCC1 7a_100000751109_100011445909 [0,1,0,1,0,0|2,0,0]=4 22134 B16R1.4564 CCSC(=O)[C@H](C)NCCCC1CCCC1 2230a_100103168634_100011713738 [0,1,0,1,0,0|1,1,0]=4 22135 B16R1.4567 CCOC(=O)C(=O)CCCCCN1CCC1 269982a_100000754969_100000068741 [0,1,0,1,0,0|1,0,1]=4 22136 B16R1.4951 CCOC(=O)C(C)NCC1CCCN1CC 2230a_100000211693_100011215307 [0,1,0,1,0,0|2,0,0]=4 22137 B16R1.4951 CCOC(=O)C(C)OC[C@H]1CCCN1CC 34a_100011739246_100011216346 [0,1,0,1,0,0|2,0,0]=4 22138 B16R1.4951 CCOC(=O)C(C)OC[C@H]1CCCN1CC 7a_100011739246_100011216346 [0,1,0,1,0,0|2,0,0]=4 22139 B16R1.4951 CCOC(=O)C(F)NCC1CCCN1CC 2230a_100000211693_100000760018 [0,1,0,1,0,0|2,0,0]=4 22140 B16R1.4951 CCOC(=O)C(F)OC[C@H]1CCCN1CC 34a_100011739246_100000760018 [0,1,0,1,0,0|2,0,0]=4 22141 B16R1.4951 CCOC(=O)C(F)OC[C@H]1CCCN1CC 7a_100011739246_100000040065 [0,1,0,1,0,0|2,0,0]=4 22142 B16R1.4952 CCOC(=O)C(C)OCCC1CCCN1C 34a_100011215177_100011216346 [0,1,0,1,0,0|2,0,0]=4 22143 B16R1.4952 CCOC(=O)C(C)OCCC1CCCN1C 7a_100011215177_100011216346 [0,1,0,1,0,0|2,0,0]=4 22144 B16R1.4952 CCOC(=O)C(C)SCCC1CCCN1C 62a_100000005710_100011216346 [0,1,0,1,0,0|2,0,0]=4 22145 B16R1.4952 CCOC(=O)C(C)SCCC1CCCN1C 62a_100011216346_100000005710 [0,1,0,1,0,0|2,0,0]=4 22146 B16R1.4952 CCOC(=O)C(F)OCCC1CCCN1C 34a_100011215177_100000760018 [0,1,0,1,0,0|2,0,0]=4 22147 B16R1.4952 CCOC(=O)C(F)OCCC1CCCN1C 7a_100011215177_100000040065 [0,1,0,1,0,0|2,0,0]=4 22148 B16R1.4952 CCOC(=O)C(F)SCCC1CCCN1C 62a_100000005710_100000760018 [0,1,0,1,0,0|2,0,0]=4 22149 B16R1.4952 CCOC(=O)C(F)SCCC1CCCN1C 62a_100000760018_100000005710 [0,1,0,1,0,0|2,0,0]=4 22150 B16R1.4952 CCOC(=O)[C@H](C)OCCC1CCCN1C 7a_100000751109_100000005710 [0,1,0,1,0,0|2,0,0]=4 22151 B16R1.4968 C=C(CN1CCCCC1CC)C(=O)OCC 269982a_100000210034_100000755967 [0,1,0,1,0,0|1,0,1]=4 22152 B16R1.4968 C=C(CN1CCCCC1CC)C(=O)OCC 34a_100000210034_100000755967 [0,1,0,1,0,0|1,0,1]=4 22153 B16R1.4968 CCNC(=O)C(C)NC1CCCCC1CC 270004a_100000736553_100000757040 [0,1,0,1,0,0|2,0,0]=4 22154 B16R1.4968 CCNC(=O)C(C)OC1CCCCC1CC 34a_100000210738_100000230173 [0,1,0,1,0,0|2,0,0]=4 22155 B16R1.4968 CCNC(=O)C(C)OC1CCCCC1CC 7a_100000210738_100000230173 [0,1,0,1,0,0|2,0,0]=4 22156 B16R1.4968 CCOC(=O)C(=O)CN1CCCCC1CC 269982a_100000210034_100000211299 [0,1,0,1,0,0|1,0,1]=4 22157 B16R1.4968 CCOC(=O)C(C)NC1CCCCC1OC 34a_100011208099_100011216346 [0,1,0,1,0,0|2,0,0]=4 22158 B16R1.4968 CCOC(=O)C(C)OC1CCCCC1CC 34a_100000210738_100011216346 [0,1,0,1,0,0|1,0,0]=3 22159 B16R1.4968 CCOC(=O)C(C)OC1CCCCC1CC 7a_100000210738_100011216346 [0,1,0,1,0,0|1,0,0]=3 22160 B16R1.4968 CCOC(=O)C(C)OC1CCCCC1CN 34a_100011216029_100011216346 [0,1,0,1,0,0|2,0,0]=4 22161 B16R1.4968 CCOC(=O)C(C)O[C@@H]1CCCC[C@H]1NC 34a_100000708425_100011216346 [0,1,0,1,0,0|2,0,0]=4 22162 B16R1.4968 CCOC(=O)C(C)O[C@H]1CCCC[C@@H]1OC 34a_200009815850_100011216346 [0,1,0,1,0,0|2,0,0]=4 22163 B16R1.4968 CCOC(=O)C(C)O[C@H]1CCCC[C@@H]1OC 7a_200009815850_100011216346 [0,1,0,1,0,0|2,0,0]=4 22164 B16R1.4968 CCOC(=O)C(F)NC1CCCCC1OC 34a_100011208099_100000760018 [0,1,0,1,0,0|2,0,0]=4 22165 B16R1.4968 CCOC(=O)C(F)OC1CCCCC1CC 34a_100000210738_100000760018 [0,1,0,1,0,0|1,0,0]=3 22166 B16R1.4968 CCOC(=O)C(F)OC1CCCCC1CC 7a_100000210738_100000040065 [0,1,0,1,0,0|1,0,0]=3 22167 B16R1.4968 CCOC(=O)C(F)OC1CCCCC1CN 34a_100011216029_100000760018 [0,1,0,1,0,0|2,0,0]=4 22168 B16R1.4968 CCOC(=O)C(F)O[C@@H]1CCCC[C@H]1NC 34a_100000708425_100000760018 [0,1,0,1,0,0|2,0,0]=4 22169 B16R1.4968 CCOC(=O)C(F)O[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000760018 [0,1,0,1,0,0|2,0,0]=4 22170 B16R1.4968 CCOC(=O)C(F)O[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000040065 [0,1,0,1,0,0|2,0,0]=4 22171 B16R1.8582 CCCCCCCCCN(C)C(=O)C1CC1 11a_100000232482_100000210395 [0,1,0,1,0,0|2,0,0]=4 22172 B16R1.8582 CCCCCCCCCN(C)C(=O)C1CC1 1626a_100000232482_100000210395 [0,1,0,1,0,0|2,0,0]=4 22173 B16R1.8582 CCCCCCCCCN(C)C(=O)C1CC1 240690a_100000232482_100000210395 [0,1,0,1,0,0|2,0,0]=4 22174 B16R1.8582 CCCCCCCCCN(C)C(=O)C1CC1 527a_100000232482_100000210395 [0,1,0,1,0,0|2,0,0]=4 22175 B16R1.13412 CCCC1CCCCN1C(=O)C(=O)OCC 11a_100000701414_100014798877 [0,1,0,1,0,0|1,0,1]=4 22176 B16R1.13412 CCCC1CCCCN1C(=O)C(=O)OCC 1626a_100000701414_100014798877 [0,1,0,1,0,0|1,0,1]=4 22177 B16R1.13412 CCCC1CCCCN1C(=O)C(=O)OCC 240690a_100000701414_100014798877 [0,1,0,1,0,0|1,0,1]=4 22178 B16R1.13412 CCCC1CCCCN1C(C)C(=O)NCC 2230a_100000701414_100000230173 [0,1,0,1,0,0|2,0,0]=4 22179 B16R1.13412 CCCC1CCCCN1C(C)C(=O)NCC 269982a_100000701414_100000230173 [0,1,0,1,0,0|2,0,0]=4 22180 B16R1.13412 CCCC1CCCCN1C(C)C(=O)NCC 34a_100000701414_100000230173 [0,1,0,1,0,0|2,0,0]=4 22181 B16R1.13412 CCCC1CCCCN1C(C)C(=O)OCC 2230a_100000701414_100011215307 [0,1,0,1,0,0|1,0,0]=3 22182 B16R1.13412 CCCC1CCCCN1C(C)C(=O)OCC 269982a_100000701414_100011216346 [0,1,0,1,0,0|1,0,0]=3 22183 B16R1.13412 CCCC1CCCCN1C(C)C(=O)OCC 34a_100000701414_100011216346 [0,1,0,1,0,0|1,0,0]=3 22184 B16R1.13412 CCCC1CCCCN1C(F)C(=O)OCC 2230a_100000701414_100000760018 [0,1,0,1,0,0|1,0,0]=3 22185 B16R1.13412 CCCC1CCCCN1C(F)C(=O)OCC 269982a_100000701414_100000760018 [0,1,0,1,0,0|1,0,0]=3 22186 B16R1.13412 CCCC1CCCCN1C(F)C(=O)OCC 34a_100000701414_100000760018 [0,1,0,1,0,0|1,0,0]=3 22187 B16R1.13412 CCCC1COCCN1C(C)C(=O)OCC 2230a_102495339903_100011215307 [0,1,0,1,0,0|2,0,0]=4 22188 B16R1.13412 CCCC1COCCN1C(C)C(=O)OCC 269982a_102495339903_100011216346 [0,1,0,1,0,0|2,0,0]=4 22189 B16R1.13412 CCCC1COCCN1C(C)C(=O)OCC 34a_102495339903_100011216346 [0,1,0,1,0,0|2,0,0]=4 22190 B16R1.13412 CCCC1COCCN1C(F)C(=O)OCC 2230a_102495339903_100000760018 [0,1,0,1,0,0|2,0,0]=4 22191 B16R1.13412 CCCC1COCCN1C(F)C(=O)OCC 269982a_102495339903_100000760018 [0,1,0,1,0,0|2,0,0]=4 22192 B16R1.13412 CCCC1COCCN1C(F)C(=O)OCC 34a_102495339903_100000760018 [0,1,0,1,0,0|2,0,0]=4 22193 B16R1.13412 CCOC(=O)C(C)N1CCCCC1CCO 2230a_100000211664_100011215307 [0,1,0,1,0,0|2,0,0]=4 22194 B16R1.13412 CCOC(=O)C(C)N1CCCCC1CCO 269982a_100000211664_100011216346 [0,1,0,1,0,0|2,0,0]=4 22195 B16R1.13412 CCOC(=O)C(C)N1CCCCC1CCO 34a_100000211664_100011216346 [0,1,0,1,0,0|2,0,0]=4 22196 B16R1.13412 CCOC(=O)C(C)N1CCCCC1COC 2230a_100015184032_100011215307 [0,1,0,1,0,0|2,0,0]=4 22197 B16R1.13412 CCOC(=O)C(C)N1CCCCC1COC 269982a_100015184032_100011216346 [0,1,0,1,0,0|2,0,0]=4 22198 B16R1.13412 CCOC(=O)C(C)N1CCCCC1COC 34a_100015184032_100011216346 [0,1,0,1,0,0|2,0,0]=4 22199 B16R1.13412 CCOC(=O)C(F)N1CCCCC1CCO 2230a_100000211664_100000760018 [0,1,0,1,0,0|2,0,0]=4 22200 B16R1.13412 CCOC(=O)C(F)N1CCCCC1CCO 269982a_100000211664_100000760018 [0,1,0,1,0,0|2,0,0]=4 22201 B16R1.13412 CCOC(=O)C(F)N1CCCCC1CCO 34a_100000211664_100000760018 [0,1,0,1,0,0|2,0,0]=4 22202 B16R1.13412 CCOC(=O)C(F)N1CCCCC1COC 2230a_100015184032_100000760018 [0,1,0,1,0,0|2,0,0]=4 22203 B16R1.13412 CCOC(=O)C(F)N1CCCCC1COC 269982a_100015184032_100000760018 [0,1,0,1,0,0|2,0,0]=4 22204 B16R1.13412 CCOC(=O)C(F)N1CCCCC1COC 34a_100015184032_100000760018 [0,1,0,1,0,0|2,0,0]=4 22205 B16R1.13598 CCCC1CCCC1NC(C)C(=O)NCC 270004a_100000736553_100000723119 [0,1,0,1,0,0|2,0,0]=4 22206 B16R1.14049 C=C(CNCC1CCCCC1)C(=O)OCC 34a_100000210473_100000755967 [0,1,0,1,0,0|1,0,1]=4 22207 B16R1.14049 C=C(COCC1CCCCC1)C(=O)OCC 