0 B18R0.220 C#CCCCCCCCCCOCC(=O)NC(C)C 34a_100000034437_100000183996 [0,0,0,0,0,0|2,0,2]=4 1 B18R0.220 C#CCCCCCCCCCOCC(=O)NC(C)C 7a_100000034437_100000183996 [0,0,0,0,0,0|2,0,2]=4 2 B18R0.220 C#CCCCCCCCCCOCC(=O)OC(C)C 34a_100000034437_100011215430 [0,0,0,0,0,0|1,0,2]=3 3 B18R0.220 C#CCCCCCCCCCOCC(=O)OC(C)C 7a_100000034437_100011215430 [0,0,0,0,0,0|1,0,2]=3 4 B18R0.220 C#CCCCCCCCCOCCC(=O)NC(C)C 7a_100000065265_100000737564 [0,0,0,0,0,0|2,0,2]=4 5 B18R0.220 C#CCCCCCCCCOCCC(=O)OC(C)C 7a_100000065265_100000760027 [0,0,0,0,0,0|1,0,2]=3 6 B18R0.220 C#CCCCCCOCCCCCC(=O)OC(C)C 34a_100000766912_200010986244 [0,0,0,0,0,0|1,0,2]=3 7 B18R0.220 C#CCCCCCOCCCCCC(=O)OC(C)C 7a_100000766912_200010986244 [0,0,0,0,0,0|1,0,2]=3 8 B18R0.220 C#CCCCCCSCCCCCC(=O)OC(C)C 62a_100012094781_200010986244 [0,0,0,0,0,0|1,0,2]=3 9 B18R0.220 C#CCCCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100012094781 [0,0,0,0,0,0|1,0,2]=3 10 B18R0.220 C#CCOCCCCCCOCCC(=O)OC(C)C 7a_200011021349_100000760027 [0,0,0,0,0,0|2,0,2]=4 11 B18R0.220 C=CCCCCCCCCCCCC(=O)CN(C)C 1458a_100000750896_102130925996 [0,0,0,0,0,0|2,0,2]=4 12 B18R0.220 C=CCCCCCCCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_102130925996 [0,0,0,0,0,0|2,0,2]=4 13 B18R0.220 C=CCCCCCCCCCCCC(=O)C[S+](C)C 1458a_200159257847_102130925996 [0,0,0,0,0,0|2,0,2]=4 14 B18R0.220 C=CCCCCCCCCCNCC(=O)NC(C)C 2230a_100000081888_100000183996 [0,0,0,0,0,0|2,0,2]=4 15 B18R0.220 C=CCCCCCCCCCNCC(=O)NC(C)C 2230a_100000168517_100009814027 [0,0,0,0,0,0|2,0,2]=4 16 B18R0.220 C=CCCCCCCCCCNCC(=O)NC(C)C 34a_100000081888_100000183996 [0,0,0,0,0,0|2,0,2]=4 17 B18R0.220 C=CCCCCCCCCCNCC(=O)OC(C)C 2230a_100000081888_100011215430 [0,0,0,0,0,0|1,0,2]=3 18 B18R0.220 C=CCCCCCCCCCNCC(=O)OC(C)C 34a_100000081888_100011215430 [0,0,0,0,0,0|1,0,2]=3 19 B18R0.220 C=CCCCCCCCCCOCC(=O)NC(C)C 34a_100000038209_100000183996 [0,0,0,0,0,0|2,0,2]=4 20 B18R0.220 C=CCCCCCCCCCOCC(=O)NC(C)C 7a_100000038209_100000183996 [0,0,0,0,0,0|2,0,2]=4 21 B18R0.220 C=CCCCCCCCCCOCC(=O)OC(C)C 34a_100000038209_100011215430 [0,0,0,0,0,0|1,0,2]=3 22 B18R0.220 C=CCCCCCCCCCOCC(=O)OC(C)C 7a_100000038209_100011215430 [0,0,0,0,0,0|1,0,2]=3 23 B18R0.220 C=CCCCCCCCCCSCC(=O)NC(C)C 62a_100000183996_100009814027 [0,0,0,0,0,0|2,0,2]=4 24 B18R0.220 C=CCCCCCCCCCSCC(=O)NC(C)C 62a_100009814027_100000183996 [0,0,0,0,0,0|2,0,2]=4 25 B18R0.220 C=CCCCCCCCCCSCC(=O)OC(C)C 62a_100009814027_100011215430 [0,0,0,0,0,0|1,0,2]=3 26 B18R0.220 C=CCCCCCCCCCSCC(=O)OC(C)C 62a_100011215430_100009814027 [0,0,0,0,0,0|1,0,2]=3 27 B18R0.220 C=CCCCCCCCCOCCC(=O)NC(C)C 7a_100011215194_100000737564 [0,0,0,0,0,0|2,0,2]=4 28 B18R0.220 C=CCCCCCCCCOCCC(=O)OC(C)C 7a_100011215194_100000760027 [0,0,0,0,0,0|1,0,2]=3 29 B18R0.220 C=CCCCCCCCCSCCC(=O)NC(C)C 62a_100000737564_100011933949 [0,0,0,0,0,0|2,0,2]=4 30 B18R0.220 C=CCCCCCCCCSCCC(=O)NC(C)C 62a_100011933949_100000737564 [0,0,0,0,0,0|2,0,2]=4 31 B18R0.220 C=CCCCCCCCCSCCC(=O)OC(C)C 62a_100000760027_100011933949 [0,0,0,0,0,0|1,0,2]=3 32 B18R0.220 C=CCCCCCCCCSCCC(=O)OC(C)C 62a_100011933949_100000760027 [0,0,0,0,0,0|1,0,2]=3 33 B18R0.220 C=CCCCCCOCCCCCC(=O)OC(C)C 34a_100011216702_200010986244 [0,0,0,0,0,0|1,0,2]=3 34 B18R0.220 C=CCCCCCOCCCCCC(=O)OC(C)C 7a_100011216702_200010986244 [0,0,0,0,0,0|1,0,2]=3 35 B18R0.220 C=CCCCCCSCCCCCC(=O)OC(C)C 62a_100000700193_200010986244 [0,0,0,0,0,0|1,0,2]=3 36 B18R0.220 C=CCCCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000700193 [0,0,0,0,0,0|1,0,2]=3 37 B18R0.220 C=COCCCCOCCCCCC(=O)OC(C)C 34a_100000031558_200010986244 [0,0,0,0,0,0|2,0,2]=4 38 B18R0.220 C=COCCCCOCCCCCC(=O)OC(C)C 7a_100000031558_200010986244 [0,0,0,0,0,0|2,0,2]=4 39 B18R0.220 CC(=CC(=O)CCCCCCCCCCCCO)C 1458a_100000211388_100009813331 [0,0,0,0,0,0|2,0,1]=3 40 B18R0.220 CC(=CC(=O)CCCCCCCCCCCCO)Cl 1458a_200042562850_100009813331 [0,0,0,0,0,0|3,0,1]=4 41 B18R0.220 CC(=CC(=O)CCCCCCOCCCCCO)C 1458a_100000211388_200132310570 [0,0,0,0,0,0|3,0,1]=4 42 B18R0.220 CC(C)CC(=O)CCCCCCCCCCCCO 1458a_100000210554_100009813331 [0,0,0,0,0,0|2,0,0]=2 43 B18R0.220 CC(C)CC(=O)CCCCCCOCCCCCO 1458a_100000210554_200132310570 [0,0,0,0,0,0|3,0,0]=3 44 B18R0.220 CC(C)CN(C)CCCCCCCCCCCCO 2230a_100000747067_100009813331 [0,0,0,0,0,0|4,0,0]=4 45 B18R0.220 CC(C)CN(C)CCCCCCCCCCCCO 269982a_100000747067_100009813331 [0,0,0,0,0,0|4,0,0]=4 46 B18R0.220 CC(C)NC(=O)CCCCCCCCCCCCO 240690a_100138425928_100102582631 [0,0,0,0,0,0|2,0,0]=2 47 B18R0.220 CC(C)NC(=O)CCNCCCCCCCCCO 2230a_100000078944_100000737564 [0,0,0,0,0,0|3,0,0]=3 48 B18R0.220 CC(C)NC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000737564 [0,0,0,0,0,0|3,0,0]=3 49 B18R0.220 CC(C)NC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000737564 [0,0,0,0,0,0|3,0,0]=3 50 B18R0.220 CC(C)NC(=O)CCSCCCCCCCCCO 62a_100000737564_100009813782 [0,0,0,0,0,0|3,0,0]=3 51 B18R0.220 CC(C)NC(=O)CCSCCCCCCCCCO 62a_100009813782_100000737564 [0,0,0,0,0,0|3,0,0]=3 52 B18R0.220 CC(C)NC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000183996 [0,0,0,0,0,0|3,0,0]=3 53 B18R0.220 CC(C)NC(=O)CNCCCCCCCCCCO 2230a_100000168517_100009813290 [0,0,0,0,0,0|3,0,0]=3 54 B18R0.220 CC(C)NC(=O)CNCCCCCCCCCCO 34a_100000066964_100000183996 [0,0,0,0,0,0|3,0,0]=3 55 B18R0.220 CC(C)NC(=O)COCCCCCCCCCCBr 34a_100009813290_100000183996 [0,0,0,0,0,0|3,0,0]=3 56 B18R0.220 CC(C)NC(=O)COCCCCCCCCCCBr 7a_100009813290_100000183996 [0,0,0,0,0,0|3,0,0]=3 57 B18R0.220 CC(C)NC(=O)COCCCCCCCCCCCl 34a_200000033068_100000183996 [0,0,0,0,0,0|3,0,0]=3 58 B18R0.220 CC(C)NC(=O)COCCCCCCCCCCCl 7a_200000033068_100000183996 [0,0,0,0,0,0|3,0,0]=3 59 B18R0.220 CC(C)NC(=O)COCCCCCCCCCCN 34a_100000066964_100000183996 [0,0,0,0,0,0|3,0,0]=3 60 B18R0.220 CC(C)NC(=O)CSCCCCCCCCCCO 62a_100000183996_200000033068 [0,0,0,0,0,0|3,0,0]=3 61 B18R0.220 CC(C)NC(=O)CSCCCCCCCCCCO 62a_100009813290_100000183996 [0,0,0,0,0,0|3,0,0]=3 62 B18R0.220 CC(C)OC(=O)CCCCCNCCCCCCO 2230a_100000686447_200010986244 [0,0,0,0,0,0|2,0,0]=2 63 B18R0.220 CC(C)OC(=O)CCCCCNCCCCCCO 34a_100000686447_200010986244 [0,0,0,0,0,0|2,0,0]=2 64 B18R0.220 CC(C)OC(=O)CCCCCNCCCCN=[N+]=[N-] 2230a_100000101370_200010986244 [0,0,0,0,0,0|4,0,0]=4 65 B18R0.220 CC(C)OC(=O)CCCCCOCCCCCCBr 34a_100011215345_200010986244 [0,0,0,0,0,0|2,0,0]=2 66 B18R0.220 CC(C)OC(=O)CCCCCOCCCCCCBr 7a_100011215345_200010986244 [0,0,0,0,0,0|2,0,0]=2 67 B18R0.220 CC(C)OC(=O)CCCCCOCCCCCCCl 34a_100000766143_200010986244 [0,0,0,0,0,0|2,0,0]=2 68 B18R0.220 CC(C)OC(=O)CCCCCOCCCCCCCl 7a_100000766143_200010986244 [0,0,0,0,0,0|2,0,0]=2 69 B18R0.220 CC(C)OC(=O)CCCCCOCCCCCCF 34a_100000732779_200010986244 [0,0,0,0,0,0|2,0,0]=2 70 B18R0.220 CC(C)OC(=O)CCCCCOCCCCCCF 7a_100000732779_200010986244 [0,0,0,0,0,0|2,0,0]=2 71 B18R0.220 CC(C)OC(=O)CCCCCOCCCCCCN 34a_100000686447_200010986244 [0,0,0,0,0,0|2,0,0]=2 72 B18R0.220 CC(C)OC(=O)CCCCCSCCCCCC#N 62a_100009813376_200010986244 [0,0,0,0,0,0|2,0,1]=3 73 B18R0.220 CC(C)OC(=O)CCCCCSCCCCCC#N 62a_200010986244_100009813376 [0,0,0,0,0,0|2,0,1]=3 74 B18R0.220 CC(C)OC(=O)CCCCCSCCCCCC=O 62a_100000139337_200010986244 [0,0,0,0,0,0|2,0,1]=3 75 B18R0.220 CC(C)OC(=O)CCCCCSCCCCCC=O 62a_200010986244_100000139337 [0,0,0,0,0,0|2,0,1]=3 76 B18R0.220 CC(C)OC(=O)CCCCCSCCCCCCF 62a_100015922095_200010986244 [0,0,0,0,0,0|2,0,0]=2 77 B18R0.220 CC(C)OC(=O)CCCCCSCCCCCCF 62a_200010986244_100015922095 [0,0,0,0,0,0|2,0,0]=2 78 B18R0.220 CC(C)OC(=O)CCCCCSCCCCCCO 62a_100000766143_200010986244 [0,0,0,0,0,0|2,0,0]=2 79 B18R0.220 CC(C)OC(=O)CCCCCSCCCCCCO 62a_200010986244_100000766143 [0,0,0,0,0,0|2,0,0]=2 80 B18R0.220 CC(C)OC(=O)CCNCCCCCCCCCO 2230a_100000078944_100000760027 [0,0,0,0,0,0|2,0,0]=2 81 B18R0.220 CC(C)OC(=O)CCNCCCOCCOCCO 2230a_100011996194_100000760027 [0,0,0,0,0,0|4,0,0]=4 82 B18R0.220 CC(C)OC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000760027 [0,0,0,0,0,0|2,0,0]=2 83 B18R0.220 CC(C)OC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000760027 [0,0,0,0,0,0|2,0,0]=2 84 B18R0.220 CC(C)OC(=O)CCSCCCCCCCCCO 62a_100000760027_100009813782 [0,0,0,0,0,0|2,0,0]=2 85 B18R0.220 CC(C)OC(=O)CCSCCCCCCCCCO 62a_100009813782_100000760027 [0,0,0,0,0,0|2,0,0]=2 86 B18R0.220 CC(C)OC(=O)CNCCCCCCCCCCO 2230a_100000066964_100011215430 [0,0,0,0,0,0|2,0,0]=2 87 B18R0.220 CC(C)OC(=O)CNCCCCCCCCCCO 34a_100000066964_100011215430 [0,0,0,0,0,0|2,0,0]=2 88 B18R0.220 CC(C)OC(=O)COCCCCCCCCCCBr 34a_100009813290_100011215430 [0,0,0,0,0,0|2,0,0]=2 89 B18R0.220 CC(C)OC(=O)COCCCCCCCCCCBr 7a_100009813290_100011215430 [0,0,0,0,0,0|2,0,0]=2 90 B18R0.220 CC(C)OC(=O)COCCCCCCCCCCCl 34a_200000033068_100011215430 [0,0,0,0,0,0|2,0,0]=2 91 B18R0.220 CC(C)OC(=O)COCCCCCCCCCCCl 7a_200000033068_100011215430 [0,0,0,0,0,0|2,0,0]=2 92 B18R0.220 CC(C)OC(=O)COCCCCCCCCCCN 34a_100000066964_100011215430 [0,0,0,0,0,0|2,0,0]=2 93 B18R0.220 CC(C)OC(=O)CSCCCCCCCCCCO 62a_100009813290_100011215430 [0,0,0,0,0,0|2,0,0]=2 94 B18R0.220 CC(C)OC(=O)CSCCCCCCCCCCO 62a_100011215430_200000033068 [0,0,0,0,0,0|2,0,0]=2 95 B18R0.220 CC(C)OC(=O)OCSCCCCCCCCCO 62a_100000003507_100009813782 [0,0,0,0,0,0|3,0,0]=3 96 B18R0.220 CC(C)OC(=O)OCSCCCCCCCCCO 62a_100009813782_100000003507 [0,0,0,0,0,0|3,0,0]=3 97 B18R0.220 CC/C=C/CCCOCCCCCC(=O)OC(C)C 34a_100016287902_200010986244 [0,0,0,0,0,0|1,0,2]=3 98 B18R0.220 CC/C=C/CCCOCCCCCC(=O)OC(C)C 7a_100016287902_200010986244 [0,0,0,0,0,0|1,0,2]=3 99 B18R0.220 CC/C=C\CCCCCCCNCC(=O)NC(C)C 269862a_100000168517_200025770492 [0,0,0,0,0,0|2,0,2]=4 100 B18R0.220 CCC#CCCCCCCSCCC(=O)NC(C)C 62a_100000737564_200000036426 [0,0,0,0,0,0|2,0,2]=4 101 B18R0.220 CCC#CCCCCCCSCCC(=O)NC(C)C 62a_200000036426_100000737564 [0,0,0,0,0,0|2,0,2]=4 102 B18R0.220 CCC#CCCCCCCSCCC(=O)OC(C)C 62a_100000760027_200000036426 [0,0,0,0,0,0|1,0,2]=3 103 B18R0.220 CCC#CCCCCCCSCCC(=O)OC(C)C 62a_200000036426_100000760027 [0,0,0,0,0,0|1,0,2]=3 104 B18R0.220 CCC#CCCCCCCSCOC(=O)OC(C)C 62a_100000003507_200000036426 [0,0,0,0,0,0|2,0,2]=4 105 B18R0.220 CCC#CCCCCCCSCOC(=O)OC(C)C 62a_200000036426_100000003507 [0,0,0,0,0,0|2,0,2]=4 106 B18R0.220 CCCC#CCCOCCCCCC(=O)OC(C)C 34a_100000042726_200010986244 [0,0,0,0,0,0|1,0,2]=3 107 B18R0.220 CCCC#CCCOCCCCCC(=O)OC(C)C 7a_100000042726_200010986244 [0,0,0,0,0,0|1,0,2]=3 108 B18R0.220 CCCC/C=C/CCCCOCCC(=O)NC(C)C 7a_200020645093_100000737564 [0,0,0,0,0,0|2,0,2]=4 109 B18R0.220 CCCC/C=C/CCCCOCCC(=O)OC(C)C 7a_200020645093_100000760027 [0,0,0,0,0,0|1,0,2]=3 110 B18R0.220 CCCC/C=C/COCCCCCC(=O)OC(C)C 34a_200016272032_200010986244 [0,0,0,0,0,0|1,0,2]=3 111 B18R0.220 CCCC/C=C/COCCCCCC(=O)OC(C)C 7a_200016272032_200010986244 [0,0,0,0,0,0|1,0,2]=3 112 B18R0.220 CCCCC#CCCCCOCCC(=O)NC(C)C 7a_200000066234_100000737564 [0,0,0,0,0,0|2,0,2]=4 113 B18R0.220 CCCCC#CCCCCOCCC(=O)OC(C)C 7a_200000066234_100000760027 [0,0,0,0,0,0|1,0,2]=3 114 B18R0.220 CCCCC#CCOCCCCCC(=O)OC(C)C 34a_200000034558_200010986244 [0,0,0,0,0,0|1,0,2]=3 115 B18R0.220 CCCCC#CCOCCCCCC(=O)OC(C)C 7a_200000034558_200010986244 [0,0,0,0,0,0|1,0,2]=3 116 B18R0.220 CCCCC/C=C\CCCOCCC(=O)NC(C)C 7a_100020655193_100000737564 [0,0,0,0,0,0|2,0,2]=4 117 B18R0.220 CCCCC/C=C\CCCOCCC(=O)OC(C)C 7a_100020655193_100000760027 [0,0,0,0,0,0|1,0,2]=3 118 B18R0.220 CCCCCCC#CCCOCCC(=O)NC(C)C 7a_200000033163_100000737564 [0,0,0,0,0,0|2,0,2]=4 119 B18R0.220 CCCCCCC#CCCOCCC(=O)OC(C)C 7a_200000033163_100000760027 [0,0,0,0,0,0|1,0,2]=3 120 B18R0.220 CCCCCCCC#CCOCCC(=O)NC(C)C 7a_200000061759_100000737564 [0,0,0,0,0,0|2,0,2]=4 121 B18R0.220 CCCCCCCC#CCOCCC(=O)OC(C)C 7a_200000061759_100000760027 [0,0,0,0,0,0|1,0,2]=3 122 B18R0.220 CCCCCCCC/C=C/COCC(=O)NC(C)C 34a_200020667288_100000183996 [0,0,0,0,0,0|2,0,2]=4 123 B18R0.220 CCCCCCCC/C=C/COCC(=O)NC(C)C 7a_200020667288_100000183996 [0,0,0,0,0,0|2,0,2]=4 124 B18R0.220 CCCCCCCC/C=C/COCC(=O)OC(C)C 34a_200020667288_100011215430 [0,0,0,0,0,0|1,0,2]=3 125 B18R0.220 CCCCCCCC/C=C/COCC(=O)OC(C)C 7a_200020667288_100011215430 [0,0,0,0,0,0|1,0,2]=3 126 B18R0.220 CCCCCCCCCCC=NNC(=O)CC(C)C 4a_100000189787_100011218819 [0,0,0,0,0,0|3,0,1]=4 127 B18R0.220 CCCCCCCCCCCCCC(=O)CC(=O)N 1458a_100000756256_100000187820 [0,0,0,0,0,0|3,0,1]=4 128 B18R0.220 CCCCCCCCCCCCCC(=O)CC(=O)N 1458a_100134613110_100000210684 [0,0,0,0,0,0|3,0,1]=4 129 B18R0.220 CCCCCCCCCCCCCC(=O)CC(=O)[O-] 1458a_100000756256_100020667443 [0,0,0,0,0,0|3,0,1]=4 130 B18R0.220 CCCCCCCCCCCCCC(=O)CN(C)C 1458a_100000750896_100000210684 [0,0,0,0,0,0|2,0,0]=2 131 B18R0.220 CCCCCCCCCCCCCC(=O)C[N+](=O)[O-] 1458a_100000756256_100000761209 [0,0,0,0,0,0|4,0,0]=4 132 B18R0.220 CCCCCCCCCCCCCN(C)CC(C)O 2230a_100000227577_100000210684 [0,0,0,0,0,0|4,0,0]=4 133 B18R0.220 CCCCCCCCCCCCCN(C)CC(C)O 269982a_100000227577_100000210684 [0,0,0,0,0,0|4,0,0]=4 134 B18R0.220 CCCCCCCCCCCCCN(C)CC(C)O 270004a_100000227577_200011215488 [0,0,0,0,0,0|4,0,0]=4 135 B18R0.220 CCCCCCCCCCCCNC(=O)C=C(C)C 11a_100000210451_100000211388 [0,0,0,0,0,0|2,0,1]=3 136 B18R0.220 CCCCCCCCCCCCNC(=O)C=C(C)C 1626a_100000210451_100000211388 [0,0,0,0,0,0|2,0,1]=3 137 B18R0.220 CCCCCCCCCCCCNC(=O)C=C(C)C 240690a_100000210451_100000211388 [0,0,0,0,0,0|2,0,1]=3 138 B18R0.220 CCCCCCCCCCCCNC(=O)CN(C)C 11a_100000210451_100000750896 [0,0,0,0,0,0|3,0,0]=3 139 B18R0.220 CCCCCCCCCCCCNC(=O)CN(C)C 240690a_100000210451_100000750896 [0,0,0,0,0,0|3,0,0]=3 140 B18R0.220 CCCCCCCCCCCCNC(=O)CN(C)C 527a_100000210451_100000750896 [0,0,0,0,0,0|3,0,0]=3 141 B18R0.220 CCCCCCCCCCCCNC(=O)C[C@@H](C)O 240690a_100000210451_100011933948 [0,0,0,0,0,0|3,0,0]=3 142 B18R0.220 CCCCCCCCCCCCNC(=O)C[S+](C)C 11a_100000210451_200159257847 [0,0,0,0,0,0|3,0,0]=3 143 B18R0.220 CCCCCCCCCCCCNC(=O)C[S+](C)C 1626a_100000210451_200159257847 [0,0,0,0,0,0|3,0,0]=3 144 B18R0.220 CCCCCCCCCCCCNC(=O)C[S+](C)C 240690a_100000210451_200159257847 [0,0,0,0,0,0|3,0,0]=3 145 B18R0.220 CCCCCCCCCCCCNC(=O)C[S+](C)C 527a_100000210451_200159257847 [0,0,0,0,0,0|3,0,0]=3 146 B18R0.220 CCCCCCCCCCCCNC(=O)NC(C)C 2708a_100000210451_100138425928 [0,0,0,0,0,0|2,0,0]=2 147 B18R0.220 CCCCCCCCCCCCNC(=O)NC(C)C 2708a_100138425928_100000210451 [0,0,0,0,0,0|2,0,0]=2 148 B18R0.220 CCCCCCCCCCCCNC(=O)NC(C)C 273464a_100138425928_100000210451 [0,0,0,0,0,0|2,0,0]=2 149 B18R0.220 CCCCCCCCCCCCNC(=O)NC(C)C 512a_100000210451_100138425928 [0,0,0,0,0,0|2,0,0]=2 150 B18R0.220 CCCCCCCCCCCCNC(=O)NC(C)C 512a_100138425928_100000210451 [0,0,0,0,0,0|2,0,0]=2 151 B18R0.220 CCCCCCCCCCCNCC(=O)NC(C)C 2230a_100000168517_100011215454 [0,0,0,0,0,0|2,0,0]=2 152 B18R0.220 CCCCCCCCCCCNCC(=O)NC(C)C 2230a_200011215754_100000183996 [0,0,0,0,0,0|2,0,0]=2 153 B18R0.220 CCCCCCCCCCCNCC(=O)NC(C)C 34a_200011215754_100000183996 [0,0,0,0,0,0|2,0,0]=2 154 B18R0.220 CCCCCCCCCCCNCC(=O)OC(C)C 2230a_200011215754_100011215430 [0,0,0,0,0,0|1,0,0]=1 155 B18R0.220 CCCCCCCCCCCNCC(=O)OC(C)C 34a_200011215754_100011215430 [0,0,0,0,0,0|1,0,0]=1 156 B18R0.220 CCCCCCCCCCCOCC(=O)NC(=O)C 7a_100000210809_100000183797 [0,0,0,0,0,0|3,0,1]=4 157 B18R0.220 CCCCCCCCCCCOCC(=O)NC(C)C 34a_100000210809_100000183996 [0,0,0,0,0,0|2,0,0]=2 158 B18R0.220 CCCCCCCCCCCOCC(=O)NC(C)C 7a_100000210809_100000183996 [0,0,0,0,0,0|2,0,0]=2 159 B18R0.220 CCCCCCCCCCCOCC(=O)OC(C)C 34a_100000210809_100011215430 [0,0,0,0,0,0|1,0,0]=1 160 B18R0.220 CCCCCCCCCCCOCC(=O)OC(C)C 7a_100000210809_100011215430 [0,0,0,0,0,0|1,0,0]=1 161 B18R0.220 CCCCCCCCCCCOC[C@@H](N)CC(C)C 34a_100011830311_100011215454 [0,0,0,0,0,0|3,0,1]=4 162 B18R0.220 CCCCCCCCCCCSCC(=O)NC(C)C 62a_100000183996_100011215454 [0,0,0,0,0,0|2,0,0]=2 163 B18R0.220 CCCCCCCCCCNCCC(=O)NC(C)C 2230a_100000684558_100000737564 [0,0,0,0,0,0|2,0,0]=2 164 B18R0.220 CCCCCCCCCCNCCC(=O)OC(C)C 2230a_100000684558_100000760027 [0,0,0,0,0,0|1,0,0]=1 165 B18R0.220 CCCCCCCCCCOCCC(=O)NC(C)C 7a_100000210711_100000737564 [0,0,0,0,0,0|2,0,0]=2 166 B18R0.220 CCCCCCCCCCOCCC(=O)OC(C)C 7a_100000210711_100000760027 [0,0,0,0,0,0|1,0,0]=1 167 B18R0.220 CCCCCCCCCCOCC[C@@H](N)CC(C)C 34a_100161151251_100000210320 [0,0,0,0,0,0|3,0,1]=4 168 B18R0.220 CCCCCCCCCCSCCC(=O)NC(C)C 62a_100000737564_100000210320 [0,0,0,0,0,0|2,0,0]=2 169 B18R0.220 CCCCCCCNCCCCCC(=O)OC(C)C 2230a_100000229938_200010986244 [0,0,0,0,0,0|1,0,0]=1 170 B18R0.220 CCCCCCCOCCCCCC(=O)OC(C)C 34a_100000210272_200010986244 [0,0,0,0,0,0|1,0,0]=1 171 B18R0.220 CCCCCCCOCCCCCC(=O)OC(C)C 7a_100000210272_200010986244 [0,0,0,0,0,0|1,0,0]=1 172 B18R0.220 CCCCOCCOCCCCCC(=O)OC(C)C 34a_100000210238_200010986244 [0,0,0,0,0,0|2,0,0]=2 173 B18R0.220 CCCCOCCOCCCCCC(=O)OC(C)C 7a_100000210238_200010986244 [0,0,0,0,0,0|2,0,0]=2 174 B18R0.220 CCCCOCCOCCOCCC(=O)NC(C)C 7a_100011215186_100000737564 [0,0,0,0,0,0|4,0,0]=4 175 B18R0.220 CCCCOCCOCCOCCC(=O)OC(C)C 7a_100011215186_100000760027 [0,0,0,0,0,0|3,0,0]=3 176 B18R0.220 CCCCOCCSCCCCCC(=O)OC(C)C 62a_100000743108_200010986244 [0,0,0,0,0,0|2,0,0]=2 177 B18R0.220 CCCCOCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000743108 [0,0,0,0,0,0|2,0,0]=2 178 B18R0.220 CCCCSCCNCCCCCC(=O)OC(C)C 2230a_100025743550_200010986244 [0,0,0,0,0,0|2,0,0]=2 179 B18R0.220 CCCCSCCOCCCCCC(=O)OC(C)C 34a_200000230436_200010986244 [0,0,0,0,0,0|2,0,0]=2 180 B18R0.220 CCCCSCCOCCCCCC(=O)OC(C)C 7a_200000230436_200010986244 [0,0,0,0,0,0|2,0,0]=2 181 B18R0.220 CCCOCCCNCCCCCC(=O)OC(C)C 2230a_100011217757_200010986244 [0,0,0,0,0,0|2,0,0]=2 182 B18R0.220 CCCOCCCNCCCCCC(=O)OC(C)C 34a_100011217757_200010986244 [0,0,0,0,0,0|2,0,0]=2 183 B18R0.220 CCOCCOCCOCCNCC(=O)OC(C)C 2230a_100012282185_100011215430 [0,0,0,0,0,0|4,0,0]=4 184 B18R0.220 CCOCCOCCOCCNCC(=O)OC(C)C 34a_100012282185_100011215430 [0,0,0,0,0,0|4,0,0]=4 185 B18R0.220 CCOCCOCCOCCOCC(=O)OC(C)C 34a_100000033264_100011215430 [0,0,0,0,0,0|4,0,0]=4 186 B18R0.220 CCOCCOCCOCCOCC(=O)OC(C)C 7a_100000033264_100011215430 [0,0,0,0,0,0|4,0,0]=4 187 B18R0.220 CN(C)CC(=O)CCCCCCCCCCCCO 1458a_100000750896_100009813331 [0,0,0,0,0,0|3,0,0]=3 188 B18R0.220 CN(C)CC(=O)CCCCCCOCCCCCO 1458a_100000750896_200132310570 [0,0,0,0,0,0|4,0,0]=4 189 B18R0.220 CNCCCCCOCCCCCC(=O)OC(C)C 34a_100000722520_200010986244 [0,0,0,0,0,0|2,0,0]=2 190 B18R0.220 CNCCOCCOCCCCCC(=O)OC(C)C 34a_100000228057_200010986244 [0,0,0,0,0,0|3,0,0]=3 191 B18R0.220 COCCCCCNCCCCCC(=O)OC(C)C 2230a_100000747528_200010986244 [0,0,0,0,0,0|2,0,0]=2 192 B18R0.220 COCCCCCNCCCCCC(=O)OC(C)C 34a_100000747528_200010986244 [0,0,0,0,0,0|2,0,0]=2 193 B18R0.220 COCCOCCNCCCCCC(=O)OC(C)C 2230a_100000745349_200010986244 [0,0,0,0,0,0|3,0,0]=3 194 B18R0.220 COCCOCCNCCCCCC(=O)OC(C)C 34a_100000745349_200010986244 [0,0,0,0,0,0|3,0,0]=3 195 B18R0.220 COCCOCCOCCCCCC(=O)OC(C)C 34a_100011215163_200010986244 [0,0,0,0,0,0|3,0,0]=3 196 B18R0.220 COCCOCCOCCCCCC(=O)OC(C)C 7a_100011215163_200010986244 [0,0,0,0,0,0|3,0,0]=3 197 B18R0.220 COCCOCCOCCNCCC(=O)OC(C)C 2230a_100012028300_100000760027 [0,0,0,0,0,0|4,0,0]=4 198 B18R0.220 COCCOCCOCCOCCC(=O)OC(C)C 7a_100000688194_100000760027 [0,0,0,0,0,0|4,0,0]=4 199 B18R0.220 COCCOCCOCCSCCC(=O)OC(C)C 62a_100000760027_100013367474 [0,0,0,0,0,0|4,0,0]=4 200 B18R0.220 COCCOCCOCCSCCC(=O)OC(C)C 62a_100013367474_100000760027 [0,0,0,0,0,0|4,0,0]=4 201 B18R0.220 COCCOCCSCCCCCC(=O)OC(C)C 62a_100000695917_200010986244 [0,0,0,0,0,0|3,0,0]=3 202 B18R0.220 COCCOCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000695917 [0,0,0,0,0,0|3,0,0]=3 203 B18R0.220 C[C@@H](O)CC(=O)CCCCCCCCCCCCO 1458a_100011933948_100009813331 [0,0,0,0,0,0|3,0,0]=3 204 B18R0.220 C[C@@H](O)CC(=O)CCCCCCOCCCCCO 1458a_100011933948_200132310570 [0,0,0,0,0,0|4,0,0]=4 205 B18R0.220 C[S+](C)CC(=O)CCCCCCCCCCCCO 1458a_200159257847_100009813331 [0,0,0,0,0,0|3,0,0]=3 206 B18R0.220 C[S+](C)CC(=O)CCCCCCOCCCCCO 1458a_200159257847_200132310570 [0,0,0,0,0,0|4,0,0]=4 207 B17R0.43 CC(C)CNCCCCCCCCCCCCO 2230a_100000066677_100000210760 [1,0,0,0,0,0|3,0,0]=4 208 B17R0.43 CC(C)CNCCCCCCCCCCCCO 2230a_100000210953_100009813331 [1,0,0,0,0,0|3,0,0]=4 209 B17R0.43 CC(C)CNCCCCCCCCCCCCO 270004a_100000066677_100000210432 [1,0,0,0,0,0|3,0,0]=4 210 B17R0.43 CC(C)CNCCCCCCCCCCCCO 34a_100000066677_100000210624 [1,0,0,0,0,0|3,0,0]=4 211 B17R0.43 CC(C)CNCCCCCCCCCCCCO 34a_100000210953_100009813331 [1,0,0,0,0,0|3,0,0]=4 212 B17R0.43 CC(C)COCCCCCCCCCCCCN 34a_100000066677_100000210624 [1,0,0,0,0,0|3,0,0]=4 213 B17R0.43 CC(C)COCCCCCCCCCCCCO 34a_100000210257_100009813331 [1,0,0,0,0,0|3,0,0]=4 214 B17R0.43 CC(C)NCCCCCCCCCCCCCO 2230a_100138425928_100009812470 [1,0,0,0,0,0|2,0,1]=4 215 B17R0.43 CC(C)NCCCCCCCCCCCCCO 34a_100138425928_100009812470 [1,0,0,0,0,0|2,0,1]=4 216 B17R0.43 CC(C)OCCCCCCCCCCCCCO 34a_100000212225_100009812470 [1,0,0,0,0,0|1,0,1]=3 217 B17R0.43 CC(C)OCCCNCCCCCCCCCO 2230a_100000737246_100009813782 [1,0,0,0,0,0|2,0,1]=4 218 B17R0.43 CC(C)OCCCNCCCCCCCCCO 34a_100000737246_100009813782 [1,0,0,0,0,0|2,0,1]=4 219 B17R0.43 CC(C)OCCNCCCCCCCCCCO 2230a_100000066964_100000211751 [1,0,0,0,0,0|2,0,1]=4 220 B17R0.43 CC(C)OCCNCCCCCCCCCCO 2230a_100000701111_100009813290 [1,0,0,0,0,0|2,0,1]=4 221 B17R0.43 CC(C)OCCNCCCCCCCCCCO 34a_100000066964_100000211751 [1,0,0,0,0,0|2,0,1]=4 222 B17R0.43 CC(C)OCCNCCCCCCCCCCO 34a_100000701111_100009813290 [1,0,0,0,0,0|2,0,1]=4 223 B17R0.43 CC(C)OCCOCCCCCCCCCCBr 34a_100009813290_100000211751 [1,0,0,0,0,0|2,0,1]=4 224 B17R0.43 CC(C)OCCOCCCCCCCCCCBr 7a_100009813290_100000211751 [1,0,0,0,0,0|2,0,1]=4 225 B17R0.43 CC(C)OCCOCCCCCCCCCCCl 34a_200000033068_100000211751 [1,0,0,0,0,0|2,0,1]=4 226 B17R0.43 CC(C)OCCOCCCCCCCCCCCl 7a_200000033068_100000211751 [1,0,0,0,0,0|2,0,1]=4 227 B17R0.43 CC(C)OCCOCCCCCCCCCCN 34a_100000066964_100000211751 [1,0,0,0,0,0|2,0,1]=4 228 B17R0.43 CC(C)OCCOCCCCCCCCCCO 34a_100000211219_100009813290 [1,0,0,0,0,0|2,0,1]=4 229 B17R0.43 CC(C)OCCOCCCCCCCCCCO 7a_100000211219_100009813290 [1,0,0,0,0,0|2,0,1]=4 230 B17R0.43 CC(C)OCCSCCCCCCCCCCO 62a_100000211751_200000033068 [1,0,0,0,0,0|2,0,1]=4 231 B17R0.43 CC(C)OCCSCCCCCCCCCCO 62a_100009813290_100000211751 [1,0,0,0,0,0|2,0,1]=4 232 B17R0.43 CC(C)OCSCCCCCCCCCCCO 62a_100009812471_100000709892 [1,0,0,0,0,0|2,0,1]=4 233 B17R0.43 CCCCCCCCCCCCCNCC(C)O 2230a_100000210904_100000210684 [1,0,0,0,0,0|3,0,0]=4 234 B17R0.43 CCCCCCCCCCCCCNCC(C)O 2230a_100011215765_100011218427 [1,0,0,0,0,0|3,0,0]=4 235 B17R0.43 CCCCCCCCCCCCCNCC(C)O 270004a_100000210904_200011215488 [1,0,0,0,0,0|3,0,0]=4 236 B17R0.43 CCCCCCCCCCCCCNCC(C)O 34a_100000210904_100000210684 [1,0,0,0,0,0|3,0,0]=4 237 B17R0.43 CCCCCCCCCCCCCNCC(C)O 34a_100011215765_100011218427 [1,0,0,0,0,0|3,0,0]=4 238 B17R0.43 CCCCCCCCCCCCCNC[C@@H](C)O 2230a_100011215765_100009817552 [1,0,0,0,0,0|3,0,0]=4 239 B17R0.43 CCCCCCCCCCCCCNC[C@@H](C)O 34a_100011215765_100009817552 [1,0,0,0,0,0|3,0,0]=4 240 B17R0.43 CCCCCCCCCCCCCOCC(C)O 34a_100000185773_100011218427 [1,0,0,0,0,0|3,0,0]=4 241 B17R0.43 CCCCCCCCCCCCCOCC(C)O 7a_100000185773_100011218427 [1,0,0,0,0,0|3,0,0]=4 242 B17R0.43 CCCCCCCCCCCCCOC[C@@H](C)N 34a_100000737577_100000210684 [1,0,0,0,0,0|3,0,0]=4 243 B17R0.43 CCCCCCCCCCCCCOC[C@@H](C)O 34a_100000185773_100009817552 [1,0,0,0,0,0|3,0,0]=4 244 B17R0.43 CCCCCCCCCCCCCOC[C@@H](C)O 7a_100000185773_100009817552 [1,0,0,0,0,0|3,0,0]=4 245 B17R0.43 CCCCCCCCCCCCNCOC(C)C 2230a_100000210451_100000709892 [1,0,0,0,0,0|1,0,1]=3 246 B17R0.43 CCCCCCCCCCCCNCOC(C)C 34a_100000210451_100000709892 [1,0,0,0,0,0|1,0,1]=3 247 B17R0.43 CCCCCCCCCCCNCCOC(C)C 2230a_100000701111_100011215454 [1,0,0,0,0,0|1,0,1]=3 248 B17R0.43 CCCCCCCCCCCNCCOC(C)C 2230a_200011215754_100000211751 [1,0,0,0,0,0|1,0,1]=3 249 B17R0.43 CCCCCCCCCCCNCCOC(C)C 34a_100000701111_100011215454 [1,0,0,0,0,0|1,0,1]=3 250 B17R0.43 CCCCCCCCCCCNCCOC(C)C 34a_200011215754_100000211751 [1,0,0,0,0,0|1,0,1]=3 251 B17R0.43 CCCCCCCCCCCOCCNC(C)C 34a_100000224655_100011215454 [1,0,0,0,0,0|2,0,1]=4 252 B17R0.43 CCCCCCCCCCCOCCOC(C)C 34a_100000210809_100000211751 [1,0,0,0,0,0|1,0,1]=3 253 B17R0.43 CCCCCCCCCCCOCCOC(C)C 34a_100000211219_100011215454 [1,0,0,0,0,0|1,0,1]=3 254 B17R0.43 CCCCCCCCCCCOCCOC(C)C 34a_100010166600_100000210206 [1,0,0,0,0,0|1,0,1]=3 255 B17R0.43 CCCCCCCCCCCOCCOC(C)C 7a_100000210809_100000211751 [1,0,0,0,0,0|1,0,1]=3 256 B17R0.43 CCCCCCCCCCCOCCOC(C)C 7a_100000211219_100011215454 [1,0,0,0,0,0|1,0,1]=3 257 B17R0.43 CCCCCCCCCCCOCCOC(C)C 7a_100010166600_100000210206 [1,0,0,0,0,0|1,0,1]=3 258 B17R0.43 CCCCCCCCCCNCCCOC(C)C 2230a_100000737246_100000210320 [1,0,0,0,0,0|1,0,1]=3 259 B17R0.43 CCCCCCCCCCNCCCOC(C)C 34a_100000737246_100000210320 [1,0,0,0,0,0|1,0,1]=3 260 B17R0.43 CCCCCCCCCCOCCCNC(C)C 34a_100000182298_100000210320 [1,0,0,0,0,0|2,0,1]=4 261 B17R0.43 CCCCCCCCCCOCCNCC(C)C 34a_100015185251_100000210320 [1,0,0,0,0,0|3,0,0]=4 262 B17R0.43 CCCCCCCCCCOCCOCC(C)C 34a_100000703358_100000210320 [1,0,0,0,0,0|3,0,0]=4 263 B17R0.43 CCCCCCCCCCOCCOCC(C)C 7a_100000703358_100000210320 [1,0,0,0,0,0|3,0,0]=4 264 B17R0.43 CCCCCCCCCNCCCOCC(C)C 2230a_100000205972_100011214924 [1,0,0,0,0,0|3,0,0]=4 265 B17R0.43 CCCCCCCCCNCCCOCC(C)C 34a_100000205972_100011214924 [1,0,0,0,0,0|3,0,0]=4 266 B17R0.43 CCCCCCCCCOCCCCNC(C)C 34a_100011521146_100011214924 [1,0,0,0,0,0|2,0,1]=4 267 B17R0.43 CCCCCCCCOCCCCCNC(C)C 34a_100011629493_100000210759 [1,0,0,0,0,0|2,0,1]=4 268 B17R0.43 CCOCCCCCCCCCOCOC(C)C 34a_100009875440_100000709892 [1,0,0,0,0,0|2,0,1]=4 269 B17R0.116 C#CCCCCCCCCOCC(=O)OC(C)C 34a_100000065265_100011215430 [1,0,0,0,0,0|1,0,2]=4 270 B17R0.116 C#CCCCCCCCCOCC(=O)OC(C)C 7a_100000065265_100011215430 [1,0,0,0,0,0|1,0,2]=4 271 B17R0.116 C#CCCCCCCCOCCC(=O)OC(C)C 7a_100000054614_100000760027 [1,0,0,0,0,0|1,0,2]=4 272 B17R0.116 C#CCCCCCCCSCCC(=O)OC(C)C 62a_100000760027_100153394163 [1,0,0,0,0,0|1,0,2]=4 273 B17R0.116 C#CCCCCCCCSCCC(=O)OC(C)C 62a_100153394163_100000760027 [1,0,0,0,0,0|1,0,2]=4 274 B17R0.116 C#CCCCCNCCCCCC(=O)OC(C)C 