34a_100000212181_100000755967 [0,1,0,1,0,0|1,0,1]=4 22208 B16R1.14049 C=C(COCC1CCCCC1)C(=O)OCC 7a_100000212181_100000755967 [0,1,0,1,0,0|1,0,1]=4 22209 B16R1.14049 C=C(CSCC1CCCCC1)C(=O)OCC 62a_100000211423_100000755967 [0,1,0,1,0,0|1,0,1]=4 22210 B16R1.14049 C=C(CSCC1CCCCC1)C(=O)OCC 62a_100000755967_100000211423 [0,1,0,1,0,0|1,0,1]=4 22211 B16R1.14049 CCNC(=O)C(=O)CCCC1CCCCC1 1458a_200011297158_100011713725 [0,1,0,1,0,0|1,0,1]=4 22212 B16R1.14049 CCNC(=O)C(C)NCCC1CCCCC1 2230a_100000736553_100012355289 [0,1,0,1,0,0|2,0,0]=4 22213 B16R1.14049 CCNC(=O)C(C)NCCC1CCCCC1 2230a_100000738074_100000230173 [0,1,0,1,0,0|2,0,0]=4 22214 B16R1.14049 CCNC(=O)C(C)NCCC1CCCCC1 270004a_100000736553_100011713444 [0,1,0,1,0,0|2,0,0]=4 22215 B16R1.14049 CCNC(=O)C(C)NCCC1CCCCC1 34a_100000736553_100011209188 [0,1,0,1,0,0|2,0,0]=4 22216 B16R1.14049 CCNC(=O)C(C)NCCC1CCCCC1 34a_100000738074_100000230173 [0,1,0,1,0,0|2,0,0]=4 22217 B16R1.14049 CCNC(=O)C(C)OCCC1CCCCC1 34a_100011217863_100000230173 [0,1,0,1,0,0|2,0,0]=4 22218 B16R1.14049 CCNC(=O)C(C)OCCC1CCCCC1 7a_100011217863_100000230173 [0,1,0,1,0,0|2,0,0]=4 22219 B16R1.14049 CCNC(=O)C(C)SCCC1CCCCC1 62a_100000230173_100012355289 [0,1,0,1,0,0|2,0,0]=4 22220 B16R1.14049 CCNC(=O)C(C)SCCC1CCCCC1 62a_100012355289_100000230173 [0,1,0,1,0,0|2,0,0]=4 22221 B16R1.14049 CCOC(=O)C(=O)CSCC1CCCCC1 62a_100000211299_100000211423 [0,1,0,1,0,0|1,0,1]=4 22222 B16R1.14049 CCOC(=O)C(=O)CSCC1CCCCC1 62a_100000211423_100000211299 [0,1,0,1,0,0|1,0,1]=4 22223 B16R1.14049 CCOC(=O)C(=O)NCCC1CCCCC1 11a_100000738074_100014798877 [0,1,0,1,0,0|1,0,1]=4 22224 B16R1.14049 CCOC(=O)C(=O)NCCC1CCCCC1 1626a_100000738074_100014798877 [0,1,0,1,0,0|1,0,1]=4 22225 B16R1.14049 CCOC(=O)C(=O)NCCC1CCCCC1 240690a_100000738074_100014798877 [0,1,0,1,0,0|1,0,1]=4 22226 B16R1.14049 CCOC(=O)C(C)NCCC1CCCCC1 2230a_100000738074_100011215307 [0,1,0,1,0,0|1,0,0]=3 22227 B16R1.14049 CCOC(=O)C(C)NCCC1CCCCC1 34a_100000738074_100011216346 [0,1,0,1,0,0|1,0,0]=3 22228 B16R1.14049 CCOC(=O)C(C)NCCC1CCCCO1 2230a_100015183643_100011215307 [0,1,0,1,0,0|2,0,0]=4 22229 B16R1.14049 CCOC(=O)C(C)NCCC1CCCCO1 34a_100015183643_100011216346 [0,1,0,1,0,0|2,0,0]=4 22230 B16R1.14049 CCOC(=O)C(C)NCCC1CCOCC1 2230a_100000755988_100011215307 [0,1,0,1,0,0|2,0,0]=4 22231 B16R1.14049 CCOC(=O)C(C)NCCC1CCOCC1 34a_100000755988_100011216346 [0,1,0,1,0,0|2,0,0]=4 22232 B16R1.14049 CCOC(=O)C(C)OCCC1CCCCC1 34a_100011217863_100011216346 [0,1,0,1,0,0|1,0,0]=3 22233 B16R1.14049 CCOC(=O)C(C)OCCC1CCCCC1 7a_100011217863_100011216346 [0,1,0,1,0,0|1,0,0]=3 22234 B16R1.14049 CCOC(=O)C(C)OCCC1CCCCN1 34a_100000211664_100011216346 [0,1,0,1,0,0|2,0,0]=4 22235 B16R1.14049 CCOC(=O)C(C)OCCC1CCCNC1 34a_100000752241_100011216346 [0,1,0,1,0,0|2,0,0]=4 22236 B16R1.14049 CCOC(=O)C(C)OCCC1CCNCC1 34a_100015190746_100011216346 [0,1,0,1,0,0|2,0,0]=4 22237 B16R1.14049 CCOC(=O)C(C)OCCC1CCOCC1 34a_100011933979_100011216346 [0,1,0,1,0,0|2,0,0]=4 22238 B16R1.14049 CCOC(=O)C(C)OCCC1CCOCC1 7a_100011933979_100011216346 [0,1,0,1,0,0|2,0,0]=4 22239 B16R1.14049 CCOC(=O)C(C)SCCC1CCCCC1 62a_100011216346_100012355289 [0,1,0,1,0,0|1,0,0]=3 22240 B16R1.14049 CCOC(=O)C(C)SCCC1CCCCC1 62a_100012355289_100011216346 [0,1,0,1,0,0|1,0,0]=3 22241 B16R1.14049 CCOC(=O)C(C)SCCC1CCOCC1 62a_100011216346_100011934994 [0,1,0,1,0,0|2,0,0]=4 22242 B16R1.14049 CCOC(=O)C(C)SCCC1CCOCC1 62a_100011934994_100011216346 [0,1,0,1,0,0|2,0,0]=4 22243 B16R1.14049 CCOC(=O)C(C)SCCN1CCCCC1 62a_100000739454_100011216346 [0,1,0,1,0,0|2,0,0]=4 22244 B16R1.14049 CCOC(=O)C(C)SCCN1CCCCC1 62a_100011216346_100000739454 [0,1,0,1,0,0|2,0,0]=4 22245 B16R1.14049 CCOC(=O)C(C)SCOC1CCCCC1 62a_100011216346_100011935260 [0,1,0,1,0,0|2,0,0]=4 22246 B16R1.14049 CCOC(=O)C(C)SCOC1CCCCC1 62a_100011935260_100011216346 [0,1,0,1,0,0|2,0,0]=4 22247 B16R1.14049 CCOC(=O)C(F)NCCC1CCCCC1 2230a_100000738074_100000760018 [0,1,0,1,0,0|1,0,0]=3 22248 B16R1.14049 CCOC(=O)C(F)NCCC1CCCCC1 34a_100000738074_100000760018 [0,1,0,1,0,0|1,0,0]=3 22249 B16R1.14049 CCOC(=O)C(F)NCCC1CCCCO1 2230a_100015183643_100000760018 [0,1,0,1,0,0|2,0,0]=4 22250 B16R1.14049 CCOC(=O)C(F)NCCC1CCCCO1 34a_100015183643_100000760018 [0,1,0,1,0,0|2,0,0]=4 22251 B16R1.14049 CCOC(=O)C(F)NCCC1CCOCC1 2230a_100000755988_100000760018 [0,1,0,1,0,0|2,0,0]=4 22252 B16R1.14049 CCOC(=O)C(F)NCCC1CCOCC1 34a_100000755988_100000760018 [0,1,0,1,0,0|2,0,0]=4 22253 B16R1.14049 CCOC(=O)C(F)OCCC1CCCCC1 34a_100011217863_100000760018 [0,1,0,1,0,0|1,0,0]=3 22254 B16R1.14049 CCOC(=O)C(F)OCCC1CCCCC1 7a_100011217863_100000040065 [0,1,0,1,0,0|1,0,0]=3 22255 B16R1.14049 CCOC(=O)C(F)OCCC1CCCCN1 34a_100000211664_100000760018 [0,1,0,1,0,0|2,0,0]=4 22256 B16R1.14049 CCOC(=O)C(F)OCCC1CCCNC1 34a_100000752241_100000760018 [0,1,0,1,0,0|2,0,0]=4 22257 B16R1.14049 CCOC(=O)C(F)OCCC1CCNCC1 34a_100015190746_100000760018 [0,1,0,1,0,0|2,0,0]=4 22258 B16R1.14049 CCOC(=O)C(F)OCCC1CCOCC1 34a_100011933979_100000760018 [0,1,0,1,0,0|2,0,0]=4 22259 B16R1.14049 CCOC(=O)C(F)OCCC1CCOCC1 7a_100011933979_100000040065 [0,1,0,1,0,0|2,0,0]=4 22260 B16R1.14049 CCOC(=O)C(F)SCCC1CCCCC1 62a_100000760018_100012355289 [0,1,0,1,0,0|1,0,0]=3 22261 B16R1.14049 CCOC(=O)C(F)SCCC1CCCCC1 62a_100012355289_100000760018 [0,1,0,1,0,0|1,0,0]=3 22262 B16R1.14049 CCOC(=O)C(F)SCCC1CCOCC1 62a_100000760018_100011934994 [0,1,0,1,0,0|2,0,0]=4 22263 B16R1.14049 CCOC(=O)C(F)SCCC1CCOCC1 62a_100011934994_100000760018 [0,1,0,1,0,0|2,0,0]=4 22264 B16R1.14049 CCOC(=O)C(F)SCCN1CCCCC1 62a_100000739454_100000760018 [0,1,0,1,0,0|2,0,0]=4 22265 B16R1.14049 CCOC(=O)C(F)SCCN1CCCCC1 62a_100000760018_100000739454 [0,1,0,1,0,0|2,0,0]=4 22266 B16R1.14049 CCOC(=O)C(F)SCOC1CCCCC1 62a_100000760018_100011935260 [0,1,0,1,0,0|2,0,0]=4 22267 B16R1.14049 CCOC(=O)C(F)SCOC1CCCCC1 62a_100011935260_100000760018 [0,1,0,1,0,0|2,0,0]=4 22268 B16R1.14049 CCOC(=O)[C@H](C)OCCC1CCCCC1 7a_100000751109_100011273959 [0,1,0,1,0,0|1,0,0]=3 22269 B16R1.14049 CCOC(=O)[C@H](C)OCCC1CCOCC1 7a_100000751109_100011934994 [0,1,0,1,0,0|2,0,0]=4 22270 B16R1.14049 CCOC(=O)[C@H](C)OCCN1CCCCC1 7a_100000751109_100000739454 [0,1,0,1,0,0|2,0,0]=4 22271 B16R1.14049 CCOC(=O)[C@H](C)OCOC1CCCCC1 7a_100000751109_100011935260 [0,1,0,1,0,0|2,0,0]=4 22272 B16R1.14049 CCSC(=O)[C@H](C)NCCC1CCCCC1 2230a_100103168634_100012355289 [0,1,0,1,0,0|1,1,0]=4 22273 B16R1.26177 CCNC(=O)C(C)N1CCCCCCCC1 2230a_100000039187_100000230173 [0,1,0,1,0,0|2,0,0]=4 22274 B16R1.26177 CCNC(=O)C(C)N1CCCCCCCC1 269982a_100000039187_100000230173 [0,1,0,1,0,0|2,0,0]=4 22275 B16R1.26177 CCNC(=O)C(C)N1CCCCCCCC1 34a_100000039187_100000230173 [0,1,0,1,0,0|2,0,0]=4 22276 B16R1.26177 CCOC(=O)C(=O)N1CCCCCCCC1 11a_100000039187_100014798877 [0,1,0,1,0,0|1,0,1]=4 22277 B16R1.26177 CCOC(=O)C(=O)N1CCCCCCCC1 1626a_100000039187_100014798877 [0,1,0,1,0,0|1,0,1]=4 22278 B16R1.26177 CCOC(=O)C(=O)N1CCCCCCCC1 240690a_100000039187_100014798877 [0,1,0,1,0,0|1,0,1]=4 22279 B16R1.26177 CCOC(=O)C(C)N1CCCCCCCC1 2230a_100000039187_100011215307 [0,1,0,1,0,0|1,0,0]=3 22280 B16R1.26177 CCOC(=O)C(C)N1CCCCCCCC1 269982a_100000039187_100011216346 [0,1,0,1,0,0|1,0,0]=3 22281 B16R1.26177 CCOC(=O)C(C)N1CCCCCCCC1 34a_100000039187_100011216346 [0,1,0,1,0,0|1,0,0]=3 22282 B16R1.26177 CCOC(=O)C(F)N1CCCCCCCC1 2230a_100000039187_100000760018 [0,1,0,1,0,0|1,0,0]=3 22283 B16R1.26177 CCOC(=O)C(F)N1CCCCCCCC1 269982a_100000039187_100000760018 [0,1,0,1,0,0|1,0,0]=3 22284 B16R1.26177 CCOC(=O)C(F)N1CCCCCCCC1 34a_100000039187_100000760018 [0,1,0,1,0,0|1,0,0]=3 22285 B16R1.26203 C=C(CNC1CCCCCC1)C(=O)OCC 34a_100000210984_100000755967 [0,1,0,1,0,0|1,0,1]=4 22286 B16R1.26203 C=C(COC1CCCCCC1)C(=O)OCC 34a_100000210887_100000755967 [0,1,0,1,0,0|1,0,1]=4 22287 B16R1.26203 C=C(COC1CCCCCC1)C(=O)OCC 7a_100000210887_100000755967 [0,1,0,1,0,0|1,0,1]=4 22288 B16R1.26203 C=C(CSC1CCCCCC1)C(=O)OCC 62a_100000755967_100011217769 [0,1,0,1,0,0|1,0,1]=4 22289 B16R1.26203 C=C(CSC1CCCCCC1)C(=O)OCC 62a_100011217769_100000755967 [0,1,0,1,0,0|1,0,1]=4 22290 B16R1.26203 CCNC(=O)C(C)NCC1CCCCCC1 2230a_100000736553_200000696569 [0,1,0,1,0,0|2,0,0]=4 22291 B16R1.26203 CCNC(=O)C(C)NCC1CCCCCC1 2230a_100015204231_100000230173 [0,1,0,1,0,0|2,0,0]=4 22292 B16R1.26203 CCNC(=O)C(C)NCC1CCCCCC1 34a_100000736553_200000696569 [0,1,0,1,0,0|2,0,0]=4 22293 B16R1.26203 CCNC(=O)C(C)NCC1CCCCCC1 34a_100015204231_100000230173 [0,1,0,1,0,0|2,0,0]=4 22294 B16R1.26203 CCNC(=O)C(C)OCC1CCCCCC1 34a_100000699130_100000230173 [0,1,0,1,0,0|2,0,0]=4 22295 B16R1.26203 CCNC(=O)C(C)OCC1CCCCCC1 7a_100000699130_100000230173 [0,1,0,1,0,0|2,0,0]=4 22296 B16R1.26203 CCNC(=O)C(C)SCC1CCCCCC1 62a_100000230173_200000696569 [0,1,0,1,0,0|2,0,0]=4 22297 B16R1.26203 CCNC(=O)C(C)SCC1CCCCCC1 62a_200000696569_100000230173 [0,1,0,1,0,0|2,0,0]=4 22298 B16R1.26203 CCOC(=O)C(=O)CSC1CCCCCC1 62a_100000211299_100011217769 [0,1,0,1,0,0|1,0,1]=4 22299 B16R1.26203 CCOC(=O)C(=O)CSC1CCCCCC1 62a_100011217769_100000211299 [0,1,0,1,0,0|1,0,1]=4 22300 B16R1.26203 CCOC(=O)C(=O)NCC1CCCCCC1 11a_100015204231_100014798877 [0,1,0,1,0,0|1,0,1]=4 22301 B16R1.26203 CCOC(=O)C(=O)NCC1CCCCCC1 1626a_100015204231_100014798877 [0,1,0,1,0,0|1,0,1]=4 22302 B16R1.26203 CCOC(=O)C(=O)NCC1CCCCCC1 240690a_100015204231_100014798877 [0,1,0,1,0,0|1,0,1]=4 22303 B16R1.26203 CCOC(=O)C(C)NCC1CCCCCC1 2230a_100015204231_100011215307 [0,1,0,1,0,0|1,0,0]=3 22304 B16R1.26203 CCOC(=O)C(C)NCC1CCCCCC1 34a_100015204231_100011216346 [0,1,0,1,0,0|1,0,0]=3 22305 B16R1.26203 CCOC(=O)C(C)OCC1CCCCCC1 34a_100000699130_100011216346 [0,1,0,1,0,0|1,0,0]=3 22306 B16R1.26203 CCOC(=O)C(C)OCC1CCCCCC1 7a_100000699130_100011216346 [0,1,0,1,0,0|1,0,0]=3 22307 B16R1.26203 CCOC(=O)C(C)SCC1CCCCCC1 62a_100011216346_200000696569 [0,1,0,1,0,0|1,0,0]=3 22308 B16R1.26203 CCOC(=O)C(C)SCC1CCCCCC1 62a_200000696569_100011216346 [0,1,0,1,0,0|1,0,0]=3 22309 B16R1.26203 CCOC(=O)C(F)NCC1CCCCCC1 2230a_100015204231_100000760018 [0,1,0,1,0,0|1,0,0]=3 22310 B16R1.26203 CCOC(=O)C(F)NCC1CCCCCC1 34a_100015204231_100000760018 [0,1,0,1,0,0|1,0,0]=3 22311 B16R1.26203 CCOC(=O)C(F)OCC1CCCCCC1 34a_100000699130_100000760018 [0,1,0,1,0,0|1,0,0]=3 22312 B16R1.26203 CCOC(=O)C(F)OCC1CCCCCC1 7a_100000699130_100000040065 [0,1,0,1,0,0|1,0,0]=3 22313 B16R1.26203 CCOC(=O)C(F)SCC1CCCCCC1 62a_100000760018_200000696569 [0,1,0,1,0,0|1,0,0]=3 22314 B16R1.26203 CCOC(=O)C(F)SCC1CCCCCC1 62a_200000696569_100000760018 [0,1,0,1,0,0|1,0,0]=3 22315 B16R1.26203 CCOC(=O)[C@H](C)OCC1CCCCCC1 7a_100000751109_200000696569 [0,1,0,1,0,0|1,0,0]=3 22316 B16R1.26203 CCSC(=O)[C@H](C)NCC1CCCCCC1 2230a_100103168634_200000696569 [0,1,0,1,0,0|1,1,0]=4 22317 B16R1.26389 C=C(CN1CCCCCCC1)C(=O)OCC 269982a_100000211400_100000755967 [0,1,0,1,0,0|1,0,1]=4 22318 B16R1.26389 C=C(CN1CCCCCCC1)C(=O)OCC 34a_100000211400_100000755967 [0,1,0,1,0,0|1,0,1]=4 22319 B16R1.26389 CCNC(=O)C(C)NC1CCCCCCC1 2230a_100000211152_100000230173 [0,1,0,1,0,0|2,0,0]=4 22320 B16R1.26389 CCNC(=O)C(C)NC1CCCCCCC1 270004a_100000736553_100000210524 [0,1,0,1,0,0|2,0,0]=4 22321 B16R1.26389 CCNC(=O)C(C)NC1CCCCCCC1 34a_100000211152_100000230173 [0,1,0,1,0,0|2,0,0]=4 22322 B16R1.26389 CCNC(=O)C(C)OC1CCCCCCC1 34a_100000210054_100000230173 [0,1,0,1,0,0|2,0,0]=4 22323 B16R1.26389 CCNC(=O)C(C)OC1CCCCCCC1 7a_100000210054_100000230173 [0,1,0,1,0,0|2,0,0]=4 22324 B16R1.26389 CCOC(=O)C(=O)CN1CCCCCCC1 269982a_100000211400_100000211299 [0,1,0,1,0,0|1,0,1]=4 22325 B16R1.26389 CCOC(=O)C(=O)NC1CCCCCCC1 11a_100000211152_100014798877 [0,1,0,1,0,0|1,0,1]=4 22326 B16R1.26389 CCOC(=O)C(=O)NC1CCCCCCC1 1626a_100000211152_100014798877 [0,1,0,1,0,0|1,0,1]=4 22327 B16R1.26389 CCOC(=O)C(=O)NC1CCCCCCC1 240690a_100000211152_100014798877 [0,1,0,1,0,0|1,0,1]=4 22328 B16R1.26389 CCOC(=O)C(C)NC1CCCCCCC1 2230a_100000211152_100011215307 [0,1,0,1,0,0|1,0,0]=3 22329 B16R1.26389 CCOC(=O)C(C)NC1CCCCCCC1 34a_100000211152_100011216346 [0,1,0,1,0,0|1,0,0]=3 22330 B16R1.26389 CCOC(=O)C(C)OC1CCCCCCC1 34a_100000210054_100011216346 [0,1,0,1,0,0|1,0,0]=3 22331 B16R1.26389 CCOC(=O)C(C)OC1CCCCCCC1 7a_100000210054_100011216346 [0,1,0,1,0,0|1,0,0]=3 22332 B16R1.26389 CCOC(=O)C(F)NC1CCCCCCC1 2230a_100000211152_100000760018 [0,1,0,1,0,0|1,0,0]=3 22333 B16R1.26389 CCOC(=O)C(F)NC1CCCCCCC1 34a_100000211152_100000760018 [0,1,0,1,0,0|1,0,0]=3 22334 B16R1.26389 CCOC(=O)C(F)OC1CCCCCCC1 34a_100000210054_100000760018 [0,1,0,1,0,0|1,0,0]=3 22335 B16R1.26389 CCOC(=O)C(F)OC1CCCCCCC1 7a_100000210054_100000040065 [0,1,0,1,0,0|1,0,0]=3 22336 B16R2.168 CCC1CCCC1NC2CCNC(=O)C2 269862a_100016994916_100000749056 [0,0,0,2,0,0|2,0,0]=4 22337 B16R2.252 O=C1CC(CCN1)COC2CCCCC2 34a_100009886756_100000210327 [0,0,0,2,0,0|2,0,0]=4 22338 B16R2.252 O=C1CC(CCN1)NCC2CCCCC2 2230a_100016994916_100000211423 [0,0,0,2,0,0|2,0,0]=4 22339 B16R2.252 O=C1CC(CCN1)NCC2CCCCC2 269862a_100016994916_100000211278 [0,0,0,2,0,0|2,0,0]=4 22340 B16R2.252 O=C1CC(CCN1)NCC2CCCCC2 34a_100016994916_100000211423 [0,0,0,2,0,0|2,0,0]=4 22341 B16R2.252 O=C1CCCC(C1)OCC2CCCCC2 34a_100012613340_100000211423 [0,0,0,2,0,0|2,0,0]=4 22342 B16R2.252 O=C1CN(CCN1)CCC2CCCCC2 2230a_100000184651_100012355289 [0,0,0,2,0,0|2,0,0]=4 22343 B16R2.252 O=C1CN(CCN1)CCC2CCCCC2 270004a_100000184651_100011713444 [0,0,0,2,0,0|2,0,0]=4 22344 B16R2.252 O=C1CN(CCO1)CCC2CCCCC2 2230a_100000131268_100012355289 [0,0,0,2,0,0|1,0,0]=3 22345 B16R2.252 O=C1CN(CCO1)CCC2CCCCC2 270004a_100000131268_100011713444 [0,0,0,2,0,0|1,0,0]=3 22346 B16R2.252 O=C1CN(CCO1)CCC2CCOCC2 2230a_100000131268_100011934994 [0,0,0,2,0,0|2,0,0]=4 22347 B16R2.252 O=C1CN(CCO1)CCN2CCCCC2 2230a_100000131268_100000739454 [0,0,0,2,0,0|2,0,0]=4 22348 B16R2.252 O=C1CN(CCO1)COC2CCCCC2 2230a_100000131268_100011935260 [0,0,0,2,0,0|2,0,0]=4 22349 B16R2.252 O=C1C[C@@H](CCN1)OCC2CCCCC2 34a_100015189427_100000211423 [0,0,0,2,0,0|2,0,0]=4 22350 B16R2.255 O=C1CC(CCN1)COCC2CCCC2 34a_100009886756_100000740388 [0,0,0,2,0,0|2,0,0]=4 22351 B16R2.255 O=C1CC(CCN1)NCCC2CCCC2 2230a_100016994916_100000760354 [0,0,0,2,0,0|2,0,0]=4 22352 B16R2.255 O=C1CC(CCN1)NCCC2CCCC2 34a_100016994916_100000760354 [0,0,0,2,0,0|2,0,0]=4 22353 B16R2.255 O=C1CCCC(C1)OCCC2CCCC2 34a_100012613340_100000760354 [0,0,0,2,0,0|2,0,0]=4 22354 B16R2.255 O=C1CN(CCN1)CCCC2CCCC2 2230a_100000184651_100011713738 [0,0,0,2,0,0|2,0,0]=4 22355 B16R2.255 O=C1CN(CCO1)CCCC2CCCC2 2230a_100000131268_100011713738 [0,0,0,2,0,0|1,0,0]=3 22356 B16R2.255 O=C1CN(CCO1)CCCN2CCCC2 2230a_100000131268_100011445909 [0,0,0,2,0,0|2,0,0]=4 22357 B16R2.255 O=C1C[C@@H](CCN1)OCCC2CCCC2 