2230a_100000706060_200010986244 [1,0,0,0,0,0|1,0,2]=4 275 B17R0.116 C#CCCCCNCCCCCC(=O)OC(C)C 34a_100000706060_200010986244 [1,0,0,0,0,0|1,0,2]=4 276 B17R0.116 C#CCCCCOCCCCCC(=O)OC(C)C 34a_100000766709_200010986244 [1,0,0,0,0,0|1,0,2]=4 277 B17R0.116 C#CCCCCOCCCCCC(=O)OC(C)C 7a_100000766709_200010986244 [1,0,0,0,0,0|1,0,2]=4 278 B17R0.116 C#CCCCCSCCCCCC(=O)OC(C)C 62a_100010269958_200010986244 [1,0,0,0,0,0|1,0,2]=4 279 B17R0.116 C#CCCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100010269958 [1,0,0,0,0,0|1,0,2]=4 280 B17R0.116 C=CCCCCCCCCOCC(=O)OC(C)C 34a_100011215194_100011215430 [1,0,0,0,0,0|1,0,2]=4 281 B17R0.116 C=CCCCCCCCCOCC(=O)OC(C)C 7a_100011215194_100011215430 [1,0,0,0,0,0|1,0,2]=4 282 B17R0.116 C=CCCCCCCCCSCC(=O)OC(C)C 62a_100011215430_100011933949 [1,0,0,0,0,0|1,0,2]=4 283 B17R0.116 C=CCCCCCCCCSCC(=O)OC(C)C 62a_100011933949_100011215430 [1,0,0,0,0,0|1,0,2]=4 284 B17R0.116 C=CCCCCCCCOCCC(=O)OC(C)C 7a_100000730831_100000760027 [1,0,0,0,0,0|1,0,2]=4 285 B17R0.116 C=CCCCCCCCSCCC(=O)OC(C)C 62a_100000760027_100012355270 [1,0,0,0,0,0|1,0,2]=4 286 B17R0.116 C=CCCCCCCCSCCC(=O)OC(C)C 62a_100012355270_100000760027 [1,0,0,0,0,0|1,0,2]=4 287 B17R0.116 C=CCCCCNCCCCCC(=O)OC(C)C 2230a_100000703577_200010986244 [1,0,0,0,0,0|1,0,2]=4 288 B17R0.116 C=CCCCCNCCCCCC(=O)OC(C)C 34a_100000703577_200010986244 [1,0,0,0,0,0|1,0,2]=4 289 B17R0.116 C=CCCCCOCCCCCC(=O)OC(C)C 34a_100000766645_200010986244 [1,0,0,0,0,0|1,0,2]=4 290 B17R0.116 C=CCCCCOCCCCCC(=O)OC(C)C 7a_100000766645_200010986244 [1,0,0,0,0,0|1,0,2]=4 291 B17R0.116 C=CCCCCSCCCCCC(=O)OC(C)C 62a_100011215482_200010986244 [1,0,0,0,0,0|1,0,2]=4 292 B17R0.116 C=CCCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100011215482 [1,0,0,0,0,0|1,0,2]=4 293 B17R0.116 CC(=CC(=O)CCCCCCCCCCCO)C 1458a_100000211388_100009812471 [1,0,0,0,0,0|2,0,1]=4 294 B17R0.116 CC(C)CC(=O)CCCCCCCCCCCO 1458a_100000210554_100009812471 [1,0,0,0,0,0|2,0,0]=3 295 B17R0.116 CC(C)CC(=O)NCCCCCCCCCCO 240690a_100000066964_100000210554 [1,0,0,0,0,0|3,0,0]=4 296 B17R0.116 CC(C)NC(=O)CCCCCCCCCCCO 240690a_100138425928_100000037981 [1,0,0,0,0,0|2,0,0]=3 297 B17R0.116 CC(C)NC(=O)CCNCCCCCCCCO 2230a_102515433106_100000737564 [1,0,0,0,0,0|3,0,0]=4 298 B17R0.116 CC(C)NC(=O)CCOCCCCCCCCBr 7a_100009813846_100000737564 [1,0,0,0,0,0|3,0,0]=4 299 B17R0.116 CC(C)NC(=O)CCOCCCCCCCCCl 7a_100000033203_100000737564 [1,0,0,0,0,0|3,0,0]=4 300 B17R0.116 CC(C)NC(=O)CCSCCCCCCCCO 62a_100000033203_100000737564 [1,0,0,0,0,0|3,0,0]=4 301 B17R0.116 CC(C)NC(=O)CCSCCCCCCCCO 62a_100000737564_100000033203 [1,0,0,0,0,0|3,0,0]=4 302 B17R0.116 CC(C)NC(=O)CNCCCCCCCCCO 2230a_100000078944_100000183996 [1,0,0,0,0,0|3,0,0]=4 303 B17R0.116 CC(C)NC(=O)CNCCCCCCCCCO 2230a_100000168517_100009813782 [1,0,0,0,0,0|3,0,0]=4 304 B17R0.116 CC(C)NC(=O)CNCCCCCCCCCO 34a_100000078944_100000183996 [1,0,0,0,0,0|3,0,0]=4 305 B17R0.116 CC(C)NC(=O)COCCCCCCCCCBr 34a_100009813782_100000183996 [1,0,0,0,0,0|3,0,0]=4 306 B17R0.116 CC(C)NC(=O)COCCCCCCCCCBr 7a_100009813782_100000183996 [1,0,0,0,0,0|3,0,0]=4 307 B17R0.116 CC(C)NC(=O)COCCCCCCCCCCl 34a_100009868337_100000183996 [1,0,0,0,0,0|3,0,0]=4 308 B17R0.116 CC(C)NC(=O)COCCCCCCCCCCl 7a_100009868337_100000183996 [1,0,0,0,0,0|3,0,0]=4 309 B17R0.116 CC(C)NC(=O)COCCCCCCCCCN 34a_100000078944_100000183996 [1,0,0,0,0,0|3,0,0]=4 310 B17R0.116 CC(C)NC(=O)CSCCCCCCCCCO 62a_100000183996_100009813782 [1,0,0,0,0,0|3,0,0]=4 311 B17R0.116 CC(C)NC(=O)CSCCCCCCCCCO 62a_100009813782_100000183996 [1,0,0,0,0,0|3,0,0]=4 312 B17R0.116 CC(C)NC(=O)NCCCCCCCCCCO 2708a_100000066964_100138425928 [1,0,0,0,0,0|3,0,0]=4 313 B17R0.116 CC(C)NC(=O)NCCCCCCCCCCO 2708a_100138425928_100000066964 [1,0,0,0,0,0|3,0,0]=4 314 B17R0.116 CC(C)NC(=O)NCCCCCCCCCCO 273464a_100138425928_100000066964 [1,0,0,0,0,0|3,0,0]=4 315 B17R0.116 CC(C)NC(=O)NCCCCCCCCCCO 512a_100000066964_100138425928 [1,0,0,0,0,0|3,0,0]=4 316 B17R0.116 CC(C)NC(=O)NCCCCCCCCCCO 512a_100138425928_100000066964 [1,0,0,0,0,0|3,0,0]=4 317 B17R0.116 CC(C)OC(=O)CCCCCNCCCCCO 2230a_100000762737_200010986244 [1,0,0,0,0,0|2,0,0]=3 318 B17R0.116 CC(C)OC(=O)CCCCCNCCCCCO 34a_100000762737_200010986244 [1,0,0,0,0,0|2,0,0]=3 319 B17R0.116 CC(C)OC(=O)CCCCCNCCOCCO 2230a_100000211614_200010986244 [1,0,0,0,0,0|3,0,0]=4 320 B17R0.116 CC(C)OC(=O)CCCCCNCCOCCO 34a_100000211614_200010986244 [1,0,0,0,0,0|3,0,0]=4 321 B17R0.116 CC(C)OC(=O)CCCCCNCCSCCO 2230a_100011219999_200010986244 [1,0,0,0,0,0|3,0,0]=4 322 B17R0.116 CC(C)OC(=O)CCCCCOCCCCCBr 34a_100000746331_200010986244 [1,0,0,0,0,0|2,0,0]=3 323 B17R0.116 CC(C)OC(=O)CCCCCOCCCCCBr 7a_100000746331_200010986244 [1,0,0,0,0,0|2,0,0]=3 324 B17R0.116 CC(C)OC(=O)CCCCCOCCCCCCl 34a_100000746330_200010986244 [1,0,0,0,0,0|2,0,0]=3 325 B17R0.116 CC(C)OC(=O)CCCCCOCCCCCCl 7a_100000746330_200010986244 [1,0,0,0,0,0|2,0,0]=3 326 B17R0.116 CC(C)OC(=O)CCCCCOCCCCCI 34a_200012148887_200010986244 [1,0,0,0,0,0|2,0,0]=3 327 B17R0.116 CC(C)OC(=O)CCCCCOCCCCCI 7a_200012148887_200010986244 [1,0,0,0,0,0|2,0,0]=3 328 B17R0.116 CC(C)OC(=O)CCCCCOCCCCCN 34a_100000762737_200010986244 [1,0,0,0,0,0|2,0,0]=3 329 B17R0.116 CC(C)OC(=O)CCCCCOCCOCCBr 34a_100000692535_200010986244 [1,0,0,0,0,0|3,0,0]=4 330 B17R0.116 CC(C)OC(=O)CCCCCOCCOCCBr 7a_100000692535_200010986244 [1,0,0,0,0,0|3,0,0]=4 331 B17R0.116 CC(C)OC(=O)CCCCCOCCOCCCl 34a_100011215305_200010986244 [1,0,0,0,0,0|3,0,0]=4 332 B17R0.116 CC(C)OC(=O)CCCCCOCCOCCCl 7a_100011215305_200010986244 [1,0,0,0,0,0|3,0,0]=4 333 B17R0.116 CC(C)OC(=O)CCCCCOCCOCCF 34a_200015357709_200010986244 [1,0,0,0,0,0|3,0,0]=4 334 B17R0.116 CC(C)OC(=O)CCCCCOCCOCCF 7a_200015357709_200010986244 [1,0,0,0,0,0|3,0,0]=4 335 B17R0.116 CC(C)OC(=O)CCCCCOCCOCCI 34a_100012149058_200010986244 [1,0,0,0,0,0|3,0,0]=4 336 B17R0.116 CC(C)OC(=O)CCCCCOCCOCCI 7a_100012149058_200010986244 [1,0,0,0,0,0|3,0,0]=4 337 B17R0.116 CC(C)OC(=O)CCCCCOCCOCCN 34a_100000211614_200010986244 [1,0,0,0,0,0|3,0,0]=4 338 B17R0.116 CC(C)OC(=O)CCCCCSCCCCC#N 62a_100011219923_200010986244 [1,0,0,0,0,0|2,0,1]=4 339 B17R0.116 CC(C)OC(=O)CCCCCSCCCCC#N 62a_200010986244_100000211819 [1,0,0,0,0,0|2,0,1]=4 340 B17R0.116 CC(C)OC(=O)CCCCCSCCCCC=O 62a_100000139335_200010986244 [1,0,0,0,0,0|2,0,1]=4 341 B17R0.116 CC(C)OC(=O)CCCCCSCCCCC=O 62a_200010986244_100000139335 [1,0,0,0,0,0|2,0,1]=4 342 B17R0.116 CC(C)OC(=O)CCCCCSCCCCCF 62a_100000729378_200010986244 [1,0,0,0,0,0|2,0,0]=3 343 B17R0.116 CC(C)OC(=O)CCCCCSCCCCCF 62a_200010986244_100000729378 [1,0,0,0,0,0|2,0,0]=3 344 B17R0.116 CC(C)OC(=O)CCCCCSCCCCCO 62a_100000746330_200010986244 [1,0,0,0,0,0|2,0,0]=3 345 B17R0.116 CC(C)OC(=O)CCCCCSCCCCCO 62a_200010986244_100000746330 [1,0,0,0,0,0|2,0,0]=3 346 B17R0.116 CC(C)OC(=O)CCCCCSCCOCCO 62a_100011215305_200010986244 [1,0,0,0,0,0|3,0,0]=4 347 B17R0.116 CC(C)OC(=O)CCCCCSCCOCCO 62a_200010986244_100011215305 [1,0,0,0,0,0|3,0,0]=4 348 B17R0.116 CC(C)OC(=O)CCNCCCCCCCCO 2230a_102515433106_100000760027 [1,0,0,0,0,0|2,0,0]=3 349 B17R0.116 CC(C)OC(=O)CCOCCCCCCCCBr 7a_100009813846_100000760027 [1,0,0,0,0,0|2,0,0]=3 350 B17R0.116 CC(C)OC(=O)CCOCCCCCCCCCl 7a_100000033203_100000760027 [1,0,0,0,0,0|2,0,0]=3 351 B17R0.116 CC(C)OC(=O)CCSCCCCCCCCO 62a_100000033203_100000760027 [1,0,0,0,0,0|2,0,0]=3 352 B17R0.116 CC(C)OC(=O)CCSCCCCCCCCO 62a_100000760027_100000033203 [1,0,0,0,0,0|2,0,0]=3 353 B17R0.116 CC(C)OC(=O)CNCCCCCCCCCO 2230a_100000078944_100011215430 [1,0,0,0,0,0|2,0,0]=3 354 B17R0.116 CC(C)OC(=O)CNCCCCCCCCCO 34a_100000078944_100011215430 [1,0,0,0,0,0|2,0,0]=3 355 B17R0.116 CC(C)OC(=O)COCCCCCCCCCBr 34a_100009813782_100011215430 [1,0,0,0,0,0|2,0,0]=3 356 B17R0.116 CC(C)OC(=O)COCCCCCCCCCBr 7a_100009813782_100011215430 [1,0,0,0,0,0|2,0,0]=3 357 B17R0.116 CC(C)OC(=O)COCCCCCCCCCCl 34a_100009868337_100011215430 [1,0,0,0,0,0|2,0,0]=3 358 B17R0.116 CC(C)OC(=O)COCCCCCCCCCCl 7a_100009868337_100011215430 [1,0,0,0,0,0|2,0,0]=3 359 B17R0.116 CC(C)OC(=O)COCCCCCCCCCN 34a_100000078944_100011215430 [1,0,0,0,0,0|2,0,0]=3 360 B17R0.116 CC(C)OC(=O)CSCCCCCCCCCO 62a_100009813782_100011215430 [1,0,0,0,0,0|2,0,0]=3 361 B17R0.116 CC(C)OC(=O)CSCCCCCCCCCO 62a_100011215430_100009813782 [1,0,0,0,0,0|2,0,0]=3 362 B17R0.116 CC(C)OC(=O)OCSCCCCCCCCO 62a_100000003507_100000033203 [1,0,0,0,0,0|3,0,0]=4 363 B17R0.116 CC(C)OC(=O)OCSCCCCCCCCO 62a_100000033203_100000003507 [1,0,0,0,0,0|3,0,0]=4 364 B17R0.116 CC/C=C\CCCCCOCCC(=O)OC(C)C 7a_100016268722_100000760027 [1,0,0,0,0,0|1,0,2]=4 365 B17R0.116 CC/C=C\CCOCCCCCC(=O)OC(C)C 34a_100016288707_200010986244 [1,0,0,0,0,0|1,0,2]=4 366 B17R0.116 CC/C=C\CCOCCCCCC(=O)OC(C)C 7a_100016288707_200010986244 [1,0,0,0,0,0|1,0,2]=4 367 B17R0.116 CC/C=C\CCSCCCCCC(=O)OC(C)C 62a_100015370543_200010986244 [1,0,0,0,0,0|1,0,2]=4 368 B17R0.116 CC/C=C\CCSCCCCCC(=O)OC(C)C 62a_200010986244_100015370543 [1,0,0,0,0,0|1,0,2]=4 369 B17R0.116 CC=CCCCOCCCCCC(=O)OC(C)C 34a_100020645299_200010986244 [1,0,0,0,0,0|1,0,2]=4 370 B17R0.116 CCC#CCCCCCCSCC(=O)OC(C)C 62a_100011215430_200000036426 [1,0,0,0,0,0|1,0,2]=4 371 B17R0.116 CCC#CCCCCCCSCC(=O)OC(C)C 62a_200000036426_100011215430 [1,0,0,0,0,0|1,0,2]=4 372 B17R0.116 CCC#CCCOCCCCCC(=O)OC(C)C 34a_100000036655_200010986244 [1,0,0,0,0,0|1,0,2]=4 373 B17R0.116 CCC#CCCOCCCCCC(=O)OC(C)C 7a_100000036655_200010986244 [1,0,0,0,0,0|1,0,2]=4 374 B17R0.116 CCC/C=C/COCCCCCC(=O)OC(C)C 34a_100016278788_200010986244 [1,0,0,0,0,0|1,0,2]=4 375 B17R0.116 CCC/C=C/COCCCCCC(=O)OC(C)C 7a_100016278788_200010986244 [1,0,0,0,0,0|1,0,2]=4 376 B17R0.116 CCCC#CCOCCCCCC(=O)OC(C)C 34a_100000034806_200010986244 [1,0,0,0,0,0|1,0,2]=4 377 B17R0.116 CCCC#CCOCCCCCC(=O)OC(C)C 7a_100000034806_200010986244 [1,0,0,0,0,0|1,0,2]=4 378 B17R0.116 CCCC/C=C/CCCCOCC(=O)OC(C)C 34a_200020645093_100011215430 [1,0,0,0,0,0|1,0,2]=4 379 B17R0.116 CCCC/C=C/CCCCOCC(=O)OC(C)C 7a_200020645093_100011215430 [1,0,0,0,0,0|1,0,2]=4 380 B17R0.116 CCCCC#CCCCCOCC(=O)OC(C)C 34a_200000066234_100011215430 [1,0,0,0,0,0|1,0,2]=4 381 B17R0.116 CCCCC#CCCCCOCC(=O)OC(C)C 7a_200000066234_100011215430 [1,0,0,0,0,0|1,0,2]=4 382 B17R0.116 CCCCC#CCCCSCCC(=O)OC(C)C 62a_100000760027_200000047210 [1,0,0,0,0,0|1,0,2]=4 383 B17R0.116 CCCCC#CCCCSCCC(=O)OC(C)C 62a_200000047210_100000760027 [1,0,0,0,0,0|1,0,2]=4 384 B17R0.116 CCCCC/C=C\CCCOCC(=O)OC(C)C 34a_100020655193_100011215430 [1,0,0,0,0,0|1,0,2]=4 385 B17R0.116 CCCCC/C=C\CCCOCC(=O)OC(C)C 7a_100020655193_100011215430 [1,0,0,0,0,0|1,0,2]=4 386 B17R0.116 CCCCC/C=C\CCOCCC(=O)OC(C)C 7a_100016277358_100000760027 [1,0,0,0,0,0|1,0,2]=4 387 B17R0.116 CCCCCC#CCCOCCC(=O)OC(C)C 7a_200000042877_100000760027 [1,0,0,0,0,0|1,0,2]=4 388 B17R0.116 CCCCCC/C=C/COCCC(=O)OC(C)C 7a_200016276170_100000760027 [1,0,0,0,0,0|1,0,2]=4 389 B17R0.116 CCCCCCC#CCCOCC(=O)OC(C)C 34a_200000033163_100011215430 [1,0,0,0,0,0|1,0,2]=4 390 B17R0.116 CCCCCCC#CCCOCC(=O)OC(C)C 7a_200000033163_100011215430 [1,0,0,0,0,0|1,0,2]=4 391 B17R0.116 CCCCCCC#CCOCCC(=O)OC(C)C 7a_200000037284_100000760027 [1,0,0,0,0,0|1,0,2]=4 392 B17R0.116 CCCCCCCC#CCOCC(=O)OC(C)C 34a_200000061759_100011215430 [1,0,0,0,0,0|1,0,2]=4 393 B17R0.116 CCCCCCCC#CCOCC(=O)OC(C)C 7a_200000061759_100011215430 [1,0,0,0,0,0|1,0,2]=4 394 B17R0.116 CCCCCCCCCCC=CC(=O)NC(C)C 11a_100138425928_100015291182 [1,0,0,0,0,0|1,0,2]=4 395 B17R0.116 CCCCCCCCCCC=CC(=O)NC(C)C 1626a_100138425928_100015291182 [1,0,0,0,0,0|1,0,2]=4 396 B17R0.116 CCCCCCCCCCC=CC(=O)NC(C)C 240690a_100138425928_100015291182 [1,0,0,0,0,0|1,0,2]=4 397 B17R0.116 CCCCCCCCCCCCC(=O)CC(C)O 1458a_100011215791_100011218427 [1,0,0,0,0,0|2,0,0]=3 398 B17R0.116 CCCCCCCCCCCCC(=O)CN(C)C 1458a_100000750896_100000759014 [1,0,0,0,0,0|2,0,0]=3 399 B17R0.116 CCCCCCCCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100000759014 [1,0,0,0,0,0|2,0,0]=3 400 B17R0.116 CCCCCCCCCCCCC(=O)C[S+](C)C 1458a_200159257847_100000759014 [1,0,0,0,0,0|2,0,0]=3 401 B17R0.116 CCCCCCCCCCCCC(=O)NC(C)C 11a_100138425928_100011215791 [1,0,0,0,0,0|1,0,0]=2 402 B17R0.116 CCCCCCCCCCCCC(=O)NC(C)C 1626a_100138425928_100011215791 [1,0,0,0,0,0|1,0,0]=2 403 B17R0.116 CCCCCCCCCCCCC(=O)NC(C)C 240690a_100138425928_100011215791 [1,0,0,0,0,0|1,0,0]=2 404 B17R0.116 CCCCCCCCCCCNC(=O)C=C(C)C 11a_200011215754_100000211388 [1,0,0,0,0,0|2,0,1]=4 405 B17R0.116 CCCCCCCCCCCNC(=O)C=C(C)C 1626a_200011215754_100000211388 [1,0,0,0,0,0|2,0,1]=4 406 B17R0.116 CCCCCCCCCCCNC(=O)C=C(C)C 240690a_200011215754_100000211388 [1,0,0,0,0,0|2,0,1]=4 407 B17R0.116 CCCCCCCCCCCNC(=O)CC(C)C 11a_200011215754_100000210554 [1,0,0,0,0,0|2,0,0]=3 408 B17R0.116 CCCCCCCCCCCNC(=O)CC(C)C 1626a_200011215754_100000210554 [1,0,0,0,0,0|2,0,0]=3 409 B17R0.116 CCCCCCCCCCCNC(=O)CC(C)C 240690a_200011215754_100000210554 [1,0,0,0,0,0|2,0,0]=3 410 B17R0.116 CCCCCCCCCCCNC(=O)CC(C)C 527a_200011215754_100000210554 [1,0,0,0,0,0|2,0,0]=3 411 B17R0.116 CCCCCCCCCCCNC(=O)CN(C)C 11a_200011215754_100000750896 [1,0,0,0,0,0|3,0,0]=4 412 B17R0.116 CCCCCCCCCCCNC(=O)CN(C)C 240690a_200011215754_100000750896 [1,0,0,0,0,0|3,0,0]=4 413 B17R0.116 CCCCCCCCCCCNC(=O)CN(C)C 527a_200011215754_100000750896 [1,0,0,0,0,0|3,0,0]=4 414 B17R0.116 CCCCCCCCCCCNC(=O)C[C@@H](C)O 240690a_200011215754_100011933948 [1,0,0,0,0,0|3,0,0]=4 415 B17R0.116 CCCCCCCCCCCNC(=O)C[S+](C)C 11a_200011215754_200159257847 [1,0,0,0,0,0|3,0,0]=4 416 B17R0.116 CCCCCCCCCCCNC(=O)C[S+](C)C 1626a_200011215754_200159257847 [1,0,0,0,0,0|3,0,0]=4 417 B17R0.116 CCCCCCCCCCCNC(=O)C[S+](C)C 240690a_200011215754_200159257847 [1,0,0,0,0,0|3,0,0]=4 418 B17R0.116 CCCCCCCCCCCNC(=O)C[S+](C)C 527a_200011215754_200159257847 [1,0,0,0,0,0|3,0,0]=4 419 B17R0.116 CCCCCCCCCCCNC(=O)NC(C)C 2708a_100138425928_200011215754 [1,0,0,0,0,0|2,0,0]=3 420 B17R0.116 CCCCCCCCCCCNC(=O)NC(C)C 2708a_200011215754_100138425928 [1,0,0,0,0,0|2,0,0]=3 421 B17R0.116 CCCCCCCCCCCNC(=O)NC(C)C 273464a_100138425928_200011215754 [1,0,0,0,0,0|2,0,0]=3 422 B17R0.116 CCCCCCCCCCCNC(=O)NC(C)C 512a_100138425928_200011215754 [1,0,0,0,0,0|2,0,0]=3 423 B17R0.116 CCCCCCCCCCCNC(=O)NC(C)C 512a_200011215754_100138425928 [1,0,0,0,0,0|2,0,0]=3 424 B17R0.116 CCCCCCCCCCNCC(=O)NC(C)C 2230a_100000168517_100000210320 [1,0,0,0,0,0|2,0,0]=3 425 B17R0.116 CCCCCCCCCCNCC(=O)NC(C)C 2230a_100000684558_100000183996 [1,0,0,0,0,0|2,0,0]=3 426 B17R0.116 CCCCCCCCCCNCC(=O)NC(C)C 34a_100000684558_100000183996 [1,0,0,0,0,0|2,0,0]=3 427 B17R0.116 CCCCCCCCCCNCC(=O)OC(C)C 2230a_100000684558_100011215430 [1,0,0,0,0,0|1,0,0]=2 428 B17R0.116 CCCCCCCCCCNCC(=O)OC(C)C 34a_100000684558_100011215430 [1,0,0,0,0,0|1,0,0]=2 429 B17R0.116 CCCCCCCCCCOCC(=O)NC(C)C 34a_100000210711_100000183996 [1,0,0,0,0,0|2,0,0]=3 430 B17R0.116 CCCCCCCCCCOCC(=O)NC(C)C 7a_100000210711_100000183996 [1,0,0,0,0,0|2,0,0]=3 431 B17R0.116 CCCCCCCCCCOCC(=O)OC(C)C 34a_100000210711_100011215430 [1,0,0,0,0,0|1,0,0]=2 432 B17R0.116 CCCCCCCCCCOCC(=O)OC(C)C 7a_100000210711_100011215430 [1,0,0,0,0,0|1,0,0]=2 433 B17R0.116 CCCCCCCCCCSCC(=O)NC(C)C 62a_100000183996_100000210320 [1,0,0,0,0,0|2,0,0]=3 434 B17R0.116 CCCCCCCCCCSCC(=O)OC(C)C 62a_100011215430_100000210320 [1,0,0,0,0,0|1,0,0]=2 435 B17R0.116 CCCCCCCCCNCCC(=O)NC(C)C 2230a_100000212291_100000737564 [1,0,0,0,0,0|2,0,0]=3 436 B17R0.116 CCCCCCCCCNCCC(=O)OC(C)C 2230a_100000212291_100000760027 [1,0,0,0,0,0|1,0,0]=2 437 B17R0.116 CCCCCCCCCOCCC(=O)NC(C)C 7a_100000210712_100000737564 [1,0,0,0,0,0|2,0,0]=3 438 B17R0.116 CCCCCCCCCOCCC(=O)OC(C)C 7a_100000210712_100000760027 [1,0,0,0,0,0|1,0,0]=2 439 B17R0.116 CCCCCCCCCSCCC(=O)NC(C)C 62a_100000737564_100000210670 [1,0,0,0,0,0|2,0,0]=3 440 B17R0.116 CCCCCCCCCSCCC(=O)OC(C)C 62a_100000760027_100000210670 [1,0,0,0,0,0|1,0,0]=2 441 B17R0.116 CCCCCCCCCSCOC(=O)OC(C)C 62a_100000003507_100000210670 [1,0,0,0,0,0|2,0,0]=3 442 B17R0.116 CCCCCCNCCCCCC(=O)OC(C)C 2230a_100000210581_200010986244 [1,0,0,0,0,0|1,0,0]=2 443 B17R0.116 CCCCCCOCCCCCC(=O)OC(C)C 34a_100000210259_200010986244 [1,0,0,0,0,0|1,0,0]=2 444 B17R0.116 CCCCCCOCCCCCC(=O)OC(C)C 7a_100000210259_200010986244 [1,0,0,0,0,0|1,0,0]=2 445 B17R0.116 CCCCCCOCCOCCC(=O)NC(C)C 7a_100000691444_100000737564 [1,0,0,0,0,0|3,0,0]=4 446 B17R0.116 CCCCCCOCCOCCC(=O)OC(C)C 7a_100000691444_100000760027 [1,0,0,0,0,0|2,0,0]=3 447 B17R0.116 CCCCCCSCCCCCC(=O)OC(C)C 62a_100000210314_200010986244 [1,0,0,0,0,0|1,0,0]=2 448 B17R0.116 CCCCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000210757 [1,0,0,0,0,0|1,0,0]=2 449 B17R0.116 CCCCOCCCCOCCC(=O)NC(C)C 7a_200000760531_100000737564 [1,0,0,0,0,0|3,0,0]=4 450 B17R0.116 CCCCOCCCCOCCC(=O)OC(C)C 7a_200000760531_100000760027 [1,0,0,0,0,0|2,0,0]=3 451 B17R0.116 CCCCOCCOCCOCC(=O)OC(C)C 34a_100011215186_100011215430 [1,0,0,0,0,0|3,0,0]=4 452 B17R0.116 CCCCOCCOCCOCC(=O)OC(C)C 7a_100011215186_100011215430 [1,0,0,0,0,0|3,0,0]=4 453 B17R0.116 CCCCOCSCCCCCC(=O)OC(C)C 62a_100011995733_200010986244 [1,0,0,0,0,0|2,0,0]=3 454 B17R0.116 CCCCOCSCCCCCC(=O)OC(C)C 62a_200010986244_100011995733 [1,0,0,0,0,0|2,0,0]=3 455 B17R0.116 CCCOCCNCCCCCC(=O)OC(C)C 2230a_100161115042_200010986244 [1,0,0,0,0,0|2,0,0]=3 456 B17R0.116 CCCOCCNCCCCCC(=O)OC(C)C 34a_100161115042_200010986244 [1,0,0,0,0,0|2,0,0]=3 457 B17R0.116 CCCOCCOCCCCCC(=O)OC(C)C 34a_100000752267_200010986244 [1,0,0,0,0,0|2,0,0]=3 458 B17R0.116 CCCOCCOCCCCCC(=O)OC(C)C 7a_100000752267_200010986244 [1,0,0,0,0,0|2,0,0]=3 459 B17R0.116 CCCOCCOCCNCCC(=O)OC(C)C 2230a_200011904461_100000760027 [1,0,0,0,0,0|3,0,0]=4 460 B17R0.116 CCCOCCSCCCCCC(=O)OC(C)C 62a_100011215938_200010986244 [1,0,0,0,0,0|2,0,0]=3 461 B17R0.116 CCCOCCSCCCCCC(=O)OC(C)C 62a_200010986244_100011215938 [1,0,0,0,0,0|2,0,0]=3 462 B17R0.116 CCCSCCNCCCCCC(=O)OC(C)C 2230a_100020603323_200010986244 [1,0,0,0,0,0|2,0,0]=3 463 B17R0.116 CCCSCCOCCCCCC(=O)OC(C)C 34a_200000230433_200010986244 [1,0,0,0,0,0|2,0,0]=3 464 B17R0.116 CCCSCCOCCCCCC(=O)OC(C)C 7a_200000230433_200010986244 [1,0,0,0,0,0|2,0,0]=3 465 B17R0.116 CCOCCCNCCCCCC(=O)OC(C)C 2230a_100000210961_200010986244 [1,0,0,0,0,0|2,0,0]=3 466 B17R0.116 CCOCCCNCCCCCC(=O)OC(C)C 34a_100000210961_200010986244 [1,0,0,0,0,0|2,0,0]=3 467 B17R0.116 CCOCCCOCCCCCC(=O)OC(C)C 34a_100000757476_200010986244 [1,0,0,0,0,0|2,0,0]=3 468 B17R0.116 CCOCCCOCCCCCC(=O)OC(C)C 7a_100000757476_200010986244 [1,0,0,0,0,0|2,0,0]=3 469 B17R0.116 CCOCCCSCCCCCC(=O)OC(C)C 62a_100012232248_200010986244 [1,0,0,0,0,0|2,0,0]=3 470 B17R0.116 CCOCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100012232248 [1,0,0,0,0,0|2,0,0]=3 471 B17R0.116 CCSCCCOCCCCCC(=O)OC(C)C 34a_100011216438_200010986244 [1,0,0,0,0,0|2,0,0]=3 472 B17R0.116 CCSCCCOCCCCCC(=O)OC(C)C 7a_100011216438_200010986244 [1,0,0,0,0,0|2,0,0]=3 473 B17R0.116 CN(C)CC(=O)CCCCCCCCCCCO 1458a_100000750896_100009812471 [1,0,0,0,0,0|3,0,0]=4 474 B17R0.116 COCCCCOCCCCCC(=O)OC(C)C 34a_100000740925_200010986244 [1,0,0,0,0,0|2,0,0]=3 475 B17R0.116 COCCCCSCCCCCC(=O)OC(C)C 62a_100000730899_200010986244 [1,0,0,0,0,0|2,0,0]=3 476 B17R0.116 COCCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000730899 [1,0,0,0,0,0|2,0,0]=3 477 B17R0.116 COCCCOCCCOCCC(=O)OC(C)C 7a_200011215475_100000760027 [1,0,0,0,0,0|3,0,0]=4 478 B17R0.116 COCCOCSCCCCCC(=O)OC(C)C 62a_100000231047_200010986244 [1,0,0,0,0,0|3,0,0]=4 479 B17R0.116 COCCOCSCCCCCC(=O)OC(C)C 62a_200010986244_100000231047 [1,0,0,0,0,0|3,0,0]=4 480 B17R0.116 CSCCCCOCCCCCC(=O)OC(C)C 34a_100011217163_200010986244 [1,0,0,0,0,0|2,0,0]=3 481 B17R0.116 CSCCCCOCCCCCC(=O)OC(C)C 7a_100011217163_200010986244 [1,0,0,0,0,0|2,0,0]=3 482 B17R0.116 C[C@@H](O)CC(=O)CCCCCCCCCCCO 1458a_100011933948_100009812471 [1,0,0,0,0,0|3,0,0]=4 483 B17R0.116 C[S+](C)CC(=O)CCCCCCCCCCCO 1458a_200159257847_100009812471 [1,0,0,0,0,0|3,0,0]=4 484 B17R0.250 C#CCCCCCCCCCOCC(=O)OCC 34a_100000034437_100000188475 [1,0,0,0,0,0|1,0,2]=4 485 B17R0.250 C#CCCCCCCCCCOCC(=O)OCC 7a_100000034437_100000188475 [1,0,0,0,0,0|1,0,2]=4 486 B17R0.250 C#CCCCCCCCCOCCC(=O)OCC 34a_100000065265_100000765890 [1,0,0,0,0,0|1,0,2]=4 487 B17R0.250 C#CCCCCCCCCOCCC(=O)OCC 7a_100000065265_100011206558 [1,0,0,0,0,0|1,0,2]=4 488 B17R0.250 C#CCCCCCCCOCCCC(=O)OCC 34a_100000054614_100009991533 [1,0,0,0,0,0|1,0,2]=4 489 B17R0.250 C#CCCCCCCCOCCCC(=O)OCC 7a_100000054614_100011215271 [1,0,0,0,0,0|1,0,2]=4 490 B17R0.250 C#CCCCCCCCOCCCC(=O)OCC 7a_100012001163_100153394163 [1,0,0,0,0,0|1,0,2]=4 491 B17R0.250 C#CCCCCCCCSCCCC(=O)OCC 62a_100009991533_100153394163 [1,0,0,0,0,0|1,0,2]=4 492 B17R0.250 C#CCCCCCCCSCCCC(=O)OCC 62a_100153394163_100009991533 [1,0,0,0,0,0|1,0,2]=4 493 B17R0.250 C#CCCCCCCOCCCCC(=O)OCC 34a_100011217361_100000750268 [1,0,0,0,0,0|1,0,2]=4 494 B17R0.250 C#CCCCCCCOCCCCC(=O)OCC 7a_100011217361_100000750268 [1,0,0,0,0,0|1,0,2]=4 495 B17R0.250 C#CCCCCCCSCCCCC(=O)OCC 62a_100000750268_100012276617 [1,0,0,0,0,0|1,0,2]=4 496 B17R0.250 C#CCCCCCCSCCCCC(=O)OCC 62a_100012276617_100000750268 [1,0,0,0,0,0|1,0,2]=4 497 B17R0.250 C#CCCCCCOCCCCCC(=O)OCC 34a_100000766912_100000755133 [1,0,0,0,0,0|1,0,2]=4 498 B17R0.250 C#CCCCCCOCCCCCC(=O)OCC 7a_100000766912_100000755133 [1,0,0,0,0,0|1,0,2]=4 499 B17R0.250 C#CCCCCCOCCCCCC(=O)OCC 7a_100011214988_100012094781 [1,0,0,0,0,0|1,0,2]=4 500 B17R0.250 C#CCCCCCSCCCCCC(=O)OCC 62a_100000755133_100012094781 [1,0,0,0,0,0|1,0,2]=4 501 B17R0.250 C#CCCCCCSCCCCCC(=O)OCC 62a_100012094781_100000755133 [1,0,0,0,0,0|1,0,2]=4 502 B17R0.250 C#CCCCCNCCCCCCC(=O)OCC 2230a_100000706060_100009814379 [1,0,0,0,0,0|1,0,2]=4 503 B17R0.250 C#CCCCCNCCCCCCC(=O)OCC 34a_100000706060_100009814379 [1,0,0,0,0,0|1,0,2]=4 504 B17R0.250 C#CCCCCOCCCCCCC(=O)OCC 34a_100000766709_100009814379 [1,0,0,0,0,0|1,0,2]=4 505 B17R0.250 C#CCCCCOCCCCCCC(=O)OCC 7a_100000766709_100009814379 [1,0,0,0,0,0|1,0,2]=4 506 B17R0.250 C#CCCCCSCCCCCCC(=O)OCC 62a_100010269958_100009814379 [1,0,0,0,0,0|1,0,2]=4 507 B17R0.250 C#CCCCNCCCCCCCC(=O)OCC 34a_100000718082_100009991516 [1,0,0,0,0,0|1,0,2]=4 508 B17R0.250 C#CCCCOCCCCCCCC(=O)OCC 34a_100000215630_100009991516 [1,0,0,0,0,0|1,0,2]=4 509 B17R0.250 C#CCCCOCCCCCCCC(=O)OCC 7a_100000215630_100009991516 [1,0,0,0,0,0|1,0,2]=4 510 B17R0.250 C#CCCCSCCCCCCCC(=O)OCC 62a_100011215417_100009991516 [1,0,0,0,0,0|1,0,2]=4 511 B17R0.250 C#CCCNCCCCCCCCC(=O)OCC 34a_100000755551_100010175975 [1,0,0,0,0,0|1,0,2]=4 512 B17R0.250 C#CCCOCCCCCCCCC(=O)OCC 34a_100011215631_100010175975 [1,0,0,0,0,0|1,0,2]=4 513 B17R0.250 C#CCCSCCCCCCCCC(=O)OCC 62a_100000688953_100010175975 [1,0,0,0,0,0|1,0,2]=4 514 B17R0.250 C#CCNCCCCCCCCCC(=O)OCC 34a_100000212058_100009828014 [1,0,0,0,0,0|1,0,2]=4 515 B17R0.250 C#CCOCCCCCCCCCC(=O)OCC 34a_100000210247_100009828014 [1,0,0,0,0,0|1,0,2]=4 516 B17R0.250 C#CCSCCCCCCCCCC(=O)OCC 62a_100000038162_100009828014 [1,0,0,0,0,0|1,0,2]=4 517 B17R0.250 C/C=C/CCOCCCCCCCC(=O)OCC 34a_100016278192_100009991516 [1,0,0,0,0,0|1,0,2]=4 518 B17R0.250 C/C=C/COCCCCCCCCC(=O)OCC 34a_100016270725_100010175975 [1,0,0,0,0,0|1,0,2]=4 519 B17R0.250 C/C=C/CSCCCCCCCCC(=O)OCC 62a_100102629194_100010175975 [1,0,0,0,0,0|1,0,2]=4 520 B17R0.250 C=CCCCCCCCCCNCC(=O)OCC 2230a_100000081888_100000188475 [1,0,0,0,0,0|1,0,2]=4 521 B17R0.250 C=CCCCCCCCCCNCC(=O)OCC 34a_100000081888_100000188475 [1,0,0,0,0,0|1,0,2]=4 522 B17R0.250 C=CCCCCCCCCCOCC(=O)OCC 34a_100000038209_100000188475 [1,0,0,0,0,0|1,0,2]=4 523 B17R0.250 C=CCCCCCCCCCOCC(=O)OCC 7a_100000038209_100000188475 [1,0,0,0,0,0|1,0,2]=4 524 B17R0.250 C=CCCCCCCCCCSCC(=O)OCC 62a_100000188475_100009814027 [1,0,0,0,0,0|1,0,2]=4 525 B17R0.250 C=CCCCCCCCCCSCC(=O)OCC 62a_100009814027_100000188475 [1,0,0,0,0,0|1,0,2]=4 526 B17R0.250 C=CCCCCCCCCOCCC(=O)OCC 34a_100011215194_100000765890 [1,0,0,0,0,0|1,0,2]=4 527 B17R0.250 C=CCCCCCCCCOCCC(=O)OCC 7a_100011215194_100011206558 [1,0,0,0,0,0|1,0,2]=4 528 B17R0.250 C=CCCCCCCCCSCCC(=O)OCC 62a_100000765890_100011933949 [1,0,0,0,0,0|1,0,2]=4 529 B17R0.250 C=CCCCCCCCCSCCC(=O)OCC 62a_100011933949_100000765890 [1,0,0,0,0,0|1,0,2]=4 530 B17R0.250 C=CCCCCCCCOCCCC(=O)OCC 34a_100000730831_100009991533 [1,0,0,0,0,0|1,0,2]=4 531 B17R0.250 C=CCCCCCCCOCCCC(=O)OCC 7a_100000730831_100011215271 [1,0,0,0,0,0|1,0,2]=4 532 B17R0.250 C=CCCCCCCCOCCCC(=O)OCC 7a_100012001163_100012355270 [1,0,0,0,0,0|1,0,2]=4 533 B17R0.250 C=CCCCCCCCSCCCC(=O)OCC 62a_100009991533_100012355270 [1,0,0,0,0,0|1,0,2]=4 534 B17R0.250 C=CCCCCCCCSCCCC(=O)OCC 62a_100012355270_100009991533 [1,0,0,0,0,0|1,0,2]=4 535 B17R0.250 C=CCCCCCCOCCCCC(=O)OCC 34a_200011216477_100000750268 [1,0,0,0,0,0|1,0,2]=4 536 B17R0.250 C=CCCCCCCOCCCCC(=O)OCC 7a_200011216477_100000750268 [1,0,0,0,0,0|1,0,2]=4 537 B17R0.250 C=CCCCCCCSCCCCC(=O)OCC 62a_100000750268_100011215473 [1,0,0,0,0,0|1,0,2]=4 538 B17R0.250 C=CCCCCCCSCCCCC(=O)OCC 62a_100011215473_100000750268 [1,0,0,0,0,0|1,0,2]=4 539 B17R0.250 C=CCCCCCOCCCCCC(=O)OCC 34a_100011216702_100000755133 [1,0,0,0,0,0|1,0,2]=4 540 B17R0.250 C=CCCCCCOCCCCCC(=O)OCC 7a_100011214988_100000700193 [1,0,0,0,0,0|1,0,2]=4 541 B17R0.250 C=CCCCCCOCCCCCC(=O)OCC 7a_100011216702_100000755133 [1,0,0,0,0,0|1,0,2]=4 542 B17R0.250 C=CCCCCCSCCCCCC(=O)OCC 62a_100000700193_100000755133 [1,0,0,0,0,0|1,0,2]=4 543 B17R0.250 C=CCCCCCSCCCCCC(=O)OCC 62a_100000755133_100000700193 [1,0,0,0,0,0|1,0,2]=4 544 B17R0.250 C=CCCCCNCCCCCCC(=O)OCC 2230a_100000703577_100009814379 [1,0,0,0,0,0|1,0,2]=4 545 B17R0.250 C=CCCCCNCCCCCCC(=O)OCC 34a_100000703577_100009814379 [1,0,0,0,0,0|1,0,2]=4 546 B17R0.250 C=CCCCCOCCCCCCC(=O)OCC 34a_100000766645_100009814379 [1,0,0,0,0,0|1,0,2]=4 547 B17R0.250 C=CCCCCOCCCCCCC(=O)OCC 7a_100000766645_100009814379 [1,0,0,0,0,0|1,0,2]=4 548 B17R0.250 C=CCCCCSCCCCCCC(=O)OCC 62a_100011215482_100009814379 [1,0,0,0,0,0|1,0,2]=4 549 B17R0.250 C=CCCCNCCCCCCCC(=O)OCC 2230a_100000700776_100009991516 [1,0,0,0,0,0|1,0,2]=4 550 B17R0.250 C=CCCCNCCCCCCCC(=O)OCC 34a_100000700776_100009991516 [1,0,0,0,0,0|1,0,2]=4 551 B17R0.250 C=CCCCOCCCCCCCC(=O)OCC 34a_100000758997_100009991516 [1,0,0,0,0,0|1,0,2]=4 552 B17R0.250 C=CCCCOCCCCCCCC(=O)OCC 7a_100000758997_100009991516 [1,0,0,0,0,0|1,0,2]=4 553 B17R0.250 C=CCCCSCCCCCCCC(=O)OCC 62a_100011713584_100009991516 [1,0,0,0,0,0|1,0,2]=4 554 B17R0.250 C=CCCNCCCCCCCCC(=O)OCC 2230a_100015191253_100010175975 [1,0,0,0,0,0|1,0,2]=4 555 B17R0.250 C=CCCOCCCCCCCCC(=O)OCC 34a_100011205117_100010175975 [1,0,0,0,0,0|1,0,2]=4 556 B17R0.250 C=CCCSCCCCCCCCC(=O)OCC 62a_100000754431_100010175975 [1,0,0,0,0,0|1,0,2]=4 557 B17R0.250 C=CCNCCCCCCCCCC(=O)OCC 2230a_100020586998_100009828014 [1,0,0,0,0,0|1,0,2]=4 558 B17R0.250 C=CCOCCCCCCCCCC(=O)OCC 34a_200000210373_100009828014 [1,0,0,0,0,0|1,0,2]=4 559 B17R0.250 C=CCSCCCCCCCCCC(=O)OCC 62a_100000210623_100009828014 [1,0,0,0,0,0|1,0,2]=4 560 B17R0.250 C=COC(=O)CNCCCCCCCCCCC 2230a_200011215754_100000036128 [1,0,0,0,0,0|1,0,2]=4 561 B17R0.250 C=COC(=O)CNCCCCCCCCCCC 34a_200011215754_100000036128 [1,0,0,0,0,0|1,0,2]=4 562 B17R0.250 C=COC(=O)COCCCCCCCCCCC 34a_100000210809_100000036128 [1,0,0,0,0,0|1,0,2]=4 563 B17R0.250 C=COC(=O)CSCCCCCCCCCCC 62a_100000036128_100011215454 [1,0,0,0,0,0|1,0,2]=4 564 B17R0.250 CC#CC(=O)CCCCCCCCCCCCO 1458a_100000763181_100009813331 [1,0,0,0,0,0|2,0,1]=4 565 B17R0.250 CC#CCCOCCCCCCCC(=O)OCC 34a_100000750427_100009991516 [1,0,0,0,0,0|1,0,2]=4 566 B17R0.250 CC#CCNCCCCCCCCC(=O)OCC 2230a_100000685387_100010175975 [1,0,0,0,0,0|1,0,2]=4 567 B17R0.250 CC#CCNCCCCCCCCC(=O)OCC 34a_100000685387_100010175975 [1,0,0,0,0,0|1,0,2]=4 568 B17R0.250 CC#CCOCCCCCCCCC(=O)OCC 34a_100000761923_100010175975 [1,0,0,0,0,0|1,0,2]=4 569 B17R0.250 CC#CCSCCCCCCCCC(=O)OCC 62a_100000748600_100010175975 [1,0,0,0,0,0|1,0,2]=4 570 B17R0.250 CC/C=C/CCCOCCCCCC(=O)OCC 34a_100016287902_100000755133 [1,0,0,0,0,0|1,0,2]=4 571 B17R0.250 CC/C=C/CCCOCCCCCC(=O)OCC 7a_100016287902_100000755133 [1,0,0,0,0,0|1,0,2]=4 572 B17R0.250 CC/C=C\CCCCCOCCCC(=O)OCC 34a_100016268722_100009991533 [1,0,0,0,0,0|1,0,2]=4 573 B17R0.250 CC/C=C\CCCCCOCCCC(=O)OCC 7a_100016268722_100011215271 [1,0,0,0,0,0|1,0,2]=4 574 B17R0.250 CC/C=C\CCCCOCCCCC(=O)OCC 34a_100016287862_100000750268 [1,0,0,0,0,0|1,0,2]=4 575 B17R0.250 CC/C=C\CCCCOCCCCC(=O)OCC 7a_100016287862_100000750268 [1,0,0,0,0,0|1,0,2]=4 576 B17R0.250 CC/C=C\CCOCCCCCCC(=O)OCC 34a_100016288707_100009814379 [1,0,0,0,0,0|1,0,2]=4 577 B17R0.250 CC/C=C\CCOCCCCCCC(=O)OCC 7a_100016288707_100009814379 [1,0,0,0,0,0|1,0,2]=4 578 B17R0.250 CC/C=C\CCSCCCCCCC(=O)OCC 62a_100015370543_100009814379 [1,0,0,0,0,0|1,0,2]=4 579 B17R0.250 CC/C=C\COCCCCCCCC(=O)OCC 34a_100016268518_100009991516 [1,0,0,0,0,0|1,0,2]=4 580 B17R0.250 CC/C=C\CSCCCCCCCC(=O)OCC 62a_100103147603_100009991516 [1,0,0,0,0,0|1,0,2]=4 581 B17R0.250 CC=CC(=O)CCCCCCCCCCCCO 1458a_100000210699_100009813331 [1,0,0,0,0,0|2,0,1]=4 582 B17R0.250 CC=CC(=O)NCCCCCCCCCCCC 11a_100000210451_100000210699 [1,0,0,0,0,0|2,0,1]=4 583 B17R0.250 CC=CC(=O)NCCCCCCCCCCCC 1626a_100000210451_100000210699 [1,0,0,0,0,0|2,0,1]=4 584 B17R0.250 CC=CC(=O)NCCCCCCCCCCCC 240690a_100000210451_100000210699 [1,0,0,0,0,0|2,0,1]=4 585 B17R0.250 CC=CCCCOCCCCCCC(=O)OCC 34a_100020645299_100009814379 [1,0,0,0,0,0|1,0,2]=4 586 B17R0.250 CC=CCSCCCCCCCCC(=O)OCC 62a_100000070051_100010175975 [1,0,0,0,0,0|1,0,2]=4 587 B17R0.250 CCC#CCCCCCCSCCC(=O)OCC 62a_100000765890_200000036426 [1,0,0,0,0,0|1,0,2]=4 588 B17R0.250 CCC#CCCCCCCSCCC(=O)OCC 62a_200000036426_100000765890 [1,0,0,0,0,0|1,0,2]=4 589 B17R0.250 CCC#CCCOCCCCCCC(=O)OCC 34a_100000036655_100009814379 [1,0,0,0,0,0|1,0,2]=4 590 B17R0.250 CCC#CCCOCCCCCCC(=O)OCC 7a_100000036655_100009814379 [1,0,0,0,0,0|1,0,2]=4 591 B17R0.250 CCC#CCOCCCCCCCC(=O)OCC 34a_100000032950_100009991516 [1,0,0,0,0,0|1,0,2]=4 592 B17R0.250 CCC#CCSCCCCCCCC(=O)OCC 62a_100009813939_100009991516 [1,0,0,0,0,0|1,0,2]=4 593 B17R0.250 CCC/C=C/COCCCCCCC(=O)OCC 34a_100016278788_100009814379 [1,0,0,0,0,0|1,0,2]=4 594 B17R0.250 CCC/C=C/COCCCCCCC(=O)OCC 7a_100016278788_100009814379 [1,0,0,0,0,0|1,0,2]=4 595 B17R0.250 CCCC#CCCOCCCCCC(=O)OCC 34a_100000042726_100000755133 [1,0,0,0,0,0|1,0,2]=4 596 B17R0.250 CCCC#CCCOCCCCCC(=O)OCC 7a_100000042726_100000755133 [1,0,0,0,0,0|1,0,2]=4 597 B17R0.250 CCCC#CCOCCCCCCC(=O)OCC 34a_100000034806_100009814379 [1,0,0,0,0,0|1,0,2]=4 598 B17R0.250 CCCC#CCOCCCCCCC(=O)OCC 7a_100000034806_100009814379 [1,0,0,0,0,0|1,0,2]=4 599 B17R0.250 CCCC(=O)CCCCCCCCCCCCO 1458a_100000211992_100009813331 [1,0,0,0,0,0|2,0,0]=3 600 B17R0.250 CCCC(=O)CCCCCCOCCCCCO 1458a_100000211992_200132310570 [1,0,0,0,0,0|3,0,0]=4 601 B17R0.250 CCCC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000747444 [1,0,0,0,0,0|3,0,0]=4 602 B17R0.250 CCCC(=O)COCCCCCCCCCCBr 7a_100009813290_100000747444 [1,0,0,0,0,0|3,0,0]=4 603 B17R0.250 CCCC(=O)COCCCCCCCCCCCl 7a_200000033068_100000747444 [1,0,0,0,0,0|3,0,0]=4 604 B17R0.250 CCCC(=O)CSCCCCCCCCCCO 62a_100000747444_200000033068 [1,0,0,0,0,0|3,0,0]=4 605 B17R0.250 CCCC(=O)CSCCCCCCCCCCO 62a_100009813290_100000747444 [1,0,0,0,0,0|3,0,0]=4 606 B17R0.250 CCCC/C=C/CCCCOCCC(=O)OCC 34a_200020645093_100000765890 [1,0,0,0,0,0|1,0,2]=4 607 B17R0.250 CCCC/C=C/CCCCOCCC(=O)OCC 7a_200020645093_100011206558 [1,0,0,0,0,0|1,0,2]=4 608 B17R0.250 CCCC/C=C/COCCCCCC(=O)OCC 34a_200016272032_100000755133 [1,0,0,0,0,0|1,0,2]=4 609 B17R0.250 CCCC/C=C/COCCCCCC(=O)OCC 7a_200016272032_100000755133 [1,0,0,0,0,0|1,0,2]=4 610 B17R0.250 CCCC/C=C\CCOCCCCC(=O)OCC 34a_200016286491_100000750268 [1,0,0,0,0,0|1,0,2]=4 611 B17R0.250 CCCC/C=C\CCOCCCCC(=O)OCC 7a_200016286491_100000750268 [1,0,0,0,0,0|1,0,2]=4 612 B17R0.250 CCCCC#CCCCCOCCC(=O)OCC 34a_200000066234_100000765890 [1,0,0,0,0,0|1,0,2]=4 613 B17R0.250 CCCCC#CCCCCOCCC(=O)OCC 7a_200000066234_100011206558 [1,0,0,0,0,0|1,0,2]=4 614 B17R0.250 CCCCC#CCCCOCCCC(=O)OCC 7a_100012001163_200000047210 [1,0,0,0,0,0|1,0,2]=4 615 B17R0.250 CCCCC#CCCCSCCCC(=O)OCC 62a_100009991533_200000047210 [1,0,0,0,0,0|1,0,2]=4 616 B17R0.250 CCCCC#CCCCSCCCC(=O)OCC 62a_200000047210_100009991533 [1,0,0,0,0,0|1,0,2]=4 617 B17R0.250 CCCCC#CCCOCCCCC(=O)OCC 34a_100000037610_100000750268 [1,0,0,0,0,0|1,0,2]=4 618 B17R0.250 CCCCC#CCCOCCCCC(=O)OCC 7a_100000037610_100000750268 [1,0,0,0,0,0|1,0,2]=4 619 B17R0.250 CCCCC#CCOCCCCCC(=O)OCC 34a_200000034558_100000755133 [1,0,0,0,0,0|1,0,2]=4 620 B17R0.250 CCCCC#CCOCCCCCC(=O)OCC 7a_200000034558_100000755133 [1,0,0,0,0,0|1,0,2]=4 621 B17R0.250 CCCCC/C=C/COCCCCC(=O)OCC 34a_100016258190_100000750268 [1,0,0,0,0,0|1,0,2]=4 622 B17R0.250 CCCCC/C=C/COCCCCC(=O)OCC 7a_100016258190_100000750268 [1,0,0,0,0,0|1,0,2]=4 623 B17R0.250 CCCCC/C=C\CCCOCCC(=O)OCC 34a_100020655193_100000765890 [1,0,0,0,0,0|1,0,2]=4 624 B17R0.250 CCCCC/C=C\CCCOCCC(=O)OCC 7a_100020655193_100011206558 [1,0,0,0,0,0|1,0,2]=4 625 B17R0.250 CCCCC/C=C\CCOCCCC(=O)OCC 34a_100016277358_100009991533 [1,0,0,0,0,0|1,0,2]=4 626 B17R0.250 CCCCC/C=C\CCOCCCC(=O)OCC 7a_100016277358_100011215271 [1,0,0,0,0,0|1,0,2]=4 627 B17R0.250 CCCCCC#CCCOCCCC(=O)OCC 34a_200000042877_100009991533 [1,0,0,0,0,0|1,0,2]=4 628 B17R0.250 CCCCCC#CCCOCCCC(=O)OCC 7a_200000042877_100011215271 [1,0,0,0,0,0|1,0,2]=4 629 B17R0.250 CCCCCC#CCOCCCCC(=O)OCC 34a_200000033628_100000750268 [1,0,0,0,0,0|1,0,2]=4 630 B17R0.250 CCCCCC#CCOCCCCC(=O)OCC 7a_200000033628_100000750268 [1,0,0,0,0,0|1,0,2]=4 631 B17R0.250 CCCCCC#CCSCCCCC(=O)OCC 62a_100000750268_100009816472 [1,0,0,0,0,0|1,0,2]=4 632 B17R0.250 CCCCCC#CCSCCCCC(=O)OCC 62a_100009816472_100000750268 [1,0,0,0,0,0|1,0,2]=4 633 B17R0.250 CCCCCC/C=C/COCCCC(=O)OCC 34a_200016276170_100009991533 [1,0,0,0,0,0|1,0,2]=4 634 B17R0.250 CCCCCC/C=C/COCCCC(=O)OCC 7a_200016276170_100011215271 [1,0,0,0,0,0|1,0,2]=4 635 B17R0.250 CCCCCCC#CCCOCCC(=O)OCC 34a_200000033163_100000765890 [1,0,0,0,0,0|1,0,2]=4 636 B17R0.250 CCCCCCC#CCCOCCC(=O)OCC 7a_200000033163_100011206558 [1,0,0,0,0,0|1,0,2]=4 637 B17R0.250 CCCCCCC#CCOCCCC(=O)OCC 34a_200000037284_100009991533 [1,0,0,0,0,0|1,0,2]=4 638 B17R0.250 CCCCCCC#CCOCCCC(=O)OCC 7a_200000037284_100011215271 [1,0,0,0,0,0|1,0,2]=4 639 B17R0.250 CCCCCCCC#CCOCCC(=O)OCC 34a_200000061759_100000765890 [1,0,0,0,0,0|1,0,2]=4 640 B17R0.250 CCCCCCCC#CCOCCC(=O)OCC 7a_200000061759_100011206558 [1,0,0,0,0,0|1,0,2]=4 641 B17R0.250 CCCCCCCC/C=C/COCC(=O)OCC 34a_200020667288_100000188475 [1,0,0,0,0,0|1,0,2]=4 642 B17R0.250 CCCCCCCC/C=C/COCC(=O)OCC 7a_200020667288_100000188475 [1,0,0,0,0,0|1,0,2]=4 643 B17R0.250 CCCCCCCCCCCCCC(=O)CCO 1458a_100000756256_100000211926 [1,0,0,0,0,0|2,0,0]=3 644 B17R0.250 CCCCCCCCCCCCCC(=O)CCO 1458a_100011216618_100000210684 [1,0,0,0,0,0|2,0,0]=3 645 B17R0.250 CCCCCCCCCCCCCC(=O)COC 1458a_100000210968_100000210684 [1,0,0,0,0,0|2,0,0]=3 646 B17R0.250 CCCCCCCCCCCCCC(=O)NCC 11a_100015525214_100000756256 [1,0,0,0,0,0|1,0,0]=2 647 B17R0.250 CCCCCCCCCCCCCC(=O)NCC 240690a_100015525214_100000756256 [1,0,0,0,0,0|1,0,0]=2 648 B17R0.250 CCCCCCCCCCCCCC(=O)NNC 22a_100016993582_100000756256 [1,0,0,0,0,0|2,0,0]=3 649 B17R0.250 CCCCCCCCCCCCNC(=O)CCC 11a_100000210451_100000211992 [1,0,0,0,0,0|2,0,0]=3 650 B17R0.250 CCCCCCCCCCCCNC(=O)CCC 1626a_100000210451_100000211992 [1,0,0,0,0,0|2,0,0]=3 651 B17R0.250 CCCCCCCCCCCCNC(=O)CCC 240690a_100000210451_100000211992 [1,0,0,0,0,0|2,0,0]=3 652 B17R0.250 CCCCCCCCCCCCNC(=O)CCC 527a_100000210451_100000211992 [1,0,0,0,0,0|2,0,0]=3 653 B17R0.250 CCCCCCCCCCCCNC(=O)CCO 240690a_100000210451_100011216618 [1,0,0,0,0,0|3,0,0]=4 654 B17R0.250 CCCCCCCCCCCCNC(=O)COC 11a_100000210451_100000210968 [1,0,0,0,0,0|3,0,0]=4 655 B17R0.250 CCCCCCCCCCCCNC(=O)COC 1626a_100000210451_100000210968 [1,0,0,0,0,0|3,0,0]=4 656 B17R0.250 CCCCCCCCCCCCNC(=O)COC 240690a_100000210451_100000210968 [1,0,0,0,0,0|3,0,0]=4 657 B17R0.250 CCCCCCCCCCCCNC(=O)COC 527a_100000210451_100000210968 [1,0,0,0,0,0|3,0,0]=4 658 B17R0.250 CCCCCCCCCCCCNC(=O)CSC 11a_100000210451_100000184570 [1,0,0,0,0,0|3,0,0]=4 659 B17R0.250 CCCCCCCCCCCCNC(=O)CSC 1626a_100000210451_100000184570 [1,0,0,0,0,0|3,0,0]=4 660 B17R0.250 CCCCCCCCCCCCNC(=O)CSC 240690a_100000210451_100000184570 [1,0,0,0,0,0|3,0,0]=4 661 B17R0.250 CCCCCCCCCCCCNC(=O)CSC 527a_100000210451_100000184570 [1,0,0,0,0,0|3,0,0]=4 662 B17R0.250 CCCCCCCCCCCCNC(=O)NCC 2708a_100000210451_100015525214 [1,0,0,0,0,0|2,0,0]=3 663 B17R0.250 CCCCCCCCCCCCNC(=O)NCC 2708a_100015525214_100000210451 [1,0,0,0,0,0|2,0,0]=3 664 B17R0.250 CCCCCCCCCCCCNC(=O)NCC 273464a_100000210451_100015525214 [1,0,0,0,0,0|2,0,0]=3 665 B17R0.250 CCCCCCCCCCCCNC(=O)NCC 273464a_100015525214_100000210451 [1,0,0,0,0,0|2,0,0]=3 666 B17R0.250 CCCCCCCCCCCCNC(=O)NCC 512a_100000210451_100015525214 [1,0,0,0,0,0|2,0,0]=3 667 B17R0.250 CCCCCCCCCCCCNC(=O)NCC 512a_100015525214_100000210451 [1,0,0,0,0,0|2,0,0]=3 668 B17R0.250 CCCCCCCCCCCCNC(=O)NNC 273464a_100000210451_100016993582 [1,0,0,0,0,0|3,0,0]=4 669 B17R0.250 CCCCCCCCCCCCNC(=O)NNC 512a_100000210451_100016993582 [1,0,0,0,0,0|3,0,0]=4 670 B17R0.250 CCCCCCCCCCCCNC(=O)NNC 512a_100016993582_100000210451 [1,0,0,0,0,0|3,0,0]=4 671 B17R0.250 CCCCCCCCCCCNCC(=O)CCC 2230a_200011215754_100000747444 [1,0,0,0,0,0|2,0,0]=3 672 B17R0.250 CCCCCCCCCCCNCC(=O)NCC 2230a_100016988866_100011215454 [1,0,0,0,0,0|2,0,0]=3 673 B17R0.250 CCCCCCCCCCCNCC(=O)NCC 2230a_200011215754_100000183381 [1,0,0,0,0,0|2,0,0]=3 674 B17R0.250 CCCCCCCCCCCNCC(=O)NCC 34a_200011215754_100000183381 [1,0,0,0,0,0|2,0,0]=3 675 B17R0.250 CCCCCCCCCCCNCC(=O)NCO 2230a_200011215754_100000185155 [1,0,0,0,0,0|3,0,0]=4 676 B17R0.250 CCCCCCCCCCCNCC(=O)NCO 34a_200011215754_100000185155 [1,0,0,0,0,0|3,0,0]=4 677 B17R0.250 CCCCCCCCCCCNCC(=O)OCC 2230a_200011215754_100000188475 [1,0,0,0,0,0|1,0,0]=2 678 B17R0.250 CCCCCCCCCCCNCC(=O)OCC 34a_200011215754_100000188475 [1,0,0,0,0,0|1,0,0]=2 679 B17R0.250 CCCCCCCCCCCOCC(=O)CCC 7a_100000210809_100000747444 [1,0,0,0,0,0|2,0,0]=3 680 B17R0.250 CCCCCCCCCCCOCC(=O)NCC 34a_100000210809_100000183381 [1,0,0,0,0,0|2,0,0]=3 681 B17R0.250 CCCCCCCCCCCOCC(=O)NCC 7a_100000210809_100000183381 [1,0,0,0,0,0|2,0,0]=3 682 B17R0.250 CCCCCCCCCCCOCC(=O)NCO 34a_100000210809_100000185155 [1,0,0,0,0,0|3,0,0]=4 683 B17R0.250 CCCCCCCCCCCOCC(=O)NCO 7a_100000210809_100000185155 [1,0,0,0,0,0|3,0,0]=4 684 B17R0.250 CCCCCCCCCCCOCC(=O)OCC 34a_100000210809_100000188475 [1,0,0,0,0,0|1,0,0]=2 685 B17R0.250 CCCCCCCCCCCOCC(=O)OCC 7a_100000210809_100000188475 [1,0,0,0,0,0|1,0,0]=2 686 B17R0.250 CCCCCCCCCCCSCC(=O)NCC 62a_100000183381_100011215454 [1,0,0,0,0,0|2,0,0]=3 687 B17R0.250 CCCCCCCCCCCSCC(=O)NCO 62a_100000185155_100011215454 [1,0,0,0,0,0|3,0,0]=4 688 B17R0.250 CCCCCCCCCCCSCC(=O)OCC 62a_100000188475_100011215454 [1,0,0,0,0,0|1,0,0]=2 689 B17R0.250 CCCCCCCCCCNCCC(=O)NCC 2230a_100000684558_100000737597 [1,0,0,0,0,0|2,0,0]=3 690 B17R0.250 CCCCCCCCCCNCCC(=O)NCC 34a_100025743525_100000210320 [1,0,0,0,0,0|2,0,0]=3 691 B17R0.250 CCCCCCCCCCNCCC(=O)OCC 2230a_100000684558_100011206558 [1,0,0,0,0,0|1,0,0]=2 692 B17R0.250 CCCCCCCCCCNCCC(=O)OCC 34a_100000684558_100000765890 [1,0,0,0,0,0|1,0,0]=2 693 B17R0.250 CCCCCCCCCCNCOC(=O)CCC 2230a_100000684558_100000034017 [1,0,0,0,0,0|3,0,0]=4 694 B17R0.250 CCCCCCCCCCNCOC(=O)CCC 34a_100000684558_100000034017 [1,0,0,0,0,0|3,0,0]=4 695 B17R0.250 CCCCCCCCCCOCCC(=O)NCC 7a_100000210711_100000737597 [1,0,0,0,0,0|2,0,0]=3 696 B17R0.250 CCCCCCCCCCOCCC(=O)OCC 34a_100000210711_100000765890 [1,0,0,0,0,0|1,0,0]=2 697 B17R0.250 CCCCCCCCCCOCCC(=O)OCC 7a_100000210711_100011206558 [1,0,0,0,0,0|1,0,0]=2 698 B17R0.250 CCCCCCCCCCOCOC(=O)CCC 34a_100000210711_100000034017 [1,0,0,0,0,0|3,0,0]=4 699 B17R0.250 CCCCCCCCCCSCCC(=O)NCC 62a_100000737597_100000210320 [1,0,0,0,0,0|2,0,0]=3 700 B17R0.250 CCCCCCCCCCSCCC(=O)OCC 62a_100000765890_100000210320 [1,0,0,0,0,0|1,0,0]=2 701 B17R0.250 CCCCCCCCCNC/C=C/C(=O)OCC 2230a_100000212291_100016267167 [1,0,0,0,0,0|1,0,2]=4 702 B17R0.250 CCCCCCCCCNC/C=C/C(=O)OCC 34a_100000212291_100016267167 [1,0,0,0,0,0|1,0,2]=4 703 B17R0.250 CCCCCCCCCNCCCC(=O)OCC 2230a_100000212291_100009991533 [1,0,0,0,0,0|1,0,0]=2 704 B17R0.250 CCCCCCCCCNCCCC(=O)OCC 34a_100000212291_100009991533 [1,0,0,0,0,0|1,0,0]=2 705 B17R0.250 CCCCCCCCCOC/C=C/C(=O)OCC 34a_100000210712_100016267167 [1,0,0,0,0,0|1,0,2]=4 706 B17R0.250 CCCCCCCCCOC/C=C/C(=O)OCC 7a_100000210712_100016267167 [1,0,0,0,0,0|1,0,2]=4 707 B17R0.250 CCCCCCCCCOCCCC(=O)OCC 34a_100000210712_100009991533 [1,0,0,0,0,0|1,0,0]=2 708 B17R0.250 CCCCCCCCCOCCCC(=O)OCC 7a_100000210712_100011215271 [1,0,0,0,0,0|1,0,0]=2 709 B17R0.250 CCCCCCCCCOCCCC(=O)OCC 7a_100012001163_100000210328 [1,0,0,0,0,0|1,0,0]=2 710 B17R0.250 CCCCCCCCCOCCNC(=O)OCC 34a_100000158857_100011214924 [1,0,0,0,0,0|2,0,0]=3 711 B17R0.250 CCCCCCCCCOCCNC(=O)OCC 7a_100000210712_200011445536 [1,0,0,0,0,0|2,0,0]=3 712 B17R0.250 CCCCCCCCCSC/C=C/C(=O)OCC 62a_100016267167_100000210670 [1,0,0,0,0,0|1,0,2]=4 713 B17R0.250 CCCCCCCCCSCCCC(=O)OCC 62a_100009991533_100000210670 [1,0,0,0,0,0|1,0,0]=2 714 B17R0.250 CCCCCCCCNCCCCC(=O)OCC 2230a_100000229939_100000750268 [1,0,0,0,0,0|1,0,0]=2 715 B17R0.250 CCCCCCCCNCCCCC(=O)OCC 34a_100000229939_100000750268 [1,0,0,0,0,0|1,0,0]=2 716 B17R0.250 CCCCCCCCNCCOCC(=O)OCC 2230a_100000229939_100000088970 [1,0,0,0,0,0|2,0,0]=3 717 B17R0.250 CCCCCCCCNCCOCC(=O)OCC 34a_100000229939_100000088970 [1,0,0,0,0,0|2,0,0]=3 718 B17R0.250 CCCCCCCCOCCCCC(=O)OCC 34a_100000210232_100000750268 [1,0,0,0,0,0|1,0,0]=2 719 B17R0.250 CCCCCCCCOCCCCC(=O)OCC 7a_100000210232_100000750268 [1,0,0,0,0,0|1,0,0]=2 720 B17R0.250 CCCCCCCCOCCOCC(=O)OCC 34a_100000210232_100000088970 [1,0,0,0,0,0|2,0,0]=3 721 B17R0.250 CCCCCCCCOCCOCC(=O)OCC 7a_100000210232_100000088970 [1,0,0,0,0,0|2,0,0]=3 722 B17R0.250 CCCCCCCCOCCSCC(=O)OCC 7a_200000230590_100000210759 [1,0,0,0,0,0|2,0,0]=3 723 B17R0.250 CCCCCCCCSCCCCC(=O)OCC 62a_100000210759_100000750268 [1,0,0,0,0,0|1,0,0]=2 724 B17R0.250 CCCCCCCCSCCCCC(=O)OCC 62a_100000750268_100000210317 [1,0,0,0,0,0|1,0,0]=2 725 B17R0.250 CCCCCCCCSCCOCC(=O)OCC 62a_100000088970_100000210317 [1,0,0,0,0,0|2,0,0]=3 726 B17R0.250 CCCCCCCCSCCOCC(=O)OCC 62a_100000210759_100000088970 [1,0,0,0,0,0|2,0,0]=3 727 B17R0.250 CCCCCCCNCCCCCC(=O)OCC 2230a_100000229938_100000755133 [1,0,0,0,0,0|1,0,0]=2 728 B17R0.250 CCCCCCCNCCCOCC(=O)OCC 2230a_100000229938_100009893628 [1,0,0,0,0,0|2,0,0]=3 729 B17R0.250 CCCCCCCOCCCCCC(=O)OCC 34a_100000210272_100000755133 [1,0,0,0,0,0|1,0,0]=2 730 B17R0.250 CCCCCCCOCCCCCC(=O)OCC 7a_100000210272_100000755133 [1,0,0,0,0,0|1,0,0]=2 731 B17R0.250 CCCCCCCOCCCCCC(=O)OCC 7a_100011214988_100000210614 [1,0,0,0,0,0|1,0,0]=2 732 B17R0.250 CCCCCCCOCCCOCC(=O)OCC 34a_100000210272_100009893628 [1,0,0,0,0,0|2,0,0]=3 733 B17R0.250 CCCCCCCOCCCOCC(=O)OCC 7a_100000210272_100009893628 [1,0,0,0,0,0|2,0,0]=3 734 B17R0.250 CCCCCCCSCCCCCC(=O)OCC 62a_100000210614_100000755133 [1,0,0,0,0,0|1,0,0]=2 735 B17R0.250 CCCCCCCSCCCCCC(=O)OCC 62a_100000755133_100000210316 [1,0,0,0,0,0|1,0,0]=2 736 B17R0.250 CCCCCCCSCCCOCC(=O)OCC 62a_100000210614_100009893628 [1,0,0,0,0,0|2,0,0]=3 737 B17R0.250 CCCCCCCSCCCOCC(=O)OCC 62a_100009893628_100000210316 [1,0,0,0,0,0|2,0,0]=3 738 B17R0.250 CCCCCCNCCCCCCC(=O)OCC 2230a_100000210581_100009814379 [1,0,0,0,0,0|1,0,0]=2 739 B17R0.250 CCCCCCOCCCCCCC(=O)OCC 34a_100000210259_100009814379 [1,0,0,0,0,0|1,0,0]=2 740 B17R0.250 CCCCCCOCCCCCCC(=O)OCC 7a_100000210259_100009814379 [1,0,0,0,0,0|1,0,0]=2 741 B17R0.250 CCCCCCOCCOCCCC(=O)OCC 34a_100000691444_100009991533 [1,0,0,0,0,0|2,0,0]=3 742 B17R0.250 CCCCCCOCCOCCCC(=O)OCC 7a_100000691444_100011215271 [1,0,0,0,0,0|2,0,0]=3 743 B17R0.250 CCCCCCOCCOCCNC(=O)OCC 7a_100000691444_200011445536 [1,0,0,0,0,0|3,0,0]=4 744 B17R0.250 CCCCCCSCCCCCCC(=O)OCC 62a_100000210314_100009814379 [1,0,0,0,0,0|1,0,0]=2 745 B17R0.250 CCCCCNCCCCCCCC(=O)OCC 2230a_100000209983_100009991516 [1,0,0,0,0,0|1,0,0]=2 746 B17R0.250 CCCCCNCCOCCCCC(=O)OCC 34a_100000224656_100000750268 [1,0,0,0,0,0|2,0,0]=3 747 B17R0.250 CCCCCNCCOCCOCC(=O)OCC 34a_100000224656_100000088970 [1,0,0,0,0,0|3,0,0]=4 748 B17R0.250 CCCCCNN=CCCCCCC(=O)OCC 4a_100000694160_100000085164 [1,0,0,0,0,0|2,0,1]=4 749 B17R0.250 CCCCCOCCCCCCCC(=O)OCC 34a_100000210253_100009991516 [1,0,0,0,0,0|1,0,0]=2 750 B17R0.250 CCCCCOCCCCCCCC(=O)OCC 7a_100000210253_100009991516 [1,0,0,0,0,0|1,0,0]=2 751 B17R0.250 CCCCCOCCOCCCCC(=O)OCC 34a_100011215259_100000750268 [1,0,0,0,0,0|2,0,0]=3 752 B17R0.250 CCCCCOCCOCCCCC(=O)OCC 7a_100011215259_100000750268 [1,0,0,0,0,0|2,0,0]=3 753 B17R0.250 CCCCCOCCOCCOCC(=O)OCC 34a_100011215259_100000088970 [1,0,0,0,0,0|3,0,0]=4 754 B17R0.250 CCCCCOCCOCCOCC(=O)OCC 7a_100011215259_100000088970 [1,0,0,0,0,0|3,0,0]=4 755 B17R0.250 CCCCCSCCCCCCCC(=O)OCC 62a_100000210326_100009991516 [1,0,0,0,0,0|1,0,0]=2 756 B17R0.250 CCCCNCCCCCCCCC(=O)OCC 2230a_100000102301_100010175975 [1,0,0,0,0,0|1,0,0]=2 757 B17R0.250 CCCCNCCCCCCCCC(=O)OCC 7a_106832991798_100010175975 [1,0,0,0,0,0|1,0,0]=2 758 B17R0.250 CCCCNCCCCOCCCC(=O)OCC 34a_200011216965_100009991533 [1,0,0,0,0,0|2,0,0]=3 759 B17R0.250 CCCCOCCCCCCCCC(=O)OCC 34a_100000210227_100010175975 [1,0,0,0,0,0|1,0,0]=2 760 B17R0.250 CCCCOCCCCCCCCC(=O)OCC 7a_100000210227_100010175975 [1,0,0,0,0,0|1,0,0]=2 761 B17R0.250 CCCCOCCCCOCCCC(=O)OCC 34a_200000760531_100009991533 [1,0,0,0,0,0|2,0,0]=3 762 B17R0.250 CCCCOCCCCOCCCC(=O)OCC 7a_200000760531_100011215271 [1,0,0,0,0,0|2,0,0]=3 763 B17R0.250 CCCCOCCCCOCCNC(=O)OCC 7a_200000760531_200011445536 [1,0,0,0,0,0|3,0,0]=4 764 B17R0.250 CCCCOCCCNCCCCC(=O)OCC 2230a_200000211371_100000750268 [1,0,0,0,0,0|2,0,0]=3 765 B17R0.250 CCCCOCCCNCCCCC(=O)OCC 34a_200000211371_100000750268 [1,0,0,0,0,0|2,0,0]=3 766 B17R0.250 CCCCOCCCNCCOCC(=O)OCC 2230a_200000211371_100000088970 [1,0,0,0,0,0|3,0,0]=4 767 B17R0.250 CCCCOCCCNCCOCC(=O)OCC 34a_200000211371_100000088970 [1,0,0,0,0,0|3,0,0]=4 768 B17R0.250 CCCCOCCCOCCCCC(=O)OCC 34a_200011215613_100000750268 [1,0,0,0,0,0|2,0,0]=3 769 B17R0.250 CCCCOCCCOCCCCC(=O)OCC 7a_200011215613_100000750268 [1,0,0,0,0,0|2,0,0]=3 770 B17R0.250 CCCCOCCCOCCOCC(=O)OCC 34a_200011215613_100000088970 [1,0,0,0,0,0|3,0,0]=4 771 B17R0.250 CCCCOCCCOCCOCC(=O)OCC 7a_200011215613_100000088970 [1,0,0,0,0,0|3,0,0]=4 772 B17R0.250 CCCCOCCOCCCCCC(=O)OCC 34a_100000210238_100000755133 [1,0,0,0,0,0|2,0,0]=3 773 B17R0.250 CCCCOCCOCCCCCC(=O)OCC 7a_100000210238_100000755133 [1,0,0,0,0,0|2,0,0]=3 774 B17R0.250 CCCCOCCOCCCCCC(=O)OCC 7a_100011214988_100000743108 [1,0,0,0,0,0|2,0,0]=3 775 B17R0.250 CCCCOCCOCCCOCC(=O)OCC 34a_100000210238_100009893628 [1,0,0,0,0,0|3,0,0]=4 776 B17R0.250 CCCCOCCOCCCOCC(=O)OCC 7a_100000210238_100009893628 [1,0,0,0,0,0|3,0,0]=4 777 B17R0.250 CCCCOCCOCCOCCC(=O)OCC 34a_100010737887_100000210210 [1,0,0,0,0,0|3,0,0]=4 778 B17R0.250 CCCCOCCOCCOCCC(=O)OCC 34a_100011215186_100000765890 [1,0,0,0,0,0|3,0,0]=4 779 B17R0.250 CCCCOCCOCCOCCC(=O)OCC 7a_100010737887_100000210211 [1,0,0,0,0,0|3,0,0]=4 780 B17R0.250 CCCCOCCOCCOCCC(=O)OCC 7a_100011215186_100011206558 [1,0,0,0,0,0|3,0,0]=4 781 B17R0.250 CCCCOCCSCCCCCC(=O)OCC 62a_100000743108_100000755133 [1,0,0,0,0,0|2,0,0]=3 782 B17R0.250 CCCCOCCSCCCCCC(=O)OCC 62a_100000755133_100000743108 [1,0,0,0,0,0|2,0,0]=3 783 B17R0.250 CCCCOCCSCCCOCC(=O)OCC 62a_100000743108_100009893628 [1,0,0,0,0,0|3,0,0]=4 784 B17R0.250 CCCCOCCSCCCOCC(=O)OCC 62a_100009893628_100000743108 [1,0,0,0,0,0|3,0,0]=4 785 B17R0.250 CCCCOCSCCCCCCC(=O)OCC 62a_100011995733_100009814379 [1,0,0,0,0,0|2,0,0]=3 786 B17R0.250 CCCCSCCCCCCCCC(=O)OCC 62a_100000210211_100010175975 [1,0,0,0,0,0|1,0,0]=2 787 B17R0.250 CCCCSCCNCCCCCC(=O)OCC 2230a_100025743550_100000755133 [1,0,0,0,0,0|2,0,0]=3 788 B17R0.250 CCCCSCCNCCCOCC(=O)OCC 2230a_100025743550_100009893628 [1,0,0,0,0,0|3,0,0]=4 789 B17R0.250 CCCCSCCOCCCCCC(=O)OCC 34a_200000230436_100000755133 [1,0,0,0,0,0|2,0,0]=3 790 B17R0.250 CCCCSCCOCCCCCC(=O)OCC 7a_200000230436_100000755133 [1,0,0,0,0,0|2,0,0]=3 791 B17R0.250 CCCCSCCOCCCOCC(=O)OCC 34a_200000230436_100009893628 [1,0,0,0,0,0|3,0,0]=4 792 B17R0.250 CCCCSCCOCCCOCC(=O)OCC 7a_200000230436_100009893628 [1,0,0,0,0,0|3,0,0]=4 793 B17R0.250 CCCNN=CCCCCCCCC(=O)OCC 4a_100000740057_100102623289 [1,0,0,0,0,0|2,0,1]=4 794 B17R0.250 CCCOCCCCCCCCCC(=O)OCC 34a_100000210258_100009828014 [1,0,0,0,0,0|1,0,0]=2 795 B17R0.250 CCCOCCCNCCCCCC(=O)OCC 2230a_100011217757_100000755133 [1,0,0,0,0,0|2,0,0]=3 796 B17R0.250 CCCOCCCNCCCCCC(=O)OCC 34a_100011217757_100000755133 [1,0,0,0,0,0|2,0,0]=3 797 B17R0.250 CCCOCCCNCCCOCC(=O)OCC 2230a_100011217757_100009893628 [1,0,0,0,0,0|3,0,0]=4 798 B17R0.250 CCCOCCCNCCCOCC(=O)OCC 34a_100011217757_100009893628 [1,0,0,0,0,0|3,0,0]=4 799 B17R0.250 CCCOCCNCCCCCCC(=O)OCC 2230a_100161115042_100009814379 [1,0,0,0,0,0|2,0,0]=3 800 B17R0.250 CCCOCCNCCCCCCC(=O)OCC 34a_100161115042_100009814379 [1,0,0,0,0,0|2,0,0]=3 801 B17R0.250 CCCOCCOCCCCCCC(=O)OCC 34a_100000752267_100009814379 [1,0,0,0,0,0|2,0,0]=3 802 B17R0.250 CCCOCCOCCCCCCC(=O)OCC 7a_100000752267_100009814379 [1,0,0,0,0,0|2,0,0]=3 803 B17R0.250 CCCOCCOCCNCCCC(=O)OCC 2230a_200011904461_100009991533 [1,0,0,0,0,0|3,0,0]=4 804 B17R0.250 CCCOCCOCCNCCCC(=O)OCC 34a_200011904461_100009991533 [1,0,0,0,0,0|3,0,0]=4 805 B17R0.250 CCCOCCSCCCCCCC(=O)OCC 62a_100011215938_100009814379 [1,0,0,0,0,0|2,0,0]=3 806 B17R0.250 CCCSCCCCCCCCCC(=O)OCC 62a_100000210303_100009828014 [1,0,0,0,0,0|1,0,0]=2 807 B17R0.250 CCCSCCNCCCCCCC(=O)OCC 2230a_100020603323_100009814379 [1,0,0,0,0,0|2,0,0]=3 808 B17R0.250 CCCSCCOCCCCCCC(=O)OCC 34a_200000230433_100009814379 [1,0,0,0,0,0|2,0,0]=3 809 B17R0.250 CCCSCCOCCCCCCC(=O)OCC 7a_200000230433_100009814379 [1,0,0,0,0,0|2,0,0]=3 810 B17R0.250 CCNC(=O)CCCCCCCCCCCCO 240690a_100015525214_100102582631 [1,0,0,0,0,0|2,0,0]=3 811 B17R0.250 CCNC(=O)CCNCCCCCCCCCO 2230a_100000078944_100000737597 [1,0,0,0,0,0|3,0,0]=4 812 B17R0.250 CCNC(=O)CCNCCCCCCCCCO 34a_100025743525_100009813782 [1,0,0,0,0,0|3,0,0]=4 813 B17R0.250 CCNC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000737597 [1,0,0,0,0,0|3,0,0]=4 814 B17R0.250 CCNC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000737597 [1,0,0,0,0,0|3,0,0]=4 815 B17R0.250 CCNC(=O)CCSCCCCCCCCCO 62a_100000737597_100009813782 [1,0,0,0,0,0|3,0,0]=4 816 B17R0.250 CCNC(=O)CCSCCCCCCCCCO 62a_100009813782_100000737597 [1,0,0,0,0,0|3,0,0]=4 817 B17R0.250 CCNC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000183381 [1,0,0,0,0,0|3,0,0]=4 818 B17R0.250 CCNC(=O)CNCCCCCCCCCCO 2230a_100016988866_100009813290 [1,0,0,0,0,0|3,0,0]=4 819 B17R0.250 CCNC(=O)CNCCCCCCCCCCO 34a_100000066964_100000183381 [1,0,0,0,0,0|3,0,0]=4 820 B17R0.250 CCNC(=O)COCCCCCCCCCCBr 34a_100009813290_100000183381 [1,0,0,0,0,0|3,0,0]=4 821 B17R0.250 CCNC(=O)COCCCCCCCCCCBr 7a_100009813290_100000183381 [1,0,0,0,0,0|3,0,0]=4 822 B17R0.250 CCNC(=O)COCCCCCCCCCCCl 34a_200000033068_100000183381 [1,0,0,0,0,0|3,0,0]=4 823 B17R0.250 CCNC(=O)COCCCCCCCCCCCl 7a_200000033068_100000183381 [1,0,0,0,0,0|3,0,0]=4 824 B17R0.250 CCNC(=O)COCCCCCCCCCCN 34a_100000066964_100000183381 [1,0,0,0,0,0|3,0,0]=4 825 B17R0.250 CCNC(=O)CSCCCCCCCCCCO 62a_100000183381_200000033068 [1,0,0,0,0,0|3,0,0]=4 826 B17R0.250 CCNC(=O)CSCCCCCCCCCCO 62a_100009813290_100000183381 [1,0,0,0,0,0|3,0,0]=4 827 B17R0.250 CCNCCCCCCCCCCC(=O)OCC 2230a_100015525214_100009827693 [1,0,0,0,0,0|1,0,0]=2 828 B17R0.250 CCOC(=O)CCCCCCCCCCCNC 2230a_106832991635_100103168309 [1,0,0,0,0,0|1,0,0]=2 829 B17R0.250 CCOC(=O)CCCCCCCCCCCNC 34a_100102657272_100103168309 [1,0,0,0,0,0|1,0,0]=2 830 B17R0.250 CCOC(=O)CCCCCCCCCCCNC 7a_106832991635_100103168309 [1,0,0,0,0,0|1,0,0]=2 831 B17R0.250 CCOC(=O)CCCCCCCCCCCOC 34a_100138415774_100103168309 [1,0,0,0,0,0|1,0,0]=2 832 B17R0.250 CCOC(=O)CCCCCCCCCCCSC 62a_200000210301_100103168309 [1,0,0,0,0,0|1,0,0]=2 833 B17R0.250 CCOC(=O)CCCCCCCCCCCS[13CH3] 62a_200025704644_100103168309 [1,0,0,0,0,0|1,0,0]=2 834 B17R0.250 CCOC(=O)CCCCCCCCCCSCC 62a_100000210202_100009827693 [1,0,0,0,0,0|1,0,0]=2 835 B17R0.250 CCOC(=O)CCCCCCCCCCSCF 62a_100015361967_100009827693 [1,0,0,0,0,0|2,0,0]=3 836 B17R0.250 CCOC(=O)CCCCCCCCCNCCF 34a_100000724931_100009828014 [1,0,0,0,0,0|2,0,0]=3 837 B17R0.250 CCOC(=O)CCCCCCCCCNCCO 2230a_100016997473_100009828014 [1,0,0,0,0,0|2,0,0]=3 838 B17R0.250 CCOC(=O)CCCCCCCCCNCCO 34a_100016990907_100009828014 [1,0,0,0,0,0|2,0,0]=3 839 B17R0.250 CCOC(=O)CCCCCCCCCOCCBr 34a_100000211926_100009828014 [1,0,0,0,0,0|2,0,0]=3 840 B17R0.250 CCOC(=O)CCCCCCCCCOCCN 34a_100000210304_100009828014 [1,0,0,0,0,0|2,0,0]=3 841 B17R0.250 CCOC(=O)CCCCCCCCCSCC#N 62a_100011215382_100009828014 [1,0,0,0,0,0|2,0,1]=4 842 B17R0.250 CCOC(=O)CCCCCCCCCSCC=O 62a_200015260668_100009828014 [1,0,0,0,0,0|2,0,1]=4 843 B17R0.250 CCOC(=O)CCCCCCCCCSCCF 62a_100011217306_100009828014 [1,0,0,0,0,0|2,0,0]=3 844 B17R0.250 CCOC(=O)CCCCCCCCCSCCO 62a_100000211926_100009828014 [1,0,0,0,0,0|2,0,0]=3 845 B17R0.250 CCOC(=O)CCCCCCCCCSCOC 62a_100000766300_100009828014 [1,0,0,0,0,0|2,0,0]=3 846 B17R0.250 CCOC(=O)CCCCCCCCCSCSC 62a_100011218213_100009828014 [1,0,0,0,0,0|2,0,0]=3 847 B17R0.250 CCOC(=O)CCCCCCCCNCCCF 2230a_100015189416_100010175975 [1,0,0,0,0,0|2,0,0]=3 848 B17R0.250 CCOC(=O)CCCCCCCCNCCCF 34a_100015189416_100010175975 [1,0,0,0,0,0|2,0,0]=3 849 B17R0.250 CCOC(=O)CCCCCCCCNCCOC 2230a_100000209980_100010175975 [1,0,0,0,0,0|2,0,0]=3 850 B17R0.250 CCOC(=O)CCCCCCCCNCCSC 2230a_100020590264_100010175975 [1,0,0,0,0,0|2,0,0]=3 851 B17R0.250 CCOC(=O)CCCCCCCCOCCCBr 34a_100011217188_100010175975 [1,0,0,0,0,0|2,0,0]=3 852 B17R0.250 CCOC(=O)CCCCCCCCOCCCCl 34a_100000230001_100010175975 [1,0,0,0,0,0|2,0,0]=3 853 B17R0.250 CCOC(=O)CCCCCCCCOCCCF 34a_100000759539_100010175975 [1,0,0,0,0,0|2,0,0]=3 854 B17R0.250 CCOC(=O)CCCCCCCCOCCCN 34a_100000182051_100010175975 [1,0,0,0,0,0|2,0,0]=3 855 B17R0.250 CCOC(=O)CCCCCCCCOCCOC 34a_100000210237_100010175975 [1,0,0,0,0,0|2,0,0]=3 856 B17R0.250 CCOC(=O)CCCCCCCCOCCON 34a_100000700252_100010175975 [1,0,0,0,0,0|3,0,0]=4 857 B17R0.250 CCOC(=O)CCCCCCCCOCCSC 34a_100000230434_100010175975 [1,0,0,0,0,0|2,0,0]=3 858 B17R0.250 CCOC(=O)CCCCCCCCOCCSC 7a_100000230434_100010175975 [1,0,0,0,0,0|2,0,0]=3 859 B17R0.250 CCOC(=O)CCCCCCCCSCCC#N 62a_100011215226_100010175975 [1,0,0,0,0,0|2,0,1]=4 860 B17R0.250 CCOC(=O)CCCCCCCCSCCCF 62a_100011934791_100010175975 [1,0,0,0,0,0|2,0,0]=3 861 B17R0.250 CCOC(=O)CCCCCCCCSCCCO 62a_100011215043_100010175975 [1,0,0,0,0,0|2,0,0]=3 862 B17R0.250 CCOC(=O)CCCCCCCCSCCOC 62a_100000233755_100010175975 [1,0,0,0,0,0|2,0,0]=3 863 B17R0.250 CCOC(=O)CCCCCCCCSCCSC 62a_100000212216_100010175975 [1,0,0,0,0,0|2,0,0]=3 864 B17R0.250 CCOC(=O)CCCCCCCNCCCCO 2230a_100000750430_100009991516 [1,0,0,0,0,0|2,0,0]=3 865 B17R0.250 CCOC(=O)CCCCCCCNCCCCO 34a_100000750430_100009991516 [1,0,0,0,0,0|2,0,0]=3 866 B17R0.250 CCOC(=O)CCCCCCCNCCCOC 34a_100150723488_100009991516 [1,0,0,0,0,0|2,0,0]=3 867 B17R0.250 CCOC(=O)CCCCCCCNCCCSC 2230a_100000749238_100009991516 [1,0,0,0,0,0|2,0,0]=3 868 B17R0.250 CCOC(=O)CCCCCCCNCCSCC 2230a_100000106463_100009991516 [1,0,0,0,0,0|2,0,0]=3 869 B17R0.250 CCOC(=O)CCCCCCCOCCCCBr 34a_100011216708_100009991516 [1,0,0,0,0,0|2,0,0]=3 870 B17R0.250 CCOC(=O)CCCCCCCOCCCCCl 34a_100000210776_100009991516 [1,0,0,0,0,0|2,0,0]=3 871 B17R0.250 CCOC(=O)CCCCCCCOCCCCCl 7a_100000210776_100009991516 [1,0,0,0,0,0|2,0,0]=3 872 B17R0.250 CCOC(=O)CCCCCCCOCCCCF 34a_100011995726_100009991516 [1,0,0,0,0,0|2,0,0]=3 873 B17R0.250 CCOC(=O)CCCCCCCOCCCCF 7a_100011995726_100009991516 [1,0,0,0,0,0|2,0,0]=3 874 B17R0.250 CCOC(=O)CCCCCCCOCCCCI 34a_200012148704_100009991516 [1,0,0,0,0,0|2,0,0]=3 875 B17R0.250 CCOC(=O)CCCCCCCOCCCCN 34a_100000750430_100009991516 [1,0,0,0,0,0|2,0,0]=3 876 B17R0.250 CCOC(=O)CCCCCCCOCCCNC 34a_100000213112_100009991516 [1,0,0,0,0,0|2,0,0]=3 877 B17R0.250 CCOC(=O)CCCCCCCOCCCOC 34a_100000740835_100009991516 [1,0,0,0,0,0|2,0,0]=3 878 B17R0.250 CCOC(=O)CCCCCCCOCCCSC 34a_100000690336_100009991516 [1,0,0,0,0,0|2,0,0]=3 879 B17R0.250 CCOC(=O)CCCCCCCOCCCSC 7a_100000690336_100009991516 [1,0,0,0,0,0|2,0,0]=3 880 B17R0.250 CCOC(=O)CCCCCCCOCCSCC 34a_100000212035_100009991516 [1,0,0,0,0,0|2,0,0]=3 881 B17R0.250 CCOC(=O)CCCCCCCOCCSCC 7a_100000212035_100009991516 [1,0,0,0,0,0|2,0,0]=3 882 B17R0.250 CCOC(=O)CCCCCCCSCCCC#N 62a_100000687738_100009991516 [1,0,0,0,0,0|2,0,1]=4 883 B17R0.250 CCOC(=O)CCCCCCCSCCCC=O 62a_200011292268_100009991516 [1,0,0,0,0,0|2,0,1]=4 884 B17R0.250 CCOC(=O)CCCCCCCSCCCCF 62a_100000729493_100009991516 [1,0,0,0,0,0|2,0,0]=3 885 B17R0.250 CCOC(=O)CCCCCCCSCCCCO 62a_100000210776_100009991516 [1,0,0,0,0,0|2,0,0]=3 886 B17R0.250 CCOC(=O)CCCCCCCSCCCOC 62a_100000709357_100009991516 [1,0,0,0,0,0|2,0,0]=3 887 B17R0.250 CCOC(=O)CCCCCCCSCCSCC 62a_100000757381_100009991516 [1,0,0,0,0,0|2,0,0]=3 888 B17R0.250 CCOC(=O)CCCCCCNCCCCCO 2230a_100000762737_100009814379 [1,0,0,0,0,0|2,0,0]=3 889 B17R0.250 CCOC(=O)CCCCCCNCCCCCO 34a_100000762737_100009814379 [1,0,0,0,0,0|2,0,0]=3 890 B17R0.250 CCOC(=O)CCCCCCNCCOCCO 2230a_100000211614_100009814379 [1,0,0,0,0,0|3,0,0]=4 891 B17R0.250 CCOC(=O)CCCCCCNCCOCCO 34a_100000211614_100009814379 [1,0,0,0,0,0|3,0,0]=4 892 B17R0.250 CCOC(=O)CCCCCCNCCSCCO 2230a_100011219999_100009814379 [1,0,0,0,0,0|3,0,0]=4 893 B17R0.250 CCOC(=O)CCCCCCOCCCCCBr 34a_100000746331_100009814379 [1,0,0,0,0,0|2,0,0]=3 894 B17R0.250 CCOC(=O)CCCCCCOCCCCCBr 7a_100000746331_100009814379 [1,0,0,0,0,0|2,0,0]=3 895 B17R0.250 CCOC(=O)CCCCCCOCCCCCCl 34a_100000746330_100009814379 [1,0,0,0,0,0|2,0,0]=3 896 B17R0.250 CCOC(=O)CCCCCCOCCCCCCl 7a_100000746330_100009814379 [1,0,0,0,0,0|2,0,0]=3 897 B17R0.250 CCOC(=O)CCCCCCOCCCCCI 34a_200012148887_100009814379 [1,0,0,0,0,0|2,0,0]=3 898 B17R0.250 CCOC(=O)CCCCCCOCCCCCI 7a_200012148887_100009814379 [1,0,0,0,0,0|2,0,0]=3 899 B17R0.250 CCOC(=O)CCCCCCOCCCCCN 34a_100000762737_100009814379 [1,0,0,0,0,0|2,0,0]=3 900 B17R0.250 CCOC(=O)CCCCCCOCCCCOC 34a_100000740925_100009814379 [1,0,0,0,0,0|2,0,0]=3 901 B17R0.250 CCOC(=O)CCCCCCOCCCCSC 34a_100011217163_100009814379 [1,0,0,0,0,0|2,0,0]=3 902 B17R0.250 CCOC(=O)CCCCCCOCCCCSC 7a_100011217163_100009814379 [1,0,0,0,0,0|2,0,0]=3 903 B17R0.250 CCOC(=O)CCCCCCOCCCSCC 34a_100011216438_100009814379 [1,0,0,0,0,0|2,0,0]=3 904 B17R0.250 CCOC(=O)CCCCCCOCCCSCC 7a_100011216438_100009814379 [1,0,0,0,0,0|2,0,0]=3 905 B17R0.250 CCOC(=O)CCCCCCOCCOCCBr 34a_100000692535_100009814379 [1,0,0,0,0,0|3,0,0]=4 906 B17R0.250 CCOC(=O)CCCCCCOCCOCCBr 7a_100000692535_100009814379 [1,0,0,0,0,0|3,0,0]=4 907 B17R0.250 CCOC(=O)CCCCCCOCCOCCCl 34a_100011215305_100009814379 [1,0,0,0,0,0|3,0,0]=4 908 B17R0.250 CCOC(=O)CCCCCCOCCOCCCl 7a_100011215305_100009814379 [1,0,0,0,0,0|3,0,0]=4 909 B17R0.250 CCOC(=O)CCCCCCOCCOCCF 34a_200015357709_100009814379 [1,0,0,0,0,0|3,0,0]=4 910 B17R0.250 CCOC(=O)CCCCCCOCCOCCF 7a_200015357709_100009814379 [1,0,0,0,0,0|3,0,0]=4 911 B17R0.250 CCOC(=O)CCCCCCOCCOCCI 34a_100012149058_100009814379 [1,0,0,0,0,0|3,0,0]=4 912 B17R0.250 CCOC(=O)CCCCCCOCCOCCI 7a_100012149058_100009814379 [1,0,0,0,0,0|3,0,0]=4 913 B17R0.250 CCOC(=O)CCCCCCOCCOCCN 34a_100000211614_100009814379 [1,0,0,0,0,0|3,0,0]=4 914 B17R0.250 CCOC(=O)CCCCCCSCCCCC#N 62a_100011219923_100009814379 [1,0,0,0,0,0|2,0,1]=4 915 B17R0.250 CCOC(=O)CCCCCCSCCCCC=O 62a_100000139335_100009814379 [1,0,0,0,0,0|2,0,1]=4 916 B17R0.250 CCOC(=O)CCCCCCSCCCCCF 62a_100000729378_100009814379 [1,0,0,0,0,0|2,0,0]=3 917 B17R0.250 CCOC(=O)CCCCCCSCCCCCO 62a_100000746330_100009814379 [1,0,0,0,0,0|2,0,0]=3 918 B17R0.250 CCOC(=O)CCCCCCSCCCCOC 62a_100000730899_100009814379 [1,0,0,0,0,0|2,0,0]=3 919 B17R0.250 CCOC(=O)CCCCCCSCCOCCO 62a_100011215305_100009814379 [1,0,0,0,0,0|3,0,0]=4 920 B17R0.250 CCOC(=O)CCCCCCSCOCCOC 62a_100000231047_100009814379 [1,0,0,0,0,0|3,0,0]=4 921 B17R0.250 CCOC(=O)CCCCCNCCCCCCO 2230a_100000686447_100000755133 [1,0,0,0,0,0|2,0,0]=3 922 B17R0.250 CCOC(=O)CCCCCNCCCCCCO 34a_100000686447_100000755133 [1,0,0,0,0,0|2,0,0]=3 923 B17R0.250 CCOC(=O)CCCCCNCCCCCOC 2230a_100000747528_100000755133 [1,0,0,0,0,0|2,0,0]=3 924 B17R0.250 CCOC(=O)CCCCCNCCCCCOC 34a_100000747528_100000755133 [1,0,0,0,0,0|2,0,0]=3 925 B17R0.250 CCOC(=O)CCCCCNCCOCCOC 2230a_100000745349_100000755133 [1,0,0,0,0,0|3,0,0]=4 926 B17R0.250 CCOC(=O)CCCCCNCCOCCOC 34a_100000745349_100000755133 [1,0,0,0,0,0|3,0,0]=4 927 B17R0.250 CCOC(=O)CCCCCOCCCCCC#N 7a_100011214988_100009813376 [1,0,0,0,0,0|2,0,1]=4 928 B17R0.250 CCOC(=O)CCCCCOCCCCCC=O 7a_100011214988_100000139337 [1,0,0,0,0,0|2,0,1]=4 929 B17R0.250 CCOC(=O)CCCCCOCCCCCCBr 34a_100011215345_100000755133 [1,0,0,0,0,0|2,0,0]=3 930 B17R0.250 CCOC(=O)CCCCCOCCCCCCBr 7a_100011215345_100000755133 [1,0,0,0,0,0|2,0,0]=3 931 B17R0.250 CCOC(=O)CCCCCOCCCCCCCl 34a_100000766143_100000755133 [1,0,0,0,0,0|2,0,0]=3 932 B17R0.250 CCOC(=O)CCCCCOCCCCCCCl 7a_100000766143_100000755133 [1,0,0,0,0,0|2,0,0]=3 933 B17R0.250 CCOC(=O)CCCCCOCCCCCCF 34a_100000732779_100000755133 [1,0,0,0,0,0|2,0,0]=3 934 B17R0.250 CCOC(=O)CCCCCOCCCCCCF 7a_100000732779_100000755133 [1,0,0,0,0,0|2,0,0]=3 935 B17R0.250 CCOC(=O)CCCCCOCCCCCCF 7a_100011214988_100015922095 [1,0,0,0,0,0|2,0,0]=3 936 B17R0.250 CCOC(=O)CCCCCOCCCCCCN 34a_100000686447_100000755133 [1,0,0,0,0,0|2,0,0]=3 937 B17R0.250 CCOC(=O)CCCCCOCCCCCCO 7a_100011214988_100000766143 [1,0,0,0,0,0|2,0,0]=3 938 B17R0.250 CCOC(=O)CCCCCOCCCCCNC 34a_100000722520_100000755133 [1,0,0,0,0,0|2,0,0]=3 939 B17R0.250 CCOC(=O)CCCCCOCCOCCNC 34a_100000228057_100000755133 [1,0,0,0,0,0|3,0,0]=4 940 B17R0.250 CCOC(=O)CCCCCOCCOCCOC 34a_100011215163_100000755133 [1,0,0,0,0,0|3,0,0]=4 941 B17R0.250 CCOC(=O)CCCCCOCCOCCOC 7a_100011214988_100000695917 [1,0,0,0,0,0|3,0,0]=4 942 B17R0.250 CCOC(=O)CCCCCOCCOCCOC 7a_100011215163_100000755133 [1,0,0,0,0,0|3,0,0]=4 943 B17R0.250 CCOC(=O)CCCCCSCCCCCC#N 62a_100000755133_100009813376 [1,0,0,0,0,0|2,0,1]=4 944 B17R0.250 CCOC(=O)CCCCCSCCCCCC#N 62a_100009813376_100000755133 [1,0,0,0,0,0|2,0,1]=4 945 B17R0.250 CCOC(=O)CCCCCSCCCCCC=O 62a_100000139337_100000755133 [1,0,0,0,0,0|2,0,1]=4 946 B17R0.250 CCOC(=O)CCCCCSCCCCCC=O 62a_100000755133_100000139337 [1,0,0,0,0,0|2,0,1]=4 947 B17R0.250 CCOC(=O)CCCCCSCCCCCCF 62a_100000755133_100015922095 [1,0,0,0,0,0|2,0,0]=3 948 B17R0.250 CCOC(=O)CCCCCSCCCCCCF 62a_100015922095_100000755133 [1,0,0,0,0,0|2,0,0]=3 949 B17R0.250 CCOC(=O)CCCCCSCCCCCCO 62a_100000755133_100000766143 [1,0,0,0,0,0|2,0,0]=3 950 B17R0.250 CCOC(=O)CCCCCSCCCCCCO 62a_100000766143_100000755133 [1,0,0,0,0,0|2,0,0]=3 951 B17R0.250 CCOC(=O)CCCCCSCCOCCOC 62a_100000695917_100000755133 [1,0,0,0,0,0|3,0,0]=4 952 B17R0.250 CCOC(=O)CCCCCSCCOCCOC 62a_100000755133_100000695917 [1,0,0,0,0,0|3,0,0]=4 953 B17R0.250 CCOC(=O)CCCCNCCCCCCCO 2230a_100011996573_100000750268 [1,0,0,0,0,0|2,0,0]=3 954 B17R0.250 CCOC(=O)CCCCNCCCCCCCO 34a_100011996573_100000750268 [1,0,0,0,0,0|2,0,0]=3 955 B17R0.250 CCOC(=O)CCCCNCCCOCCCO 2230a_100011310245_100000750268 [1,0,0,0,0,0|3,0,0]=4 956 B17R0.250 CCOC(=O)CCCCNCCCOCCCO 34a_100011310245_100000750268 [1,0,0,0,0,0|3,0,0]=4 957 B17R0.250 CCOC(=O)CCCCNCCCOCCOC 2230a_100000206027_100000750268 [1,0,0,0,0,0|3,0,0]=4 958 B17R0.250 CCOC(=O)CCCCNCCCOCCOC 34a_100000206027_100000750268 [1,0,0,0,0,0|3,0,0]=4 959 B17R0.250 CCOC(=O)CCCCOCCCCCCCBr 34a_100000760002_100000750268 [1,0,0,0,0,0|2,0,0]=3 960 B17R0.250 CCOC(=O)CCCCOCCCCCCCBr 7a_100000760002_100000750268 [1,0,0,0,0,0|2,0,0]=3 961 B17R0.250 CCOC(=O)CCCCOCCCCCCCN 34a_100011996573_100000750268 [1,0,0,0,0,0|2,0,0]=3 962 B17R0.250 CCOC(=O)CCCCOCCCCCCOC 34a_200012092642_100000750268 [1,0,0,0,0,0|2,0,0]=3 963 B17R0.250 CCOC(=O)CCCCOCCCCCCOC 7a_200012092642_100000750268 [1,0,0,0,0,0|2,0,0]=3 964 B17R0.250 CCOC(=O)CCCCOCCCOCCCN 34a_100011310245_100000750268 [1,0,0,0,0,0|3,0,0]=4 965 B17R0.250 CCOC(=O)CCCCSCCCCCCC#N 62a_100000750268_100009813337 [1,0,0,0,0,0|2,0,1]=4 966 B17R0.250 CCOC(=O)CCCCSCCCCCCC#N 62a_100009813337_100000750268 [1,0,0,0,0,0|2,0,1]=4 967 B17R0.250 CCOC(=O)CCCCSCCCCCCCO 62a_100000750268_100000760002 [1,0,0,0,0,0|2,0,0]=3 968 B17R0.250 CCOC(=O)CCCCSCCCCCCCO 62a_100000760002_100000750268 [1,0,0,0,0,0|2,0,0]=3 969 B17R0.250 CCOC(=O)CCCCSCCCCCCOC 62a_100000750268_100011998445 [1,0,0,0,0,0|2,0,0]=3 970 B17R0.250 CCOC(=O)CCCCSCCCCCCOC 62a_100011998445_100000750268 [1,0,0,0,0,0|2,0,0]=3 971 B17R0.250 CCOC(=O)CCCCSCCCOCCOC 62a_100000750268_100011216529 [1,0,0,0,0,0|3,0,0]=4 972 B17R0.250 CCOC(=O)CCCCSCCCOCCOC 62a_100011216529_100000750268 [1,0,0,0,0,0|3,0,0]=4 973 B17R0.250 CCOC(=O)CCCNCCCCCCCCO 2230a_102515433106_100009991533 [1,0,0,0,0,0|2,0,0]=3 974 B17R0.250 CCOC(=O)CCCNCCCCCCCCO 34a_102515433106_100009991533 [1,0,0,0,0,0|2,0,0]=3 975 B17R0.250 CCOC(=O)CCCOCCCCCCCCBr 34a_100009813846_100009991533 [1,0,0,0,0,0|2,0,0]=3 976 B17R0.250 CCOC(=O)CCCOCCCCCCCCBr 7a_100009813846_100011215271 [1,0,0,0,0,0|2,0,0]=3 977 B17R0.250 CCOC(=O)CCCOCCCCCCCCCl 34a_100000033203_100009991533 [1,0,0,0,0,0|2,0,0]=3 978 B17R0.250 CCOC(=O)CCCOCCCCCCCCCl 7a_100000033203_100011215271 [1,0,0,0,0,0|2,0,0]=3 979 B17R0.250 CCOC(=O)CCCOCCCCCCCCN 34a_102515433106_100009991533 [1,0,0,0,0,0|2,0,0]=3 980 B17R0.250 CCOC(=O)CCCOCCCCCCCCO 7a_100012001163_100000033203 [1,0,0,0,0,0|2,0,0]=3 981 B17R0.250 CCOC(=O)CCCOCCCCCNCCN 34a_103619048469_100009991533 [1,0,0,0,0,0|3,0,0]=4 982 B17R0.250 CCOC(=O)CCCOCCCOCCCOC 34a_200011215475_100009991533 [1,0,0,0,0,0|3,0,0]=4 983 B17R0.250 CCOC(=O)CCCOCCCOCCCOC 7a_200011215475_100011215271 [1,0,0,0,0,0|3,0,0]=4 984 B17R0.250 CCOC(=O)CCCSCCCCCCCCO 62a_100000033203_100009991533 [1,0,0,0,0,0|2,0,0]=3 985 B17R0.250 CCOC(=O)CCCSCCCCCCCCO 62a_100009991533_100000033203 [1,0,0,0,0,0|2,0,0]=3 986 B17R0.250 CCOC(=O)CCNCCCCCCCCCO 2230a_100000078944_100011206558 [1,0,0,0,0,0|2,0,0]=3 987 B17R0.250 CCOC(=O)CCNCCCCCCCCCO 34a_100000078944_100000765890 [1,0,0,0,0,0|2,0,0]=3 988 B17R0.250 CCOC(=O)CCOCCCCCCCCCBr 34a_100009813782_100000765890 [1,0,0,0,0,0|2,0,0]=3 989 B17R0.250 CCOC(=O)CCOCCCCCCCCCBr 7a_100009813782_100011206558 [1,0,0,0,0,0|2,0,0]=3 990 B17R0.250 CCOC(=O)CCOCCCCCCCCCCl 34a_100009868337_100000765890 [1,0,0,0,0,0|2,0,0]=3 991 B17R0.250 CCOC(=O)CCOCCCCCCCCCCl 7a_100009868337_100011206558 [1,0,0,0,0,0|2,0,0]=3 992 B17R0.250 CCOC(=O)CCOCCCCCCCCCN 34a_100000078944_100000765890 [1,0,0,0,0,0|2,0,0]=3 993 B17R0.250 CCOC(=O)CCSCCCCCCCCCO 62a_100000765890_100009813782 [1,0,0,0,0,0|2,0,0]=3 994 B17R0.250 CCOC(=O)CCSCCCCCCCCCO 62a_100009813782_100000765890 [1,0,0,0,0,0|2,0,0]=3 995 B17R0.250 CCOC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000188475 [1,0,0,0,0,0|2,0,0]=3 996 B17R0.250 CCOC(=O)CNCCCCCCCCCCO 34a_100000066964_100000188475 [1,0,0,0,0,0|2,0,0]=3 997 B17R0.250 CCOC(=O)COCCCCCCCCCCBr 34a_100009813290_100000188475 [1,0,0,0,0,0|2,0,0]=3 998 B17R0.250 CCOC(=O)COCCCCCCCCCCBr 7a_100009813290_100000188475 [1,0,0,0,0,0|2,0,0]=3 999 B17R0.250 CCOC(=O)COCCCCCCCCCCCl 34a_200000033068_100000188475 [1,0,0,0,0,0|2,0,0]=3 1000 B17R0.250 CCOC(=O)COCCCCCCCCCCCl 7a_200000033068_100000188475 [1,0,0,0,0,0|2,0,0]=3 1001 B17R0.250 CCOC(=O)COCCCCCCCCCCN 34a_100000066964_100000188475 [1,0,0,0,0,0|2,0,0]=3 1002 B17R0.250 CCOC(=O)COCCCNCCCCCCO 2230a_100000686447_100009893628 [1,0,0,0,0,0|3,0,0]=4 1003 B17R0.250 CCOC(=O)COCCCNCCCCCCO 34a_100000686447_100009893628 [1,0,0,0,0,0|3,0,0]=4 1004 B17R0.250 CCOC(=O)COCCCNCCCCCOC 2230a_100000747528_100009893628 [1,0,0,0,0,0|3,0,0]=4 1005 B17R0.250 CCOC(=O)COCCCNCCCCCOC 34a_100000747528_100009893628 [1,0,0,0,0,0|3,0,0]=4 1006 B17R0.250 CCOC(=O)COCCCOCCCCCCBr 34a_100011215345_100009893628 [1,0,0,0,0,0|3,0,0]=4 1007 B17R0.250 CCOC(=O)COCCCOCCCCCCBr 7a_100011215345_100009893628 [1,0,0,0,0,0|3,0,0]=4 1008 B17R0.250 CCOC(=O)COCCCOCCCCCCCl 34a_100000766143_100009893628 [1,0,0,0,0,0|3,0,0]=4 1009 B17R0.250 CCOC(=O)COCCCOCCCCCCCl 7a_100000766143_100009893628 [1,0,0,0,0,0|3,0,0]=4 1010 B17R0.250 CCOC(=O)COCCCOCCCCCCF 34a_100000732779_100009893628 [1,0,0,0,0,0|3,0,0]=4 1011 B17R0.250 CCOC(=O)COCCCOCCCCCCF 7a_100000732779_100009893628 [1,0,0,0,0,0|3,0,0]=4 1012 B17R0.250 CCOC(=O)COCCCOCCCCCCN 34a_100000686447_100009893628 [1,0,0,0,0,0|3,0,0]=4 1013 B17R0.250 CCOC(=O)COCCCOCCCCCNC 34a_100000722520_100009893628 [1,0,0,0,0,0|3,0,0]=4 1014 B17R0.250 CCOC(=O)COCCCSCCCCCCF 62a_100009893628_100015922095 [1,0,0,0,0,0|3,0,0]=4 1015 B17R0.250 CCOC(=O)COCCCSCCCCCCF 62a_100015922095_100009893628 [1,0,0,0,0,0|3,0,0]=4 1016 B17R0.250 CCOC(=O)COCCCSCCCCCCO 62a_100000766143_100009893628 [1,0,0,0,0,0|3,0,0]=4 1017 B17R0.250 CCOC(=O)COCCCSCCCCCCO 62a_100009893628_100000766143 [1,0,0,0,0,0|3,0,0]=4 1018 B17R0.250 CCOC(=O)COCCNCCCCCCCO 2230a_100011996573_100000088970 [1,0,0,0,0,0|3,0,0]=4 1019 B17R0.250 CCOC(=O)COCCNCCCCCCCO 34a_100011996573_100000088970 [1,0,0,0,0,0|3,0,0]=4 1020 B17R0.250 CCOC(=O)COCCOCCCCCCCBr 34a_100000760002_100000088970 [1,0,0,0,0,0|3,0,0]=4 1021 B17R0.250 CCOC(=O)COCCOCCCCCCCBr 7a_100000760002_100000088970 [1,0,0,0,0,0|3,0,0]=4 1022 B17R0.250 CCOC(=O)COCCOCCCCCCCN 34a_100011996573_100000088970 [1,0,0,0,0,0|3,0,0]=4 1023 B17R0.250 CCOC(=O)COCCOCCCCCCOC 34a_200012092642_100000088970 [1,0,0,0,0,0|3,0,0]=4 1024 B17R0.250 CCOC(=O)COCCOCCCCCCOC 7a_200012092642_100000088970 [1,0,0,0,0,0|3,0,0]=4 1025 B17R0.250 CCOC(=O)COCCSCCCCCCCO 62a_100000088970_100000760002 [1,0,0,0,0,0|3,0,0]=4 1026 B17R0.250 CCOC(=O)COCCSCCCCCCCO 62a_100000760002_100000088970 [1,0,0,0,0,0|3,0,0]=4 1027 B17R0.250 CCOC(=O)COCCSCCCCCCOC 62a_100000088970_100011998445 [1,0,0,0,0,0|3,0,0]=4 1028 B17R0.250 CCOC(=O)COCCSCCCCCCOC 62a_100011998445_100000088970 [1,0,0,0,0,0|3,0,0]=4 1029 B17R0.250 CCOC(=O)CSCCCCCCCCCCO 62a_100000188475_200000033068 [1,0,0,0,0,0|2,0,0]=3 1030 B17R0.250 CCOC(=O)CSCCCCCCCCCCO 62a_100009813290_100000188475 [1,0,0,0,0,0|2,0,0]=3 1031 B17R0.250 CCOC(=O)CSCCOCCCCCCCO 7a_200000230590_100000760002 [1,0,0,0,0,0|3,0,0]=4 1032 B17R0.250 CCOC(=O)CSCCOCCCCCCOC 7a_200000230590_100011998445 [1,0,0,0,0,0|3,0,0]=4 1033 B17R0.250 CCOC(=O)NCCOCCCCCCCCBr 7a_100009813846_200011445536 [1,0,0,0,0,0|3,0,0]=4 1034 B17R0.250 CCOC(=O)NCCOCCCCCCCCCl 7a_100000033203_200011445536 [1,0,0,0,0,0|3,0,0]=4 1035 B17R0.250 CCOC(=O)NCCOCCCCCCCCO 34a_100000158857_100000033203 [1,0,0,0,0,0|3,0,0]=4 1036 B17R0.250 CCOC(=O)NCCSCCCCCCCCO 62a_100000033203_200011445536 [1,0,0,0,0,0|3,0,0]=4 1037 B17R0.250 CCOC(=O)OCSCCCCCCCCCO 62a_100009813782_100000075025 [1,0,0,0,0,0|3,0,0]=4 1038 B17R0.250 CCOCCCCCCCCCCC(=O)OCC 34a_100121572206_100009827693 [1,0,0,0,0,0|1,0,0]=2 1039 B17R0.250 CCOCCCNCCCCCCC(=O)OCC 2230a_100000210961_100009814379 [1,0,0,0,0,0|2,0,0]=3 1040 B17R0.250 CCOCCCNCCCCCCC(=O)OCC 34a_100000210961_100009814379 [1,0,0,0,0,0|2,0,0]=3 1041 B17R0.250 CCOCCCOCCCCCCC(=O)OCC 34a_100000757476_100009814379 [1,0,0,0,0,0|2,0,0]=3 1042 B17R0.250 CCOCCCOCCCCCCC(=O)OCC 7a_100000757476_100009814379 [1,0,0,0,0,0|2,0,0]=3 1043 B17R0.250 CCOCCCSCCCCCCC(=O)OCC 62a_100012232248_100009814379 [1,0,0,0,0,0|2,0,0]=3 1044 B17R0.250 CCOCCNCCCCCCCC(=O)OCC 2230a_102516460346_100009991516 [1,0,0,0,0,0|2,0,0]=3 1045 B17R0.250 CCOCCNCCCCCCCC(=O)OCC 34a_102516460346_100009991516 [1,0,0,0,0,0|2,0,0]=3 1046 B17R0.250 CCOCCOCCCCCCCC(=O)OCC 34a_100000210136_100009991516 [1,0,0,0,0,0|2,0,0]=3 1047 B17R0.250 CCOCCOCCCCCCCC(=O)OCC 7a_100000210136_100009991516 [1,0,0,0,0,0|2,0,0]=3 1048 B17R0.250 CCOCCOCCNCCCCC(=O)OCC 2230a_100102712874_100000750268 [1,0,0,0,0,0|3,0,0]=4 1049 B17R0.250 CCOCCOCCNCCCCC(=O)OCC 34a_100102712874_100000750268 [1,0,0,0,0,0|3,0,0]=4 1050 B17R0.250 CCOCCOCCOCCCCC(=O)OCC 34a_100000210240_100000750268 [1,0,0,0,0,0|3,0,0]=4 1051 B17R0.250 CCOCCOCCOCCCCC(=O)OCC 7a_100000210240_100000750268 [1,0,0,0,0,0|3,0,0]=4 1052 B17R0.250 CCOCCOCCSCCCCC(=O)OCC 62a_100000750268_100011211534 [1,0,0,0,0,0|3,0,0]=4 1053 B17R0.250 CCOCCOCCSCCCCC(=O)OCC 62a_100011211534_100000750268 [1,0,0,0,0,0|3,0,0]=4 1054 B17R0.250 CCOCCSCCCCCCCC(=O)OCC 62a_100000210147_100009991516 [1,0,0,0,0,0|2,0,0]=3 1055 B17R0.250 CCOCSCCCCCCCCC(=O)OCC 62a_100000739092_100010175975 [1,0,0,0,0,0|2,0,0]=3 1056 B17R0.250 CNNC(=O)CCCCCCCCCCCCO 22a_100016993582_100102582631 [1,0,0,0,0,0|3,0,0]=4 1057 B17R0.250 COCC(=O)CCCCCCCCCCCCO 1458a_100000210968_100009813331 [1,0,0,0,0,0|3,0,0]=4 1058 B17R0.250 CSCC(=O)CCCCCCCCCCCCO 1458a_100000184570_100009813331 [1,0,0,0,0,0|3,0,0]=4 1059 B17R0.250 O=C(CCO)CCCCCCCCCCCCO 1458a_100011216618_100009813331 [1,0,0,0,0,0|3,0,0]=4 1060 B19R1.340 CCCCCCC1CCCC1NCC(=O)NC(C)C 269862a_100000168517_100000189428 [0,0,0,1,0,0|2,0,0]=3 1061 B19R1.340 CCCCCCC1CCCC1NCC(=O)NC(C)C 270004a_100000168517_100000189428 [0,0,0,1,0,0|2,0,0]=3 1062 B19R1.734 CC(C)OC(=O)COCC1CCCCN1CCCN 34a_200011473794_100011215430 [0,0,0,1,0,0|3,0,0]=4 1063 B19R1.1000 COCCCC1CCCCN1CCC(=O)NC(C)C 2230a_100011804088_100000737564 [0,0,0,1,0,0|3,0,0]=4 1064 B19R1.1000 COCCCC1CCCCN1CCC(=O)NC(C)C 269982a_100011804088_100000737564 [0,0,0,1,0,0|3,0,0]=4 1065 B19R1.1000 COCCCC1CCCCN1CCC(=O)OC(C)C 2230a_100011804088_100000760027 [0,0,0,1,0,0|2,0,0]=3 1066 B19R1.1000 COCCCC1CCCCN1CCC(=O)OC(C)C 269982a_100011804088_100000760027 [0,0,0,1,0,0|2,0,0]=3 1067 B19R1.1000 COCCCC1CCCCN1COC(=O)OC(C)C 269982a_100011804088_100010125566 [0,0,0,1,0,0|3,0,0]=4 1068 B19R1.7976 CC(C)OC(=O)CCCCCO[C@@H]1CCC[C@H]1C#N 34a_100011907464_200010986244 [0,0,0,1,0,0|2,0,1]=4 1069 B19R1.7976 CC(C)OC(=O)CCCCCO[C@@H]1CCC[C@H]1C#N 7a_100011907464_200010986244 [0,0,0,1,0,0|2,0,1]=4 1070 B19R1.8946 CCCCCCCCCCCN1CC(OC(C1)C)C 2230a_100000210032_100011215454 [0,0,0,1,0,0|2,0,1]=4 1071 B19R1.8946 CCCCCCCCCCCN1CC(OC(C1)C)C 269982a_100000210032_100011215454 [0,0,0,1,0,0|2,0,1]=4 1072 B19R1.8946 CCCCCCCCCCCN1CC(OC(C1)C)C 34a_100000210032_100011215454 [0,0,0,1,0,0|2,0,1]=4 1073 B19R1.8946 CCCCCCCCCCNC1CC(OC(C1)C)C 270004a_100000684558_200102525066 [0,0,0,1,0,0|2,0,1]=4 1074 B19R1.9588 CC(C)CC(=O)CCCCCCOC1CCCCO1 1458a_100000210554_100000033462 [0,0,0,1,0,0|3,0,0]=4 1075 B19R1.9588 CC(C)NC(=O)CCOCCCCC1CCCCC1 7a_100011215267_100000737564 [0,0,0,1,0,0|2,0,0]=3 1076 B19R1.9588 CC(C)NC(=O)COCCCCCN1CCCCC1 34a_100011216611_100000183996 [0,0,0,1,0,0|3,0,0]=4 1077 B19R1.9588 CC(C)NC(=O)COCCCCCN1CCCCC1 7a_100011216611_100000183996 [0,0,0,1,0,0|3,0,0]=4 1078 B19R1.9588 CC(C)OC(=O)CCCCCNCC1CCCCC1 2230a_100000210473_200010986244 [0,0,0,1,0,0|1,0,0]=2 1079 B19R1.9588 CC(C)OC(=O)CCCCCNCC1CCCCC1 34a_100000210473_200010986244 [0,0,0,1,0,0|1,0,0]=2 1080 B19R1.9588 CC(C)OC(=O)CCCCCNCC1CCCCO1 2230a_100000174945_200010986244 [0,0,0,1,0,0|2,0,0]=3 1081 B19R1.9588 CC(C)OC(=O)CCCCCNCC1CCCCO1 34a_100000174945_200010986244 [0,0,0,1,0,0|2,0,0]=3 1082 B19R1.9588 CC(C)OC(=O)CCCCCNCC1CCCOC1 2230a_100000720124_200010986244 [0,0,0,1,0,0|2,0,0]=3 1083 B19R1.9588 CC(C)OC(=O)CCCCCNCC1CCCOC1 34a_100000720124_200010986244 [0,0,0,1,0,0|2,0,0]=3 1084 B19R1.9588 CC(C)OC(=O)CCCCCNCC1CCOCC1 2230a_100000746373_200010986244 [0,0,0,1,0,0|2,0,0]=3 1085 B19R1.9588 CC(C)OC(=O)CCCCCNCC1CCOCC1 34a_100000746373_200010986244 [0,0,0,1,0,0|2,0,0]=3 1086 B19R1.9588 CC(C)OC(=O)CCCCCNCC1CCSCC1 2230a_100015188806_200010986244 [0,0,0,1,0,0|2,0,0]=3 1087 B19R1.9588 CC(C)OC(=O)CCCCCNCC1CCSCC1 34a_100015188806_200010986244 [0,0,0,1,0,0|2,0,0]=3 1088 B19R1.9588 CC(C)OC(=O)CCCCCNC[C@H]1COCCO1 2230a_100010981119_200010986244 [0,0,0,1,0,0|3,0,0]=4 1089 B19R1.9588 CC(C)OC(=O)CCCCCNC[C@H]1COCCO1 34a_100010981119_200010986244 [0,0,0,1,0,0|3,0,0]=4 1090 B19R1.9588 CC(C)OC(=O)CCCCCOCC1CC=CCC1 34a_100000210713_200010986244 [0,0,0,1,0,0|1,0,2]=4 1091 B19R1.9588 CC(C)OC(=O)CCCCCOCC1CCCCC1 34a_100000212181_200010986244 [0,0,0,1,0,0|1,0,0]=2 1092 B19R1.9588 CC(C)OC(=O)CCCCCOCC1CCCCC1 7a_100000212181_200010986244 [0,0,0,1,0,0|1,0,0]=2 1093 B19R1.9588 CC(C)OC(=O)CCCCCOCC1CCCCN1 34a_100000210821_200010986244 [0,0,0,1,0,0|2,0,0]=3 1094 B19R1.9588 CC(C)OC(=O)CCCCCOCC1CCCCO1 34a_100000211370_200010986244 [0,0,0,1,0,0|2,0,0]=3 1095 B19R1.9588 CC(C)OC(=O)CCCCCOCC1CCCCO1 7a_100000211370_200010986244 [0,0,0,1,0,0|2,0,0]=3 1096 B19R1.9588 CC(C)OC(=O)CCCCCOCC1CCCNC1 34a_100000211344_200010986244 [0,0,0,1,0,0|2,0,0]=3 1097 B19R1.9588 CC(C)OC(=O)CCCCCOCC1CCCOC1 34a_100000741520_200010986244 [0,0,0,1,0,0|2,0,0]=3 1098 B19R1.9588 CC(C)OC(=O)CCCCCOCC1CCNCC1 34a_100000738675_200010986244 [0,0,0,1,0,0|2,0,0]=3 1099 B19R1.9588 CC(C)OC(=O)CCCCCOCC1CCOCC1 34a_100000749013_200010986244 [0,0,0,1,0,0|2,0,0]=3 1100 B19R1.9588 CC(C)OC(=O)CCCCCOCC1CCSCC1 34a_100000070558_200010986244 [0,0,0,1,0,0|2,0,0]=3 1101 B19R1.9588 CC(C)OC(=O)CCCCCOCC1CCSCC1 7a_100000070558_200010986244 [0,0,0,1,0,0|2,0,0]=3 1102 B19R1.9588 CC(C)OC(=O)CCCCCOC[C@@H]1CNCCO1 34a_100015189573_200010986244 [0,0,0,1,0,0|3,0,0]=4 1103 B19R1.9588 CC(C)OC(=O)CCCCCOC[C@@H]1COCCN1 34a_100000717676_200010986244 [0,0,0,1,0,0|3,0,0]=4 1104 B19R1.9588 CC(C)OC(=O)CCCCCOC[C@H]1COCCO1 34a_100009875890_200010986244 [0,0,0,1,0,0|3,0,0]=4 1105 B19R1.9588 CC(C)OC(=O)CCCCCSCC1CCCCC1 62a_100000211423_200010986244 [0,0,0,1,0,0|1,0,0]=2 1106 B19R1.9588 CC(C)OC(=O)CCCCCSCC1CCCCC1 62a_200010986244_100000211423 [0,0,0,1,0,0|1,0,0]=2 1107 B19R1.9588 CC(C)OC(=O)CCCCCSCC1CCCCO1 62a_100000211543_200010986244 [0,0,0,1,0,0|2,0,0]=3 1108 B19R1.9588 CC(C)OC(=O)CCCCCSCC1CCCCO1 62a_200010986244_100000211543 [0,0,0,1,0,0|2,0,0]=3 1109 B19R1.9588 CC(C)OC(=O)CCCCCSCC1CCCOC1 62a_100000741521_200010986244 [0,0,0,1,0,0|2,0,0]=3 1110 B19R1.9588 CC(C)OC(=O)CCCCCSCC1CCCOC1 62a_200010986244_100000741521 [0,0,0,1,0,0|2,0,0]=3 1111 B19R1.9588 CC(C)OC(=O)CCCCCSCC1CCOCC1 62a_100000754603_200010986244 [0,0,0,1,0,0|2,0,0]=3 1112 B19R1.9588 CC(C)OC(=O)CCCCCSCC1CCOCC1 62a_200010986244_100000749018 [0,0,0,1,0,0|2,0,0]=3 1113 B19R1.9588 CC(C)OC(=O)CCOCCCCC1CCCCC1 7a_100011215267_100000760027 [0,0,0,1,0,0|1,0,0]=2 1114 B19R1.9588 CC(C)OC(=O)CCSCCCOC1CCCCO1 62a_100000700653_100000760027 [0,0,0,1,0,0|3,0,0]=4 1115 B19R1.9588 CC(C)OC(=O)CCSCCCOC1CCCCO1 62a_100000760027_100000700653 [0,0,0,1,0,0|3,0,0]=4 1116 B19R1.9588 CC(C)OC(=O)CNCCCCCN1CCOCC1 2230a_100015187005_100011215430 [0,0,0,1,0,0|3,0,0]=4 1117 B19R1.9588 CC(C)OC(=O)COCCCCCN1CCCCC1 34a_100011216611_100011215430 [0,0,0,1,0,0|2,0,0]=3 1118 B19R1.9588 CC(C)OC(=O)COCCCCCN1CCCCC1 7a_100011216611_100011215430 [0,0,0,1,0,0|2,0,0]=3 1119 B19R1.9588 CC(C)OC(=O)COCCOCCN1CCCCC1 34a_200011409831_100011215430 [0,0,0,1,0,0|3,0,0]=4 1120 B19R1.9588 CC(C)OC(=O)COCCOCCN1CCCCC1 7a_200011409831_100011215430 [0,0,0,1,0,0|3,0,0]=4 1121 B19R1.9588 CC(C)OC(=O)CSCCCCOC1CCCCO1 62a_100000031530_100011215430 [0,0,0,1,0,0|3,0,0]=4 1122 B19R1.9588 CC(C)OC(=O)CSCCCCOC1CCCCO1 62a_100011215430_100000031530 [0,0,0,1,0,0|3,0,0]=4 1123 B19R1.10546 CC(C)NC(=O)CCOCCCN1CCCCC1C 7a_100000213889_100000737564 [0,0,0,1,0,0|3,0,0]=4 1124 B19R1.10546 CC(C)OC(=O)CCCCCNC1CCCCC1C 2230a_100000211402_200010986244 [0,0,0,1,0,0|1,0,0]=2 1125 B19R1.10546 CC(C)OC(=O)CCCCCNC1CCCCC1C 34a_100000211402_200010986244 [0,0,0,1,0,0|1,0,0]=2 1126 B19R1.10546 CC(C)OC(=O)CCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_200010986244 [0,0,0,1,0,0|2,0,0]=3 1127 B19R1.10546 CC(C)OC(=O)CCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_200010986244 [0,0,0,1,0,0|2,0,0]=3 1128 B19R1.10546 CC(C)OC(=O)CCCCCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_200010986244 [0,0,0,1,0,0|3,0,0]=4 1129 B19R1.10546 CC(C)OC(=O)CCCCCN[C@H]1CCOC[C@@H]1F 2230a_100016994078_200010986244 [0,0,0,1,0,0|3,0,0]=4 1130 B19R1.10546 CC(C)OC(=O)CCCCCN[C@H]1CCOC[C@@H]1F 34a_100016994078_200010986244 [0,0,0,1,0,0|3,0,0]=4 1131 B19R1.10546 CC(C)OC(=O)CCCCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_200010986244 [0,0,0,1,0,0|3,0,0]=4 1132 B19R1.10546 CC(C)OC(=O)CCCCCOC1CCCCC1=O 34a_100011214950_200010986244 [0,0,0,1,0,0|2,0,1]=4 1133 B19R1.10546 CC(C)OC(=O)CCCCCOC1CCCCC1C 34a_100000211207_200010986244 [0,0,0,1,0,0|1,0,0]=2 1134 B19R1.10546 CC(C)OC(=O)CCCCCOC1CCCCC1C 7a_100000211207_200010986244 [0,0,0,1,0,0|1,0,0]=2 1135 B19R1.10546 CC(C)OC(=O)CCCCCOC1CCCCC1Cl 34a_100000038908_200010986244 [0,0,0,1,0,0|2,0,0]=3 1136 B19R1.10546 CC(C)OC(=O)CCCCCOC1CCCCC1Cl 7a_100000038908_200010986244 [0,0,0,1,0,0|2,0,0]=3 1137 B19R1.10546 CC(C)OC(=O)CCCCCOC1CCNCC1C 34a_100011998114_200010986244 [0,0,0,1,0,0|2,0,0]=3 1138 B19R1.10546 CC(C)OC(=O)CCCCCOC1CNCCC1C 34a_100000696640_200010986244 [0,0,0,1,0,0|2,0,0]=3 1139 B19R1.10546 CC(C)OC(=O)CCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_200010986244 [0,0,0,1,0,0|2,0,0]=3 1140 B19R1.10546 CC(C)OC(=O)CCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_200010986244 [0,0,0,1,0,0|2,0,0]=3 1141 B19R1.10546 CC(C)OC(=O)CCCCCO[C@@H]1CCNC[C@@H]1F 34a_200016994291_200010986244 [0,0,0,1,0,0|3,0,0]=4 1142 B19R1.10546 CC(C)OC(=O)CCCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_200010986244 [0,0,0,1,0,0|2,0,0]=3 1143 B19R1.10546 CC(C)OC(=O)CCCCCO[C@H]1CCOC[C@@H]1N 34a_100015739063_200010986244 [0,0,0,1,0,0|3,0,0]=4 1144 B19R1.10546 CC(C)OC(=O)CCCCCO[C@H]1COCC[C@H]1N 34a_100016994285_200010986244 [0,0,0,1,0,0|3,0,0]=4 1145 B19R1.10546 CC(C)OC(=O)CCCCCSC1CCCCC1=O 62a_100000204591_200010986244 [0,0,0,1,0,0|2,0,1]=4 1146 B19R1.10546 CC(C)OC(=O)CCCCCSC1CCCCC1=O 62a_200010986244_100000204591 [0,0,0,1,0,0|2,0,1]=4 1147 B19R1.10546 CC(C)OC(=O)CCCCCSC1CCCCC1F 62a_100015423560_200010986244 [0,0,0,1,0,0|2,0,0]=3 1148 B19R1.10546 CC(C)OC(=O)CCCCCSC1CCCCC1F 62a_200010986244_100015423560 [0,0,0,1,0,0|2,0,0]=3 1149 B19R1.10546 CC(C)OC(=O)CCCCCSC1CCCCC1O 62a_100000038908_200010986244 [0,0,0,1,0,0|2,0,0]=3 1150 B19R1.10546 CC(C)OC(=O)CCCCCSC1CCCCC1O 62a_200010986244_100000038908 [0,0,0,1,0,0|2,0,0]=3 1151 B19R1.10546 CC(C)OC(=O)CCOCCCN1CCCCC1C 7a_100000213889_100000760027 [0,0,0,1,0,0|2,0,0]=3 1152 B19R1.10904 CC(C)OC(=O)CCCCCOCC1CCCN1C 34a_100000743107_200010986244 [0,0,0,1,0,0|2,0,0]=3 1153 B19R1.15244 CC(C)NC(=O)[C@H]1CCCN1CCCCCCCO 2230a_100153395200_100000760002 [0,0,0,1,0,0|3,0,0]=4 1154 B19R1.15244 CC(C)NC(=O)[C@H]1CCCN1CCCCCCCO 269982a_100153395200_100000760002 [0,0,0,1,0,0|3,0,0]=4 1155 B19R1.15244 CC(C)NC(=O)[C@H]1CCCN1CCCCCCCO 34a_100153395200_100000760002 [0,0,0,1,0,0|3,0,0]=4 1156 B19R1.15244 CCCCCCCCN1CCC[C@@H]1C(=O)NC(C)C 2230a_100153395200_100000210759 [0,0,0,1,0,0|2,0,0]=3 1157 B19R1.15244 CCCCCCCCN1CCC[C@@H]1C(=O)NC(C)C 269982a_100153395200_100000210759 [0,0,0,1,0,0|2,0,0]=3 1158 B19R1.15244 CCCCCCCCN1CCC[C@@H]1C(=O)NC(C)C 34a_100153395200_100000210759 [0,0,0,1,0,0|2,0,0]=3 1159 B19R1.15244 COCCCCCCN1CCC[C@@H]1C(=O)NC(C)C 2230a_100153395200_100011998445 [0,0,0,1,0,0|3,0,0]=4 1160 B19R1.15244 COCCCCCCN1CCC[C@@H]1C(=O)NC(C)C 269982a_100153395200_100011998445 [0,0,0,1,0,0|3,0,0]=4 1161 B19R1.15244 COCCCCCCN1CCC[C@@H]1C(=O)NC(C)C 34a_100153395200_100011998445 [0,0,0,1,0,0|3,0,0]=4 1162 B19R1.15484 CCCCCCCCCCCN1CC(C1)OC(C)C 2230a_100000698322_100011215454 [0,0,0,1,0,0|2,0,1]=4 1163 B19R1.15484 CCCCCCCCCCCN1CC(C1)OC(C)C 269982a_100000698322_100011215454 [0,0,0,1,0,0|2,0,1]=4 1164 B19R1.15484 CCCCCCCCCCCN1CC(C1)OC(C)C 34a_100000698322_100011215454 [0,0,0,1,0,0|2,0,1]=4 1165 B19R1.15975 CCCCCCCCCN1CCNC(=O)C1C(C)C 2230a_100000751287_100011214924 [0,0,0,1,0,0|3,0,0]=4 1166 B19R1.15975 CCCCCCCCCN1CCNC(=O)C1C(C)C 269982a_100000751287_100000210670 [0,0,0,1,0,0|3,0,0]=4 1167 B19R1.15975 CCCCCCCCCN1CCNC(=O)C1C(C)C 34a_100000751287_100011214924 [0,0,0,1,0,0|3,0,0]=4 1168 B19R1.16759 CC(C)CC(=O)C1CCCCCCCCCCC1=O 1458a_100000210554_200009990614 [0,0,0,1,0,0|2,0,1]=4 1169 B19R1.16801 COC[C@@H]1CCCN1CCCCCC(=O)OC(C)C 2230a_100020646714_200010986244 [0,0,0,1,0,0|2,0,0]=3 1170 B19R1.16801 COC[C@@H]1CCCN1CCCCCC(=O)OC(C)C 269982a_100020646714_200010986244 [0,0,0,1,0,0|2,0,0]=3 1171 B19R1.16801 COC[C@@H]1CCCN1CCCCCC(=O)OC(C)C 34a_100020646714_200010986244 [0,0,0,1,0,0|2,0,0]=3 1172 B19R1.20997 CC(C)OC(=O)CCCCCSCCC1CCC1=O 62a_200010986244_200016118888 [0,0,0,1,0,0|2,0,1]=4 1173 B19R1.20997 CC(C)OC(=O)CCCCCSCCC1CCC1=O 62a_200016118888_200010986244 [0,0,0,1,0,0|2,0,1]=4 1174 B19R1.26382 CC(C)OC(=O)CCCCCNCCC1CCCC1 2230a_100000739158_200010986244 [0,0,0,1,0,0|1,0,0]=2 1175 B19R1.26382 CC(C)OC(=O)CCCCCNCCC1CCCC1 34a_100000739158_200010986244 [0,0,0,1,0,0|1,0,0]=2 1176 B19R1.26382 CC(C)OC(=O)CCCCCNCCC1OCCO1 2230a_100000034215_200010986244 [0,0,0,1,0,0|3,0,0]=4 1177 B19R1.26382 CC(C)OC(=O)CCCCCNCCC1OCCO1 34a_100000034215_200010986244 [0,0,0,1,0,0|3,0,0]=4 1178 B19R1.26382 CC(C)OC(=O)CCCCCOCCC1CCCC1 34a_100000749090_200010986244 [0,0,0,1,0,0|1,0,0]=2 1179 B19R1.26382 CC(C)OC(=O)CCCCCOCCC1CCCC1 7a_100000749090_200010986244 [0,0,0,1,0,0|1,0,0]=2 1180 B19R1.26382 CC(C)OC(=O)CCCCCOCCC1CCNC1 34a_100016987287_200010986244 [0,0,0,1,0,0|2,0,0]=3 1181 B19R1.26382 CC(C)OC(=O)CCCCCOCCC1CCOC1 34a_100011879284_200010986244 [0,0,0,1,0,0|2,0,0]=3 1182 B19R1.26382 CC(C)OC(=O)CCCCCSCCC1CCCC1 62a_100000760354_200010986244 [0,0,0,1,0,0|1,0,0]=2 1183 B19R1.26382 CC(C)OC(=O)CCCCCSCCC1CCCC1 62a_200010986244_100000760354 [0,0,0,1,0,0|1,0,0]=2 1184 B19R1.26382 CC(C)OC(=O)CCCCCSCCC1OCCO1 62a_200010986244_100000740749 [0,0,0,1,0,0|3,0,0]=4 1185 B19R1.26382 CC(C)OC(=O)CCCCCSCCN1CCCC1 62a_100000700749_200010986244 [0,0,0,1,0,0|2,0,0]=3 1186 B19R1.26382 CC(C)OC(=O)CCCCCSCCN1CCCC1 62a_200010986244_100000004467 [0,0,0,1,0,0|2,0,0]=3 1187 B19R1.26382 CC(C)OC(=O)CCOCCCCOC1CCCO1 7a_100011018183_100000760027 [0,0,0,1,0,0|3,0,0]=4 1188 B19R1.50929 C#CC1CCCCN1CCCCCC(=O)OC(C)C 2230a_200020621307_200010986244 [0,0,0,1,0,0|1,0,2]=4 1189 B19R1.50929 C#CC1CCCCN1CCCCCC(=O)OC(C)C 269982a_200020621307_200010986244 [0,0,0,1,0,0|1,0,2]=4 1190 B19R1.50929 C#CC1CCCCN1CCCCCC(=O)OC(C)C 34a_200020621307_200010986244 [0,0,0,1,0,0|1,0,2]=4 1191 B19R1.50929 CC(C)OC(=O)CCCCCN1CCCCC1C#N 34a_100016989756_200010986244 [0,0,0,1,0,0|2,0,1]=4 1192 B19R1.50929 CC(C)OC(=O)CCCCCN1CCCCC1CO 2230a_100000210821_200010986244 [0,0,0,1,0,0|2,0,0]=3 1193 B19R1.50929 CC(C)OC(=O)CCCCCN1CCCCC1CO 269982a_100000210821_200010986244 [0,0,0,1,0,0|2,0,0]=3 1194 B19R1.50929 CC(C)OC(=O)CCCCCN1CCCCC1CO 34a_100000210821_200010986244 [0,0,0,1,0,0|2,0,0]=3 1195 B19R1.50929 CC(C)OC(=O)CCCCCN1CCOC[C@H]1CO 2230a_100000717676_200010986244 [0,0,0,1,0,0|3,0,0]=4 1196 B19R1.50929 CC(C)OC(=O)CCCCCN1CCOC[C@H]1CO 269982a_100000717676_200010986244 [0,0,0,1,0,0|3,0,0]=4 1197 B19R1.50929 CC(C)OC(=O)CCCCCN1CCOC[C@H]1CO 34a_100000717676_200010986244 [0,0,0,1,0,0|3,0,0]=4 1198 B19R1.50929 CC(C)OC(=O)CCNCCN1CCCCC1CO 2230a_100011473795_100000760027 [0,0,0,1,0,0|3,0,0]=4 1199 B19R1.50929 CC(C)OC(=O)CNCCCN1CCCCC1CO 34a_200011473794_100011215430 [0,0,0,1,0,0|3,0,0]=4 1200 B19R1.50929 CCC1CCCCN1CCCCCC(=O)OC(C)C 2230a_100000210034_200010986244 [0,0,0,1,0,0|1,0,0]=2 1201 B19R1.50929 CCC1CCCCN1CCCCCC(=O)OC(C)C 269982a_100000210034_200010986244 [0,0,0,1,0,0|1,0,0]=2 1202 B19R1.50929 CCC1CCCCN1CCCCCC(=O)OC(C)C 34a_100000210034_200010986244 [0,0,0,1,0,0|1,0,0]=2 1203 B19R1.50929 CCC1CCCCN1CCCNCC(=O)NC(C)C 34a_100011191702_100000183996 [0,0,0,1,0,0|3,0,0]=4 1204 B19R1.50929 CCC1CCCCN1CCCNCC(=O)OC(C)C 34a_100011191702_100011215430 [0,0,0,1,0,0|2,0,0]=3 1205 B19R1.50929 CCC1CCCCN1CCNCCC(=O)NC(C)C 2230a_100000755458_100000737564 [0,0,0,1,0,0|3,0,0]=4 1206 B19R1.50929 CCC1CCCCN1CCNCCC(=O)OC(C)C 2230a_100000755458_100000760027 [0,0,0,1,0,0|2,0,0]=3 1207 B19R1.50929 CC[C@H]1COCCN1CCCCCC(=O)OC(C)C 2230a_100016988097_200010986244 [0,0,0,1,0,0|2,0,0]=3 1208 B19R1.50929 CC[C@H]1COCCN1CCCCCC(=O)OC(C)C 269982a_100016988097_200010986244 [0,0,0,1,0,0|2,0,0]=3 1209 B19R1.50929 CC[C@H]1COCCN1CCCCCC(=O)OC(C)C 34a_100016988097_200010986244 [0,0,0,1,0,0|2,0,0]=3 1210 B19R1.53162 C#CCCCCCCCCCOC1CC(OC1=O)C 34a_100000034437_200000216747 [0,0,0,1,0,0|1,0,2]=4 1211 B19R1.53162 C#CCCCCCCCCCOC1CC(OC1=O)C 7a_100000034437_200000216747 [0,0,0,1,0,0|1,0,2]=4 1212 B19R1.53162 C=CCCCCCCCCCNC1CC(OC1=O)C 2230a_100000081888_200000216747 [0,0,0,1,0,0|1,0,2]=4 1213 B19R1.53162 C=CCCCCCCCCCNC1CC(OC1=O)C 34a_100000081888_200000216747 [0,0,0,1,0,0|1,0,2]=4 1214 B19R1.53162 C=CCCCCCCCCCOC1CC(OC1=O)C 34a_100000038209_200000216747 [0,0,0,1,0,0|1,0,2]=4 1215 B19R1.53162 C=CCCCCCCCCCOC1CC(OC1=O)C 7a_100000038209_200000216747 [0,0,0,1,0,0|1,0,2]=4 1216 B19R1.53162 C=CCCCCCCCCCSC1CC(OC1=O)C 62a_100009814027_200000216747 [0,0,0,1,0,0|1,0,2]=4 1217 B19R1.53162 C=CCCCCCCCCCSC1CC(OC1=O)C 62a_200000216747_100009814027 [0,0,0,1,0,0|1,0,2]=4 1218 B19R1.53162 CC1CC(C(=O)O1)NCCCCCCCCCCO 2230a_100000066964_200000216747 [0,0,0,1,0,0|2,0,0]=3 1219 B19R1.53162 CC1CC(C(=O)O1)NCCCCCCCCCCO 34a_100000066964_200000216747 [0,0,0,1,0,0|2,0,0]=3 1220 B19R1.53162 CC1CC(C(=O)O1)OCCCCCCCCCCBr 34a_100009813290_200000216747 [0,0,0,1,0,0|2,0,0]=3 1221 B19R1.53162 CC1CC(C(=O)O1)OCCCCCCCCCCBr 7a_100009813290_200000216747 [0,0,0,1,0,0|2,0,0]=3 1222 B19R1.53162 CC1CC(C(=O)O1)OCCCCCCCCCCCl 34a_200000033068_200000216747 [0,0,0,1,0,0|2,0,0]=3 1223 B19R1.53162 CC1CC(C(=O)O1)OCCCCCCCCCCCl 7a_200000033068_200000216747 [0,0,0,1,0,0|2,0,0]=3 1224 B19R1.53162 CC1CC(C(=O)O1)OCCCCCCCCCCN 34a_100000066964_200000216747 [0,0,0,1,0,0|2,0,0]=3 1225 B19R1.53162 CC1CC(C(=O)O1)SCCCCCCCCCCO 62a_100009813290_200000216747 [0,0,0,1,0,0|2,0,0]=3 1226 B19R1.53162 CC1CC(C(=O)O1)SCCCCCCCCCCO 62a_200000216747_200000033068 [0,0,0,1,0,0|2,0,0]=3 1227 B19R1.53162 CCCCCCCC/C=C/COC1CC(OC1=O)C 34a_200020667288_200000216747 [0,0,0,1,0,0|1,0,2]=4 1228 B19R1.53162 CCCCCCCC/C=C/COC1CC(OC1=O)C 7a_200020667288_200000216747 [0,0,0,1,0,0|1,0,2]=4 1229 B19R1.53162 CCCCCCCCCCCNC1CC(OC1=O)C 2230a_200011215754_200000216747 [0,0,0,1,0,0|1,0,0]=2 1230 B19R1.53162 CCCCCCCCCCCNC1CC(OC1=O)C 34a_200011215754_200000216747 [0,0,0,1,0,0|1,0,0]=2 1231 B19R1.53162 CCCCCCCCCCCOC1CC(OC1=O)C 34a_100000210809_200000216747 [0,0,0,1,0,0|1,0,0]=2 1232 B19R1.53162 CCCCCCCCCCCOC1CC(OC1=O)C 7a_100000210809_200000216747 [0,0,0,1,0,0|1,0,0]=2 1233 B19R1.53162 CCCCCCCCCCCSC1CC(OC1=O)C 62a_200000216747_100011215454 [0,0,0,1,0,0|1,0,0]=2 1234 B19R1.68512 CCCCCCCCCCCCCC(=O)NC1CC1 1626a_100000212008_100000756256 [0,0,0,1,0,0|1,0,0]=2 1235 B19R1.68512 CCCCCCCCCCCCCC(=O)NC1CC1 240690a_100000212008_100000756256 [0,0,0,1,0,0|1,0,0]=2 1236 B19R1.68512 CCCCCCCCCCCCNC(=O)CC1CC1 11a_100000210451_100000738066 [0,0,0,1,0,0|2,0,0]=3 1237 B19R1.68512 CCCCCCCCCCCCNC(=O)CC1CC1 1626a_100000210451_100000738066 [0,0,0,1,0,0|2,0,0]=3 1238 B19R1.68512 CCCCCCCCCCCCNC(=O)CC1CC1 240690a_100000210451_100000738066 [0,0,0,1,0,0|2,0,0]=3 1239 B19R1.68512 CCCCCCCCCCCCNC(=O)CC1CC1 527a_100000210451_100000738066 [0,0,0,1,0,0|2,0,0]=3 1240 B19R1.68512 CCCCCCCCCCCCNC(=O)NC1CC1 2708a_100000210451_100000212008 [0,0,0,1,0,0|2,0,0]=3 1241 B19R1.68512 CCCCCCCCCCCCNC(=O)NC1CC1 2708a_100000212008_100000210451 [0,0,0,1,0,0|2,0,0]=3 1242 B19R1.68512 CCCCCCCCCCCCNC(=O)NC1CC1 273464a_100000210451_100000212008 [0,0,0,1,0,0|2,0,0]=3 1243 B19R1.68512 CCCCCCCCCCCCNC(=O)NC1CC1 273464a_100000212008_100000210451 [0,0,0,1,0,0|2,0,0]=3 1244 B19R1.68512 CCCCCCCCCCCCNC(=O)NC1CC1 512a_100000212008_100000210451 [0,0,0,1,0,0|2,0,0]=3 1245 B19R1.68512 CCCCCCCCCCCNCC(=O)NC1CC1 2230a_100000702991_100011215454 [0,0,0,1,0,0|2,0,0]=3 1246 B19R1.68512 CCCCCCCCCCCNCC(=O)NC1CC1 2230a_200011215754_100000182950 [0,0,0,1,0,0|2,0,0]=3 1247 B19R1.68512 CCCCCCCCCCCNCC(=O)NC1CC1 34a_200011215754_100000182950 [0,0,0,1,0,0|2,0,0]=3 1248 B19R1.68512 CCCCCCCCCCCOCC(=O)NC1CC1 34a_100000210809_100000182950 [0,0,0,1,0,0|2,0,0]=3 1249 B19R1.68512 CCCCCCCCCCCOCC(=O)NC1CC1 7a_100000210809_100000182950 [0,0,0,1,0,0|2,0,0]=3 1250 B19R1.68512 CCCCCCCCCCCSCC(=O)NC1CC1 62a_100000182950_100011215454 [0,0,0,1,0,0|2,0,0]=3 1251 B19R1.68512 CCCCCCCCCCNCCC(=O)NC1CC1 2230a_100000684558_100000737409 [0,0,0,1,0,0|2,0,0]=3 1252 B19R1.68512 CCCCCCCCCCNCCC(=O)NC1CC1 34a_100000684558_100000737409 [0,0,0,1,0,0|2,0,0]=3 1253 B19R1.68512 CCCCCCCCCCOCCC(=O)NC1CC1 34a_100000210711_100000737409 [0,0,0,1,0,0|2,0,0]=3 1254 B19R1.68512 CCCCCCCCCCSCCC(=O)NC1CC1 62a_100000737409_100000210320 [0,0,0,1,0,0|2,0,0]=3 1255 B19R1.68512 NCCCCCCCCCCOCC(=O)NC1CC1 34a_100000066964_100000182950 [0,0,0,1,0,0|3,0,0]=4 1256 B19R1.68512 NCCCCCCCCCOCCC(=O)NC1CC1 34a_100000078944_100000737409 [0,0,0,1,0,0|3,0,0]=4 1257 B19R1.68512 O=C(CCCCCCCCCCCCO)CC1CC1 1458a_100000738066_100009813331 [0,0,0,1,0,0|2,0,0]=3 1258 B19R1.68512 O=C(CCCCCCCCCCCCO)NC1CC1 240690a_100000212008_100102582631 [0,0,0,1,0,0|2,0,0]=3 1259 B19R1.68512 O=C(CCCCCCOCCCCCO)CC1CC1 1458a_100000738066_200132310570 [0,0,0,1,0,0|3,0,0]=4 1260 B19R1.68512 O=C(CCNCCCCCCCCCO)NC1CC1 2230a_100000078944_100000737409 [0,0,0,1,0,0|3,0,0]=4 1261 B19R1.68512 O=C(CCNCCCCCCCCCO)NC1CC1 34a_100000078944_100000737409 [0,0,0,1,0,0|3,0,0]=4 1262 B19R1.68512 O=C(CCOCCCCCCCCCBr)NC1CC1 34a_100009813782_100000737409 [0,0,0,1,0,0|3,0,0]=4 1263 B19R1.68512 O=C(CCOCCCCCCCCCCl)NC1CC1 34a_100009868337_100000737409 [0,0,0,1,0,0|3,0,0]=4 1264 B19R1.68512 O=C(CCSCCCCCCCCCO)NC1CC1 62a_100000737409_100009813782 [0,0,0,1,0,0|3,0,0]=4 1265 B19R1.68512 O=C(CCSCCCCCCCCCO)NC1CC1 62a_100009813782_100000737409 [0,0,0,1,0,0|3,0,0]=4 1266 B19R1.68512 O=C(CNCCCCCCCCCCO)NC1CC1 2230a_100000066964_100000182950 [0,0,0,1,0,0|3,0,0]=4 1267 B19R1.68512 O=C(CNCCCCCCCCCCO)NC1CC1 2230a_100000702991_100009813290 [0,0,0,1,0,0|3,0,0]=4 1268 B19R1.68512 O=C(CNCCCCCCCCCCO)NC1CC1 34a_100000066964_100000182950 [0,0,0,1,0,0|3,0,0]=4 1269 B19R1.68512 O=C(COCCCCCCCCCCBr)NC1CC1 34a_100009813290_100000182950 [0,0,0,1,0,0|3,0,0]=4 1270 B19R1.68512 O=C(COCCCCCCCCCCBr)NC1CC1 7a_100009813290_100000182950 [0,0,0,1,0,0|3,0,0]=4 1271 B19R1.68512 O=C(COCCCCCCCCCCCl)NC1CC1 34a_200000033068_100000182950 [0,0,0,1,0,0|3,0,0]=4 1272 B19R1.68512 O=C(COCCCCCCCCCCCl)NC1CC1 7a_200000033068_100000182950 [0,0,0,1,0,0|3,0,0]=4 1273 B19R1.68512 O=C(CSCCCCCCCCCCO)NC1CC1 62a_100000182950_200000033068 [0,0,0,1,0,0|3,0,0]=4 1274 B19R1.68512 O=C(CSCCCCCCCCCCO)NC1CC1 62a_100009813290_100000182950 [0,0,0,1,0,0|3,0,0]=4 1275 B19R1.146809 CC(C)NC(=O)CCNCCC1CCCCCCC1 2230a_100011532352_100000737564 [0,0,0,1,0,0|2,0,0]=3 1276 B19R1.146809 CC(C)OC(=O)CCCCCN1CCCCCCC1 2230a_100000211400_200010986244 [0,0,0,1,0,0|1,0,0]=2 1277 B19R1.146809 CC(C)OC(=O)CCCCCN1CCCCCCC1 269982a_100000211400_200010986244 [0,0,0,1,0,0|1,0,0]=2 1278 B19R1.146809 CC(C)OC(=O)CCCCCN1CCCCCCC1 34a_100000211400_200010986244 [0,0,0,1,0,0|1,0,0]=2 1279 B19R1.146809 CC(C)OC(=O)CCNCCC1CCCCCCC1 2230a_100011532352_100000760027 [0,0,0,1,0,0|1,0,0]=2 1280 B19R1.281345 CC(C)NC(=O)CCOCCCN1CCCCCC1 7a_100102886287_100000737564 [0,0,0,1,0,0|3,0,0]=4 1281 B19R1.281345 CC(C)NC(=O)COCCCCN1CCCCCC1 34a_100011305542_100000183996 [0,0,0,1,0,0|3,0,0]=4 1282 B19R1.281345 CC(C)OC(=O)CCCCCNC1CCCCCC1 2230a_100000210984_200010986244 [0,0,0,1,0,0|1,0,0]=2 1283 B19R1.281345 CC(C)OC(=O)CCCCCNC1CCCCCC1 34a_100000210984_200010986244 [0,0,0,1,0,0|1,0,0]=2 1284 B19R1.281345 CC(C)OC(=O)CCCCCOC1CCCCCC1 34a_100000210887_200010986244 [0,0,0,1,0,0|1,0,0]=2 1285 B19R1.281345 CC(C)OC(=O)CCCCCOC1CCCCCC1 7a_100000210887_200010986244 [0,0,0,1,0,0|1,0,0]=2 1286 B19R1.281345 CC(C)OC(=O)CCCCCSC1CCCCCC1 62a_100011217769_200010986244 [0,0,0,1,0,0|1,0,0]=2 1287 B19R1.281345 CC(C)OC(=O)CCCCCSC1CCCCCC1 62a_200010986244_100011217769 [0,0,0,1,0,0|1,0,0]=2 1288 B19R1.281345 CC(C)OC(=O)CCOCCCN1CCCCCC1 7a_100102886287_100000760027 [0,0,0,1,0,0|2,0,0]=3 1289 B19R1.281345 CC(C)OC(=O)COCCCCN1CCCCCC1 34a_100011305542_100011215430 [0,0,0,1,0,0|2,0,0]=3 1290 B19R1.281406 CC(=CC(=O)NC1CCCCCCCCCCC1)C 11a_100011194316_100000211388 [0,0,0,1,0,0|2,0,1]=4 1291 B19R1.281406 CC(=CC(=O)NC1CCCCCCCCCCC1)C 1626a_100011194316_100000211388 [0,0,0,1,0,0|2,0,1]=4 1292 B19R1.281406 CC(=CC(=O)NC1CCCCCCCCCCC1)C 240690a_100011194316_100000211388 [0,0,0,1,0,0|2,0,1]=4 1293 B19R1.281406 CC(C)CC(=O)NC1CCCCCCCCCCC1 11a_100011194316_100000210554 [0,0,0,1,0,0|2,0,0]=3 1294 B19R1.281406 CC(C)CC(=O)NC1CCCCCCCCCCC1 1626a_100011194316_100000210554 [0,0,0,1,0,0|2,0,0]=3 1295 B19R1.281406 CC(C)CC(=O)NC1CCCCCCCCCCC1 240690a_100011194316_100000210554 [0,0,0,1,0,0|2,0,0]=3 1296 B19R1.281406 CC(C)CC(=O)NC1CCCCCCCCCCC1 527a_100011194316_100000210554 [0,0,0,1,0,0|2,0,0]=3 1297 B19R1.281406 CC(C)NC(=O)NC1CCCCCCCCCCC1 2708a_100011194316_100138425928 [0,0,0,1,0,0|2,0,0]=3 1298 B19R1.281406 CC(C)NC(=O)NC1CCCCCCCCCCC1 2708a_100138425928_100011194316 [0,0,0,1,0,0|2,0,0]=3 1299 B19R1.281406 CC(C)NC(=O)NC1CCCCCCCCCCC1 273464a_100138425928_100011194316 [0,0,0,1,0,0|2,0,0]=3 1300 B19R1.281406 CN(C)CC(=O)NC1CCCCCCCCCCC1 11a_100011194316_100000750896 [0,0,0,1,0,0|3,0,0]=4 1301 B19R1.281406 CN(C)CC(=O)NC1CCCCCCCCCCC1 240690a_100011194316_100000750896 [0,0,0,1,0,0|3,0,0]=4 1302 B19R1.281406 CN(C)CC(=O)NC1CCCCCCCCCCC1 527a_100011194316_100000750896 [0,0,0,1,0,0|3,0,0]=4 1303 B19R1.281406 C[C@@H](O)CC(=O)NC1CCCCCCCCCCC1 240690a_100011194316_100011933948 [0,0,0,1,0,0|3,0,0]=4 1304 B19R1.281406 C[S+](C)CC(=O)NC1CCCCCCCCCCC1 11a_100011194316_200159257847 [0,0,0,1,0,0|3,0,0]=4 1305 B19R1.281406 C[S+](C)CC(=O)NC1CCCCCCCCCCC1 1626a_100011194316_200159257847 [0,0,0,1,0,0|3,0,0]=4 1306 B19R1.281406 C[S+](C)CC(=O)NC1CCCCCCCCCCC1 240690a_100011194316_200159257847 [0,0,0,1,0,0|3,0,0]=4 1307 B19R1.281406 C[S+](C)CC(=O)NC1CCCCCCCCCCC1 527a_100011194316_200159257847 [0,0,0,1,0,0|3,0,0]=4 1308 B19R1.878881 CC1CC1C(=O)CCCCCCCCCCCCO 1458a_100000211227_100009813331 [0,0,0,1,0,0|2,0,0]=3 1309 B19R1.878881 CC1CC1C(=O)CCCCCCOCCCCCO 1458a_100000211227_200132310570 [0,0,0,1,0,0|3,0,0]=4 1310 B19R1.878881 CCCCCCCCCCCCNC(=O)C1CC1C 11a_100000210451_100000211227 [0,0,0,1,0,0|2,0,0]=3 1311 B19R1.878881 CCCCCCCCCCCCNC(=O)C1CC1C 1626a_100000210451_100000211227 [0,0,0,1,0,0|2,0,0]=3 1312 B19R1.878881 CCCCCCCCCCCCNC(=O)C1CC1C 527a_100000210451_100000211227 [0,0,0,1,0,0|2,0,0]=3 1313 B19R1.878881 CCCCCCCCCCCCNC(=O)[C@@H]1C[C@@H]1F 11a_100000210451_100015396687 [0,0,0,1,0,0|3,0,0]=4 1314 B19R1.878881 CCCCCCCCCCCCNC(=O)[C@@H]1C[C@@H]1F 240690a_100000210451_100015396687 [0,0,0,1,0,0|3,0,0]=4 1315 B19R1.878881 CCCCCCCCCCCCNC(=O)[C@@H]1C[C@@H]1F 527a_100000210451_100015396687 [0,0,0,1,0,0|3,0,0]=4 1316 B19R1.878881 O=C(CCCCCCCCCCCCO)[C@@H]1C[C@@H]1F 1458a_100015396687_100009813331 [0,0,0,1,0,0|3,0,0]=4 1317 B17R0.14245 C#CCCCCCCCCCOCC(=O)C(C)C 34a_100000034437_100000753385 [0,0,0,0,1,0|1,0,2]=4 1318 B17R0.14245 C#CCCCCCCCCCOCC(=O)C(C)C 7a_100000034437_100000753385 [0,0,0,0,1,0|1,0,2]=4 1319 B17R0.14245 C=C(C)C(=O)CCCCCCCCCCCCO 1458a_100000185857_100009813331 [0,0,0,0,1,0|1,0,2]=4 1320 B17R0.14245 C=C(C)C(=O)NCCCCCCCCCCCC 11a_100000210451_100000185857 [0,0,0,0,1,0|1,0,2]=4 1321 B17R0.14245 C=C(C)C(=O)NCCCCCCCCCCCC 1626a_100000210451_100000185857 [0,0,0,0,1,0|1,0,2]=4 1322 B17R0.14245 C=CCCCCCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_102130925996 [0,0,0,0,1,0|1,0,2]=4 1323 B17R0.14245 C=CCCCCCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_102130925996 [0,0,0,0,1,0|1,0,2]=4 1324 B17R0.14245 C=CCCCCCCCCCNCC(=O)C(C)C 2230a_100000081888_100000753385 [0,0,0,0,1,0|1,0,2]=4 1325 B17R0.14245 C=CCCCCCCCCCNCC(=O)C(C)C 34a_100000081888_100000753385 [0,0,0,0,1,0|1,0,2]=4 1326 B17R0.14245 C=CCCCCCCCCCOCC(=O)C(C)C 34a_100000038209_100000753385 [0,0,0,0,1,0|1,0,2]=4 1327 B17R0.14245 C=CCCCCCCCCCOCC(=O)C(C)C 7a_100000038209_100000753385 [0,0,0,0,1,0|1,0,2]=4 1328 B17R0.14245 CC(C)C(=O)CCCCCCCCCCCCO 1458a_100000210198_100009813331 [0,0,0,0,1,0|1,0,0]=2 1329 B17R0.14245 CC(C)C(=O)CCCCCCOCCCCCO 1458a_100000210198_200132310570 [0,0,0,0,1,0|2,0,0]=3 1330 B17R0.14245 CC(C)C(=O)CNCCCCCCCCCCO 2230a_100000066964_100000753385 [0,0,0,0,1,0|2,0,0]=3 1331 B17R0.14245 CC(C)C(=O)CNCCCCCCCCCCO 34a_100000066964_100000753385 [0,0,0,0,1,0|2,0,0]=3 1332 B17R0.14245 CC(C)C(=O)COCCCCCCCCCCBr 34a_100009813290_100000753385 [0,0,0,0,1,0|2,0,0]=3 1333 B17R0.14245 CC(C)C(=O)COCCCCCCCCCCBr 7a_100009813290_100000753385 [0,0,0,0,1,0|2,0,0]=3 1334 B17R0.14245 CC(C)C(=O)COCCCCCCCCCCCl 34a_200000033068_100000753385 [0,0,0,0,1,0|2,0,0]=3 1335 B17R0.14245 CC(C)C(=O)COCCCCCCCCCCCl 7a_200000033068_100000753385 [0,0,0,0,1,0|2,0,0]=3 1336 B17R0.14245 CC(C)C(=O)COCCCCCCCCCCN 34a_100000066964_100000753385 [0,0,0,0,1,0|2,0,0]=3 1337 B17R0.14245 CC(C)C(=O)CSCCCCCCCCCCO 62a_100000753385_200000033068 [0,0,0,0,1,0|2,0,0]=3 1338 B17R0.14245 CC(C)C(=O)CSCCCCCCCCCCO 62a_100009813290_100000753385 [0,0,0,0,1,0|2,0,0]=3 1339 B17R0.14245 CC(C)C(=O)NCCNCCCCCCCCO 2230a_100000752568_100000033203 [0,0,0,0,1,0|3,0,0]=4 1340 B17R0.14245 CC(C)C(=O)NCCNCCCCCCCCO 34a_100000752568_100000033203 [0,0,0,0,1,0|3,0,0]=4 1341 B17R0.14245 CC(C)C(=O)OCSCCCCCCCCCO 62a_100000139345_100009813782 [0,0,0,0,1,0|3,0,0]=4 1342 B17R0.14245 CC(C)C(=O)OCSCCCCCCCCCO 62a_100009813782_100000139345 [0,0,0,0,1,0|3,0,0]=4 1343 B17R0.14245 CC(C)N(C)CCCCCCCCCCCCO 269982a_200000211004_100009813331 [0,0,0,0,1,0|3,0,0]=4 1344 B17R0.14245 CC(F)C(=O)CCCCCCCCCCCCO 1458a_100000062450_100009813331 [0,0,0,0,1,0|2,0,0]=3 1345 B17R0.14245 CC(F)C(=O)CCCCCCOCCCCCO 1458a_100000062450_200132310570 [0,0,0,0,1,0|3,0,0]=4 1346 B17R0.14245 CCCCCCCC/C=C/COCC(=O)C(C)C 34a_200020667288_100000753385 [0,0,0,0,1,0|1,0,2]=4 1347 B17R0.14245 CCCCCCCC/C=C/COCC(=O)C(C)C 7a_200020667288_100000753385 [0,0,0,0,1,0|1,0,2]=4 1348 B17R0.14245 CCCCCCCCCCC=NNC(=O)C(C)C 4a_100000184118_100011218819 [0,0,0,0,1,0|2,0,1]=4 1349 B17R0.14245 CCCCCCCCCCCCCC(=O)C(O)O 1458a_100000233687_100000210684 [0,0,0,0,1,0|2,0,0]=3 1350 B17R0.14245 CCCCCCCCCCCCCC(=O)N(C)C 11a_100102631434_100000756256 [0,0,0,0,1,0|1,0,0]=2 1351 B17R0.14245 CCCCCCCCCCCCCC(=O)N(C)C 1626a_100102631434_100000756256 [0,0,0,0,1,0|1,0,0]=2 1352 B17R0.14245 CCCCCCCCCCCCCC(=O)N(C)C 240690a_100102631434_100000756256 [0,0,0,0,1,0|1,0,0]=2 1353 B17R0.14245 CCCCCCCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100000210684 [0,0,0,0,1,0|1,0,0]=2 1354 B17R0.14245 CCCCCCCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100000210684 [0,0,0,0,1,0|1,0,0]=2 1355 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)C 11a_100000210451_100000210198 [0,0,0,0,1,0|1,0,0]=2 1356 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)C 1626a_100000210451_100000210198 [0,0,0,0,1,0|1,0,0]=2 1357 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)C 240690a_100000210451_100000210198 [0,0,0,0,1,0|1,0,0]=2 1358 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)C 527a_100000210451_100000210198 [0,0,0,0,1,0|1,0,0]=2 1359 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)F 11a_100000210451_100000062450 [0,0,0,0,1,0|2,0,0]=3 1360 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)F 1626a_100000210451_100000062450 [0,0,0,0,1,0|2,0,0]=3 1361 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)F 240690a_100000210451_100000062450 [0,0,0,0,1,0|2,0,0]=3 1362 B17R0.14245 CCCCCCCCCCCCNC(=O)C(C)F 527a_100000210451_100000062450 [0,0,0,0,1,0|2,0,0]=3 1363 B17R0.14245 CCCCCCCCCCCCNC(=O)C(F)F 11a_100000210451_100000210393 [0,0,0,0,1,0|3,0,0]=4 1364 B17R0.14245 CCCCCCCCCCCCNC(=O)C(F)F 1626a_100000210451_100000210393 [0,0,0,0,1,0|3,0,0]=4 1365 B17R0.14245 CCCCCCCCCCCCNC(=O)C(F)F 240690a_100000210451_100000210393 [0,0,0,0,1,0|3,0,0]=4 1366 B17R0.14245 CCCCCCCCCCCCNC(=O)C(F)F 527a_100000210451_100000210393 [0,0,0,0,1,0|3,0,0]=4 1367 B17R0.14245 CCCCCCCCCCCCNC(=O)C(O)O 240690a_100000210451_100000233687 [0,0,0,0,1,0|3,0,0]=4 1368 B17R0.14245 CCCCCCCCCCCCNC(=O)N(C)C 2708a_100000210451_100102631434 [0,0,0,0,1,0|2,0,0]=3 1369 B17R0.14245 CCCCCCCCCCCCNC(=O)[C@@H](C)O 240690a_100000210451_100000717761 [0,0,0,0,1,0|2,0,0]=3 1370 B17R0.14245 CCCCCCCCCCCCNC(=O)[C@H](C)O 1626a_100000210451_217856618621 [0,0,0,0,1,0|2,0,0]=3 1371 B17R0.14245 CCCCCCCCCCCCNC(=O)[C@H](C)O 240690a_100000210451_217856618621 [0,0,0,0,1,0|2,0,0]=3 1372 B17R0.14245 CCCCCCCCCCCNCC(=O)C(=O)C 34a_200011215754_100011261029 [0,0,0,0,1,0|2,0,1]=4 1373 B17R0.14245 CCCCCCCCCCCNCC(=O)C(C)C 2230a_200011215754_100000753385 [0,0,0,0,1,0|1,0,0]=2 1374 B17R0.14245 CCCCCCCCCCCNCC(=O)C(C)C 34a_200011215754_100000753385 [0,0,0,0,1,0|1,0,0]=2 1375 B17R0.14245 CCCCCCCCCCCNCC(=O)N(C)C 2230a_100015183351_100011215454 [0,0,0,0,1,0|2,0,0]=3 1376 B17R0.14245 CCCCCCCCCCCNCC(=O)N(C)C 2230a_200011215754_100000185267 [0,0,0,0,1,0|2,0,0]=3 1377 B17R0.14245 CCCCCCCCCCCNCC(=O)N(C)C 34a_200011215754_100000692301 [0,0,0,0,1,0|2,0,0]=3 1378 B17R0.14245 CCCCCCCCCCCNCC(O)C(C)C 2230a_100000759067_100011215454 [0,0,0,0,1,0|1,0,2]=4 1379 B17R0.14245 CCCCCCCCCCCNCC(O)C(C)C 34a_100000759067_100011215454 [0,0,0,0,1,0|1,0,2]=4 1380 B17R0.14245 CCCCCCCCCCCOCC(=O)C(=O)C 34a_100000210809_100011261029 [0,0,0,0,1,0|2,0,1]=4 1381 B17R0.14245 CCCCCCCCCCCOCC(=O)C(C)C 34a_100000210809_100000753385 [0,0,0,0,1,0|1,0,0]=2 1382 B17R0.14245 CCCCCCCCCCCOCC(=O)C(C)C 7a_100000210809_100000753385 [0,0,0,0,1,0|1,0,0]=2 1383 B17R0.14245 CCCCCCCCCCCOCC(=O)N(C)C 34a_100000210809_100000692301 [0,0,0,0,1,0|2,0,0]=3 1384 B17R0.14245 CCCCCCCCCCCOCC(=O)N(C)C 7a_100000210809_100000692301 [0,0,0,0,1,0|2,0,0]=3 1385 B17R0.14245 CCCCCCCCCCCOC[C@H](N)C(C)C 34a_100011830312_100011215454 [0,0,0,0,1,0|2,0,1]=4 1386 B17R0.14245 CCCCCCCCCCCSCC(=O)C(=O)C 62a_100011261029_100011215454 [0,0,0,0,1,0|2,0,1]=4 1387 B17R0.14245 CCCCCCCCCCCSCC(=O)N(C)C 62a_100000692301_100011215454 [0,0,0,0,1,0|2,0,0]=3 1388 B17R0.14245 CCCCCCCCCCNCCC(=O)N(C)C 2230a_100000684558_100000737620 [0,0,0,0,1,0|2,0,0]=3 1389 B17R0.14245 CCCCCCCCCCNCCC(=O)N(C)C 2230a_100000738053_100000210320 [0,0,0,0,1,0|2,0,0]=3 1390 B17R0.14245 CCCCCCCCCCOCCC(=O)N(C)C 34a_200000747469_100000210320 [0,0,0,0,1,0|2,0,0]=3 1391 B17R0.14245 CCCCCCCCCCOCCC(=O)N(C)C 7a_100000210711_100000737620 [0,0,0,0,1,0|2,0,0]=3 1392 B17R0.14245 CCCCCCCCCCOCCC(N)C(C)C 34a_100161115045_100000210320 [0,0,0,0,1,0|2,0,1]=4 1393 B17R0.14245 CCCCCCCCCCSCCC(=O)N(C)C 62a_100000737620_100000210320 [0,0,0,0,1,0|2,0,0]=3 1394 B17R0.14245 CCCCCCCCCNCCCC(=O)N(C)C 2230a_100000212291_100000737642 [0,0,0,0,1,0|2,0,0]=3 1395 B17R0.14245 CCCCCCCCCNCCCC(=O)N(C)C 2230a_200000744827_100011214924 [0,0,0,0,1,0|2,0,0]=3 1396 B17R0.14245 CCCCCCCCCNCCNC(=O)C(C)C 2230a_100000752568_100011214924 [0,0,0,0,1,0|2,0,0]=3 1397 B17R0.14245 CCCCCCCCCNCCNC(=O)C(C)C 34a_100000752568_100011214924 [0,0,0,0,1,0|2,0,0]=3 1398 B17R0.14245 CCCCCCCCCOCCCC(=O)N(C)C 7a_100000210712_100000737642 [0,0,0,0,1,0|2,0,0]=3 1399 B17R0.14245 CCCCCCCCCSCCCC(=O)N(C)C 62a_100000737642_100000210670 [0,0,0,0,1,0|2,0,0]=3 1400 B17R0.14245 CCCCCCCCNCCCCC(=O)N(C)C 34a_100000229939_100000752486 [0,0,0,0,1,0|2,0,0]=3 1401 B17R0.14245 CCCCCCCCOCCCCC(=O)N(C)C 34a_100000210232_100000752486 [0,0,0,0,1,0|2,0,0]=3 1402 B17R0.14245 CCCCCCCCOCCCCC(=O)N(C)C 7a_100000210232_100000752486 [0,0,0,0,1,0|2,0,0]=3 1403 B17R0.14245 CCCCCCCCSCCCCC(=O)N(C)C 62a_100000210759_100000752486 [0,0,0,0,1,0|2,0,0]=3 1404 B17R0.14245 CCCCCCCCSCCCCC(=O)N(C)C 62a_100000752486_100000210317 [0,0,0,0,1,0|2,0,0]=3 1405 B17R0.14245 CCCCCCOCCOCCCC(=O)N(C)C 7a_100000691444_100000737642 [0,0,0,0,1,0|3,0,0]=4 1406 B17R0.14245 CCCCCNCCOCCCCC(=O)N(C)C 34a_100000224656_100000752486 [0,0,0,0,1,0|3,0,0]=4 1407 B17R0.14245 CCCCCOCCOCCCCC(=O)N(C)C 34a_100011215259_100000752486 [0,0,0,0,1,0|3,0,0]=4 1408 B17R0.14245 CCCCCOCCOCCCCC(=O)N(C)C 7a_100011215259_100000752486 [0,0,0,0,1,0|3,0,0]=4 1409 B17R0.14245 CCCCOCCCCOCCCC(=O)N(C)C 7a_200000760531_100000737642 [0,0,0,0,1,0|3,0,0]=4 1410 B17R0.14245 CCCCOCCCNCCCCC(=O)N(C)C 34a_200000211371_100000752486 [0,0,0,0,1,0|3,0,0]=4 1411 B17R0.14245 CCCCOCCCOCCCCC(=O)N(C)C 34a_200011215613_100000752486 [0,0,0,0,1,0|3,0,0]=4 1412 B17R0.14245 CCCCOCCCOCCCCC(=O)N(C)C 7a_200011215613_100000752486 [0,0,0,0,1,0|3,0,0]=4 1413 B17R0.14245 CN(C)C(=O)CCCCCCCCCCCCO 240690a_100102631434_100102582631 [0,0,0,0,1,0|2,0,0]=3 1414 B17R0.14245 CN(C)C(=O)CCCCNCCCCCCCO 34a_100011996573_100000752486 [0,0,0,0,1,0|3,0,0]=4 1415 B17R0.14245 CN(C)C(=O)CCCCOCCCCCCCBr 34a_100000760002_100000752486 [0,0,0,0,1,0|3,0,0]=4 1416 B17R0.14245 CN(C)C(=O)CCCCOCCCCCCCBr 7a_100000760002_100000752486 [0,0,0,0,1,0|3,0,0]=4 1417 B17R0.14245 CN(C)C(=O)CCCCOCCCCCCCN 34a_100011996573_100000752486 [0,0,0,0,1,0|3,0,0]=4 1418 B17R0.14245 CN(C)C(=O)CCCCSCCCCCCCO 62a_100000752486_100000760002 [0,0,0,0,1,0|3,0,0]=4 1419 B17R0.14245 CN(C)C(=O)CCCCSCCCCCCCO 62a_100000760002_100000752486 [0,0,0,0,1,0|3,0,0]=4 1420 B17R0.14245 CN(C)C(=O)CCCNCCCCCCCCO 2230a_102515433106_100000737642 [0,0,0,0,1,0|3,0,0]=4 1421 B17R0.14245 CN(C)C(=O)CCCNCCCCCCCCO 2230a_200000744827_100000033203 [0,0,0,0,1,0|3,0,0]=4 1422 B17R0.14245 CN(C)C(=O)CCCOCCCCCCCCBr 7a_100009813846_100000737642 [0,0,0,0,1,0|3,0,0]=4 1423 B17R0.14245 CN(C)C(=O)CCCOCCCCCCCCCl 7a_100000033203_100000737642 [0,0,0,0,1,0|3,0,0]=4 1424 B17R0.14245 CN(C)C(=O)CCCSCCCCCCCCO 62a_100000033203_100000737642 [0,0,0,0,1,0|3,0,0]=4 1425 B17R0.14245 CN(C)C(=O)CCCSCCCCCCCCO 62a_100000737642_100000033203 [0,0,0,0,1,0|3,0,0]=4 1426 B17R0.14245 CN(C)C(=O)CCNCCCCCCCCCO 2230a_100000078944_100000737620 [0,0,0,0,1,0|3,0,0]=4 1427 B17R0.14245 CN(C)C(=O)CCNCCCCCCCCCO 2230a_100000738053_100009813782 [0,0,0,0,1,0|3,0,0]=4 1428 B17R0.14245 CN(C)C(=O)CCOCCCCCCCCCBr 7a_100009813782_100000737620 [0,0,0,0,1,0|3,0,0]=4 1429 B17R0.14245 CN(C)C(=O)CCOCCCCCCCCCCl 7a_100009868337_100000737620 [0,0,0,0,1,0|3,0,0]=4 1430 B17R0.14245 CN(C)C(=O)CCOCCCCCCCCCO 34a_200000747469_100009813782 [0,0,0,0,1,0|3,0,0]=4 1431 B17R0.14245 CN(C)C(=O)CCSCCCCCCCCCO 62a_100000737620_100009813782 [0,0,0,0,1,0|3,0,0]=4 1432 B17R0.14245 CN(C)C(=O)CCSCCCCCCCCCO 62a_100009813782_100000737620 [0,0,0,0,1,0|3,0,0]=4 1433 B17R0.14245 CN(C)C(=O)CNCCCCCCCCCCO 2230a_100000066964_100000185267 [0,0,0,0,1,0|3,0,0]=4 1434 B17R0.14245 CN(C)C(=O)CNCCCCCCCCCCO 2230a_100015183351_100009813290 [0,0,0,0,1,0|3,0,0]=4 1435 B17R0.14245 CN(C)C(=O)CNCCCCCCCCCCO 34a_100000066964_100000692301 [0,0,0,0,1,0|3,0,0]=4 1436 B17R0.14245 CN(C)C(=O)COCCCCCCCCCCBr 34a_100009813290_100000692301 [0,0,0,0,1,0|3,0,0]=4 1437 B17R0.14245 CN(C)C(=O)COCCCCCCCCCCBr 7a_100009813290_100000692301 [0,0,0,0,1,0|3,0,0]=4 1438 B17R0.14245 CN(C)C(=O)COCCCCCCCCCCCl 34a_200000033068_100000692301 [0,0,0,0,1,0|3,0,0]=4 1439 B17R0.14245 CN(C)C(=O)COCCCCCCCCCCCl 7a_200000033068_100000692301 [0,0,0,0,1,0|3,0,0]=4 1440 B17R0.14245 CN(C)C(=O)COCCCCCCCCCCN 34a_100000066964_100000692301 [0,0,0,0,1,0|3,0,0]=4 1441 B17R0.14245 CN(C)C(=O)CSCCCCCCCCCCO 62a_100000692301_200000033068 [0,0,0,0,1,0|3,0,0]=4 1442 B17R0.14245 CN(C)C(=O)CSCCCCCCCCCCO 62a_100009813290_100000692301 [0,0,0,0,1,0|3,0,0]=4 1443 B17R0.14245 COCCCCCCOCCCCC(=O)N(C)C 34a_200012092642_100000752486 [0,0,0,0,1,0|3,0,0]=4 1444 B17R0.14245 COCCCCCCOCCCCC(=O)N(C)C 7a_200012092642_100000752486 [0,0,0,0,1,0|3,0,0]=4 1445 B17R0.14245 COCCCCCCSCCCCC(=O)N(C)C 62a_100000752486_100011998445 [0,0,0,0,1,0|3,0,0]=4 1446 B17R0.14245 COCCCCCCSCCCCC(=O)N(C)C 62a_100011998445_100000752486 [0,0,0,0,1,0|3,0,0]=4 1447 B17R0.14245 C[C@@H](O)C(=O)CCCCCCCCCCCCO 1458a_100000717761_100009813331 [0,0,0,0,1,0|2,0,0]=3 1448 B17R0.14245 C[C@@H](O)C(=O)CCCCCCOCCCCCO 1458a_100000717761_200132310570 [0,0,0,0,1,0|3,0,0]=4 1449 B17R0.14245 C[C@H](O)C(=O)CCCCCCCCCCCCO 1458a_217856618621_100009813331 [0,0,0,0,1,0|2,0,0]=3 1450 B17R0.14245 C[C@H](O)C(=O)CCCCCCOCCCCCO 1458a_217856618621_200132310570 [0,0,0,0,1,0|3,0,0]=4 1451 B17R0.14245 O=C(CCCCCCCCCCCCO)C(O)O 1458a_100000233687_100009813331 [0,0,0,0,1,0|3,0,0]=4 1452 B16R0.274 CC(C)NCCCCCCCCCCCCO 2230a_100000066677_100000210206 [2,0,0,0,0,0|2,0,0]=4 1453 B16R0.274 CC(C)NCCCCCCCCCCCCO 2230a_100138425928_100009813331 [2,0,0,0,0,0|2,0,0]=4 1454 B16R0.274 CC(C)NCCCCCCCCCCCCO 34a_100000066677_100000210206 [2,0,0,0,0,0|2,0,0]=4 1455 B16R0.274 CC(C)NCCCCCCCCCCCCO 34a_100138425928_100009813331 [2,0,0,0,0,0|2,0,0]=4 1456 B16R0.274 CC(C)OCCCCCCCCCCCCN 34a_100000066677_100000210206 [2,0,0,0,0,0|1,0,0]=3 1457 B16R0.274 CC(C)OCCCCCCCCCCCCO 34a_100000212225_100009813331 [2,0,0,0,0,0|1,0,0]=3 1458 B16R0.274 CC(C)OCCCCCCOCCCCCO 34a_100000212225_200132310570 [2,0,0,0,0,0|2,0,0]=4 1459 B16R0.274 CC(C)OCCCCCOCCCCCCCl 34a_200132310570_100000210206 [2,0,0,0,0,0|2,0,0]=4 1460 B16R0.274 CC(C)OCCCCCOCCCCCCCl 7a_200132310570_100000210206 [2,0,0,0,0,0|2,0,0]=4 1461 B16R0.274 CC(C)OCCCNCCCCCCCCO 2230a_100000737246_100000033203 [2,0,0,0,0,0|2,0,0]=4 1462 B16R0.274 CC(C)OCCCNCCCCCCCCO 34a_100000737246_100000033203 [2,0,0,0,0,0|2,0,0]=4 1463 B16R0.274 CC(C)OCCNCCCCCCCCCO 2230a_100000078944_100000211751 [2,0,0,0,0,0|2,0,0]=4 1464 B16R0.274 CC(C)OCCNCCCCCCCCCO 2230a_100000701111_100009813782 [2,0,0,0,0,0|2,0,0]=4 1465 B16R0.274 CC(C)OCCNCCCCCCCCCO 34a_100000078944_100000211751 [2,0,0,0,0,0|2,0,0]=4 1466 B16R0.274 CC(C)OCCNCCCCCCCCCO 34a_100000701111_100009813782 [2,0,0,0,0,0|2,0,0]=4 1467 B16R0.274 CC(C)OCCOCCCCCCCCCBr 34a_100009813782_100000211751 [2,0,0,0,0,0|2,0,0]=4 1468 B16R0.274 CC(C)OCCOCCCCCCCCCBr 7a_100009813782_100000211751 [2,0,0,0,0,0|2,0,0]=4 1469 B16R0.274 CC(C)OCCOCCCCCCCCCCl 34a_100009868337_100000211751 [2,0,0,0,0,0|2,0,0]=4 1470 B16R0.274 CC(C)OCCOCCCCCCCCCCl 7a_100009868337_100000211751 [2,0,0,0,0,0|2,0,0]=4 1471 B16R0.274 CC(C)OCCOCCCCCCCCCN 34a_100000078944_100000211751 [2,0,0,0,0,0|2,0,0]=4 1472 B16R0.274 CC(C)OCCOCCCCCCCCCO 34a_100000211219_100009813782 [2,0,0,0,0,0|2,0,0]=4 1473 B16R0.274 CC(C)OCCOCCCCCCCCCO 7a_100000211219_100009813782 [2,0,0,0,0,0|2,0,0]=4 1474 B16R0.274 CC(C)OCCSCCCCCCCCCO 62a_100000211751_100009813782 [2,0,0,0,0,0|2,0,0]=4 1475 B16R0.274 CC(C)OCCSCCCCCCCCCO 62a_100009813782_100000211751 [2,0,0,0,0,0|2,0,0]=4 1476 B16R0.274 CC(C)OCNCCCCCCCCCCO 2230a_100000066964_100000709892 [2,0,0,0,0,0|2,0,0]=4 1477 B16R0.274 CC(C)OCNCCCCCCCCCCO 34a_100000066964_100000709892 [2,0,0,0,0,0|2,0,0]=4 1478 B16R0.274 CC(C)OCOCCCCCCCCCCBr 34a_100009813290_100000709892 [2,0,0,0,0,0|2,0,0]=4 1479 B16R0.274 CC(C)OCOCCCCCCCCCCCl 34a_200000033068_100000709892 [2,0,0,0,0,0|2,0,0]=4 1480 B16R0.274 CC(C)OCOCCCCCCCCCCN 34a_100000066964_100000709892 [2,0,0,0,0,0|2,0,0]=4 1481 B16R0.274 CC(C)OCSCCCCCCCCCCO 62a_100000709892_200000033068 [2,0,0,0,0,0|2,0,0]=4 1482 B16R0.274 CC(C)OCSCCCCCCCCCCO 62a_100009813290_100000709892 [2,0,0,0,0,0|2,0,0]=4 1483 B16R0.274 CCCCCCCCCCCNCOC(C)C 2230a_200011215754_100000709892 [2,0,0,0,0,0|1,0,0]=3 1484 B16R0.274 CCCCCCCCCCCNCOC(C)C 34a_200011215754_100000709892 [2,0,0,0,0,0|1,0,0]=3 1485 B16R0.274 CCCCCCCCCCCOCOC(C)C 34a_100000210809_100000709892 [2,0,0,0,0,0|1,0,0]=3 1486 B16R0.274 CCCCCCCCCCNCCOC(C)C 2230a_100000684558_100000211751 [2,0,0,0,0,0|1,0,0]=3 1487 B16R0.274 CCCCCCCCCCNCCOC(C)C 2230a_100000701111_100000210320 [2,0,0,0,0,0|1,0,0]=3 1488 B16R0.274 CCCCCCCCCCNCCOC(C)C 34a_100000684558_100000211751 [2,0,0,0,0,0|1,0,0]=3 1489 B16R0.274 CCCCCCCCCCNCCOC(C)C 34a_100000701111_100000210320 [2,0,0,0,0,0|1,0,0]=3 1490 B16R0.274 CCCCCCCCCCNCCSC(C)C 2230a_100000684558_100000730970 [2,0,0,0,0,0|1,1,0]=4 1491 B16R0.274 CCCCCCCCCCNCCSC(C)C 2230a_100000731138_100000210320 [2,0,0,0,0,0|1,1,0]=4 1492 B16R0.274 CCCCCCCCCCNCCSC(C)C 34a_100000684558_100000730970 [2,0,0,0,0,0|1,1,0]=4 1493 B16R0.274 CCCCCCCCCCNCCSC(C)C 34a_100000731138_100000210320 [2,0,0,0,0,0|1,1,0]=4 1494 B16R0.274 CCCCCCCCCCOCCNC(C)C 34a_100000224655_100000210320 [2,0,0,0,0,0|2,0,0]=4 1495 B16R0.274 CCCCCCCCCCOCCOC(C)C 34a_100000210711_100000211751 [2,0,0,0,0,0|1,0,0]=3 1496 B16R0.274 CCCCCCCCCCOCCOC(C)C 34a_100000211219_100000210320 [2,0,0,0,0,0|1,0,0]=3 1497 B16R0.274 CCCCCCCCCCOCCOC(C)C 7a_100000210711_100000211751 [2,0,0,0,0,0|1,0,0]=3 1498 B16R0.274 CCCCCCCCCCOCCOC(C)C 7a_100000211219_100000210320 [2,0,0,0,0,0|1,0,0]=3 1499 B16R0.274 CCCCCCCCCNCCCOC(C)C 2230a_100000737246_100011214924 [2,0,0,0,0,0|1,0,0]=3 1500 B16R0.274 CCCCCCCCCNCCCOC(C)C 34a_100000737246_100011214924 [2,0,0,0,0,0|1,0,0]=3 1501 B16R0.274 CCCCCCCCCOCCCNC(C)C 34a_100000182298_100011214924 [2,0,0,0,0,0|2,0,0]=4 1502 B16R0.274 CCCCCCCCOCCCCNC(C)C 34a_100011521146_100000210759 [2,0,0,0,0,0|2,0,0]=4 1503 B16R0.274 CCCCCCCOCCCCCNC(C)C 34a_100011629493_100000210614 [2,0,0,0,0,0|2,0,0]=4 1504 B16R0.303 CCCCCCCCCCCNCCOCC 2230a_102516460346_100011215454 [2,0,0,0,0,0|1,0,1]=4 1505 B16R0.303 CCCCCCCCCCCNCCOCC 2230a_200011215754_100011215890 [2,0,0,0,0,0|1,0,1]=4 1506 B16R0.303 CCCCCCCCCCCNCCOCC 34a_102516460346_100011215454 [2,0,0,0,0,0|1,0,1]=4 1507 B16R0.303 CCCCCCCCCCCNCCOCC 34a_200011215754_100000210147 [2,0,0,0,0,0|1,0,1]=4 1508 B16R0.303 CCCCCCCCCCCOCCOCC 34a_100000210136_100011215454 [2,0,0,0,0,0|1,0,1]=4 1509 B16R0.303 CCCCCCCCCCCOCCOCC 34a_100000210809_100000210147 [2,0,0,0,0,0|1,0,1]=4 1510 B16R0.303 CCCCCCCCCCCOCCOCC 34a_100010166600_100000210202 [2,0,0,0,0,0|1,0,1]=4 1511 B16R0.303 CCCCCCCCCCCOCCOCC 7a_100000210136_100011215454 [2,0,0,0,0,0|1,0,1]=4 1512 B16R0.303 CCCCCCCCCCCOCCOCC 7a_100000210809_100011215890 [2,0,0,0,0,0|1,0,1]=4 1513 B16R0.303 CCCCCCCCCCCOCCOCC 7a_100010166600_100000210202 [2,0,0,0,0,0|1,0,1]=4 1514 B16R0.303 CCCCCCCCCCNCCCOCC 2230a_100000210961_100000210320 [2,0,0,0,0,0|1,0,1]=4 1515 B16R0.303 CCCCCCCCCCNCCCOCC 2230a_100000684558_100012232248 [2,0,0,0,0,0|1,0,1]=4 1516 B16R0.303 CCCCCCCCCCNCCCOCC 34a_100000210961_100000210320 [2,0,0,0,0,0|1,0,1]=4 1517 B16R0.303 CCCCCCCCCCNCCCOCC 34a_100000684558_100012232248 [2,0,0,0,0,0|1,0,1]=4 1518 B16R0.303 CCCCCCCCCCOCCCOCC 34a_100000210711_100012232248 [2,0,0,0,0,0|1,0,1]=4 1519 B16R0.303 CCCCCCCCCCOCCCOCC 34a_100000757476_100000210320 [2,0,0,0,0,0|1,0,1]=4 1520 B16R0.303 CCCCCCCCCCOCCCOCC 7a_100000210711_100012232248 [2,0,0,0,0,0|1,0,1]=4 1521 B16R0.303 CCCCCCCCCCOCCCOCC 7a_100000757476_100000210320 [2,0,0,0,0,0|1,0,1]=4 1522 B16R0.303 CCCCOCCCCCCCCCOCC 34a_100009875440_100000210210 [2,0,0,0,0,0|1,0,1]=4 1523 B16R0.303 CCCCOCCCCCCCCCOCC 7a_100009875440_100000210211 [2,0,0,0,0,0|1,0,1]=4 1524 B16R0.303 CCOCCCCCCCCCCCCCO 34a_100121572206_100009812470 [2,0,0,0,0,0|1,0,1]=4 1525 B16R0.61 CC#CC(=O)CCCCCCCCCCCC 1458a_100000763181_100000759014 [2,0,0,0,0,0|1,0,1]=4 1526 B16R0.61 CCCC(=O)CCCCCCCCCCCO 1458a_100000211992_100009812471 [2,0,0,0,0,0|2,0,0]=4 1527 B16R0.61 CCCCCCCCCCCCC(=O)CCO 1458a_100011215791_100000211926 [2,0,0,0,0,0|2,0,0]=4 1528 B16R0.61 CCCCCCCCCCCCC(=O)CCO 1458a_100011216618_100000759014 [2,0,0,0,0,0|2,0,0]=4 1529 B16R0.61 CCCCCCCCCCCCC(=O)COC 1458a_100000210968_100000759014 [2,0,0,0,0,0|2,0,0]=4 1530 B16R0.61 CCCCCCCCCCCCC(=O)NCC 11a_100015525214_100011215791 [2,0,0,0,0,0|1,0,0]=3 1531 B16R0.61 CCCCCCCCCCCCC(=O)NCC 240690a_100015525214_100011215791 [2,0,0,0,0,0|1,0,0]=3 1532 B16R0.61 CCCCCCCCCCCCC(=O)NNC 22a_100016993582_100011215791 [2,0,0,0,0,0|2,0,0]=4 1533 B16R0.61 CCCCCCCCCCCNC(=O)CCC 11a_200011215754_100000211992 [2,0,0,0,0,0|2,0,0]=4 1534 B16R0.61 CCCCCCCCCCCNC(=O)CCC 1626a_200011215754_100000211992 [2,0,0,0,0,0|2,0,0]=4 1535 B16R0.61 CCCCCCCCCCCNC(=O)CCC 240690a_200011215754_100000211992 [2,0,0,0,0,0|2,0,0]=4 1536 B16R0.61 CCCCCCCCCCCNC(=O)CCC 527a_200011215754_100000211992 [2,0,0,0,0,0|2,0,0]=4 1537 B16R0.61 CCCCCCCCCCCNC(=O)NCC 2708a_100015525214_200011215754 [2,0,0,0,0,0|2,0,0]=4 1538 B16R0.61 CCCCCCCCCCCNC(=O)NCC 2708a_200011215754_100015525214 [2,0,0,0,0,0|2,0,0]=4 1539 B16R0.61 CCCCCCCCCCCNC(=O)NCC 273464a_100015525214_200011215754 [2,0,0,0,0,0|2,0,0]=4 1540 B16R0.61 CCCCCCCCCCCNC(=O)NCC 273464a_200011215754_100015525214 [2,0,0,0,0,0|2,0,0]=4 1541 B16R0.61 CCCCCCCCCCCNC(=O)NCC 512a_100015525214_200011215754 [2,0,0,0,0,0|2,0,0]=4 1542 B16R0.61 CCCCCCCCCCCNC(=O)NCC 512a_200011215754_100015525214 [2,0,0,0,0,0|2,0,0]=4 1543 B16R0.61 CCCCCCCCCCNCC(=O)CCC 2230a_100000684558_100000747444 [2,0,0,0,0,0|2,0,0]=4 1544 B16R0.61 CCCCCCCCCCNCC(=O)NCC 2230a_100000684558_100000183381 [2,0,0,0,0,0|2,0,0]=4 1545 B16R0.61 CCCCCCCCCCNCC(=O)NCC 2230a_100016988866_100000210320 [2,0,0,0,0,0|2,0,0]=4 1546 B16R0.61 CCCCCCCCCCNCC(=O)NCC 34a_100000684558_100000183381 [2,0,0,0,0,0|2,0,0]=4 1547 B16R0.61 CCCCCCCCCCNCC(=O)OCC 2230a_100000684558_100000188475 [2,0,0,0,0,0|1,0,0]=3 1548 B16R0.61 CCCCCCCCCCNCC(=O)OCC 34a_100000684558_100000188475 [2,0,0,0,0,0|1,0,0]=3 1549 B16R0.61 CCCCCCCCCCOCC(=O)CCC 7a_100000210711_100000747444 [2,0,0,0,0,0|2,0,0]=4 1550 B16R0.61 CCCCCCCCCCOCC(=O)NCC 34a_100000210711_100000183381 [2,0,0,0,0,0|2,0,0]=4 1551 B16R0.61 CCCCCCCCCCOCC(=O)NCC 7a_100000210711_100000183381 [2,0,0,0,0,0|2,0,0]=4 1552 B16R0.61 CCCCCCCCCCOCC(=O)OCC 34a_100000210711_100000188475 [2,0,0,0,0,0|1,0,0]=3 1553 B16R0.61 CCCCCCCCCCOCC(=O)OCC 7a_100000210711_100000188475 [2,0,0,0,0,0|1,0,0]=3 1554 B16R0.61 CCCCCCCCCCSCC(=O)NCC 62a_100000183381_100000210320 [2,0,0,0,0,0|2,0,0]=4 1555 B16R0.61 CCCCCCCCCCSCC(=O)OCC 62a_100000188475_100000210320 [2,0,0,0,0,0|1,0,0]=3 1556 B16R0.61 CCCCCCCCCNCCC(=O)NCC 2230a_100000212291_100000737597 [2,0,0,0,0,0|2,0,0]=4 1557 B16R0.61 CCCCCCCCCNCCC(=O)NCC 34a_100025743525_100011214924 [2,0,0,0,0,0|2,0,0]=4 1558 B16R0.61 CCCCCCCCCNCCC(=O)OCC 2230a_100000212291_100011206558 [2,0,0,0,0,0|1,0,0]=3 1559 B16R0.61 CCCCCCCCCNCCC(=O)OCC 34a_100000212291_100000765890 [2,0,0,0,0,0|1,0,0]=3 1560 B16R0.61 CCCCCCCCCOCCC(=O)NCC 7a_100000210712_100000737597 [2,0,0,0,0,0|2,0,0]=4 1561 B16R0.61 CCCCCCCCCOCCC(=O)OCC 34a_100000210712_100000765890 [2,0,0,0,0,0|1,0,0]=3 1562 B16R0.61 CCCCCCCCCOCCC(=O)OCC 7a_100000210712_100011206558 [2,0,0,0,0,0|1,0,0]=3 1563 B16R0.61 CCCCCCCCCSCCC(=O)NCC 62a_100000737597_100000210670 [2,0,0,0,0,0|2,0,0]=4 1564 B16R0.61 CCCCCCCCCSCCC(=O)OCC 62a_100000765890_100000210670 [2,0,0,0,0,0|1,0,0]=3 1565 B16R0.61 CCCCCCCCNCCCC(=O)OCC 2230a_100000229939_100009991533 [2,0,0,0,0,0|1,0,0]=3 1566 B16R0.61 CCCCCCCCNCCCC(=O)OCC 34a_100000229939_100009991533 [2,0,0,0,0,0|1,0,0]=3 1567 B16R0.61 CCCCCCCCOCCCC(=O)OCC 34a_100000210232_100009991533 [2,0,0,0,0,0|1,0,0]=3 1568 B16R0.61 CCCCCCCCOCCCC(=O)OCC 7a_100000210232_100011215271 [2,0,0,0,0,0|1,0,0]=3 1569 B16R0.61 CCCCCCCCOCCCC(=O)OCC 7a_100012001163_100000210759 [2,0,0,0,0,0|1,0,0]=3 1570 B16R0.61 CCCCCCCCOCCNC(=O)OCC 34a_100000158857_100000210759 [2,0,0,0,0,0|2,0,0]=4 1571 B16R0.61 CCCCCCCCOCCNC(=O)OCC 7a_100000210232_200011445536 [2,0,0,0,0,0|2,0,0]=4 1572 B16R0.61 CCCCCCCCSCCCC(=O)OCC 62a_100000210759_100009991533 [2,0,0,0,0,0|1,0,0]=3 1573 B16R0.61 CCCCCCCCSCCCC(=O)OCC 62a_100009991533_100000210317 [2,0,0,0,0,0|1,0,0]=3 1574 B16R0.61 CCCCCCCCSCCNC(=O)OCC 62a_100000210759_200011445536 [2,0,0,0,0,0|2,0,0]=4 1575 B16R0.61 CCCCCCCNCCCCC(=O)OCC 2230a_100000229938_100000750268 [2,0,0,0,0,0|1,0,0]=3 1576 B16R0.61 CCCCCCCNCCOCC(=O)OCC 2230a_100000229938_100000088970 [2,0,0,0,0,0|2,0,0]=4 1577 B16R0.61 CCCCCCCOCCCCC(=O)OCC 34a_100000210272_100000750268 [2,0,0,0,0,0|1,0,0]=3 1578 B16R0.61 CCCCCCCOCCCCC(=O)OCC 7a_100000210272_100000750268 [2,0,0,0,0,0|1,0,0]=3 1579 B16R0.61 CCCCCCCOCCOCC(=O)OCC 34a_100000210272_100000088970 [2,0,0,0,0,0|2,0,0]=4 1580 B16R0.61 CCCCCCCOCCOCC(=O)OCC 7a_100000210272_100000088970 [2,0,0,0,0,0|2,0,0]=4 1581 B16R0.61 CCCCCCCOCCSCC(=O)OCC 7a_200000230590_100000210614 [2,0,0,0,0,0|2,0,0]=4 1582 B16R0.61 CCCCCCCSCCCCC(=O)OCC 62a_100000210614_100000750268 [2,0,0,0,0,0|1,0,0]=3 1583 B16R0.61 CCCCCCCSCCCCC(=O)OCC 62a_100000750268_100000210316 [2,0,0,0,0,0|1,0,0]=3 1584 B16R0.61 CCCCCCCSCCOCC(=O)OCC 62a_100000088970_100000210316 [2,0,0,0,0,0|2,0,0]=4 1585 B16R0.61 CCCCCCCSCCOCC(=O)OCC 62a_100000210614_100000088970 [2,0,0,0,0,0|2,0,0]=4 1586 B16R0.61 CCCCCCNCCCCCC(=O)OCC 2230a_100000210581_100000755133 [2,0,0,0,0,0|1,0,0]=3 1587 B16R0.61 CCCCCCNCCCOCC(=O)OCC 2230a_100000210581_100009893628 [2,0,0,0,0,0|2,0,0]=4 1588 B16R0.61 CCCCCCOCCCCCC(=O)OCC 34a_100000210259_100000755133 [2,0,0,0,0,0|1,0,0]=3 1589 B16R0.61 CCCCCCOCCCCCC(=O)OCC 7a_100000210259_100000755133 [2,0,0,0,0,0|1,0,0]=3 1590 B16R0.61 CCCCCCOCCCCCC(=O)OCC 7a_100011214988_100000210314 [2,0,0,0,0,0|1,0,0]=3 1591 B16R0.61 CCCCCCOCCCOCC(=O)OCC 34a_100000210259_100009893628 [2,0,0,0,0,0|2,0,0]=4 1592 B16R0.61 CCCCCCOCCCOCC(=O)OCC 7a_100000210259_100009893628 [2,0,0,0,0,0|2,0,0]=4 1593 B16R0.61 CCCCCCOCCOCCC(=O)OCC 34a_100000691444_100000765890 [2,0,0,0,0,0|2,0,0]=4 1594 B16R0.61 CCCCCCOCCOCCC(=O)OCC 7a_100000691444_100011206558 [2,0,0,0,0,0|2,0,0]=4 1595 B16R0.61 CCCCCCSCCCCCC(=O)OCC 62a_100000210314_100000755133 [2,0,0,0,0,0|1,0,0]=3 1596 B16R0.61 CCCCCCSCCCCCC(=O)OCC 62a_100000755133_100000210757 [2,0,0,0,0,0|1,0,0]=3 1597 B16R0.61 CCCCCCSCCCOCC(=O)OCC 62a_100000210314_100009893628 [2,0,0,0,0,0|2,0,0]=4 1598 B16R0.61 CCCCCCSCCCOCC(=O)OCC 62a_100009893628_100000210757 [2,0,0,0,0,0|2,0,0]=4 1599 B16R0.61 CCCCCNCCCCCCC(=O)OCC 2230a_100000209983_100009814379 [2,0,0,0,0,0|1,0,0]=3 1600 B16R0.61 CCCCCNCCOCCCC(=O)OCC 34a_100000224656_100009991533 [2,0,0,0,0,0|2,0,0]=4 1601 B16R0.61 CCCCCOCCCCCCC(=O)OCC 34a_100000210253_100009814379 [2,0,0,0,0,0|1,0,0]=3 1602 B16R0.61 CCCCCOCCCCCCC(=O)OCC 7a_100000210253_100009814379 [2,0,0,0,0,0|1,0,0]=3 1603 B16R0.61 CCCCCOCCOCCCC(=O)OCC 34a_100011215259_100009991533 [2,0,0,0,0,0|2,0,0]=4 1604 B16R0.61 CCCCCOCCOCCCC(=O)OCC 7a_100011215259_100011215271 [2,0,0,0,0,0|2,0,0]=4 1605 B16R0.61 CCCCCSCCCCCCC(=O)OCC 62a_100000210326_100009814379 [2,0,0,0,0,0|1,0,0]=3 1606 B16R0.61 CCCCNCCCCCCCC(=O)OCC 2230a_100000102301_100009991516 [2,0,0,0,0,0|1,0,0]=3 1607 B16R0.61 CCCCNCCCCCCCC(=O)OCC 7a_106832991798_100009991516 [2,0,0,0,0,0|1,0,0]=3 1608 B16R0.61 CCCCNCCCCOCCC(=O)OCC 34a_200011216965_100000765890 [2,0,0,0,0,0|2,0,0]=4 1609 B16R0.61 CCCCOCCCCCCCC(=O)OCC 34a_100000210227_100009991516 [2,0,0,0,0,0|1,0,0]=3 1610 B16R0.61 CCCCOCCCCCCCC(=O)OCC 7a_100000210227_100009991516 [2,0,0,0,0,0|1,0,0]=3 1611 B16R0.61 CCCCOCCCCOCCC(=O)OCC 34a_200000760531_100000765890 [2,0,0,0,0,0|2,0,0]=4 1612 B16R0.61 CCCCOCCCCOCCC(=O)OCC 7a_200000760531_100011206558 [2,0,0,0,0,0|2,0,0]=4 1613 B16R0.61 CCCCOCCCNCCCC(=O)OCC 2230a_200000211371_100009991533 [2,0,0,0,0,0|2,0,0]=4 1614 B16R0.61 CCCCOCCCNCCCC(=O)OCC 34a_200000211371_100009991533 [2,0,0,0,0,0|2,0,0]=4 1615 B16R0.61 CCCCOCCCOCCCC(=O)OCC 34a_200011215613_100009991533 [2,0,0,0,0,0|2,0,0]=4 1616 B16R0.61 CCCCOCCCOCCCC(=O)OCC 7a_200011215613_100011215271 [2,0,0,0,0,0|2,0,0]=4 1617 B16R0.61 CCCCOCCOCCCCC(=O)OCC 34a_100000210238_100000750268 [2,0,0,0,0,0|2,0,0]=4 1618 B16R0.61 CCCCOCCOCCCCC(=O)OCC 7a_100000210238_100000750268 [2,0,0,0,0,0|2,0,0]=4 1619 B16R0.61 CCCCOCCSCCCCC(=O)OCC 62a_100000743108_100000750268 [2,0,0,0,0,0|2,0,0]=4 1620 B16R0.61 CCCCOCCSCCCCC(=O)OCC 62a_100000750268_100000743108 [2,0,0,0,0,0|2,0,0]=4 1621 B16R0.61 CCCCOCSCCCCCC(=O)OCC 62a_100000755133_100011995733 [2,0,0,0,0,0|2,0,0]=4 1622 B16R0.61 CCCCOCSCCCCCC(=O)OCC 62a_100011995733_100000755133 [2,0,0,0,0,0|2,0,0]=4 1623 B16R0.61 CCCCSCCCCCCCC(=O)OCC 62a_100000210211_100009991516 [2,0,0,0,0,0|1,0,0]=3 1624 B16R0.61 CCCCSCCNCCCCC(=O)OCC 2230a_100025743550_100000750268 [2,0,0,0,0,0|2,0,0]=4 1625 B16R0.61 CCCCSCCOCCCCC(=O)OCC 34a_200000230436_100000750268 [2,0,0,0,0,0|2,0,0]=4 1626 B16R0.61 CCCCSCCOCCCCC(=O)OCC 7a_200000230436_100000750268 [2,0,0,0,0,0|2,0,0]=4 1627 B16R0.61 CCCOCCCCCCCCC(=O)OCC 34a_100000210258_100010175975 [2,0,0,0,0,0|1,0,0]=3 1628 B16R0.61 CCCOCCCNCCCCC(=O)OCC 2230a_100011217757_100000750268 [2,0,0,0,0,0|2,0,0]=4 1629 B16R0.61 CCCOCCCNCCCCC(=O)OCC 34a_100011217757_100000750268 [2,0,0,0,0,0|2,0,0]=4 1630 B16R0.61 CCCOCCNCCCCCC(=O)OCC 2230a_100161115042_100000755133 [2,0,0,0,0,0|2,0,0]=4 1631 B16R0.61 CCCOCCNCCCCCC(=O)OCC 34a_100161115042_100000755133 [2,0,0,0,0,0|2,0,0]=4 1632 B16R0.61 CCCOCCOCCCCCC(=O)OCC 34a_100000752267_100000755133 [2,0,0,0,0,0|2,0,0]=4 1633 B16R0.61 CCCOCCOCCCCCC(=O)OCC 7a_100000752267_100000755133 [2,0,0,0,0,0|2,0,0]=4 1634 B16R0.61 CCCOCCOCCCCCC(=O)OCC 7a_100011214988_100011215938 [2,0,0,0,0,0|2,0,0]=4 1635 B16R0.61 CCCOCCSCCCCCC(=O)OCC 62a_100000755133_100011215938 [2,0,0,0,0,0|2,0,0]=4 1636 B16R0.61 CCCOCCSCCCCCC(=O)OCC 62a_100011215938_100000755133 [2,0,0,0,0,0|2,0,0]=4 1637 B16R0.61 CCCSCCCCCCCCC(=O)OCC 62a_100000210303_100010175975 [2,0,0,0,0,0|1,0,0]=3 1638 B16R0.61 CCCSCCNCCCCCC(=O)OCC 2230a_100020603323_100000755133 [2,0,0,0,0,0|2,0,0]=4 1639 B16R0.61 CCCSCCOCCCCCC(=O)OCC 34a_200000230433_100000755133 [2,0,0,0,0,0|2,0,0]=4 1640 B16R0.61 CCCSCCOCCCCCC(=O)OCC 7a_200000230433_100000755133 [2,0,0,0,0,0|2,0,0]=4 1641 B16R0.61 CCNC(=O)CCCCCCCCCCCO 240690a_100015525214_100000037981 [2,0,0,0,0,0|2,0,0]=4 1642 B16R0.61 CCNCCCCCCCCCC(=O)OCC 2230a_100015525214_100009828014 [2,0,0,0,0,0|1,0,0]=3 1643 B16R0.61 CCOC(=O)CCCCCCCCCCNC 2230a_106832991635_100009827693 [2,0,0,0,0,0|1,0,0]=3 1644 B16R0.61 CCOC(=O)CCCCCCCCCCNC 34a_100102657272_100009827693 [2,0,0,0,0,0|1,0,0]=3 1645 B16R0.61 CCOC(=O)CCCCCCCCCCNC 7a_106832991635_100009827693 [2,0,0,0,0,0|1,0,0]=3 1646 B16R0.61 CCOC(=O)CCCCCCCCCCOC 34a_100138415774_100009827693 [2,0,0,0,0,0|1,0,0]=3 1647 B16R0.61 CCOC(=O)CCCCCCCCCCSC 62a_200000210301_100009827693 [2,0,0,0,0,0|1,0,0]=3 1648 B16R0.61 CCOC(=O)CCCCCCCCCCS[13CH3] 62a_200025704644_100009827693 [2,0,0,0,0,0|1,0,0]=3 1649 B16R0.61 CCOC(=O)CCCCCCCCCSCC 62a_100000210202_100009828014 [2,0,0,0,0,0|1,0,0]=3 1650 B16R0.61 CCOC(=O)CCCCCCCCCSCF 62a_100015361967_100009828014 [2,0,0,0,0,0|2,0,0]=4 1651 B16R0.61 CCOC(=O)CCCCCCCCNCCF 34a_100000724931_100010175975 [2,0,0,0,0,0|2,0,0]=4 1652 B16R0.61 CCOC(=O)CCCCCCCCNCCO 2230a_100016997473_100010175975 [2,0,0,0,0,0|2,0,0]=4 1653 B16R0.61 CCOC(=O)CCCCCCCCNCCO 34a_100016990907_100010175975 [2,0,0,0,0,0|2,0,0]=4 1654 B16R0.61 CCOC(=O)CCCCCCCCOCCBr 34a_100000211926_100010175975 [2,0,0,0,0,0|2,0,0]=4 1655 B16R0.61 CCOC(=O)CCCCCCCCOCCN 34a_100000210304_100010175975 [2,0,0,0,0,0|2,0,0]=4 1656 B16R0.61 CCOC(=O)CCCCCCCCSCCF 62a_100011217306_100010175975 [2,0,0,0,0,0|2,0,0]=4 1657 B16R0.61 CCOC(=O)CCCCCCCCSCCO 62a_100000211926_100010175975 [2,0,0,0,0,0|2,0,0]=4 1658 B16R0.61 CCOC(=O)CCCCCCCCSCOC 62a_100000766300_100010175975 [2,0,0,0,0,0|2,0,0]=4 1659 B16R0.61 CCOC(=O)CCCCCCCCSCSC 62a_100011218213_100010175975 [2,0,0,0,0,0|2,0,0]=4 1660 B16R0.61 CCOC(=O)CCCCCCCNCCCF 2230a_100015189416_100009991516 [2,0,0,0,0,0|2,0,0]=4 1661 B16R0.61 CCOC(=O)CCCCCCCNCCCF 34a_100015189416_100009991516 [2,0,0,0,0,0|2,0,0]=4 1662 B16R0.61 CCOC(=O)CCCCCCCNCCOC 2230a_100000209980_100009991516 [2,0,0,0,0,0|2,0,0]=4 1663 B16R0.61 CCOC(=O)CCCCCCCNCCSC 2230a_100020590264_100009991516 [2,0,0,0,0,0|2,0,0]=4 1664 B16R0.61 CCOC(=O)CCCCCCCOCCCBr 34a_100011217188_100009991516 [2,0,0,0,0,0|2,0,0]=4 1665 B16R0.61 CCOC(=O)CCCCCCCOCCCCl 34a_100000230001_100009991516 [2,0,0,0,0,0|2,0,0]=4 1666 B16R0.61 CCOC(=O)CCCCCCCOCCCF 34a_100000759539_100009991516 [2,0,0,0,0,0|2,0,0]=4 1667 B16R0.61 CCOC(=O)CCCCCCCOCCCN 34a_100000182051_100009991516 [2,0,0,0,0,0|2,0,0]=4 1668 B16R0.61 CCOC(=O)CCCCCCCOCCOC 34a_100000210237_100009991516 [2,0,0,0,0,0|2,0,0]=4 1669 B16R0.61 CCOC(=O)CCCCCCCOCCSC 34a_100000230434_100009991516 [2,0,0,0,0,0|2,0,0]=4 1670 B16R0.61 CCOC(=O)CCCCCCCOCCSC 7a_100000230434_100009991516 [2,0,0,0,0,0|2,0,0]=4 1671 B16R0.61 CCOC(=O)CCCCCCCSCCCF 62a_100011934791_100009991516 [2,0,0,0,0,0|2,0,0]=4 1672 B16R0.61 CCOC(=O)CCCCCCCSCCCO 62a_100011215043_100009991516 [2,0,0,0,0,0|2,0,0]=4 1673 B16R0.61 CCOC(=O)CCCCCCCSCCOC 62a_100000233755_100009991516 [2,0,0,0,0,0|2,0,0]=4 1674 B16R0.61 CCOC(=O)CCCCCCCSCCSC 62a_100000212216_100009991516 [2,0,0,0,0,0|2,0,0]=4 1675 B16R0.61 CCOC(=O)CCCCCCNCCCCO 2230a_100000750430_100009814379 [2,0,0,0,0,0|2,0,0]=4 1676 B16R0.61 CCOC(=O)CCCCCCNCCCCO 34a_100000750430_100009814379 [2,0,0,0,0,0|2,0,0]=4 1677 B16R0.61 CCOC(=O)CCCCCCNCCCOC 34a_100150723488_100009814379 [2,0,0,0,0,0|2,0,0]=4 1678 B16R0.61 CCOC(=O)CCCCCCNCCCSC 2230a_100000749238_100009814379 [2,0,0,0,0,0|2,0,0]=4 1679 B16R0.61 CCOC(=O)CCCCCCNCCSCC 2230a_100000106463_100009814379 [2,0,0,0,0,0|2,0,0]=4 1680 B16R0.61 CCOC(=O)CCCCCCOCCCCBr 34a_100011216708_100009814379 [2,0,0,0,0,0|2,0,0]=4 1681 B16R0.61 CCOC(=O)CCCCCCOCCCCCl 34a_100000210776_100009814379 [2,0,0,0,0,0|2,0,0]=4 1682 B16R0.61 CCOC(=O)CCCCCCOCCCCCl 7a_100000210776_100009814379 [2,0,0,0,0,0|2,0,0]=4 1683 B16R0.61 CCOC(=O)CCCCCCOCCCCF 34a_100011995726_100009814379 [2,0,0,0,0,0|2,0,0]=4 1684 B16R0.61 CCOC(=O)CCCCCCOCCCCF 7a_100011995726_100009814379 [2,0,0,0,0,0|2,0,0]=4 1685 B16R0.61 CCOC(=O)CCCCCCOCCCCI 34a_200012148704_100009814379 [2,0,0,0,0,0|2,0,0]=4 1686 B16R0.61 CCOC(=O)CCCCCCOCCCCN 34a_100000750430_100009814379 [2,0,0,0,0,0|2,0,0]=4 1687 B16R0.61 CCOC(=O)CCCCCCOCCCNC 34a_100000213112_100009814379 [2,0,0,0,0,0|2,0,0]=4 1688 B16R0.61 CCOC(=O)CCCCCCOCCCOC 34a_100000740835_100009814379 [2,0,0,0,0,0|2,0,0]=4 1689 B16R0.61 CCOC(=O)CCCCCCOCCCSC 34a_100000690336_100009814379 [2,0,0,0,0,0|2,0,0]=4 1690 B16R0.61 CCOC(=O)CCCCCCOCCCSC 7a_100000690336_100009814379 [2,0,0,0,0,0|2,0,0]=4 1691 B16R0.61 CCOC(=O)CCCCCCOCCSCC 34a_100000212035_100009814379 [2,0,0,0,0,0|2,0,0]=4 1692 B16R0.61 CCOC(=O)CCCCCCOCCSCC 7a_100000212035_100009814379 [2,0,0,0,0,0|2,0,0]=4 1693 B16R0.61 CCOC(=O)CCCCCCSCCCCF 62a_100000729493_100009814379 [2,0,0,0,0,0|2,0,0]=4 1694 B16R0.61 CCOC(=O)CCCCCCSCCCCO 62a_100000210776_100009814379 [2,0,0,0,0,0|2,0,0]=4 1695 B16R0.61 CCOC(=O)CCCCCCSCCCOC 62a_100000709357_100009814379 [2,0,0,0,0,0|2,0,0]=4 1696 B16R0.61 CCOC(=O)CCCCCCSCCSCC 62a_100000757381_100009814379 [2,0,0,0,0,0|2,0,0]=4 1697 B16R0.61 CCOC(=O)CCCCCNCCCCCO 2230a_100000762737_100000755133 [2,0,0,0,0,0|2,0,0]=4 1698 B16R0.61 CCOC(=O)CCCCCNCCCCCO 34a_100000762737_100000755133 [2,0,0,0,0,0|2,0,0]=4 1699 B16R0.61 CCOC(=O)CCCCCOCCCCCBr 34a_100000746331_100000755133 [2,0,0,0,0,0|2,0,0]=4 1700 B16R0.61 CCOC(=O)CCCCCOCCCCCBr 7a_100000746331_100000755133 [2,0,0,0,0,0|2,0,0]=4 1701 B16R0.61 CCOC(=O)CCCCCOCCCCCCl 34a_100000746330_100000755133 [2,0,0,0,0,0|2,0,0]=4 1702 B16R0.61 CCOC(=O)CCCCCOCCCCCCl 7a_100000746330_100000755133 [2,0,0,0,0,0|2,0,0]=4 1703 B16R0.61 CCOC(=O)CCCCCOCCCCCF 7a_100011214988_100000729378 [2,0,0,0,0,0|2,0,0]=4 1704 B16R0.61 CCOC(=O)CCCCCOCCCCCI 34a_200012148887_100000755133 [2,0,0,0,0,0|2,0,0]=4 1705 B16R0.61 CCOC(=O)CCCCCOCCCCCI 7a_200012148887_100000755133 [2,0,0,0,0,0|2,0,0]=4 1706 B16R0.61 CCOC(=O)CCCCCOCCCCCN 34a_100000762737_100000755133 [2,0,0,0,0,0|2,0,0]=4 1707 B16R0.61 CCOC(=O)CCCCCOCCCCCO 7a_100011214988_100000746330 [2,0,0,0,0,0|2,0,0]=4 1708 B16R0.61 CCOC(=O)CCCCCOCCCCOC 34a_100000740925_100000755133 [2,0,0,0,0,0|2,0,0]=4 1709 B16R0.61 CCOC(=O)CCCCCOCCCCOC 7a_100011214988_100000730899 [2,0,0,0,0,0|2,0,0]=4 1710 B16R0.61 CCOC(=O)CCCCCOCCCCSC 34a_100011217163_100000755133 [2,0,0,0,0,0|2,0,0]=4 1711 B16R0.61 CCOC(=O)CCCCCOCCCCSC 7a_100011217163_100000755133 [2,0,0,0,0,0|2,0,0]=4 1712 B16R0.61 CCOC(=O)CCCCCOCCCSCC 34a_100011216438_100000755133 [2,0,0,0,0,0|2,0,0]=4 1713 B16R0.61 CCOC(=O)CCCCCOCCCSCC 7a_100011216438_100000755133 [2,0,0,0,0,0|2,0,0]=4 1714 B16R0.61 CCOC(=O)CCCCCSCCCCCF 62a_100000729378_100000755133 [2,0,0,0,0,0|2,0,0]=4 1715 B16R0.61 CCOC(=O)CCCCCSCCCCCF 62a_100000755133_100000729378 [2,0,0,0,0,0|2,0,0]=4 1716 B16R0.61 CCOC(=O)CCCCCSCCCCCO 62a_100000746330_100000755133 [2,0,0,0,0,0|2,0,0]=4 1717 B16R0.61 CCOC(=O)CCCCCSCCCCCO 62a_100000755133_100000746330 [2,0,0,0,0,0|2,0,0]=4 1718 B16R0.61 CCOC(=O)CCCCCSCCCCOC 62a_100000730899_100000755133 [2,0,0,0,0,0|2,0,0]=4 1719 B16R0.61 CCOC(=O)CCCCCSCCCCOC 62a_100000755133_100000730899 [2,0,0,0,0,0|2,0,0]=4 1720 B16R0.61 CCOC(=O)CCCCNCCCCCCO 2230a_100000686447_100000750268 [2,0,0,0,0,0|2,0,0]=4 1721 B16R0.61 CCOC(=O)CCCCNCCCCCCO 34a_100000686447_100000750268 [2,0,0,0,0,0|2,0,0]=4 1722 B16R0.61 CCOC(=O)CCCCNCCCCCOC 2230a_100000747528_100000750268 [2,0,0,0,0,0|2,0,0]=4 1723 B16R0.61 CCOC(=O)CCCCNCCCCCOC 34a_100000747528_100000750268 [2,0,0,0,0,0|2,0,0]=4 1724 B16R0.61 CCOC(=O)CCCCOCCCCCCBr 34a_100011215345_100000750268 [2,0,0,0,0,0|2,0,0]=4 1725 B16R0.61 CCOC(=O)CCCCOCCCCCCBr 7a_100011215345_100000750268 [2,0,0,0,0,0|2,0,0]=4 1726 B16R0.61 CCOC(=O)CCCCOCCCCCCCl 34a_100000766143_100000750268 [2,0,0,0,0,0|2,0,0]=4 1727 B16R0.61 CCOC(=O)CCCCOCCCCCCCl 7a_100000766143_100000750268 [2,0,0,0,0,0|2,0,0]=4 1728 B16R0.61 CCOC(=O)CCCCOCCCCCCF 34a_100000732779_100000750268 [2,0,0,0,0,0|2,0,0]=4 1729 B16R0.61 CCOC(=O)CCCCOCCCCCCF 7a_100000732779_100000750268 [2,0,0,0,0,0|2,0,0]=4 1730 B16R0.61 CCOC(=O)CCCCOCCCCCCN 34a_100000686447_100000750268 [2,0,0,0,0,0|2,0,0]=4 1731 B16R0.61 CCOC(=O)CCCCOCCCCCNC 34a_100000722520_100000750268 [2,0,0,0,0,0|2,0,0]=4 1732 B16R0.61 CCOC(=O)CCCCSCCCCCCF 62a_100000750268_100015922095 [2,0,0,0,0,0|2,0,0]=4 1733 B16R0.61 CCOC(=O)CCCCSCCCCCCF 62a_100015922095_100000750268 [2,0,0,0,0,0|2,0,0]=4 1734 B16R0.61 CCOC(=O)CCCCSCCCCCCO 62a_100000750268_100000766143 [2,0,0,0,0,0|2,0,0]=4 1735 B16R0.61 CCOC(=O)CCCCSCCCCCCO 62a_100000766143_100000750268 [2,0,0,0,0,0|2,0,0]=4 1736 B16R0.61 CCOC(=O)CCCNCCCCCCCO 2230a_100011996573_100009991533 [2,0,0,0,0,0|2,0,0]=4 1737 B16R0.61 CCOC(=O)CCCNCCCCCCCO 34a_100011996573_100009991533 [2,0,0,0,0,0|2,0,0]=4 1738 B16R0.61 CCOC(=O)CCCOCCCCCCCBr 34a_100000760002_100009991533 [2,0,0,0,0,0|2,0,0]=4 1739 B16R0.61 CCOC(=O)CCCOCCCCCCCBr 7a_100000760002_100011215271 [2,0,0,0,0,0|2,0,0]=4 1740 B16R0.61 CCOC(=O)CCCOCCCCCCCN 34a_100011996573_100009991533 [2,0,0,0,0,0|2,0,0]=4 1741 B16R0.61 CCOC(=O)CCCOCCCCCCCO 7a_100012001163_100000760002 [2,0,0,0,0,0|2,0,0]=4 1742 B16R0.61 CCOC(=O)CCCOCCCCCCOC 34a_200012092642_100009991533 [2,0,0,0,0,0|2,0,0]=4 1743 B16R0.61 CCOC(=O)CCCOCCCCCCOC 7a_100012001163_100011998445 [2,0,0,0,0,0|2,0,0]=4 1744 B16R0.61 CCOC(=O)CCCOCCCCCCOC 7a_200012092642_100011215271 [2,0,0,0,0,0|2,0,0]=4 1745 B16R0.61 CCOC(=O)CCCSCCCCCCCO 62a_100000760002_100009991533 [2,0,0,0,0,0|2,0,0]=4 1746 B16R0.61 CCOC(=O)CCCSCCCCCCCO 62a_100009991533_100000760002 [2,0,0,0,0,0|2,0,0]=4 1747 B16R0.61 CCOC(=O)CCCSCCCCCCOC 62a_100009991533_100011998445 [2,0,0,0,0,0|2,0,0]=4 1748 B16R0.61 CCOC(=O)CCCSCCCCCCOC 62a_100011998445_100009991533 [2,0,0,0,0,0|2,0,0]=4 1749 B16R0.61 CCOC(=O)CCNCCCCCCCCO 2230a_102515433106_100011206558 [2,0,0,0,0,0|2,0,0]=4 1750 B16R0.61 CCOC(=O)CCNCCCCCCCCO 34a_102515433106_100000765890 [2,0,0,0,0,0|2,0,0]=4 1751 B16R0.61 CCOC(=O)CCOCCCCCCCCBr 34a_100009813846_100000765890 [2,0,0,0,0,0|2,0,0]=4 1752 B16R0.61 CCOC(=O)CCOCCCCCCCCBr 7a_100009813846_100011206558 [2,0,0,0,0,0|2,0,0]=4 1753 B16R0.61 CCOC(=O)CCOCCCCCCCCCl 34a_100000033203_100000765890 [2,0,0,0,0,0|2,0,0]=4 1754 B16R0.61 CCOC(=O)CCOCCCCCCCCCl 7a_100000033203_100011206558 [2,0,0,0,0,0|2,0,0]=4 1755 B16R0.61 CCOC(=O)CCOCCCCCCCCN 34a_102515433106_100000765890 [2,0,0,0,0,0|2,0,0]=4 1756 B16R0.61 CCOC(=O)CCSCCCCCCCCO 62a_100000033203_100000765890 [2,0,0,0,0,0|2,0,0]=4 1757 B16R0.61 CCOC(=O)CCSCCCCCCCCO 62a_100000765890_100000033203 [2,0,0,0,0,0|2,0,0]=4 1758 B16R0.61 CCOC(=O)CNCCCCCCCCCO 2230a_100000078944_100000188475 [2,0,0,0,0,0|2,0,0]=4 1759 B16R0.61 CCOC(=O)CNCCCCCCCCCO 34a_100000078944_100000188475 [2,0,0,0,0,0|2,0,0]=4 1760 B16R0.61 CCOC(=O)COCCCCCCCCCBr 34a_100009813782_100000188475 [2,0,0,0,0,0|2,0,0]=4 1761 B16R0.61 CCOC(=O)COCCCCCCCCCBr 7a_100009813782_100000188475 [2,0,0,0,0,0|2,0,0]=4 1762 B16R0.61 CCOC(=O)COCCCCCCCCCCl 34a_100009868337_100000188475 [2,0,0,0,0,0|2,0,0]=4 1763 B16R0.61 CCOC(=O)COCCCCCCCCCCl 7a_100009868337_100000188475 [2,0,0,0,0,0|2,0,0]=4 1764 B16R0.61 CCOC(=O)COCCCCCCCCCN 34a_100000078944_100000188475 [2,0,0,0,0,0|2,0,0]=4 1765 B16R0.61 CCOC(=O)CSCCCCCCCCCO 62a_100000188475_100009813782 [2,0,0,0,0,0|2,0,0]=4 1766 B16R0.61 CCOC(=O)CSCCCCCCCCCO 62a_100009813782_100000188475 [2,0,0,0,0,0|2,0,0]=4 1767 B16R0.61 CCOCCCCCCCCCC(=O)OCC 34a_100121572206_100009828014 [2,0,0,0,0,0|1,0,0]=3 1768 B16R0.61 CCOCCCNCCCCCC(=O)OCC 2230a_100000210961_100000755133 [2,0,0,0,0,0|2,0,0]=4 1769 B16R0.61 CCOCCCNCCCCCC(=O)OCC 34a_100000210961_100000755133 [2,0,0,0,0,0|2,0,0]=4 1770 B16R0.61 CCOCCCOCCCCCC(=O)OCC 34a_100000757476_100000755133 [2,0,0,0,0,0|2,0,0]=4 1771 B16R0.61 CCOCCCOCCCCCC(=O)OCC 7a_100000757476_100000755133 [2,0,0,0,0,0|2,0,0]=4 1772 B16R0.61 CCOCCCOCCCCCC(=O)OCC 7a_100011214988_100012232248 [2,0,0,0,0,0|2,0,0]=4 1773 B16R0.61 CCOCCCSCCCCCC(=O)OCC 62a_100000755133_100012232248 [2,0,0,0,0,0|2,0,0]=4 1774 B16R0.61 CCOCCCSCCCCCC(=O)OCC 62a_100012232248_100000755133 [2,0,0,0,0,0|2,0,0]=4 1775 B16R0.61 CCOCCNCCCCCCC(=O)OCC 2230a_102516460346_100009814379 [2,0,0,0,0,0|2,0,0]=4 1776 B16R0.61 CCOCCNCCCCCCC(=O)OCC 34a_102516460346_100009814379 [2,0,0,0,0,0|2,0,0]=4 1777 B16R0.61 CCOCCOCCCCCCC(=O)OCC 34a_100000210136_100009814379 [2,0,0,0,0,0|2,0,0]=4 1778 B16R0.61 CCOCCOCCCCCCC(=O)OCC 7a_100000210136_100009814379 [2,0,0,0,0,0|2,0,0]=4 1779 B16R0.61 CCOCCSCCCCCCC(=O)OCC 62a_100000210147_100009814379 [2,0,0,0,0,0|2,0,0]=4 1780 B16R0.61 CCOCSCCCCCCCC(=O)OCC 62a_100000739092_100009991516 [2,0,0,0,0,0|2,0,0]=4 1781 B16R0.302 CC(C)CC(=O)CCCCCCCCCCO 1458a_100000210554_100009813290 [2,0,0,0,0,0|2,0,0]=4 1782 B16R0.302 CC(C)NC(=O)CCCCCCCCCCO 240690a_100138425928_200000016029 [2,0,0,0,0,0|2,0,0]=4 1783 B16R0.302 CC(C)OC(=O)CCCCCNCCCCO 2230a_100000750430_200010986244 [2,0,0,0,0,0|2,0,0]=4 1784 B16R0.302 CC(C)OC(=O)CCCCCNCCCCO 34a_100000750430_200010986244 [2,0,0,0,0,0|2,0,0]=4 1785 B16R0.302 CC(C)OC(=O)CCCCCOCCCCBr 34a_100011216708_200010986244 [2,0,0,0,0,0|2,0,0]=4 1786 B16R0.302 CC(C)OC(=O)CCCCCOCCCCCl 34a_100000210776_200010986244 [2,0,0,0,0,0|2,0,0]=4 1787 B16R0.302 CC(C)OC(=O)CCCCCOCCCCCl 7a_100000210776_200010986244 [2,0,0,0,0,0|2,0,0]=4 1788 B16R0.302 CC(C)OC(=O)CCCCCOCCCCF 34a_100011995726_200010986244 [2,0,0,0,0,0|2,0,0]=4 1789 B16R0.302 CC(C)OC(=O)CCCCCOCCCCF 7a_100011995726_200010986244 [2,0,0,0,0,0|2,0,0]=4 1790 B16R0.302 CC(C)OC(=O)CCCCCOCCCCI 34a_200012148704_200010986244 [2,0,0,0,0,0|2,0,0]=4 1791 B16R0.302 CC(C)OC(=O)CCCCCOCCCCN 34a_100000750430_200010986244 [2,0,0,0,0,0|2,0,0]=4 1792 B16R0.302 CC(C)OC(=O)CCCCCSCCCCF 62a_100000729493_200010986244 [2,0,0,0,0,0|2,0,0]=4 1793 B16R0.302 CC(C)OC(=O)CCCCCSCCCCF 62a_200010986244_100000729493 [2,0,0,0,0,0|2,0,0]=4 1794 B16R0.302 CC(C)OC(=O)CCCCCSCCCCO 62a_100000210776_200010986244 [2,0,0,0,0,0|2,0,0]=4 1795 B16R0.302 CC(C)OC(=O)CCCCCSCCCCO 62a_200010986244_100000210776 [2,0,0,0,0,0|2,0,0]=4 1796 B16R0.302 CC(C)OC(=O)CCNCCCCCCCO 2230a_100011996573_100000760027 [2,0,0,0,0,0|2,0,0]=4 1797 B16R0.302 CC(C)OC(=O)CCOCCCCCCCBr 7a_100000760002_100000760027 [2,0,0,0,0,0|2,0,0]=4 1798 B16R0.302 CC(C)OC(=O)CCSCCCCCCCO 62a_100000760002_100000760027 [2,0,0,0,0,0|2,0,0]=4 1799 B16R0.302 CC(C)OC(=O)CCSCCCCCCCO 62a_100000760027_100000760002 [2,0,0,0,0,0|2,0,0]=4 1800 B16R0.302 CC(C)OC(=O)CNCCCCCCCCO 2230a_102515433106_100011215430 [2,0,0,0,0,0|2,0,0]=4 1801 B16R0.302 CC(C)OC(=O)CNCCCCCCCCO 34a_102515433106_100011215430 [2,0,0,0,0,0|2,0,0]=4 1802 B16R0.302 CC(C)OC(=O)COCCCCCCCCBr 34a_100009813846_100011215430 [2,0,0,0,0,0|2,0,0]=4 1803 B16R0.302 CC(C)OC(=O)COCCCCCCCCBr 7a_100009813846_100011215430 [2,0,0,0,0,0|2,0,0]=4 1804 B16R0.302 CC(C)OC(=O)COCCCCCCCCCl 34a_100000033203_100011215430 [2,0,0,0,0,0|2,0,0]=4 1805 B16R0.302 CC(C)OC(=O)COCCCCCCCCCl 7a_100000033203_100011215430 [2,0,0,0,0,0|2,0,0]=4 1806 B16R0.302 CC(C)OC(=O)COCCCCCCCCN 34a_102515433106_100011215430 [2,0,0,0,0,0|2,0,0]=4 1807 B16R0.302 CC(C)OC(=O)CSCCCCCCCCO 62a_100000033203_100011215430 [2,0,0,0,0,0|2,0,0]=4 1808 B16R0.302 CC(C)OC(=O)CSCCCCCCCCO 62a_100011215430_100000033203 [2,0,0,0,0,0|2,0,0]=4 1809 B16R0.302 CCCCCCCCCCCC(=O)CC(C)O 1458a_100000210736_100011218427 [2,0,0,0,0,0|2,0,0]=4 1810 B16R0.302 CCCCCCCCCCCC(=O)CN(C)C 1458a_100000750896_100011215454 [2,0,0,0,0,0|2,0,0]=4 1811 B16R0.302 CCCCCCCCCCCC(=O)C[C@@H](C)O 1458a_100011933948_100011215454 [2,0,0,0,0,0|2,0,0]=4 1812 B16R0.302 CCCCCCCCCCCC(=O)C[S+](C)C 1458a_200159257847_100011215454 [2,0,0,0,0,0|2,0,0]=4 1813 B16R0.302 CCCCCCCCCCCC(=O)NC(C)C 11a_100138425928_100000210736 [2,0,0,0,0,0|1,0,0]=3 1814 B16R0.302 CCCCCCCCCCCC(=O)NC(C)C 1626a_100138425928_100000210736 [2,0,0,0,0,0|1,0,0]=3 1815 B16R0.302 CCCCCCCCCCCC(=O)NC(C)C 240690a_100138425928_100000210736 [2,0,0,0,0,0|1,0,0]=3 1816 B16R0.302 CCCCCCCCCCNC(=O)CC(C)C 11a_100000684558_100000210554 [2,0,0,0,0,0|2,0,0]=4 1817 B16R0.302 CCCCCCCCCCNC(=O)CC(C)C 1626a_100000684558_100000210554 [2,0,0,0,0,0|2,0,0]=4 1818 B16R0.302 CCCCCCCCCCNC(=O)CC(C)C 240690a_100000684558_100000210554 [2,0,0,0,0,0|2,0,0]=4 1819 B16R0.302 CCCCCCCCCCNC(=O)CC(C)C 527a_100000684558_100000210554 [2,0,0,0,0,0|2,0,0]=4 1820 B16R0.302 CCCCCCCCCCNC(=O)NC(C)C 2708a_100000684558_100138425928 [2,0,0,0,0,0|2,0,0]=4 1821 B16R0.302 CCCCCCCCCCNC(=O)NC(C)C 2708a_100138425928_100000684558 [2,0,0,0,0,0|2,0,0]=4 1822 B16R0.302 CCCCCCCCCCNC(=O)NC(C)C 273464a_100138425928_100000684558 [2,0,0,0,0,0|2,0,0]=4 1823 B16R0.302 CCCCCCCCCCNC(=O)NC(C)C 512a_100000684558_100138425928 [2,0,0,0,0,0|2,0,0]=4 1824 B16R0.302 CCCCCCCCCCNC(=O)NC(C)C 512a_100138425928_100000684558 [2,0,0,0,0,0|2,0,0]=4 1825 B16R0.302 CCCCCCCCCNCC(=O)NC(C)C 2230a_100000168517_100011214924 [2,0,0,0,0,0|2,0,0]=4 1826 B16R0.302 CCCCCCCCCNCC(=O)NC(C)C 2230a_100000212291_100000183996 [2,0,0,0,0,0|2,0,0]=4 1827 B16R0.302 CCCCCCCCCNCC(=O)NC(C)C 34a_100000212291_100000183996 [2,0,0,0,0,0|2,0,0]=4 1828 B16R0.302 CCCCCCCCCNCC(=O)OC(C)C 2230a_100000212291_100011215430 [2,0,0,0,0,0|1,0,0]=3 1829 B16R0.302 CCCCCCCCCNCC(=O)OC(C)C 34a_100000212291_100011215430 [2,0,0,0,0,0|1,0,0]=3 1830 B16R0.302 CCCCCCCCCOCC(=O)NC(C)C 34a_100000210712_100000183996 [2,0,0,0,0,0|2,0,0]=4 1831 B16R0.302 CCCCCCCCCOCC(=O)NC(C)C 7a_100000210712_100000183996 [2,0,0,0,0,0|2,0,0]=4 1832 B16R0.302 CCCCCCCCCOCC(=O)OC(C)C 34a_100000210712_100011215430 [2,0,0,0,0,0|1,0,0]=3 1833 B16R0.302 CCCCCCCCCOCC(=O)OC(C)C 7a_100000210712_100011215430 [2,0,0,0,0,0|1,0,0]=3 1834 B16R0.302 CCCCCCCCCSCC(=O)NC(C)C 62a_100000183996_100000210670 [2,0,0,0,0,0|2,0,0]=4 1835 B16R0.302 CCCCCCCCCSCC(=O)OC(C)C 62a_100011215430_100000210670 [2,0,0,0,0,0|1,0,0]=3 1836 B16R0.302 CCCCCCCCNCCC(=O)NC(C)C 2230a_100000229939_100000737564 [2,0,0,0,0,0|2,0,0]=4 1837 B16R0.302 CCCCCCCCNCCC(=O)OC(C)C 2230a_100000229939_100000760027 [2,0,0,0,0,0|1,0,0]=3 1838 B16R0.302 CCCCCCCCOCCC(=O)NC(C)C 7a_100000210232_100000737564 [2,0,0,0,0,0|2,0,0]=4 1839 B16R0.302 CCCCCCCCOCCC(=O)OC(C)C 7a_100000210232_100000760027 [2,0,0,0,0,0|1,0,0]=3 1840 B16R0.302 CCCCCCCCSCCC(=O)NC(C)C 62a_100000210759_100000737564 [2,0,0,0,0,0|2,0,0]=4 1841 B16R0.302 CCCCCCCCSCCC(=O)NC(C)C 62a_100000737564_100000210317 [2,0,0,0,0,0|2,0,0]=4 1842 B16R0.302 CCCCCCCCSCCC(=O)OC(C)C 62a_100000210759_100000760027 [2,0,0,0,0,0|1,0,0]=3 1843 B16R0.302 CCCCCCCCSCCC(=O)OC(C)C 62a_100000760027_100000210317 [2,0,0,0,0,0|1,0,0]=3 1844 B16R0.302 CCCCCCCCSCOC(=O)OC(C)C 62a_100000003507_100000210317 [2,0,0,0,0,0|2,0,0]=4 1845 B16R0.302 CCCCCCCCSCOC(=O)OC(C)C 62a_100000210759_100000003507 [2,0,0,0,0,0|2,0,0]=4 1846 B16R0.302 CCCCCCOCCOCC(=O)OC(C)C 34a_100000691444_100011215430 [2,0,0,0,0,0|2,0,0]=4 1847 B16R0.302 CCCCCCOCCOCC(=O)OC(C)C 7a_100000691444_100011215430 [2,0,0,0,0,0|2,0,0]=4 1848 B16R0.302 CCCCCNCCCCCC(=O)OC(C)C 2230a_100000209983_200010986244 [2,0,0,0,0,0|1,0,0]=3 1849 B16R0.302 CCCCCOCCCCCC(=O)OC(C)C 34a_100000210253_200010986244 [2,0,0,0,0,0|1,0,0]=3 1850 B16R0.302 CCCCCOCCCCCC(=O)OC(C)C 7a_100000210253_200010986244 [2,0,0,0,0,0|1,0,0]=3 1851 B16R0.302 CCCCCOCCOCCC(=O)OC(C)C 7a_100011215259_100000760027 [2,0,0,0,0,0|2,0,0]=4 1852 B16R0.302 CCCCCSCCCCCC(=O)OC(C)C 62a_100000210326_200010986244 [2,0,0,0,0,0|1,0,0]=3 1853 B16R0.302 CCCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000210326 [2,0,0,0,0,0|1,0,0]=3 1854 B16R0.302 CCCCNCCCCOCC(=O)OC(C)C 34a_200011216965_100011215430 [2,0,0,0,0,0|2,0,0]=4 1855 B16R0.302 CCCCOCCCCOCC(=O)OC(C)C 34a_200000760531_100011215430 [2,0,0,0,0,0|2,0,0]=4 1856 B16R0.302 CCCCOCCCCOCC(=O)OC(C)C 7a_200000760531_100011215430 [2,0,0,0,0,0|2,0,0]=4 1857 B16R0.302 CCCCOCCCNCCC(=O)OC(C)C 2230a_200000211371_100000760027 [2,0,0,0,0,0|2,0,0]=4 1858 B16R0.302 CCCCOCCCOCCC(=O)OC(C)C 7a_200011215613_100000760027 [2,0,0,0,0,0|2,0,0]=4 1859 B16R0.302 CCOCCNCCCCCC(=O)OC(C)C 2230a_102516460346_200010986244 [2,0,0,0,0,0|2,0,0]=4 1860 B16R0.302 CCOCCNCCCCCC(=O)OC(C)C 34a_102516460346_200010986244 [2,0,0,0,0,0|2,0,0]=4 1861 B16R0.302 CCOCCOCCCCCC(=O)OC(C)C 34a_100000210136_200010986244 [2,0,0,0,0,0|2,0,0]=4 1862 B16R0.302 CCOCCOCCCCCC(=O)OC(C)C 7a_100000210136_200010986244 [2,0,0,0,0,0|2,0,0]=4 1863 B16R0.302 CCOCCSCCCCCC(=O)OC(C)C 62a_100000210147_200010986244 [2,0,0,0,0,0|2,0,0]=4 1864 B16R0.302 CCOCCSCCCCCC(=O)OC(C)C 62a_200010986244_100011215890 [2,0,0,0,0,0|2,0,0]=4 1865 B16R0.302 CCSCCNCCCCCC(=O)OC(C)C 2230a_100000106463_200010986244 [2,0,0,0,0,0|2,0,0]=4 1866 B16R0.302 CCSCCOCCCCCC(=O)OC(C)C 34a_100000212035_200010986244 [2,0,0,0,0,0|2,0,0]=4 1867 B16R0.302 CCSCCOCCCCCC(=O)OC(C)C 7a_100000212035_200010986244 [2,0,0,0,0,0|2,0,0]=4 1868 B16R0.302 CCSCCSCCCCCC(=O)OC(C)C 62a_100000757381_200010986244 [2,0,0,0,0,0|2,0,0]=4 1869 B16R0.302 CCSCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000757381 [2,0,0,0,0,0|2,0,0]=4 1870 B16R0.302 CNCCCOCCCCCC(=O)OC(C)C 34a_100000213112_200010986244 [2,0,0,0,0,0|2,0,0]=4 1871 B16R0.302 COCCCCCCOCCC(=O)OC(C)C 7a_200012092642_100000760027 [2,0,0,0,0,0|2,0,0]=4 1872 B16R0.302 COCCCCCCSCCC(=O)OC(C)C 62a_100000760027_100011998445 [2,0,0,0,0,0|2,0,0]=4 1873 B16R0.302 COCCCCCCSCCC(=O)OC(C)C 62a_100011998445_100000760027 [2,0,0,0,0,0|2,0,0]=4 1874 B16R0.302 COCCCNCCCCCC(=O)OC(C)C 34a_100150723488_200010986244 [2,0,0,0,0,0|2,0,0]=4 1875 B16R0.302 COCCCOCCCCCC(=O)OC(C)C 34a_100000740835_200010986244 [2,0,0,0,0,0|2,0,0]=4 1876 B16R0.302 COCCCSCCCCCC(=O)OC(C)C 62a_100000709357_200010986244 [2,0,0,0,0,0|2,0,0]=4 1877 B16R0.302 COCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000709357 [2,0,0,0,0,0|2,0,0]=4 1878 B16R0.302 CSCCCNCCCCCC(=O)OC(C)C 2230a_100000749238_200010986244 [2,0,0,0,0,0|2,0,0]=4 1879 B16R0.302 CSCCCOCCCCCC(=O)OC(C)C 34a_100000690336_200010986244 [2,0,0,0,0,0|2,0,0]=4 1880 B16R0.302 CSCCCOCCCCCC(=O)OC(C)C 7a_100000690336_200010986244 [2,0,0,0,0,0|2,0,0]=4 1881 B16R0.221 C#CC(=O)CCCCCCCCCCCCC 1458a_100000211873_100000210684 [2,0,0,0,0,0|0,0,2]=4 1882 B16R0.221 CCC(=O)CCCCCCCCCCCCO 1458a_100000210414_100009813331 [2,0,0,0,0,0|1,0,0]=3 1883 B16R0.221 CCC(=O)CCCCCCOCCCCCO 1458a_100000210414_200132310570 [2,0,0,0,0,0|2,0,0]=4 1884 B16R0.221 CCC(=O)COCCCCCCCCCCBr 7a_100009813290_100000747405 [2,0,0,0,0,0|2,0,0]=4 1885 B16R0.221 CCC(=O)COCCCCCCCCCCCl 7a_200000033068_100000747405 [2,0,0,0,0,0|2,0,0]=4 1886 B16R0.221 CCC(=O)COCCCCCCCCCCO 34a_100000725409_100009813290 [2,0,0,0,0,0|2,0,0]=4 1887 B16R0.221 CCC(=O)CSCCCCCCCCCCO 62a_100000747405_200000033068 [2,0,0,0,0,0|2,0,0]=4 1888 B16R0.221 CCC(=O)CSCCCCCCCCCCO 62a_100009813290_100000747405 [2,0,0,0,0,0|2,0,0]=4 1889 B16R0.221 CCCCCCCCCCCCCC(=O)CO 1458a_100000210174_100000210684 [2,0,0,0,0,0|1,0,0]=3 1890 B16R0.221 CCCCCCCCCCCCCC(=O)NC 11a_106832991635_100000756256 [2,0,0,0,0,0|1,0,0]=3 1891 B16R0.221 CCCCCCCCCCCCCC(=O)NC 1626a_100102657272_100000756256 [2,0,0,0,0,0|1,0,0]=3 1892 B16R0.221 CCCCCCCCCCCCCC(=O)NC 240690a_100102657272_100000756256 [2,0,0,0,0,0|1,0,0]=3 1893 B16R0.221 CCCCCCCCCCCCNC(=O)CC 11a_100000210451_100000210414 [2,0,0,0,0,0|1,0,0]=3 1894 B16R0.221 CCCCCCCCCCCCNC(=O)CC 1626a_100000210451_100000210414 [2,0,0,0,0,0|1,0,0]=3 1895 B16R0.221 CCCCCCCCCCCCNC(=O)CC 240690a_100000210451_100000210414 [2,0,0,0,0,0|1,0,0]=3 1896 B16R0.221 CCCCCCCCCCCCNC(=O)CC 527a_100000210451_100000210414 [2,0,0,0,0,0|1,0,0]=3 1897 B16R0.221 CCCCCCCCCCCCNC(=O)CO 240690a_100000210451_100000210174 [2,0,0,0,0,0|2,0,0]=4 1898 B16R0.221 CCCCCCCCCCCCNC(=O)CO 527a_100000210451_100000210174 [2,0,0,0,0,0|2,0,0]=4 1899 B16R0.221 CCCCCCCCCCCCNC(=O)NC 2708a_100000210451_106832991635 [2,0,0,0,0,0|2,0,0]=4 1900 B16R0.221 CCCCCCCCCCCCNC(=O)NC 2708a_100102657272_100000210451 [2,0,0,0,0,0|2,0,0]=4 1901 B16R0.221 CCCCCCCCCCCCNC(=O)NC 273464a_100000210451_100102657272 [2,0,0,0,0,0|2,0,0]=4 1902 B16R0.221 CCCCCCCCCCCCNC(=O)NC 273464a_100102657272_100000210451 [2,0,0,0,0,0|2,0,0]=4 1903 B16R0.221 CCCCCCCCCCCCNC(=O)NC 512a_100000210451_100102657272 [2,0,0,0,0,0|2,0,0]=4 1904 B16R0.221 CCCCCCCCCCCCNC(=O)NC 512a_106832991638_100000210451 [2,0,0,0,0,0|2,0,0]=4 1905 B16R0.221 CCCCCCCCCCCNCC(=O)NC 2230a_100000693194_100011215454 [2,0,0,0,0,0|2,0,0]=4 1906 B16R0.221 CCCCCCCCCCCNCC(=O)NC 2230a_200011215754_100000183359 [2,0,0,0,0,0|2,0,0]=4 1907 B16R0.221 CCCCCCCCCCCNCC(=O)NC 34a_200011215754_100000183359 [2,0,0,0,0,0|2,0,0]=4 1908 B16R0.221 CCCCCCCCCCCNCC(=O)OC 2230a_200011215754_100000747449 [2,0,0,0,0,0|1,0,0]=3 1909 B16R0.221 CCCCCCCCCCCNCC(=O)OC 34a_200011215754_100000747449 [2,0,0,0,0,0|1,0,0]=3 1910 B16R0.221 CCCCCCCCCCCOCC(=O)CC 34a_100000725409_100011215454 [2,0,0,0,0,0|1,0,0]=3 1911 B16R0.221 CCCCCCCCCCCOCC(=O)CC 7a_100000210809_100000747405 [2,0,0,0,0,0|1,0,0]=3 1912 B16R0.221 CCCCCCCCCCCOCC(=O)NC 34a_100000210809_100000183359 [2,0,0,0,0,0|2,0,0]=4 1913 B16R0.221 CCCCCCCCCCCOCC(=O)NC 34a_100000750040_100011215454 [2,0,0,0,0,0|2,0,0]=4 1914 B16R0.221 CCCCCCCCCCCOCC(=O)NC 7a_100000210809_100000183359 [2,0,0,0,0,0|2,0,0]=4 1915 B16R0.221 CCCCCCCCCCCOCC(=O)OC 34a_100000210809_100000747449 [2,0,0,0,0,0|1,0,0]=3 1916 B16R0.221 CCCCCCCCCCCOCC(=O)OC 7a_100000210809_100000747449 [2,0,0,0,0,0|1,0,0]=3 1917 B16R0.221 CCCCCCCCCCCSCC(=O)NC 62a_100000183359_100011215454 [2,0,0,0,0,0|2,0,0]=4 1918 B16R0.221 CCCCCCCCCCCSCC(=O)OC 62a_100000747449_100011215454 [2,0,0,0,0,0|1,0,0]=3 1919 B16R0.221 CCCCCCCCCCNCCC(=O)NC 2230a_100000684558_100000737683 [2,0,0,0,0,0|2,0,0]=4 1920 B16R0.221 CCCCCCCCCCNCCC(=O)NC 2230a_100000738227_100000210320 [2,0,0,0,0,0|2,0,0]=4 1921 B16R0.221 CCCCCCCCCCNCCC(=O)NC 34a_100000684558_100012179268 [2,0,0,0,0,0|2,0,0]=4 1922 B16R0.221 CCCCCCCCCCNCCC(=O)NC 34a_100000738227_100000210320 [2,0,0,0,0,0|2,0,0]=4 1923 B16R0.221 CCCCCCCCCCNCCC(=O)OC 2230a_100000684558_100000204255 [2,0,0,0,0,0|1,0,0]=3 1924 B16R0.221 