34a_100015189427_100000760354 [0,0,0,2,0,0|2,0,0]=4 22358 B16R2.2245 CCC1CCCCC1N2CCNC(=O)C2 270004a_100000184651_100000757040 [0,0,0,2,0,0|2,0,0]=4 22359 B16R2.2245 CCC1CCCCC1N2CCOC(=O)C2 270004a_100000131268_100000757040 [0,0,0,2,0,0|1,0,0]=3 22360 B16R2.2245 COC1CCCCC1N2CCOC(=O)C2 270004a_100000131268_100000740605 [0,0,0,2,0,0|2,0,0]=4 22361 B16R2.2245 O=C1CN(CCO1)C2CCCCC2CO 270004a_100000131268_100009861125 [0,0,0,2,0,0|2,0,0]=4 22362 B16R2.2813 CCCC1CCCC1N2CCNC(=O)C2 270004a_100000184651_100000723119 [0,0,0,2,0,0|2,0,0]=4 22363 B16R2.2813 CCCC1CCCC1N2CCOC(=O)C2 270004a_100000131268_100000723119 [0,0,0,2,0,0|1,0,0]=3 22364 B16R2.2910 CN1CCCC1CCN2CCOC(=O)C2 2230a_100000131268_100000005710 [0,0,0,2,0,0|2,0,0]=4 22365 B16R2.2923 CC1CCCCC1NC2CCNC(=O)C2 269862a_100016994916_100000210921 [0,0,0,2,0,0|2,0,0]=4 22366 B16R2.11867 O=C1CN(CCN1)C2CCCCCCC2 270004a_100000184651_100000210524 [0,0,0,2,0,0|2,0,0]=4 22367 B16R2.11867 O=C1CN(CCO1)C2CCCCCCC2 270004a_100000131268_100000210524 [0,0,0,2,0,0|1,0,0]=3 22368 B16R2.11928 O=C1CC(CCN1)NC2CCCCCC2 34a_100016994916_100011217769 [0,0,0,2,0,0|2,0,0]=4 22369 B16R2.11928 O=C1CCCC(C1)OC2CCCCCC2 34a_100012613340_100011217769 [0,0,0,2,0,0|2,0,0]=4 22370 B16R2.11928 O=C1CN(CCN1)CC2CCCCCC2 2230a_100000184651_200000696569 [0,0,0,2,0,0|2,0,0]=4 22371 B16R2.11928 O=C1CN(CCO1)CC2CCCCCC2 2230a_100000131268_200000696569 [0,0,0,2,0,0|1,0,0]=3 22372 B16R2.11928 O=C1C[C@@H](CCN1)OC2CCCCCC2 34a_100015189427_100011217769 [0,0,0,2,0,0|2,0,0]=4 22373 B16R2.3018 O=C1CCCC1NCCCC2CCCC2 2230a_100000736752_100000211823 [0,0,0,2,0,0|2,0,0]=4 22374 B16R2.3018 O=C1CCCC1NCCCC2CCCC2 34a_100000736752_100000709159 [0,0,0,2,0,0|2,0,0]=4 22375 B16R2.3018 O=C1CCCC1OCCCC2CCCC2 34a_100011215328_100000709159 [0,0,0,2,0,0|2,0,0]=4 22376 B16R2.3018 O=C1CCCC1OCCCC2CCCC2 34a_200000719330_100011713738 [0,0,0,2,0,0|2,0,0]=4 22377 B16R2.3018 O=C1CCCC1OCCCC2CCCC2 7a_100011215328_100000211823 [0,0,0,2,0,0|2,0,0]=4 22378 B16R2.3018 O=C1CCCC1SCCCC2CCCC2 62a_100000211823_100011713738 [0,0,0,2,0,0|2,0,0]=4 22379 B16R2.3018 O=C1CCCC1SCCCC2CCCC2 62a_100011713738_100000211823 [0,0,0,2,0,0|2,0,0]=4 22380 B16R2.3018 O=C1NCCC1COCCC2CCCC2 34a_100000133458_100000760354 [0,0,0,2,0,0|2,0,0]=4 22381 B16R2.3018 O=C1NCCC1NCCCC2CCCC2 2230a_100016995588_100011713738 [0,0,0,2,0,0|2,0,0]=4 22382 B16R2.3018 O=C1NCCC1NCCCC2CCCC2 34a_100016995588_100011713738 [0,0,0,2,0,0|2,0,0]=4 22383 B16R2.3018 O=C1NCC[C@@H]1OCCCC2CCCC2 34a_100000688343_100011713738 [0,0,0,2,0,0|2,0,0]=4 22384 B16R2.3018 O=C1OCCC1NCCCC2CCCC2 2230a_100000736752_100000211211 [0,0,0,2,0,0|1,0,0]=3 22385 B16R2.3018 O=C1OCCC1NCCCC2CCCC2 34a_100000736752_100000211211 [0,0,0,2,0,0|1,0,0]=3 22386 B16R2.3018 O=C1OCCC1NCCOC2CCCC2 34a_100000741755_100000211211 [0,0,0,2,0,0|2,0,0]=4 22387 B16R2.3018 O=C1OCCC1OCCCC2CCCC2 34a_100011215328_100000211211 [0,0,0,2,0,0|1,0,0]=3 22388 B16R2.3018 O=C1OCCC1OCCCC2CCCC2 7a_100011215328_100000211211 [0,0,0,2,0,0|1,0,0]=3 22389 B16R2.3018 O=C1OCCC1OCCNC2CCCC2 34a_200000200444_100000211211 [0,0,0,2,0,0|2,0,0]=4 22390 B16R2.3018 O=C1OCCC1OCCOC2CCCC2 34a_100000738311_100000211211 [0,0,0,2,0,0|2,0,0]=4 22391 B16R2.3018 O=C1OCCC1OCCOC2CCCC2 7a_100000738311_100000211211 [0,0,0,2,0,0|2,0,0]=4 22392 B16R2.3018 O=C1OCCC1SCCCC2CCCC2 62a_100000211211_100011713738 [0,0,0,2,0,0|1,0,0]=3 22393 B16R2.3018 O=C1OCCC1SCCCC2CCCC2 62a_100011713738_100000211211 [0,0,0,2,0,0|1,0,0]=3 22394 B16R2.3018 O=C1OCCC1SCCCN2CCCC2 62a_100000211211_100011445909 [0,0,0,2,0,0|2,0,0]=4 22395 B16R2.3018 O=C1OCCC1SCCCN2CCCC2 62a_100016991639_100000211211 [0,0,0,2,0,0|2,0,0]=4 22396 B16R2.639 CCCC1CCCC1NC2CCNC2=O 270004a_100016995588_100000723119 [0,0,0,2,0,0|2,0,0]=4 22397 B16R2.29573 CCNC(=O)CCN1CCCC1C2CC2 2230a_200000757794_100000737597 [0,0,0,2,0,0|2,0,0]=4 22398 B16R2.29573 CCNC(=O)CCN1CCCC1C2CC2 269982a_200000757794_100000737597 [0,0,0,2,0,0|2,0,0]=4 22399 B16R2.29573 CCOC(=O)CCN1CCCC1C2CC2 2230a_200000757794_100011206558 [0,0,0,2,0,0|1,0,0]=3 22400 B16R2.29573 CCOC(=O)CCN1CCCC1C2CC2 269982a_200000757794_100011206558 [0,0,0,2,0,0|1,0,0]=3 22401 B16R2.29573 CCOC(=O)CCN1CCCC1C2CC2 34a_200000757794_100000765890 [0,0,0,2,0,0|1,0,0]=3 22402 B16R2.29600 CCOC(=O)CCN1C2CCC1COC2 2230a_100015205251_100011206558 [0,0,0,2,0,0|2,0,0]=4 22403 B16R2.29600 CCOC(=O)CCN1C2CCC1COC2 269982a_100015205251_100011206558 [0,0,0,2,0,0|2,0,0]=4 22404 B16R2.29600 CCOC(=O)CCN1C2CCC1COC2 34a_100015205251_100000765890 [0,0,0,2,0,0|2,0,0]=4 22405 B16R2.29620 CCOC(=O)CCN1C[C@@H]2C[C@H]1CN2C 2230a_100025763010_100011206558 [0,0,0,2,0,0|2,0,0]=4 22406 B16R2.29620 CCOC(=O)CCN1C[C@@H]2C[C@H]1CN2C 269982a_100025763010_100011206558 [0,0,0,2,0,0|2,0,0]=4 22407 B16R2.159296 CCCC(=O)NCC12CCCC1CCC2 11a_100159271432_100000211992 [0,0,0,2,0,0|2,0,0]=4 22408 B16R2.159296 CCCC(=O)NCC12CCCC1CCC2 1626a_100159271432_100000211992 [0,0,0,2,0,0|2,0,0]=4 22409 B16R2.159296 CCCC(=O)NCC12CCCC1CCC2 240690a_100159271432_100000211992 [0,0,0,2,0,0|2,0,0]=4 22410 B16R2.159296 CCCC(=O)NCC12CCCC1CCC2 527a_100159271432_100000211992 [0,0,0,2,0,0|2,0,0]=4 22411 B16R2.159296 CCNC(=O)NCC12CCCC1CCC2 2708a_100015525214_100159271432 [0,0,0,2,0,0|2,0,0]=4 22412 B16R2.159296 CCNC(=O)NCC12CCCC1CCC2 2708a_100159271432_100015525214 [0,0,0,2,0,0|2,0,0]=4 22413 B16R2.159296 CCNC(=O)NCC12CCCC1CCC2 273464a_100015525214_100159271432 [0,0,0,2,0,0|2,0,0]=4 22414 B16R2.159296 CCNC(=O)NCC12CCCC1CCC2 273464a_100159271432_100015525214 [0,0,0,2,0,0|2,0,0]=4 22415 B16R2.159296 CCNC(=O)NCC12CCCC1CCC2 512a_100015525214_100159271432 [0,0,0,2,0,0|2,0,0]=4 22416 B16R2.159296 CCNC(=O)NCC12CCCC1CCC2 512a_100159271432_100015525214 [0,0,0,2,0,0|2,0,0]=4 22417 B16R2.767 CCCC(=O)N1CCC2CCCCC2C1 11a_100000211783_100000211992 [0,0,0,2,0,0|2,0,0]=4 22418 B16R2.767 CCCC(=O)N1CCC2CCCCC2C1 1626a_100000211783_100000211992 [0,0,0,2,0,0|2,0,0]=4 22419 B16R2.767 CCCC(=O)N1CCC2CCCCC2C1 240690a_100000211783_100000211992 [0,0,0,2,0,0|2,0,0]=4 22420 B16R2.767 CCCC(=O)N1CCC2CCCCC2C1 527a_100000211783_100000211992 [0,0,0,2,0,0|2,0,0]=4 22421 B16R2.767 CCNC(=O)N1CCC2CCCCC2C1 2708a_100015525214_100000211783 [0,0,0,2,0,0|2,0,0]=4 22422 B16R2.767 CCNC(=O)N1CCC2CCCCC2C1 273464a_100015525214_100000211783 [0,0,0,2,0,0|2,0,0]=4 22423 B16R2.2451 CCC1CCCCC1NC2CCNC2=O 270004a_100016995588_100000757040 [0,0,0,2,0,0|2,0,0]=4 22424 B16R2.2451 CCC1CCCCC1OC2CCCC2=O 34a_100000210738_100000709159 [0,0,0,2,0,0|2,0,0]=4 22425 B16R2.2451 CCC1CCCCC1OC2CCCC2=O 7a_100000210738_100000211823 [0,0,0,2,0,0|2,0,0]=4 22426 B16R2.2451 CCC1CCCCC1OC2CCOC2=O 34a_100000210738_100000211211 [0,0,0,2,0,0|1,0,0]=3 22427 B16R2.2451 CCC1CCCCC1OC2CCOC2=O 7a_100000210738_100000211211 [0,0,0,2,0,0|1,0,0]=3 22428 B16R2.2451 CN[C@@H]1CCCC[C@H]1OC2CCOC2=O 34a_100000708425_100000211211 [0,0,0,2,0,0|2,0,0]=4 22429 B16R2.2451 COC1CCCCC1NC2CCOC2=O 34a_100011208099_100000211211 [0,0,0,2,0,0|2,0,0]=4 22430 B16R2.2451 CO[C@H]1CCCC[C@@H]1OC2CCOC2=O 34a_200009815850_100000211211 [0,0,0,2,0,0|2,0,0]=4 22431 B16R2.2451 CO[C@H]1CCCC[C@@H]1OC2CCOC2=O 7a_200009815850_100000211211 [0,0,0,2,0,0|2,0,0]=4 22432 B16R2.2451 NCC1CCCCC1OC2CCOC2=O 34a_100011216029_100000211211 [0,0,0,2,0,0|2,0,0]=4 22433 B16R2.7863 CCC1CCCCC1OCC(=O)C2CC2 34a_100000210738_100000746382 [0,0,0,2,0,0|2,0,0]=4 22434 B16R2.7863 CCC1CCCCC1OCC(=O)C2CC2 7a_100000210738_100000746382 [0,0,0,2,0,0|2,0,0]=4 22435 B16R2.29622 CCNC(=O)CCN1CC2CCC1CC2 2230a_100000750499_100000737597 [0,0,0,2,0,0|2,0,0]=4 22436 B16R2.29622 CCNC(=O)CCN1CC2CCC1CC2 269982a_100000750499_100000737597 [0,0,0,2,0,0|2,0,0]=4 22437 B16R2.29622 CCOC(=O)CCN1CC2CCC1CC2 2230a_100000750499_100011206558 [0,0,0,2,0,0|1,0,0]=3 22438 B16R2.29622 CCOC(=O)CCN1CC2CCC1CC2 269982a_100000750499_100011206558 [0,0,0,2,0,0|1,0,0]=3 22439 B16R2.29622 CCOC(=O)CCN1CC2CCC1CC2 34a_100000750499_100000765890 [0,0,0,2,0,0|1,0,0]=3 22440 B16R2.29622 CCOC(=O)CN[C@H]1CN2CCC1CC2 2230a_100016987387_100000188475 [0,0,0,2,0,0|2,0,0]=4 22441 B16R2.735 CCCC(=O)NCC1CC12CCCCC2 11a_100015185624_100000211992 [0,0,0,2,0,0|2,0,0]=4 22442 B16R2.735 CCCC(=O)NCC1CC12CCCCC2 1626a_100015185624_100000211992 [0,0,0,2,0,0|2,0,0]=4 22443 B16R2.735 CCCC(=O)NCC1CC12CCCCC2 240690a_100015185624_100000211992 [0,0,0,2,0,0|2,0,0]=4 22444 B16R2.735 CCCC(=O)NCC1CC12CCCCC2 527a_100015185624_100000211992 [0,0,0,2,0,0|2,0,0]=4 22445 B16R2.735 CCNC(=O)NCC1CC12CCCCC2 2708a_100015185624_100015525214 [0,0,0,2,0,0|2,0,0]=4 22446 B16R2.735 CCNC(=O)NCC1CC12CCCCC2 2708a_100015525214_100015185624 [0,0,0,2,0,0|2,0,0]=4 22447 B16R2.735 CCNC(=O)NCC1CC12CCCCC2 273464a_100015185624_100015525214 [0,0,0,2,0,0|2,0,0]=4 22448 B16R2.735 CCNC(=O)NCC1CC12CCCCC2 273464a_100015525214_100015185624 [0,0,0,2,0,0|2,0,0]=4 22449 B16R2.735 CCNC(=O)NCC1CC12CCCCC2 512a_100015185624_100015525214 [0,0,0,2,0,0|2,0,0]=4 22450 B16R2.735 CCNC(=O)NCC1CC12CCCCC2 512a_100015525214_100015185624 [0,0,0,2,0,0|2,0,0]=4 22451 B16R2.3250 O=C1CCCC1NCCC2CCCCC2 2230a_100000738074_100000211823 [0,0,0,2,0,0|2,0,0]=4 22452 B16R2.3250 O=C1CCCC1NCCC2CCCCC2 34a_100000738074_100000709159 [0,0,0,2,0,0|2,0,0]=4 22453 B16R2.3250 O=C1CCCC1OCCC2CCCCC2 34a_100011217863_100000709159 [0,0,0,2,0,0|2,0,0]=4 22454 B16R2.3250 O=C1CCCC1OCCC2CCCCC2 34a_200000719330_100011209188 [0,0,0,2,0,0|2,0,0]=4 22455 B16R2.3250 O=C1CCCC1OCCC2CCCCC2 7a_100011217863_100000211823 [0,0,0,2,0,0|2,0,0]=4 22456 B16R2.3250 O=C1CCCC1SCCC2CCCCC2 62a_100000211823_100012355289 [0,0,0,2,0,0|2,0,0]=4 22457 B16R2.3250 O=C1CCCC1SCCC2CCCCC2 62a_100012355289_100000211823 [0,0,0,2,0,0|2,0,0]=4 22458 B16R2.3250 O=C1NCCC1COCC2CCCCC2 34a_100000133458_100000211423 [0,0,0,2,0,0|2,0,0]=4 22459 B16R2.3250 O=C1NCCC1NCCC2CCCCC2 2230a_100016995588_100012355289 [0,0,0,2,0,0|2,0,0]=4 22460 B16R2.3250 O=C1NCCC1NCCC2CCCCC2 270004a_100016995588_100011713444 [0,0,0,2,0,0|2,0,0]=4 22461 B16R2.3250 O=C1NCCC1NCCC2CCCCC2 34a_100016995588_100011209188 [0,0,0,2,0,0|2,0,0]=4 22462 B16R2.3250 O=C1NCC[C@@H]1OCCC2CCCCC2 34a_100000688343_100011209188 [0,0,0,2,0,0|2,0,0]=4 22463 B16R2.3250 O=C1OCCC1NCCC2CCCCC2 2230a_100000738074_100000211211 [0,0,0,2,0,0|1,0,0]=3 22464 B16R2.3250 O=C1OCCC1NCCC2CCCCC2 34a_100000738074_100000211211 [0,0,0,2,0,0|1,0,0]=3 22465 B16R2.3250 O=C1OCCC1NCCC2CCCCO2 2230a_100015183643_100000211211 [0,0,0,2,0,0|2,0,0]=4 22466 B16R2.3250 O=C1OCCC1NCCC2CCCCO2 34a_100015183643_100000211211 [0,0,0,2,0,0|2,0,0]=4 22467 B16R2.3250 O=C1OCCC1NCCC2CCOCC2 2230a_100000755988_100000211211 [0,0,0,2,0,0|2,0,0]=4 22468 B16R2.3250 O=C1OCCC1NCCC2CCOCC2 34a_100000755988_100000211211 [0,0,0,2,0,0|2,0,0]=4 22469 B16R2.3250 O=C1OCCC1OCCC2CCCCC2 34a_100011217863_100000211211 [0,0,0,2,0,0|1,0,0]=3 22470 B16R2.3250 O=C1OCCC1OCCC2CCCCC2 7a_100011217863_100000211211 [0,0,0,2,0,0|1,0,0]=3 22471 B16R2.3250 O=C1OCCC1OCCC2CCCCN2 34a_100000211664_100000211211 [0,0,0,2,0,0|2,0,0]=4 22472 B16R2.3250 O=C1OCCC1OCCC2CCCNC2 34a_100000752241_100000211211 [0,0,0,2,0,0|2,0,0]=4 22473 B16R2.3250 O=C1OCCC1OCCC2CCNCC2 34a_100015190746_100000211211 [0,0,0,2,0,0|2,0,0]=4 22474 B16R2.3250 O=C1OCCC1OCCC2CCOCC2 34a_100011933979_100000211211 [0,0,0,2,0,0|2,0,0]=4 22475 B16R2.3250 O=C1OCCC1OCCC2CCOCC2 7a_100011933979_100000211211 [0,0,0,2,0,0|2,0,0]=4 22476 B16R2.3250 O=C1OCCC1SCCC2CCCCC2 62a_100000211211_100012355289 [0,0,0,2,0,0|1,0,0]=3 22477 B16R2.3250 O=C1OCCC1SCCC2CCCCC2 62a_100012355289_100000211211 [0,0,0,2,0,0|1,0,0]=3 22478 B16R2.3250 O=C1OCCC1SCCC2CCOCC2 62a_100000211211_100011934994 [0,0,0,2,0,0|2,0,0]=4 22479 B16R2.3250 O=C1OCCC1SCCC2CCOCC2 62a_100011934994_100000211211 [0,0,0,2,0,0|2,0,0]=4 22480 B16R2.3250 O=C1OCCC1SCCN2CCCCC2 62a_100000211211_100000739454 [0,0,0,2,0,0|2,0,0]=4 22481 B16R2.3250 O=C1OCCC1SCCN2CCCCC2 62a_100000739454_100000211211 [0,0,0,2,0,0|2,0,0]=4 22482 B16R2.3250 O=C1OCCC1SCOC2CCCCC2 62a_100000211211_100011935260 [0,0,0,2,0,0|2,0,0]=4 22483 B16R2.3250 O=C1OCCC1SCOC2CCCCC2 62a_100011935260_100000211211 [0,0,0,2,0,0|2,0,0]=4 22484 B16R2.3258 O=C1CCN(CCN1)CC2CCCCC2 2230a_100000698595_100000211423 [0,0,0,2,0,0|2,0,0]=4 22485 B16R2.3258 O=C1CCN(CCN1)CC2CCCCC2 269982a_100000698595_100000211423 [0,0,0,2,0,0|2,0,0]=4 22486 B16R2.4825 CCNC(=O)CCNC1C2CCC1CC2 34a_100025743525_100009813300 [0,0,0,2,0,0|2,0,0]=4 22487 B16R2.4825 CCNC(=O)CCSC1C2CCC1CC2 62a_100000737597_100009813300 [0,0,0,2,0,0|2,0,0]=4 22488 B16R2.4825 CCNC(=O)CCSC1C2CCC1CC2 62a_100009813300_100000737597 [0,0,0,2,0,0|2,0,0]=4 22489 B16R2.4825 CCOC(=O)CCCN1C2CCC1CC2 2230a_100000735658_100009991533 [0,0,0,2,0,0|1,0,0]=3 22490 B16R2.4825 CCOC(=O)CCCN1C2CCC1CC2 269982a_100000735658_100009991533 [0,0,0,2,0,0|1,0,0]=3 22491 B16R2.4825 CCOC(=O)CCCN1C2CCC1CC2 34a_100000735658_100009991533 [0,0,0,2,0,0|1,0,0]=3 22492 B16R2.4825 CCOC(=O)CCSC1C2CCC1CC2 62a_100000765890_100009813300 [0,0,0,2,0,0|1,0,0]=3 22493 B16R2.4825 CCOC(=O)CCSC1C2CCC1CC2 62a_100009813300_100000765890 [0,0,0,2,0,0|1,0,0]=3 22494 B16R2.4825 CCOC(=O)NCCN1C2CCC1CC2 269982a_100000735658_200011445536 [0,0,0,2,0,0|2,0,0]=4 22495 B16R2.4825 CCOC(=O)OCSC1C2CCC1CC2 62a_100009813300_100000075025 [0,0,0,2,0,0|2,0,0]=4 22496 B16R2.4846 CCOC(=O)CN1CCN2CCC1CC2 269982a_100000027273_100000188475 [0,0,0,2,0,0|2,0,0]=4 22497 B16R2.4861 CCOC(=O)CCCCN1CC2CC2C1 2230a_100000741873_100000750268 [0,0,0,2,0,0|1,0,0]=3 22498 B16R2.4861 CCOC(=O)CCCCN1CC2CC2C1 269982a_100000741873_100000750268 [0,0,0,2,0,0|1,0,0]=3 22499 B16R2.4861 CCOC(=O)CCCCN1CC2CC2C1 34a_100000741873_100000750268 [0,0,0,2,0,0|1,0,0]=3 22500 B16R2.4861 CCOC(=O)COCCN1CC2CC2C1 2230a_100000741873_100000088970 [0,0,0,2,0,0|2,0,0]=4 22501 B16R2.4861 CCOC(=O)COCCN1CC2CC2C1 269982a_100000741873_100000088970 [0,0,0,2,0,0|2,0,0]=4 22502 B16R2.4861 CCOC(=O)COCCN1CC2CC2C1 34a_100000741873_100000088970 [0,0,0,2,0,0|2,0,0]=4 22503 B16R2.27717 O=C(CNCCC1CCCCC1)C2CC2 2230a_100000738074_100000746382 [0,0,0,2,0,0|2,0,0]=4 22504 B16R2.27717 O=C(CNCCC1CCCCC1)C2CC2 34a_100000738074_100000746382 [0,0,0,2,0,0|2,0,0]=4 22505 B16R2.27717 O=C(COCCC1CCCCC1)C2CC2 34a_100000686663_100011209188 [0,0,0,2,0,0|2,0,0]=4 22506 B16R2.27717 O=C(COCCC1CCCCC1)C2CC2 34a_100011217863_100000746382 [0,0,0,2,0,0|2,0,0]=4 22507 B16R2.27717 O=C(COCCC1CCCCC1)C2CC2 7a_100011217863_100000746382 [0,0,0,2,0,0|2,0,0]=4 22508 B16R2.27717 O=C(CSCCC1CCCCC1)C2CC2 62a_100000746382_100012355289 [0,0,0,2,0,0|2,0,0]=4 22509 B16R2.27717 O=C(CSCCC1CCCCC1)C2CC2 62a_100012355289_100000746382 [0,0,0,2,0,0|2,0,0]=4 22510 B16R2.27717 O=C(NCCCC1CCCCC1)C2CC2 11a_100011211642_100000210395 [0,0,0,2,0,0|2,0,0]=4 22511 B16R2.27717 O=C(NCCCC1CCCCC1)C2CC2 1626a_100011211642_100000210395 [0,0,0,2,0,0|2,0,0]=4 22512 B16R2.27717 O=C(NCCCC1CCCCC1)C2CC2 240690a_100011211642_100000210395 [0,0,0,2,0,0|2,0,0]=4 22513 B16R2.27717 O=C(NCCCC1CCCCC1)C2CC2 527a_100011211642_100000210395 [0,0,0,2,0,0|2,0,0]=4 22514 B16R2.50773 CCOC(=O)CCCNC1C2C1COC2 2230a_100000702821_100009991533 [0,0,0,2,0,0|2,0,0]=4 22515 B16R2.50773 CCOC(=O)CCCNC1C2C1COC2 34a_100000702821_100009991533 [0,0,0,2,0,0|2,0,0]=4 22516 B16R2.50773 CCOC(=O)CCOCC1C2C1CNC2 34a_100000045132_100000765890 [0,0,0,2,0,0|2,0,0]=4 22517 B16R2.159641 CCOC(=O)CCCOC1CCC2C1C2 34a_200012295571_100009991533 [0,0,0,2,0,0|1,0,0]=3 22518 B16R2.160202 CCCC(=O)N1CCCC2C1CCCC2 11a_100000211887_100000211992 [0,0,0,2,0,0|2,0,0]=4 22519 B16R2.160202 CCCC(=O)N1CCCC2C1CCCC2 240690a_100000211887_100000211992 [0,0,0,2,0,0|2,0,0]=4 22520 B16R2.160202 CCCC(=O)N1CCCC2C1CCCC2 527a_100000211887_100000211992 [0,0,0,2,0,0|2,0,0]=4 22521 B16R2.160202 CCNC(=O)N1CCCC2C1CCCC2 273464a_100015525214_100000211887 [0,0,0,2,0,0|2,0,0]=4 22522 B16R2.724 CCCC(=O)N1CCCC1C2CCCC2 11a_100000743374_100000211992 [0,0,0,2,0,0|2,0,0]=4 22523 B16R2.724 CCCC(=O)N1CCCC1C2CCCC2 1626a_100000743374_100000211992 [0,0,0,2,0,0|2,0,0]=4 22524 B16R2.724 CCCC(=O)N1CCCC1C2CCCC2 240690a_100000743374_100000211992 [0,0,0,2,0,0|2,0,0]=4 22525 B16R2.724 CCCC(=O)N1CCCC1C2CCCC2 527a_100000743374_100000211992 [0,0,0,2,0,0|2,0,0]=4 22526 B16R2.724 CCNC(=O)N1CCCC1C2CCCC2 2708a_100015525214_100000743374 [0,0,0,2,0,0|2,0,0]=4 22527 B16R2.724 CCNC(=O)N1CCCC1C2CCCC2 273464a_100015525214_100000743374 [0,0,0,2,0,0|2,0,0]=4 22528 B16R2.724 CCNC(=O)[C@@H]1CCCN1C2CCCC2 2230a_100020641767_100000179811 [0,0,0,2,0,0|2,0,0]=4 22529 B16R2.724 CCNC(=O)[C@@H]1CCCN1C2CCCC2 269982a_100020641767_100000179811 [0,0,0,2,0,0|2,0,0]=4 22530 B16R2.724 CCNC(=O)[C@@H]1CCCN1C2CCCC2 270004a_100020641767_100000210133 [0,0,0,2,0,0|2,0,0]=4 22531 B16R2.724 CCNC(=O)[C@@H]1CCCN1C2CCCC2 34a_100020641767_100000179811 [0,0,0,2,0,0|2,0,0]=4 22532 B16R2.724 CCOC(=O)[C@@H]1CCCN1C2CCCC2 2230a_100000703725_100000179811 [0,0,0,2,0,0|1,0,0]=3 22533 B16R2.724 CCOC(=O)[C@@H]1CCCN1C2CCCC2 269982a_100000703725_100000179811 [0,0,0,2,0,0|1,0,0]=3 22534 B16R2.724 CCOC(=O)[C@@H]1CCCN1C2CCCC2 270004a_100000703725_100000210133 [0,0,0,2,0,0|1,0,0]=3 22535 B16R2.724 CCOC(=O)[C@@H]1CCCN1C2CCOC2 2230a_100000703725_100000731011 [0,0,0,2,0,0|2,0,0]=4 22536 B16R2.724 CCOC(=O)[C@@H]1CCCN1C2CCOC2 269982a_100000703725_100000731011 [0,0,0,2,0,0|2,0,0]=4 22537 B16R2.724 CCOC(=O)[C@@H]1CCCN1C2CCOC2 270004a_100000703725_100000752484 [0,0,0,2,0,0|2,0,0]=4 22538 B16R2.724 CCOC(=O)[C@@H]1CCCN1C2CCSC2 270004a_100000703725_100000212027 [0,0,0,2,0,0|2,0,0]=4 22539 B16R2.724 CCOC(=O)[C@@H]1CSCN1C2CCCC2 269982a_100016989239_100000179811 [0,0,0,2,0,0|2,0,0]=4 22540 B16R2.724 CCOC(=O)[C@@H]1CSCN1C2CCCC2 270004a_100016989239_100000210133 [0,0,0,2,0,0|2,0,0]=4 22541 B16R2.14533 O=C1CCN(CCN1)CCC2CCCC2 2230a_100000698595_100000760354 [0,0,0,2,0,0|2,0,0]=4 22542 B16R2.14533 O=C1CCN(CCN1)CCC2CCCC2 269982a_100000698595_100000760354 [0,0,0,2,0,0|2,0,0]=4 22543 B16R2.29720 CCNC(=O)CCNC1CC2CCC1C2 2230a_100000758229_100000737597 [0,0,0,2,0,0|2,0,0]=4 22544 B16R2.29720 CCNC(=O)CCNC1CC2CCC1C2 269862a_100025743525_100000223372 [0,0,0,2,0,0|2,0,0]=4 22545 B16R2.29720 CCNC(=O)CCNC1CC2CCC1C2 270004a_100025743525_100000223372 [0,0,0,2,0,0|2,0,0]=4 22546 B16R2.29720 CCNC(=O)CCNC1CC2CCC1C2 34a_100025743525_100000727232 [0,0,0,2,0,0|2,0,0]=4 22547 B16R2.29720 CCNC(=O)CCSC1CC2CCC1C2 62a_100000727232_100000737597 [0,0,0,2,0,0|2,0,0]=4 22548 B16R2.29720 CCNC(=O)CCSC1CC2CCC1C2 62a_100000737597_100000727232 [0,0,0,2,0,0|2,0,0]=4 22549 B16R2.29720 CCNC(=O)CNCC1CC2CCC1C2 270004a_100016988866_100000697602 [0,0,0,2,0,0|2,0,0]=4 22550 B16R2.29720 CCNC(=O)COCC1CC2CCC1C2 34a_100000229996_100000183381 [0,0,0,2,0,0|2,0,0]=4 22551 B16R2.29720 CCOC(=O)CCCN1CC2CCC1C2 2230a_100000743476_100009991533 [0,0,0,2,0,0|1,0,0]=3 22552 B16R2.29720 CCOC(=O)CCCN1CC2CCC1C2 269982a_100000743476_100009991533 [0,0,0,2,0,0|1,0,0]=3 22553 B16R2.29720 CCOC(=O)CCCN1CC2CCC1C2 34a_100000743476_100009991533 [0,0,0,2,0,0|1,0,0]=3 22554 B16R2.29720 CCOC(=O)CCCN1C[C@H]2C[C@@H]1CO2 2230a_100016995552_100009991533 [0,0,0,2,0,0|2,0,0]=4 22555 B16R2.29720 CCOC(=O)CCCN1C[C@H]2C[C@@H]1CO2 269982a_100016995552_100009991533 [0,0,0,2,0,0|2,0,0]=4 22556 B16R2.29720 CCOC(=O)CCCN1C[C@H]2C[C@@H]1CO2 34a_100016995552_100009991533 [0,0,0,2,0,0|2,0,0]=4 22557 B16R2.29720 CCOC(=O)CCNC1CC2CCC1C2 2230a_100000758229_100011206558 [0,0,0,2,0,0|1,0,0]=3 22558 B16R2.29720 CCOC(=O)CCNC1CC2CCC1C2 34a_100000758229_100000765890 [0,0,0,2,0,0|1,0,0]=3 22559 B16R2.29720 CCOC(=O)CCOC1CC2CCC1C2 34a_100000211339_100000765890 [0,0,0,2,0,0|1,0,0]=3 22560 B16R2.29720 CCOC(=O)CCSC1CC2CCC1C2 62a_100000727232_100000765890 [0,0,0,2,0,0|1,0,0]=3 22561 B16R2.29720 CCOC(=O)CCSC1CC2CCC1C2 62a_100000765890_100000727232 [0,0,0,2,0,0|1,0,0]=3 22562 B16R2.29720 CCOC(=O)COCC1CC2CCC1C2 34a_100000229996_100000188475 [0,0,0,2,0,0|1,0,0]=3 22563 B16R2.29720 CCOC(=O)NCCN1CC2CCC1C2 269982a_100000743476_200011445536 [0,0,0,2,0,0|2,0,0]=4 22564 B16R2.29720 CCOC(=O)OCSC1CC2CCC1C2 62a_100000727232_100000075025 [0,0,0,2,0,0|2,0,0]=4 22565 B16R2.147079 O=C(CNCCCC1CCCC1)C2CC2 2230a_100000736752_100000746382 [0,0,0,2,0,0|2,0,0]=4 22566 B16R2.147079 O=C(CNCCCC1CCCC1)C2CC2 34a_100000736752_100000746382 [0,0,0,2,0,0|2,0,0]=4 22567 B16R2.147079 O=C(COCCCC1CCCC1)C2CC2 34a_100000686663_100011713738 [0,0,0,2,0,0|2,0,0]=4 22568 B16R2.147079 O=C(COCCCC1CCCC1)C2CC2 34a_100011215328_100000746382 [0,0,0,2,0,0|2,0,0]=4 22569 B16R2.147079 O=C(COCCCC1CCCC1)C2CC2 7a_100011215328_100000746382 [0,0,0,2,0,0|2,0,0]=4 22570 B16R2.147079 O=C(CSCCCC1CCCC1)C2CC2 62a_100000746382_100011713738 [0,0,0,2,0,0|2,0,0]=4 22571 B16R2.147079 O=C(CSCCCC1CCCC1)C2CC2 62a_100011713738_100000746382 [0,0,0,2,0,0|2,0,0]=4 22572 B16R2.2151 CCOC(=O)CN1CCN2CCC[C@@H]2C1 2230a_100000008389_100000188475 [0,0,0,2,0,0|2,0,0]=4 22573 B16R2.2151 CCOC(=O)CN1CCN2CCC[C@@H]2C1 269982a_100000008389_100000188475 [0,0,0,2,0,0|2,0,0]=4 22574 B16R2.2151 CCOC(=O)CN1CCN2CCC[C@@H]2C1 34a_100000008389_100000188475 [0,0,0,2,0,0|2,0,0]=4 22575 B16R2.2544 CCN1CCCC1CNC2CCOC2=O 2230a_100000211693_100000211211 [0,0,0,2,0,0|2,0,0]=4 22576 B16R2.2544 CCN1CCC[C@@H]1COC2CCOC2=O 34a_100011739246_100000211211 [0,0,0,2,0,0|2,0,0]=4 22577 B16R2.2544 CCN1CCC[C@@H]1COC2CCOC2=O 7a_100011739246_100000211211 [0,0,0,2,0,0|2,0,0]=4 22578 B16R2.4865 CCOC(=O)CN1C[C@H]2C[C@@H]1CN2CC 2230a_200016994038_100000188475 [0,0,0,2,0,0|2,0,0]=4 22579 B16R2.4865 CCOC(=O)CN1C[C@H]2C[C@@H]1CN2CC 269982a_200016994038_100000188475 [0,0,0,2,0,0|2,0,0]=4 22580 B16R2.8600 CCC1CCCC1N2CCNC(=O)CC2 270004a_100000698595_100000749056 [0,0,0,2,0,0|2,0,0]=4 22581 B16R2.29013 CCNC(=O)CCNC1CCCC12CC2 269862a_100025743525_100009881796 [0,0,0,2,0,0|2,0,0]=4 22582 B16R2.29013 CCOC(=O)CCCN1CCCC12CC2 2230a_100020620911_100009991533 [0,0,0,2,0,0|1,0,0]=3 22583 B16R2.29013 CCOC(=O)CCCN1CCCC12CC2 269982a_100020620911_100009991533 [0,0,0,2,0,0|1,0,0]=3 22584 B16R2.29013 CCOC(=O)CCCN1CCCC12CC2 34a_100020620911_100009991533 [0,0,0,2,0,0|1,0,0]=3 22585 B16R2.29013 CCOC(=O)NCCN1CCCC12CC2 269982a_100020620911_200011445536 [0,0,0,2,0,0|2,0,0]=4 22586 B16R2.29775 CCOC(=O)C1CCCCN1CC2CC2 2230a_100016990872_100000742324 [0,0,0,2,0,0|1,0,0]=3 22587 B16R2.29775 CCOC(=O)C1CCCCN1CC2CC2 269982a_100016990872_100000756562 [0,0,0,2,0,0|1,0,0]=3 22588 B16R2.29775 CCOC(=O)C1CCCCN1CC2CO2 2230a_100016990872_100011216344 [0,0,0,2,0,0|2,0,0]=4 22589 B16R2.29775 CCOC(=O)C1CCCCN1CC2CO2 269982a_100016990872_102125554688 [0,0,0,2,0,0|2,0,0]=4 22590 B16R2.29775 CCOC(=O)C1CCCCN1CC2CS2 269982a_100016990872_100000031435 [0,0,0,2,0,0|2,0,0]=4 22591 B16R2.29775 CCOC(=O)C1CCCCN1C[C@@H]2CO2 269982a_100016990872_100000745022 [0,0,0,2,0,0|2,0,0]=4 22592 B16R2.29775 CCOC(=O)C1CSCCN1CC2CC2 2230a_100000735462_100000742324 [0,0,0,2,0,0|2,0,0]=4 22593 B16R2.29775 CCOC(=O)C1CSCCN1CC2CC2 269982a_100000735462_100000756562 [0,0,0,2,0,0|2,0,0]=4 22594 B16R2.29775 CCOC(=O)[C@@H]1COCCN1CC2CC2 2230a_100015229691_100000742324 [0,0,0,2,0,0|2,0,0]=4 22595 B16R2.29775 CCOC(=O)[C@@H]1COCCN1CC2CC2 269982a_100015229691_100000756562 [0,0,0,2,0,0|2,0,0]=4 22596 B16R2.29848 CCOC(=O)C1CCCCN1C2CCC2 269982a_100016990872_100000749161 [0,0,0,2,0,0|1,0,0]=3 22597 B16R2.29848 CCOC(=O)C1CCCCN1C2CCC2 270004a_100016990872_100000241760 [0,0,0,2,0,0|1,0,0]=3 22598 B16R2.29848 CCOC(=O)C1CCCCN1C2COC2 269982a_100016990872_100000687716 [0,0,0,2,0,0|2,0,0]=4 22599 B16R2.29848 CCOC(=O)C1CSCCN1C2CCC2 269982a_100000735462_100000749161 [0,0,0,2,0,0|2,0,0]=4 22600 B16R2.29848 CCOC(=O)C1CSCCN1C2CCC2 270004a_100000735462_100000241760 [0,0,0,2,0,0|2,0,0]=4 22601 B16R2.29848 CCOC(=O)[C@@H]1COCCN1C2CCC2 269982a_100015229691_100000749161 [0,0,0,2,0,0|2,0,0]=4 22602 B16R2.29848 CCOC(=O)[C@@H]1COCCN1C2CCC2 270004a_100015229691_100000241760 [0,0,0,2,0,0|2,0,0]=4 22603 B16R2.28950 CCOC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1CC 2230a_100016991816_100000210202 [0,0,0,2,0,0|1,0,0]=3 22604 B16R2.28950 CCOC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1CC 269982a_100016991816_100000204670 [0,0,0,2,0,0|1,0,0]=3 22605 B16R2.28950 CCOC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1CF 269982a_100016991816_100015361967 [0,0,0,2,0,0|2,0,0]=4 22606 B16R2.734 CCCC(=O)CN1C[C@H]2CCCC[C@H]2C1 2230a_100015204113_100000747444 [0,0,0,2,0,0|2,0,0]=4 22607 B16R2.734 CCCC(=O)CN1C[C@H]2CCCC[C@H]2C1 269982a_100015204113_100000747444 [0,0,0,2,0,0|2,0,0]=4 22608 B16R2.734 CCNC(=O)CN1C[C@H]2CCCC[C@H]2C1 2230a_100015204113_100000183381 [0,0,0,2,0,0|2,0,0]=4 22609 B16R2.734 CCNC(=O)CN1C[C@H]2CCCC[C@H]2C1 269982a_100015204113_100000183381 [0,0,0,2,0,0|2,0,0]=4 22610 B16R2.734 CCNC(=O)CN1C[C@H]2CCCC[C@H]2C1 34a_100015204113_100000183381 [0,0,0,2,0,0|2,0,0]=4 22611 B16R2.734 CCOC(=O)CN1C[C@H]2CCCC[C@H]2C1 2230a_100015204113_100000188475 [0,0,0,2,0,0|1,0,0]=3 22612 B16R2.734 CCOC(=O)CN1C[C@H]2CCCC[C@H]2C1 269982a_100015204113_100000188475 [0,0,0,2,0,0|1,0,0]=3 22613 B16R2.734 CCOC(=O)CN1C[C@H]2CCCC[C@H]2C1 34a_100015204113_100000188475 [0,0,0,2,0,0|1,0,0]=3 22614 B16R2.2966 CN1CCCCC1CNC2CCOC2=O 34a_100011228421_100000211211 [0,0,0,2,0,0|2,0,0]=4 22615 B16R2.2966 CN1CCCCC1COC2CCOC2=O 34a_100000225079_100000211211 [0,0,0,2,0,0|2,0,0]=4 22616 B16R2.2966 CN1CCCCC1CSC2CCOC2=O 62a_100000211211_100015185383 [0,0,0,2,0,0|2,0,0]=4 22617 B16R2.2966 CN1CCCCC1CSC2CCOC2=O 62a_100015185383_100000211211 [0,0,0,2,0,0|2,0,0]=4 22618 B16R2.2966 O=C1OCCC1NCC2CCCCC2O 34a_100011216029_100000211211 [0,0,0,2,0,0|2,0,0]=4 22619 B16R2.14496 CC1CCCCC1N2CCNC(=O)CC2 270004a_100000698595_100000210921 [0,0,0,2,0,0|2,0,0]=4 22620 B16R2.208589 CCNC(=O)CCNC1CCCC2C1C2 269862a_100025743525_100000697651 [0,0,0,2,0,0|2,0,0]=4 22621 B16R2.29930 CCNC(=O)[C@@H]1CCCN1CC2CCC2 2230a_100020641767_100000763275 [0,0,0,2,0,0|2,0,0]=4 22622 B16R2.29930 CCNC(=O)[C@@H]1CCCN1CC2CCC2 269982a_100020641767_100000763275 [0,0,0,2,0,0|2,0,0]=4 22623 B16R2.29930 CCNC(=O)[C@@H]1CCCN1CC2CCC2 34a_100020641767_100000763275 [0,0,0,2,0,0|2,0,0]=4 22624 B16R2.29930 CCOC(=O)[C@@H]1CCCN1CC2CCC2 2230a_100000703725_100000763275 [0,0,0,2,0,0|1,0,0]=3 22625 B16R2.29930 CCOC(=O)[C@@H]1CCCN1CC2CCC2 269982a_100000703725_100000763275 [0,0,0,2,0,0|1,0,0]=3 22626 B16R2.29930 CCOC(=O)[C@@H]1CCCN1CC2CCO2 2230a_100000703725_100000103362 [0,0,0,2,0,0|2,0,0]=4 22627 B16R2.29930 CCOC(=O)[C@@H]1CCCN1CC2CCO2 269982a_100000703725_100000103362 [0,0,0,2,0,0|2,0,0]=4 22628 B16R2.29930 CCOC(=O)[C@@H]1CCCN1CC2COC2 2230a_100000703725_100010264016 [0,0,0,2,0,0|2,0,0]=4 22629 B16R2.29930 CCOC(=O)[C@@H]1CCCN1CC2COC2 269982a_100000703725_100010264016 [0,0,0,2,0,0|2,0,0]=4 22630 B16R2.29930 CCOC(=O)[C@@H]1CCC[C@@H]1OC2COC2 7a_200015395474_100009818527 [0,0,0,2,0,0|2,0,0]=4 22631 B16R2.29930 CCOC(=O)[C@@H]1CSCN1CC2CCC2 269982a_100016989239_100000763275 [0,0,0,2,0,0|2,0,0]=4 22632 B16R2.159905 CCOC(=O)CCCN1CCC12COC2 2230a_100015204706_100009991533 [0,0,0,2,0,0|2,0,0]=4 22633 B16R2.159905 CCOC(=O)CCCN1CCC12COC2 269982a_100015204706_100009991533 [0,0,0,2,0,0|2,0,0]=4 22634 B16R2.94177 O=C1CCN(CCN1)C2CCCCCC2 269982a_100000698595_100011217769 [0,0,0,2,0,0|2,0,0]=4 22635 B16R2.94177 O=C1CCN(CCN1)C2CCCCCC2 270004a_100000698595_100000210131 [0,0,0,2,0,0|2,0,0]=4 22636 B16R2.12829 O=C1CCCC1NCC2CCCCCC2 2230a_100015204231_100000211823 [0,0,0,2,0,0|2,0,0]=4 22637 B16R2.12829 O=C1CCCC1NCC2CCCCCC2 34a_100015204231_100000709159 [0,0,0,2,0,0|2,0,0]=4 22638 B16R2.12829 O=C1CCCC1OCC2CCCCCC2 34a_100000699130_100000709159 [0,0,0,2,0,0|2,0,0]=4 22639 B16R2.12829 O=C1CCCC1OCC2CCCCCC2 34a_200000719330_200000696569 [0,0,0,2,0,0|2,0,0]=4 22640 B16R2.12829 O=C1CCCC1OCC2CCCCCC2 7a_100000699130_100000211823 [0,0,0,2,0,0|2,0,0]=4 22641 B16R2.12829 O=C1CCCC1SCC2CCCCCC2 62a_100000211823_200000696569 [0,0,0,2,0,0|2,0,0]=4 22642 B16R2.12829 O=C1CCCC1SCC2CCCCCC2 62a_200000696569_100000211823 [0,0,0,2,0,0|2,0,0]=4 22643 B16R2.12829 O=C1NCCC1COC2CCCCCC2 34a_100000133458_100011217769 [0,0,0,2,0,0|2,0,0]=4 22644 B16R2.12829 O=C1NCCC1NCC2CCCCCC2 2230a_100016995588_200000696569 [0,0,0,2,0,0|2,0,0]=4 22645 B16R2.12829 O=C1NCCC1NCC2CCCCCC2 34a_100016995588_200000696569 [0,0,0,2,0,0|2,0,0]=4 22646 B16R2.12829 O=C1NCC[C@@H]1OCC2CCCCCC2 34a_100000688343_200000696569 [0,0,0,2,0,0|2,0,0]=4 22647 B16R2.12829 O=C1OCCC1NCC2CCCCCC2 2230a_100015204231_100000211211 [0,0,0,2,0,0|1,0,0]=3 22648 B16R2.12829 O=C1OCCC1NCC2CCCCCC2 34a_100015204231_100000211211 [0,0,0,2,0,0|1,0,0]=3 22649 B16R2.12829 O=C1OCCC1OCC2CCCCCC2 34a_100000699130_100000211211 [0,0,0,2,0,0|1,0,0]=3 22650 B16R2.12829 O=C1OCCC1OCC2CCCCCC2 7a_100000699130_100000211211 [0,0,0,2,0,0|1,0,0]=3 22651 B16R2.12829 O=C1OCCC1SCC2CCCCCC2 62a_100000211211_200000696569 [0,0,0,2,0,0|1,0,0]=3 22652 B16R2.12829 O=C1OCCC1SCC2CCCCCC2 62a_200000696569_100000211211 [0,0,0,2,0,0|1,0,0]=3 22653 B16R2.147034 O=C(CNCC1CCCCCC1)C2CC2 2230a_100015204231_100000746382 [0,0,0,2,0,0|2,0,0]=4 22654 B16R2.147034 O=C(CNCC1CCCCCC1)C2CC2 34a_100015204231_100000746382 [0,0,0,2,0,0|2,0,0]=4 22655 B16R2.147034 O=C(COCC1CCCCCC1)C2CC2 34a_100000686663_200000696569 [0,0,0,2,0,0|2,0,0]=4 22656 B16R2.147034 O=C(COCC1CCCCCC1)C2CC2 34a_100000699130_100000746382 [0,0,0,2,0,0|2,0,0]=4 22657 B16R2.147034 O=C(COCC1CCCCCC1)C2CC2 7a_100000699130_100000746382 [0,0,0,2,0,0|2,0,0]=4 22658 B16R2.147034 O=C(CSCC1CCCCCC1)C2CC2 62a_100000746382_200000696569 [0,0,0,2,0,0|2,0,0]=4 22659 B16R2.147034 O=C(CSCC1CCCCCC1)C2CC2 62a_200000696569_100000746382 [0,0,0,2,0,0|2,0,0]=4 22660 B16R2.147034 O=C(NCCC1CCCCCC1)C2CC2 11a_100011532351_100000210395 [0,0,0,2,0,0|2,0,0]=4 22661 B16R2.147034 O=C(NCCC1CCCCCC1)C2CC2 1626a_100011532351_100000210395 [0,0,0,2,0,0|2,0,0]=4 22662 B16R2.147034 O=C(NCCC1CCCCCC1)C2CC2 240690a_100011532351_100000210395 [0,0,0,2,0,0|2,0,0]=4 22663 B16R2.147034 O=C(NCCC1CCCCCC1)C2CC2 527a_100011532351_100000210395 [0,0,0,2,0,0|2,0,0]=4 22664 B16R2.611 CCCC1CCCCN1C2CCCC2=O 2230a_100000701414_100000211823 [0,0,0,2,0,0|2,0,0]=4 22665 B16R2.611 CCCC1CCCCN1C2CCCC2=O 269982a_100000701414_100000211823 [0,0,0,2,0,0|2,0,0]=4 22666 B16R2.611 CCCC1CCCCN1C2CCCC2=O 34a_100000701414_100000709159 [0,0,0,2,0,0|2,0,0]=4 22667 B16R2.611 CCCC1CCCCN1C2CCOC2=O 2230a_100000701414_100000211211 [0,0,0,2,0,0|1,0,0]=3 22668 B16R2.611 CCCC1CCCCN1C2CCOC2=O 269982a_100000701414_100000211211 [0,0,0,2,0,0|1,0,0]=3 22669 B16R2.611 CCCC1CCCCN1C2CCOC2=O 34a_100000701414_100000211211 [0,0,0,2,0,0|1,0,0]=3 22670 B16R2.611 CCCC1COCCN1C2CCOC2=O 2230a_102495339903_100000211211 [0,0,0,2,0,0|2,0,0]=4 22671 B16R2.611 CCCC1COCCN1C2CCOC2=O 269982a_102495339903_100000211211 [0,0,0,2,0,0|2,0,0]=4 22672 B16R2.611 CCCC1COCCN1C2CCOC2=O 34a_102495339903_100000211211 [0,0,0,2,0,0|2,0,0]=4 22673 B16R2.611 COCC1CCCCN1C2CCOC2=O 2230a_100015184032_100000211211 [0,0,0,2,0,0|2,0,0]=4 22674 B16R2.611 COCC1CCCCN1C2CCOC2=O 269982a_100015184032_100000211211 [0,0,0,2,0,0|2,0,0]=4 22675 B16R2.611 COCC1CCCCN1C2CCOC2=O 34a_100015184032_100000211211 [0,0,0,2,0,0|2,0,0]=4 22676 B16R2.611 O=C1OCCC1N2CCCCC2CCO 2230a_100000211664_100000211211 [0,0,0,2,0,0|2,0,0]=4 22677 B16R2.611 O=C1OCCC1N2CCCCC2CCO 269982a_100000211664_100000211211 [0,0,0,2,0,0|2,0,0]=4 22678 B16R2.611 O=C1OCCC1N2CCCCC2CCO 34a_100000211664_100000211211 [0,0,0,2,0,0|2,0,0]=4 22679 B16R2.3222 CN1CCCC1CCOC2CCOC2=O 34a_100011215177_100000211211 [0,0,0,2,0,0|2,0,0]=4 22680 B16R2.3222 CN1CCCC1CCOC2CCOC2=O 7a_100011215177_100000211211 [0,0,0,2,0,0|2,0,0]=4 22681 B16R2.3222 CN1CCCC1CCSC2CCOC2=O 62a_100000005710_100000211211 [0,0,0,2,0,0|2,0,0]=4 22682 B16R2.3222 CN1CCCC1CCSC2CCOC2=O 62a_100000211211_100000005710 [0,0,0,2,0,0|2,0,0]=4 22683 B16R2.12850 O=C1CCCC1N2CCCCCCCC2 2230a_100000039187_100000211823 [0,0,0,2,0,0|2,0,0]=4 22684 B16R2.12850 O=C1CCCC1N2CCCCCCCC2 269982a_100000039187_100000211823 [0,0,0,2,0,0|2,0,0]=4 22685 B16R2.12850 O=C1CCCC1N2CCCCCCCC2 34a_100000039187_100000709159 [0,0,0,2,0,0|2,0,0]=4 22686 B16R2.12850 O=C1OCCC1N2CCCCCCCC2 2230a_100000039187_100000211211 [0,0,0,2,0,0|1,0,0]=3 22687 B16R2.12850 O=C1OCCC1N2CCCCCCCC2 269982a_100000039187_100000211211 [0,0,0,2,0,0|1,0,0]=3 22688 B16R2.12850 O=C1OCCC1N2CCCCCCCC2 34a_100000039187_100000211211 [0,0,0,2,0,0|1,0,0]=3 22689 B16R2.23378 O=C1CCCC1NC2CCCCCCC2 2230a_100000211152_100000211823 [0,0,0,2,0,0|2,0,0]=4 22690 B16R2.23378 O=C1CCCC1NC2CCCCCCC2 34a_100000211152_100000709159 [0,0,0,2,0,0|2,0,0]=4 22691 B16R2.23378 O=C1CCCC1OC2CCCCCCC2 34a_100000210054_100000709159 [0,0,0,2,0,0|2,0,0]=4 22692 B16R2.23378 O=C1CCCC1OC2CCCCCCC2 7a_100000210054_100000211823 [0,0,0,2,0,0|2,0,0]=4 22693 B16R2.23378 O=C1NCCC1NC2CCCCCCC2 270004a_100016995588_100000210524 [0,0,0,2,0,0|2,0,0]=4 22694 B16R2.23378 O=C1OCCC1NC2CCCCCCC2 2230a_100000211152_100000211211 [0,0,0,2,0,0|1,0,0]=3 22695 B16R2.23378 O=C1OCCC1NC2CCCCCCC2 34a_100000211152_100000211211 [0,0,0,2,0,0|1,0,0]=3 22696 B16R2.23378 O=C1OCCC1OC2CCCCCCC2 34a_100000210054_100000211211 [0,0,0,2,0,0|1,0,0]=3 22697 B16R2.23378 O=C1OCCC1OC2CCCCCCC2 7a_100000210054_100000211211 [0,0,0,2,0,0|1,0,0]=3 22698 B16R2.205486 CCCCCN1CCN2C(=O)CCC2C1 2230a_100020639069_100000210326 [0,0,0,2,0,0|2,0,0]=4 22699 B16R2.205486 CCCCCN1CCN2C(=O)CCC2C1 269982a_100020639069_100000210215 [0,0,0,2,0,0|2,0,0]=4 22700 B16R2.205486 CCCCCN1CCN2C(=O)CCC2C1 34a_100020639069_100000718602 [0,0,0,2,0,0|2,0,0]=4 22701 B16R2.737 CCNC(=O)CCN1C[C@H]2CCC[C@H]2C1 2230a_100102946302_100000737597 [0,0,0,2,0,0|2,0,0]=4 22702 B16R2.737 CCNC(=O)CCN1C[C@H]2CCC[C@H]2C1 269982a_100102946302_100000737597 [0,0,0,2,0,0|2,0,0]=4 22703 B16R2.737 CCOC(=O)CCN1C[C@H]2CCC[C@H]2C1 2230a_100102946302_100011206558 [0,0,0,2,0,0|1,0,0]=3 22704 B16R2.737 CCOC(=O)CCN1C[C@H]2CCC[C@H]2C1 269982a_100102946302_100011206558 [0,0,0,2,0,0|1,0,0]=3 22705 B16R2.737 CCOC(=O)CCN1C[C@H]2CCC[C@H]2C1 34a_100102946302_100000765890 [0,0,0,2,0,0|1,0,0]=3 22706 B16R2.737 CCOC(=O)CCN1C[C@H]2COC[C@H]2C1 2230a_100000700037_100011206558 [0,0,0,2,0,0|2,0,0]=4 22707 B16R2.737 CCOC(=O)CCN1C[C@H]2COC[C@H]2C1 269982a_100000700037_100011206558 [0,0,0,2,0,0|2,0,0]=4 22708 B16R2.737 CCOC(=O)CCN1C[C@H]2COC[C@H]2C1 34a_100000700037_100000765890 [0,0,0,2,0,0|2,0,0]=4 22709 B16R2.28388 CCCC1CCCCN1CC(=O)C2CC2 2230a_100000701414_100000746382 [0,0,0,2,0,0|2,0,0]=4 22710 B16R2.28388 CCCC1CCCCN1CC(=O)C2CC2 269982a_100000701414_100000746382 [0,0,0,2,0,0|2,0,0]=4 22711 B16R2.28388 CCCC1CCCCN1CC(=O)C2CC2 34a_100000701414_100000746382 [0,0,0,2,0,0|2,0,0]=4 22712 B16R2.29977 CCOC(=O)CC1CCCCN1C2CC2 269982a_100116209990_100000211595 [0,0,0,2,0,0|1,0,0]=3 22713 B16R2.29929 CCNC(=O)[C@@H]1CCCN1CCC2CC2 2230a_100020641767_100000694398 [0,0,0,2,0,0|2,0,0]=4 22714 B16R2.29929 CCNC(=O)[C@@H]1CCCN1CCC2CC2 269982a_100020641767_100000694398 [0,0,0,2,0,0|2,0,0]=4 22715 B16R2.29929 CCNC(=O)[C@@H]1CCCN1CCC2CC2 34a_100020641767_100000694398 [0,0,0,2,0,0|2,0,0]=4 22716 B16R2.29929 CCOC(=O)[C@@H]1CCCN1CCC2CC2 2230a_100000703725_100000694398 [0,0,0,2,0,0|1,0,0]=3 22717 B16R2.29929 CCOC(=O)[C@@H]1CCCN1CCC2CC2 269982a_100000703725_100000694398 [0,0,0,2,0,0|1,0,0]=3 22718 B16R2.29929 CCOC(=O)[C@@H]1CCCN1CCC2CO2 2230a_100000703725_100000732470 [0,0,0,2,0,0|2,0,0]=4 22719 B16R2.29929 CCOC(=O)[C@@H]1CCCN1CCC2CO2 269982a_100000703725_100000732470 [0,0,0,2,0,0|2,0,0]=4 22720 B16R2.29929 CCOC(=O)[C@@H]1CCC[C@@H]1OCC2CC2 7a_200015395474_100000742324 [0,0,0,2,0,0|1,0,0]=3 22721 B16R2.29929 CCOC(=O)[C@@H]1CCC[C@@H]1OCC2CO2 7a_200015395474_102125554688 [0,0,0,2,0,0|2,0,0]=4 22722 B16R2.29929 CCOC(=O)[C@@H]1CCC[C@@H]1OCC2CS2 7a_200015395474_100000031435 [0,0,0,2,0,0|2,0,0]=4 22723 B16R2.29929 CCOC(=O)[C@@H]1CCC[C@@H]1OC[C@@H]2CO2 7a_200015395474_100000745022 [0,0,0,2,0,0|2,0,0]=4 22724 B16R2.29929 CCOC(=O)[C@@H]1CSCN1CCC2CC2 269982a_100016989239_100000694398 [0,0,0,2,0,0|2,0,0]=4 22725 B16R2.147301 O=C(CNC1CCCCCCC1)C2CC2 2230a_100000211152_100000746382 [0,0,0,2,0,0|2,0,0]=4 22726 B16R2.147301 O=C(CNC1CCCCCCC1)C2CC2 34a_100000211152_100000746382 [0,0,0,2,0,0|2,0,0]=4 22727 B16R2.147301 O=C(COC1CCCCCCC1)C2CC2 34a_100000210054_100000746382 [0,0,0,2,0,0|2,0,0]=4 22728 B16R2.147301 O=C(COC1CCCCCCC1)C2CC2 7a_100000210054_100000746382 [0,0,0,2,0,0|2,0,0]=4 22729 B16R2.146933 O=C(CN1CCCCCCCC1)C2CC2 2230a_100000039187_100000746382 [0,0,0,2,0,0|2,0,0]=4 22730 B16R2.146933 O=C(CN1CCCCCCCC1)C2CC2 269982a_100000039187_100000746382 [0,0,0,2,0,0|2,0,0]=4 22731 B16R2.146933 O=C(CN1CCCCCCCC1)C2CC2 34a_100000039187_100000746382 [0,0,0,2,0,0|2,0,0]=4