CCCCCCCCCCNCCC(=O)OC 34a_100000684558_100000742370 [2,0,0,0,0,0|1,0,0]=3 1925 B16R0.221 CCCCCCCCCCOCCC(=O)NC 34a_100000210711_100012179268 [2,0,0,0,0,0|2,0,0]=4 1926 B16R0.221 CCCCCCCCCCOCCC(=O)NC 34a_100000754576_100000210320 [2,0,0,0,0,0|2,0,0]=4 1927 B16R0.221 CCCCCCCCCCOCCC(=O)NC 7a_100000210711_100000737683 [2,0,0,0,0,0|2,0,0]=4 1928 B16R0.221 CCCCCCCCCCOCCC(=O)OC 34a_100000210711_100000742370 [2,0,0,0,0,0|1,0,0]=3 1929 B16R0.221 CCCCCCCCCCOCCC(=O)OC 7a_100000210711_100000204255 [2,0,0,0,0,0|1,0,0]=3 1930 B16R0.221 CCCCCCCCCCSCCC(=O)NC 62a_100000737683_100000210320 [2,0,0,0,0,0|2,0,0]=4 1931 B16R0.221 CCCCCCCCCCSCCC(=O)OC 62a_100000204255_100000210320 [2,0,0,0,0,0|1,0,0]=3 1932 B16R0.221 CCCCCCCCCNCCCC(=O)NC 2230a_100000212291_100000741757 [2,0,0,0,0,0|2,0,0]=4 1933 B16R0.221 CCCCCCCCCNCCCC(=O)NC 2230a_100000740002_100011214924 [2,0,0,0,0,0|2,0,0]=4 1934 B16R0.221 CCCCCCCCCNCCCC(=O)NC 34a_100000212291_100000741757 [2,0,0,0,0,0|2,0,0]=4 1935 B16R0.221 CCCCCCCCCNCCCC(=O)NC 34a_100000740002_100011214924 [2,0,0,0,0,0|2,0,0]=4 1936 B16R0.221 CCCCCCCCCNCCCC(=O)OC 2230a_100000212291_100011218270 [2,0,0,0,0,0|1,0,0]=3 1937 B16R0.221 CCCCCCCCCNCCCC(=O)OC 34a_100000212291_100000742333 [2,0,0,0,0,0|1,0,0]=3 1938 B16R0.221 CCCCCCCCCNCCNC(=O)CC 34a_100132302217_100011214924 [2,0,0,0,0,0|2,0,0]=4 1939 B16R0.221 CCCCCCCCCOCCCC(=O)NC 34a_100000210712_100000741757 [2,0,0,0,0,0|2,0,0]=4 1940 B16R0.221 CCCCCCCCCOCCCC(=O)NC 7a_100000210712_100000741757 [2,0,0,0,0,0|2,0,0]=4 1941 B16R0.221 CCCCCCCCCOCCCC(=O)OC 34a_100000210712_100000742333 [2,0,0,0,0,0|1,0,0]=3 1942 B16R0.221 CCCCCCCCCOCCCC(=O)OC 7a_100000210712_100011218270 [2,0,0,0,0,0|1,0,0]=3 1943 B16R0.221 CCCCCCCCCOCCNC(=O)CC 34a_200000158885_100011214924 [2,0,0,0,0,0|2,0,0]=4 1944 B16R0.221 CCCCCCCCCOCCNC(=O)CC 7a_200000158885_100000210328 [2,0,0,0,0,0|2,0,0]=4 1945 B16R0.221 CCCCCCCCCOCCNC(=O)OC 34a_100000757965_100011214924 [2,0,0,0,0,0|2,0,0]=4 1946 B16R0.221 CCCCCCCCCOCCOC(=O)CC 7a_200000031056_100000210328 [2,0,0,0,0,0|2,0,0]=4 1947 B16R0.221 CCCCCCCCCOCCOC(=O)OC 34a_100010262106_100011214924 [2,0,0,0,0,0|2,0,0]=4 1948 B16R0.221 CCCCCCCCCSCCCC(=O)NC 62a_100000741757_100000210670 [2,0,0,0,0,0|2,0,0]=4 1949 B16R0.221 CCCCCCCCCSCCCC(=O)OC 62a_100011218270_100000210670 [2,0,0,0,0,0|1,0,0]=3 1950 B16R0.221 CCCCCCCCNCCCCC(=O)OC 2230a_100000229939_100000204269 [2,0,0,0,0,0|1,0,0]=3 1951 B16R0.221 CCCCCCCCNCCCCC(=O)OC 34a_100000229939_100000204269 [2,0,0,0,0,0|1,0,0]=3 1952 B16R0.221 CCCCCCCCNCCOCC(=O)OC 2230a_100000229939_100000090808 [2,0,0,0,0,0|2,0,0]=4 1953 B16R0.221 CCCCCCCCNCCOCC(=O)OC 34a_100000229939_100000090808 [2,0,0,0,0,0|2,0,0]=4 1954 B16R0.221 CCCCCCCCOCCCCC(=O)OC 34a_100000059025_100000210759 [2,0,0,0,0,0|1,0,0]=3 1955 B16R0.221 CCCCCCCCOCCCCC(=O)OC 34a_100000210232_100000204269 [2,0,0,0,0,0|1,0,0]=3 1956 B16R0.221 CCCCCCCCOCCCCC(=O)OC 7a_100000059025_100000210759 [2,0,0,0,0,0|1,0,0]=3 1957 B16R0.221 CCCCCCCCOCCCCC(=O)OC 7a_100000210232_100000204269 [2,0,0,0,0,0|1,0,0]=3 1958 B16R0.221 CCCCCCCCOCCOCC(=O)OC 34a_100000210232_100000090808 [2,0,0,0,0,0|2,0,0]=4 1959 B16R0.221 CCCCCCCCOCCOCC(=O)OC 7a_100000210232_100000090808 [2,0,0,0,0,0|2,0,0]=4 1960 B16R0.221 CCCCCCCCSCCCCC(=O)OC 62a_100000204269_100000210317 [2,0,0,0,0,0|1,0,0]=3 1961 B16R0.221 CCCCCCCCSCCCCC(=O)OC 62a_100000210759_100000204269 [2,0,0,0,0,0|1,0,0]=3 1962 B16R0.221 CCCCCCCCSCCOCC(=O)OC 62a_100000090808_100000210317 [2,0,0,0,0,0|2,0,0]=4 1963 B16R0.221 CCCCCCCCSCCOCC(=O)OC 62a_100000210759_100000090808 [2,0,0,0,0,0|2,0,0]=4 1964 B16R0.221 CCCCCCCNCCCCCC(=O)OC 2230a_100000229938_100009816466 [2,0,0,0,0,0|1,0,0]=3 1965 B16R0.221 CCCCCCCOCCCCCC(=O)OC 34a_100000074720_100000210614 [2,0,0,0,0,0|1,0,0]=3 1966 B16R0.221 CCCCCCCOCCCCCC(=O)OC 34a_100000210272_100009816466 [2,0,0,0,0,0|1,0,0]=3 1967 B16R0.221 CCCCCCCOCCCCCC(=O)OC 7a_100000074720_100000210614 [2,0,0,0,0,0|1,0,0]=3 1968 B16R0.221 CCCCCCCOCCCCCC(=O)OC 7a_100000210272_100009816466 [2,0,0,0,0,0|1,0,0]=3 1969 B16R0.221 CCCCCCCSCCCCCC(=O)OC 62a_100000210614_100009816466 [2,0,0,0,0,0|1,0,0]=3 1970 B16R0.221 CCCCCCCSCCCCCC(=O)OC 62a_100009816466_100000210316 [2,0,0,0,0,0|1,0,0]=3 1971 B16R0.221 CCCCCCNCCCCCCC(=O)OC 2230a_100000210581_100009815986 [2,0,0,0,0,0|1,0,0]=3 1972 B16R0.221 CCCCCCOCCCCCCC(=O)OC 34a_100000210259_100009815986 [2,0,0,0,0,0|1,0,0]=3 1973 B16R0.221 CCCCCCOCCCCCCC(=O)OC 34a_100009863599_100000210314 [2,0,0,0,0,0|1,0,0]=3 1974 B16R0.221 CCCCCCOCCCCCCC(=O)OC 7a_100000210259_100009815986 [2,0,0,0,0,0|1,0,0]=3 1975 B16R0.221 CCCCCCOCCCCCCC(=O)OC 7a_100009863599_100000210314 [2,0,0,0,0,0|1,0,0]=3 1976 B16R0.221 CCCCCCOCCOCCCC(=O)OC 34a_100000691444_100000742333 [2,0,0,0,0,0|2,0,0]=4 1977 B16R0.221 CCCCCCOCCOCCCC(=O)OC 7a_100000691444_100011218270 [2,0,0,0,0,0|2,0,0]=4 1978 B16R0.221 CCCCCCSCCCCCCC(=O)OC 62a_100000210314_100009815986 [2,0,0,0,0,0|1,0,0]=3 1979 B16R0.221 CCCCCCSCCCCCCC(=O)OC 62a_100009815986_100000210757 [2,0,0,0,0,0|1,0,0]=3 1980 B16R0.221 CCCCCNCCCCCCCC(=O)OC 2230a_100000209983_100010004213 [2,0,0,0,0,0|1,0,0]=3 1981 B16R0.221 CCCCCNCCOCCCCC(=O)OC 34a_100000224656_100000204269 [2,0,0,0,0,0|2,0,0]=4 1982 B16R0.221 CCCCCOCCCCCCCC(=O)OC 34a_100000210253_100010004213 [2,0,0,0,0,0|1,0,0]=3 1983 B16R0.221 CCCCCOCCCCCCCC(=O)OC 34a_100011022521_100000718602 [2,0,0,0,0,0|1,0,0]=3 1984 B16R0.221 CCCCCOCCCCCCCC(=O)OC 7a_100000210253_100010004213 [2,0,0,0,0,0|1,0,0]=3 1985 B16R0.221 CCCCCOCCCCCCCC(=O)OC 7a_100011022521_100000210326 [2,0,0,0,0,0|1,0,0]=3 1986 B16R0.221 CCCCCOCCOCCCCC(=O)OC 34a_100011215259_100000204269 [2,0,0,0,0,0|2,0,0]=4 1987 B16R0.221 CCCCCOCCOCCCCC(=O)OC 7a_100011215259_100000204269 [2,0,0,0,0,0|2,0,0]=4 1988 B16R0.221 CCCCCSCCCCCCCC(=O)OC 62a_100000210326_100010004213 [2,0,0,0,0,0|1,0,0]=3 1989 B16R0.221 CCCCCSCCCCCCCC(=O)OC 62a_100010004213_100000210326 [2,0,0,0,0,0|1,0,0]=3 1990 B16R0.221 CCCCNCCCCCCCCC(=O)OC 2230a_100000102301_100010282707 [2,0,0,0,0,0|1,0,0]=3 1991 B16R0.221 CCCCNCCCCCCCCC(=O)OC 7a_106832991798_100010282707 [2,0,0,0,0,0|1,0,0]=3 1992 B16R0.221 CCCCNCCCCOCCCC(=O)OC 34a_200011216965_100000742333 [2,0,0,0,0,0|2,0,0]=4 1993 B16R0.221 CCCCOCCCCCCCCC(=O)OC 34a_100000035544_100000210210 [2,0,0,0,0,0|1,0,0]=3 1994 B16R0.221 CCCCOCCCCCCCCC(=O)OC 34a_100000210227_100010282707 [2,0,0,0,0,0|1,0,0]=3 1995 B16R0.221 CCCCOCCCCCCCCC(=O)OC 7a_100000035544_100000210211 [2,0,0,0,0,0|1,0,0]=3 1996 B16R0.221 CCCCOCCCCCCCCC(=O)OC 7a_100000210227_100010282707 [2,0,0,0,0,0|1,0,0]=3 1997 B16R0.221 CCCCOCCCCOCCCC(=O)OC 34a_200000760531_100000742333 [2,0,0,0,0,0|2,0,0]=4 1998 B16R0.221 CCCCOCCCCOCCCC(=O)OC 7a_200000760531_100011218270 [2,0,0,0,0,0|2,0,0]=4 1999 B16R0.221 CCCCOCCCNCCCCC(=O)OC 2230a_200000211371_100000204269 [2,0,0,0,0,0|2,0,0]=4 2000 B16R0.221 CCCCOCCCNCCCCC(=O)OC 34a_200000211371_100000204269 [2,0,0,0,0,0|2,0,0]=4 2001 B16R0.221 CCCCOCCCOCCCCC(=O)OC 34a_200011215613_100000204269 [2,0,0,0,0,0|2,0,0]=4 2002 B16R0.221 CCCCOCCCOCCCCC(=O)OC 7a_200011215613_100000204269 [2,0,0,0,0,0|2,0,0]=4 2003 B16R0.221 CCCCOCCOCCCCCC(=O)OC 34a_100000074720_100000743108 [2,0,0,0,0,0|2,0,0]=4 2004 B16R0.221 CCCCOCCOCCCCCC(=O)OC 34a_100000210238_100009816466 [2,0,0,0,0,0|2,0,0]=4 2005 B16R0.221 CCCCOCCOCCCCCC(=O)OC 7a_100000074720_100000743108 [2,0,0,0,0,0|2,0,0]=4 2006 B16R0.221 CCCCOCCOCCCCCC(=O)OC 7a_100000210238_100009816466 [2,0,0,0,0,0|2,0,0]=4 2007 B16R0.221 CCCCOCCSCCCCCC(=O)OC 62a_100000743108_100009816466 [2,0,0,0,0,0|2,0,0]=4 2008 B16R0.221 CCCCOCCSCCCCCC(=O)OC 62a_100009816466_100000743108 [2,0,0,0,0,0|2,0,0]=4 2009 B16R0.221 CCCCOCOCCCCCCC(=O)OC 34a_100009863599_100011995733 [2,0,0,0,0,0|2,0,0]=4 2010 B16R0.221 CCCCOCSCCCCCCC(=O)OC 62a_100009815986_100011995733 [2,0,0,0,0,0|2,0,0]=4 2011 B16R0.221 CCCCOCSCCCCCCC(=O)OC 62a_100011995733_100009815986 [2,0,0,0,0,0|2,0,0]=4 2012 B16R0.221 CCCCSCCCCCCCCC(=O)OC 62a_100000210211_100010282707 [2,0,0,0,0,0|1,0,0]=3 2013 B16R0.221 CCCCSCCCCCCCCC(=O)OC 62a_100010282707_100000210210 [2,0,0,0,0,0|1,0,0]=3 2014 B16R0.221 CCCCSCCNCCCCCC(=O)OC 2230a_100025743550_100009816466 [2,0,0,0,0,0|2,0,0]=4 2015 B16R0.221 CCCCSCCOCCCCCC(=O)OC 34a_200000230436_100009816466 [2,0,0,0,0,0|2,0,0]=4 2016 B16R0.221 CCCCSCCOCCCCCC(=O)OC 7a_200000230436_100009816466 [2,0,0,0,0,0|2,0,0]=4 2017 B16R0.221 CCCOCCCCCCCCCC(=O)OC 34a_100000210258_100009813843 [2,0,0,0,0,0|1,0,0]=3 2018 B16R0.221 CCCOCCCNCCCCCC(=O)OC 2230a_100011217757_100009816466 [2,0,0,0,0,0|2,0,0]=4 2019 B16R0.221 CCCOCCCNCCCCCC(=O)OC 34a_100011217757_100009816466 [2,0,0,0,0,0|2,0,0]=4 2020 B16R0.221 CCCOCCNCCCCCCC(=O)OC 2230a_100161115042_100009815986 [2,0,0,0,0,0|2,0,0]=4 2021 B16R0.221 CCCOCCNCCCCCCC(=O)OC 34a_100161115042_100009815986 [2,0,0,0,0,0|2,0,0]=4 2022 B16R0.221 CCCOCCOCCCCCCC(=O)OC 34a_100000752267_100009815986 [2,0,0,0,0,0|2,0,0]=4 2023 B16R0.221 CCCOCCOCCCCCCC(=O)OC 34a_100009863599_100011215938 [2,0,0,0,0,0|2,0,0]=4 2024 B16R0.221 CCCOCCOCCCCCCC(=O)OC 7a_100000752267_100009815986 [2,0,0,0,0,0|2,0,0]=4 2025 B16R0.221 CCCOCCOCCCCCCC(=O)OC 7a_100009863599_100011215938 [2,0,0,0,0,0|2,0,0]=4 2026 B16R0.221 CCCOCCSCCCCCCC(=O)OC 62a_100009815986_100011215938 [2,0,0,0,0,0|2,0,0]=4 2027 B16R0.221 CCCOCCSCCCCCCC(=O)OC 62a_100011215938_100009815986 [2,0,0,0,0,0|2,0,0]=4 2028 B16R0.221 CCCSCCCCCCCCCC(=O)OC 62a_100000210303_100009813843 [2,0,0,0,0,0|1,0,0]=3 2029 B16R0.221 CCCSCCNCCCCCCC(=O)OC 2230a_100020603323_100009815986 [2,0,0,0,0,0|2,0,0]=4 2030 B16R0.221 CCCSCCOCCCCCCC(=O)OC 34a_200000230433_100009815986 [2,0,0,0,0,0|2,0,0]=4 2031 B16R0.221 CCCSCCOCCCCCCC(=O)OC 7a_200000230433_100009815986 [2,0,0,0,0,0|2,0,0]=4 2032 B16R0.221 CCNCCCCCCCCCCC(=O)OC 2230a_100015525214_100009812566 [2,0,0,0,0,0|1,0,0]=3 2033 B16R0.221 CCOCCCCCCCCCCC(=O)OC 34a_100011003013_100000210202 [2,0,0,0,0,0|1,0,0]=3 2034 B16R0.221 CCOCCCCCCCCCCC(=O)OC 34a_100121572206_100009812566 [2,0,0,0,0,0|1,0,0]=3 2035 B16R0.221 CCOCCCCCCCCCCC(=O)OC 7a_100011003013_100000210202 [2,0,0,0,0,0|1,0,0]=3 2036 B16R0.221 CCOCCCNCCCCCCC(=O)OC 2230a_100000210961_100009815986 [2,0,0,0,0,0|2,0,0]=4 2037 B16R0.221 CCOCCCNCCCCCCC(=O)OC 34a_100000210961_100009815986 [2,0,0,0,0,0|2,0,0]=4 2038 B16R0.221 CCOCCCOCCCCCCC(=O)OC 34a_100000757476_100009815986 [2,0,0,0,0,0|2,0,0]=4 2039 B16R0.221 CCOCCCOCCCCCCC(=O)OC 34a_100009863599_100012232248 [2,0,0,0,0,0|2,0,0]=4 2040 B16R0.221 CCOCCCOCCCCCCC(=O)OC 7a_100000757476_100009815986 [2,0,0,0,0,0|2,0,0]=4 2041 B16R0.221 CCOCCCOCCCCCCC(=O)OC 7a_100009863599_100012232248 [2,0,0,0,0,0|2,0,0]=4 2042 B16R0.221 CCOCCCSCCCCCCC(=O)OC 62a_100009815986_100012232248 [2,0,0,0,0,0|2,0,0]=4 2043 B16R0.221 CCOCCCSCCCCCCC(=O)OC 62a_100012232248_100009815986 [2,0,0,0,0,0|2,0,0]=4 2044 B16R0.221 CCOCCNCCCCCCCC(=O)OC 2230a_102516460346_100010004213 [2,0,0,0,0,0|2,0,0]=4 2045 B16R0.221 CCOCCNCCCCCCCC(=O)OC 34a_102516460346_100010004213 [2,0,0,0,0,0|2,0,0]=4 2046 B16R0.221 CCOCCOCCCCCCCC(=O)OC 34a_100000210136_100010004213 [2,0,0,0,0,0|2,0,0]=4 2047 B16R0.221 CCOCCOCCCCCCCC(=O)OC 34a_100011022521_100000210147 [2,0,0,0,0,0|2,0,0]=4 2048 B16R0.221 CCOCCOCCCCCCCC(=O)OC 7a_100000210136_100010004213 [2,0,0,0,0,0|2,0,0]=4 2049 B16R0.221 CCOCCOCCCCCCCC(=O)OC 7a_100011022521_100011215890 [2,0,0,0,0,0|2,0,0]=4 2050 B16R0.221 CCOCCSCCCCCCCC(=O)OC 62a_100000210147_100010004213 [2,0,0,0,0,0|2,0,0]=4 2051 B16R0.221 CCOCCSCCCCCCCC(=O)OC 62a_100010004213_100011215890 [2,0,0,0,0,0|2,0,0]=4 2052 B16R0.221 CCOCSCCCCCCCCC(=O)OC 62a_100000739092_100010282707 [2,0,0,0,0,0|2,0,0]=4 2053 B16R0.221 CCOCSCCCCCCCCC(=O)OC 62a_100010282707_100000739092 [2,0,0,0,0,0|2,0,0]=4 2054 B16R0.221 CCSCCCCCCCCCCC(=O)OC 62a_100000210202_100009812566 [2,0,0,0,0,0|1,0,0]=3 2055 B16R0.221 CCSCCCOCCCCCCC(=O)OC 34a_100011216438_100009815986 [2,0,0,0,0,0|2,0,0]=4 2056 B16R0.221 CCSCCCOCCCCCCC(=O)OC 7a_100011216438_100009815986 [2,0,0,0,0,0|2,0,0]=4 2057 B16R0.221 CCSCCNCCCCCCCC(=O)OC 2230a_100000106463_100010004213 [2,0,0,0,0,0|2,0,0]=4 2058 B16R0.221 CCSCCOCCCCCCCC(=O)OC 34a_100000212035_100010004213 [2,0,0,0,0,0|2,0,0]=4 2059 B16R0.221 CCSCCOCCCCCCCC(=O)OC 34a_100011022521_100000757381 [2,0,0,0,0,0|2,0,0]=4 2060 B16R0.221 CCSCCOCCCCCCCC(=O)OC 7a_100000212035_100010004213 [2,0,0,0,0,0|2,0,0]=4 2061 B16R0.221 CCSCCOCCCCCCCC(=O)OC 7a_100011022521_100000757381 [2,0,0,0,0,0|2,0,0]=4 2062 B16R0.221 CCSCCSCCCCCCCC(=O)OC 62a_100000757381_100010004213 [2,0,0,0,0,0|2,0,0]=4 2063 B16R0.221 CCSCCSCCCCCCCC(=O)OC 62a_100010004213_100000757381 [2,0,0,0,0,0|2,0,0]=4 2064 B16R0.221 CNC(=O)CCCCCCCCCCCCO 240690a_100102657272_100102582631 [2,0,0,0,0,0|2,0,0]=4 2065 B16R0.221 CNCCCCCCCCCCCC(=O)OC 2230a_106832991635_100010983606 [2,0,0,0,0,0|1,0,0]=3 2066 B16R0.221 CNCCCCCCCCCCCC(=O)OC 34a_100102657272_100010983606 [2,0,0,0,0,0|1,0,0]=3 2067 B16R0.221 CNCCCCCCCCCCCC(=O)OC 7a_106832991635_100010983606 [2,0,0,0,0,0|1,0,0]=3 2068 B16R0.221 CNCCCCCOCCCCCC(=O)OC 34a_100000722520_100009816466 [2,0,0,0,0,0|2,0,0]=4 2069 B16R0.221 CNCCCOCCCCCCCC(=O)OC 34a_100000213112_100010004213 [2,0,0,0,0,0|2,0,0]=4 2070 B16R0.221 COC(=O)CCCCCCCCCCCSC 62a_200000210301_100010983606 [2,0,0,0,0,0|1,0,0]=3 2071 B16R0.221 COC(=O)CCCCCCCCCCCS[13CH3] 62a_200025704644_100010983606 [2,0,0,0,0,0|1,0,0]=3 2072 B16R0.221 COC(=O)CCCCCCCCCCOCF 34a_100011003013_100015361967 [2,0,0,0,0,0|2,0,0]=4 2073 B16R0.221 COC(=O)CCCCCCCCCCOCF 7a_100011003013_100015361967 [2,0,0,0,0,0|2,0,0]=4 2074 B16R0.221 COC(=O)CCCCCCCCCCSCF 62a_100015361967_100009812566 [2,0,0,0,0,0|2,0,0]=4 2075 B16R0.221 COC(=O)CCCCCCCCCNCCF 34a_100000724931_100009813843 [2,0,0,0,0,0|2,0,0]=4 2076 B16R0.221 COC(=O)CCCCCCCCCNCCO 2230a_100016997473_100009813843 [2,0,0,0,0,0|2,0,0]=4 2077 B16R0.221 COC(=O)CCCCCCCCCNCCO 34a_100016990907_100009813843 [2,0,0,0,0,0|2,0,0]=4 2078 B16R0.221 COC(=O)CCCCCCCCCOCCBr 34a_100000211926_100009813843 [2,0,0,0,0,0|2,0,0]=4 2079 B16R0.221 COC(=O)CCCCCCCCCOCCN 34a_100000210304_100009813843 [2,0,0,0,0,0|2,0,0]=4 2080 B16R0.221 COC(=O)CCCCCCCCCSCCF 62a_100011217306_100009813843 [2,0,0,0,0,0|2,0,0]=4 2081 B16R0.221 COC(=O)CCCCCCCCCSCCO 62a_100000211926_100009813843 [2,0,0,0,0,0|2,0,0]=4 2082 B16R0.221 COC(=O)CCCCCCCCCSCSC 62a_100011218213_100009813843 [2,0,0,0,0,0|2,0,0]=4 2083 B16R0.221 COC(=O)CCCCCCCCNCCCF 2230a_100015189416_100010282707 [2,0,0,0,0,0|2,0,0]=4 2084 B16R0.221 COC(=O)CCCCCCCCNCCCF 34a_100015189416_100010282707 [2,0,0,0,0,0|2,0,0]=4 2085 B16R0.221 COC(=O)CCCCCCCCNCCSC 2230a_100020590264_100010282707 [2,0,0,0,0,0|2,0,0]=4 2086 B16R0.221 COC(=O)CCCCCCCCOCCCBr 34a_100011217188_100010282707 [2,0,0,0,0,0|2,0,0]=4 2087 B16R0.221 COC(=O)CCCCCCCCOCCCCl 34a_100000230001_100010282707 [2,0,0,0,0,0|2,0,0]=4 2088 B16R0.221 COC(=O)CCCCCCCCOCCCF 34a_100000035544_100011934791 [2,0,0,0,0,0|2,0,0]=4 2089 B16R0.221 COC(=O)CCCCCCCCOCCCF 34a_100000759539_100010282707 [2,0,0,0,0,0|2,0,0]=4 2090 B16R0.221 COC(=O)CCCCCCCCOCCCF 7a_100000035544_100011934791 [2,0,0,0,0,0|2,0,0]=4 2091 B16R0.221 COC(=O)CCCCCCCCOCCCN 34a_100000182051_100010282707 [2,0,0,0,0,0|2,0,0]=4 2092 B16R0.221 COC(=O)CCCCCCCCOCCCO 34a_100000035544_100000230001 [2,0,0,0,0,0|2,0,0]=4 2093 B16R0.221 COC(=O)CCCCCCCCOCCCO 7a_100000035544_100011215043 [2,0,0,0,0,0|2,0,0]=4 2094 B16R0.221 COC(=O)CCCCCCCCOCCSC 34a_100000035544_100000212216 [2,0,0,0,0,0|2,0,0]=4 2095 B16R0.221 COC(=O)CCCCCCCCOCCSC 34a_100000230434_100010282707 [2,0,0,0,0,0|2,0,0]=4 2096 B16R0.221 COC(=O)CCCCCCCCOCCSC 7a_100000035544_100000212216 [2,0,0,0,0,0|2,0,0]=4 2097 B16R0.221 COC(=O)CCCCCCCCOCCSC 7a_100000230434_100010282707 [2,0,0,0,0,0|2,0,0]=4 2098 B16R0.221 COC(=O)CCCCCCCCSCCCF 62a_100010282707_100011934791 [2,0,0,0,0,0|2,0,0]=4 2099 B16R0.221 COC(=O)CCCCCCCCSCCCF 62a_100011934791_100010282707 [2,0,0,0,0,0|2,0,0]=4 2100 B16R0.221 COC(=O)CCCCCCCCSCCCO 62a_100010282707_100011215043 [2,0,0,0,0,0|2,0,0]=4 2101 B16R0.221 COC(=O)CCCCCCCCSCCCO 62a_100011215043_100010282707 [2,0,0,0,0,0|2,0,0]=4 2102 B16R0.221 COC(=O)CCCCCCCCSCCSC 62a_100000212216_100010282707 [2,0,0,0,0,0|2,0,0]=4 2103 B16R0.221 COC(=O)CCCCCCCCSCCSC 62a_100010282707_100000751147 [2,0,0,0,0,0|2,0,0]=4 2104 B16R0.221 COC(=O)CCCCCCCNCCCCO 2230a_100000750430_100010004213 [2,0,0,0,0,0|2,0,0]=4 2105 B16R0.221 COC(=O)CCCCCCCNCCCCO 34a_100000750430_100010004213 [2,0,0,0,0,0|2,0,0]=4 2106 B16R0.221 COC(=O)CCCCCCCNCCCSC 2230a_100000749238_100010004213 [2,0,0,0,0,0|2,0,0]=4 2107 B16R0.221 COC(=O)CCCCCCCOCCCCBr 34a_100011216708_100010004213 [2,0,0,0,0,0|2,0,0]=4 2108 B16R0.221 COC(=O)CCCCCCCOCCCCCl 34a_100000210776_100010004213 [2,0,0,0,0,0|2,0,0]=4 2109 B16R0.221 COC(=O)CCCCCCCOCCCCCl 7a_100000210776_100010004213 [2,0,0,0,0,0|2,0,0]=4 2110 B16R0.221 COC(=O)CCCCCCCOCCCCF 34a_100011022521_100000729493 [2,0,0,0,0,0|2,0,0]=4 2111 B16R0.221 COC(=O)CCCCCCCOCCCCF 34a_100011995726_100010004213 [2,0,0,0,0,0|2,0,0]=4 2112 B16R0.221 COC(=O)CCCCCCCOCCCCF 7a_100011022521_100000729493 [2,0,0,0,0,0|2,0,0]=4 2113 B16R0.221 COC(=O)CCCCCCCOCCCCF 7a_100011995726_100010004213 [2,0,0,0,0,0|2,0,0]=4 2114 B16R0.221 COC(=O)CCCCCCCOCCCCI 34a_200012148704_100010004213 [2,0,0,0,0,0|2,0,0]=4 2115 B16R0.221 COC(=O)CCCCCCCOCCCCN 34a_100000750430_100010004213 [2,0,0,0,0,0|2,0,0]=4 2116 B16R0.221 COC(=O)CCCCCCCOCCCCO 34a_100011022521_100011216708 [2,0,0,0,0,0|2,0,0]=4 2117 B16R0.221 COC(=O)CCCCCCCOCCCCO 7a_100011022521_100000210776 [2,0,0,0,0,0|2,0,0]=4 2118 B16R0.221 COC(=O)CCCCCCCOCCCSC 34a_100000690336_100010004213 [2,0,0,0,0,0|2,0,0]=4 2119 B16R0.221 COC(=O)CCCCCCCOCCCSC 7a_100000690336_100010004213 [2,0,0,0,0,0|2,0,0]=4 2120 B16R0.221 COC(=O)CCCCCCCSCCCCF 62a_100000729493_100010004213 [2,0,0,0,0,0|2,0,0]=4 2121 B16R0.221 COC(=O)CCCCCCCSCCCCF 62a_100010004213_100000729493 [2,0,0,0,0,0|2,0,0]=4 2122 B16R0.221 COC(=O)CCCCCCCSCCCCO 62a_100000210776_100010004213 [2,0,0,0,0,0|2,0,0]=4 2123 B16R0.221 COC(=O)CCCCCCCSCCCCO 62a_100010004213_100000210776 [2,0,0,0,0,0|2,0,0]=4 2124 B16R0.221 COC(=O)CCCCCCNCCCCCO 2230a_100000762737_100009815986 [2,0,0,0,0,0|2,0,0]=4 2125 B16R0.221 COC(=O)CCCCCCNCCCCCO 34a_100000762737_100009815986 [2,0,0,0,0,0|2,0,0]=4 2126 B16R0.221 COC(=O)CCCCCCOCCCCCBr 34a_100000746331_100009815986 [2,0,0,0,0,0|2,0,0]=4 2127 B16R0.221 COC(=O)CCCCCCOCCCCCBr 7a_100000746331_100009815986 [2,0,0,0,0,0|2,0,0]=4 2128 B16R0.221 COC(=O)CCCCCCOCCCCCCl 34a_100000746330_100009815986 [2,0,0,0,0,0|2,0,0]=4 2129 B16R0.221 COC(=O)CCCCCCOCCCCCCl 7a_100000746330_100009815986 [2,0,0,0,0,0|2,0,0]=4 2130 B16R0.221 COC(=O)CCCCCCOCCCCCF 34a_100009863599_100000729378 [2,0,0,0,0,0|2,0,0]=4 2131 B16R0.221 COC(=O)CCCCCCOCCCCCF 7a_100009863599_100000729378 [2,0,0,0,0,0|2,0,0]=4 2132 B16R0.221 COC(=O)CCCCCCOCCCCCI 34a_200012148887_100009815986 [2,0,0,0,0,0|2,0,0]=4 2133 B16R0.221 COC(=O)CCCCCCOCCCCCI 7a_200012148887_100009815986 [2,0,0,0,0,0|2,0,0]=4 2134 B16R0.221 COC(=O)CCCCCCOCCCCCN 34a_100000762737_100009815986 [2,0,0,0,0,0|2,0,0]=4 2135 B16R0.221 COC(=O)CCCCCCOCCCCCO 34a_100009863599_100000746330 [2,0,0,0,0,0|2,0,0]=4 2136 B16R0.221 COC(=O)CCCCCCOCCCCCO 7a_100009863599_100000746330 [2,0,0,0,0,0|2,0,0]=4 2137 B16R0.221 COC(=O)CCCCCCOCCCCSC 34a_100011217163_100009815986 [2,0,0,0,0,0|2,0,0]=4 2138 B16R0.221 COC(=O)CCCCCCOCCCCSC 7a_100011217163_100009815986 [2,0,0,0,0,0|2,0,0]=4 2139 B16R0.221 COC(=O)CCCCCCSCCCCCF 62a_100000729378_100009815986 [2,0,0,0,0,0|2,0,0]=4 2140 B16R0.221 COC(=O)CCCCCCSCCCCCF 62a_100009815986_100000729378 [2,0,0,0,0,0|2,0,0]=4 2141 B16R0.221 COC(=O)CCCCCCSCCCCCO 62a_100000746330_100009815986 [2,0,0,0,0,0|2,0,0]=4 2142 B16R0.221 COC(=O)CCCCCCSCCCCCO 62a_100009815986_100000746330 [2,0,0,0,0,0|2,0,0]=4 2143 B16R0.221 COC(=O)CCCCCNCCCCCCO 2230a_100000686447_100009816466 [2,0,0,0,0,0|2,0,0]=4 2144 B16R0.221 COC(=O)CCCCCNCCCCCCO 34a_100000686447_100009816466 [2,0,0,0,0,0|2,0,0]=4 2145 B16R0.221 COC(=O)CCCCCOCCCCCCBr 34a_100011215345_100009816466 [2,0,0,0,0,0|2,0,0]=4 2146 B16R0.221 COC(=O)CCCCCOCCCCCCBr 7a_100011215345_100009816466 [2,0,0,0,0,0|2,0,0]=4 2147 B16R0.221 COC(=O)CCCCCOCCCCCCCl 34a_100000766143_100009816466 [2,0,0,0,0,0|2,0,0]=4 2148 B16R0.221 COC(=O)CCCCCOCCCCCCCl 7a_100000766143_100009816466 [2,0,0,0,0,0|2,0,0]=4 2149 B16R0.221 COC(=O)CCCCCOCCCCCCF 34a_100000074720_100015922095 [2,0,0,0,0,0|2,0,0]=4 2150 B16R0.221 COC(=O)CCCCCOCCCCCCF 34a_100000732779_100009816466 [2,0,0,0,0,0|2,0,0]=4 2151 B16R0.221 COC(=O)CCCCCOCCCCCCF 7a_100000074720_100015922095 [2,0,0,0,0,0|2,0,0]=4 2152 B16R0.221 COC(=O)CCCCCOCCCCCCF 7a_100000732779_100009816466 [2,0,0,0,0,0|2,0,0]=4 2153 B16R0.221 COC(=O)CCCCCOCCCCCCN 34a_100000686447_100009816466 [2,0,0,0,0,0|2,0,0]=4 2154 B16R0.221 COC(=O)CCCCCOCCCCCCO 34a_100000074720_100000766143 [2,0,0,0,0,0|2,0,0]=4 2155 B16R0.221 COC(=O)CCCCCOCCCCCCO 7a_100000074720_100000766143 [2,0,0,0,0,0|2,0,0]=4 2156 B16R0.221 COC(=O)CCCCCSCCCCCCF 62a_100009816466_100015922095 [2,0,0,0,0,0|2,0,0]=4 2157 B16R0.221 COC(=O)CCCCCSCCCCCCF 62a_100015922095_100009816466 [2,0,0,0,0,0|2,0,0]=4 2158 B16R0.221 COC(=O)CCCCCSCCCCCCO 62a_100000766143_100009816466 [2,0,0,0,0,0|2,0,0]=4 2159 B16R0.221 COC(=O)CCCCCSCCCCCCO 62a_100009816466_100000766143 [2,0,0,0,0,0|2,0,0]=4 2160 B16R0.221 COC(=O)CCCCNCCCCCCCO 2230a_100011996573_100000204269 [2,0,0,0,0,0|2,0,0]=4 2161 B16R0.221 COC(=O)CCCCNCCCCCCCO 34a_100011996573_100000204269 [2,0,0,0,0,0|2,0,0]=4 2162 B16R0.221 COC(=O)CCCCOCCCCCCCBr 34a_100000760002_100000204269 [2,0,0,0,0,0|2,0,0]=4 2163 B16R0.221 COC(=O)CCCCOCCCCCCCBr 7a_100000760002_100000204269 [2,0,0,0,0,0|2,0,0]=4 2164 B16R0.221 COC(=O)CCCCOCCCCCCCN 34a_100011996573_100000204269 [2,0,0,0,0,0|2,0,0]=4 2165 B16R0.221 COC(=O)CCCCOCCCCCCCO 34a_100000059025_100000760002 [2,0,0,0,0,0|2,0,0]=4 2166 B16R0.221 COC(=O)CCCCOCCCCCCCO 7a_100000059025_100000760002 [2,0,0,0,0,0|2,0,0]=4 2167 B16R0.221 COC(=O)CCCCSCCCCCCCO 62a_100000204269_100000760002 [2,0,0,0,0,0|2,0,0]=4 2168 B16R0.221 COC(=O)CCCCSCCCCCCCO 62a_100000760002_100000204269 [2,0,0,0,0,0|2,0,0]=4 2169 B16R0.221 COC(=O)CCCNCCCCCCCCO 2230a_102515433106_100011218270 [2,0,0,0,0,0|2,0,0]=4 2170 B16R0.221 COC(=O)CCCNCCCCCCCCO 34a_102515433106_100000742333 [2,0,0,0,0,0|2,0,0]=4 2171 B16R0.221 COC(=O)CCCOCCCCCCCCBr 34a_100009813846_100000742333 [2,0,0,0,0,0|2,0,0]=4 2172 B16R0.221 COC(=O)CCCOCCCCCCCCBr 7a_100009813846_100011218270 [2,0,0,0,0,0|2,0,0]=4 2173 B16R0.221 COC(=O)CCCOCCCCCCCCCl 34a_100000033203_100000742333 [2,0,0,0,0,0|2,0,0]=4 2174 B16R0.221 COC(=O)CCCOCCCCCCCCCl 7a_100000033203_100011218270 [2,0,0,0,0,0|2,0,0]=4 2175 B16R0.221 COC(=O)CCCOCCCCCCCCN 34a_102515433106_100000742333 [2,0,0,0,0,0|2,0,0]=4 2176 B16R0.221 COC(=O)CCCSCCCCCCCCO 62a_100000033203_100011218270 [2,0,0,0,0,0|2,0,0]=4 2177 B16R0.221 COC(=O)CCCSCCCCCCCCO 62a_100011218270_100000033203 [2,0,0,0,0,0|2,0,0]=4 2178 B16R0.221 COC(=O)CCNCCCCCCCCCO 2230a_100000078944_100000204255 [2,0,0,0,0,0|2,0,0]=4 2179 B16R0.221 COC(=O)CCNCCCCCCCCCO 34a_100000078944_100000742370 [2,0,0,0,0,0|2,0,0]=4 2180 B16R0.221 COC(=O)CCOCCCCCCCCCBr 34a_100009813782_100000742370 [2,0,0,0,0,0|2,0,0]=4 2181 B16R0.221 COC(=O)CCOCCCCCCCCCBr 7a_100009813782_100000204255 [2,0,0,0,0,0|2,0,0]=4 2182 B16R0.221 COC(=O)CCOCCCCCCCCCCl 34a_100009868337_100000742370 [2,0,0,0,0,0|2,0,0]=4 2183 B16R0.221 COC(=O)CCOCCCCCCCCCCl 7a_100009868337_100000204255 [2,0,0,0,0,0|2,0,0]=4 2184 B16R0.221 COC(=O)CCOCCCCCCCCCN 34a_100000078944_100000742370 [2,0,0,0,0,0|2,0,0]=4 2185 B16R0.221 COC(=O)CCSCCCCCCCCCO 62a_100000204255_100009813782 [2,0,0,0,0,0|2,0,0]=4 2186 B16R0.221 COC(=O)CCSCCCCCCCCCO 62a_100009813782_100000204255 [2,0,0,0,0,0|2,0,0]=4 2187 B16R0.221 COC(=O)CNCCCCCCCCCCO 2230a_100000066964_100000747449 [2,0,0,0,0,0|2,0,0]=4 2188 B16R0.221 COC(=O)CNCCCCCCCCCCO 34a_100000066964_100000747449 [2,0,0,0,0,0|2,0,0]=4 2189 B16R0.221 COC(=O)COCCCCCCCCCCBr 34a_100009813290_100000747449 [2,0,0,0,0,0|2,0,0]=4 2190 B16R0.221 COC(=O)COCCCCCCCCCCBr 7a_100009813290_100000747449 [2,0,0,0,0,0|2,0,0]=4 2191 B16R0.221 COC(=O)COCCCCCCCCCCCl 34a_200000033068_100000747449 [2,0,0,0,0,0|2,0,0]=4 2192 B16R0.221 COC(=O)COCCCCCCCCCCCl 7a_200000033068_100000747449 [2,0,0,0,0,0|2,0,0]=4 2193 B16R0.221 COC(=O)COCCCCCCCCCCN 34a_100000066964_100000747449 [2,0,0,0,0,0|2,0,0]=4 2194 B16R0.221 COC(=O)CSCCCCCCCCCCO 62a_100000747449_200000033068 [2,0,0,0,0,0|2,0,0]=4 2195 B16R0.221 COC(=O)CSCCCCCCCCCCO 62a_100009813290_100000747449 [2,0,0,0,0,0|2,0,0]=4 2196 B16R0.221 COCCCCCCCCCCCC(=O)OC 34a_100138415774_100010983606 [2,0,0,0,0,0|1,0,0]=3 2197 B16R0.221 COCCCCCCOCCCCC(=O)OC 34a_100000059025_100011998445 [2,0,0,0,0,0|2,0,0]=4 2198 B16R0.221 COCCCCCCOCCCCC(=O)OC 34a_200012092642_100000204269 [2,0,0,0,0,0|2,0,0]=4 2199 B16R0.221 COCCCCCCOCCCCC(=O)OC 7a_100000059025_100011998445 [2,0,0,0,0,0|2,0,0]=4 2200 B16R0.221 COCCCCCCOCCCCC(=O)OC 7a_200012092642_100000204269 [2,0,0,0,0,0|2,0,0]=4 2201 B16R0.221 COCCCCCCSCCCCC(=O)OC 62a_100000204269_100011998445 [2,0,0,0,0,0|2,0,0]=4 2202 B16R0.221 COCCCCCCSCCCCC(=O)OC 62a_100011998445_100000204269 [2,0,0,0,0,0|2,0,0]=4 2203 B16R0.221 COCCCCCNCCCCCC(=O)OC 2230a_100000747528_100009816466 [2,0,0,0,0,0|2,0,0]=4 2204 B16R0.221 COCCCCCNCCCCCC(=O)OC 34a_100000747528_100009816466 [2,0,0,0,0,0|2,0,0]=4 2205 B16R0.221 COCCCCOCCCCCCC(=O)OC 34a_100000740925_100009815986 [2,0,0,0,0,0|2,0,0]=4 2206 B16R0.221 COCCCCOCCCCCCC(=O)OC 34a_100009863599_100000755781 [2,0,0,0,0,0|2,0,0]=4 2207 B16R0.221 COCCCCOCCCCCCC(=O)OC 7a_100009863599_100000730899 [2,0,0,0,0,0|2,0,0]=4 2208 B16R0.221 COCCCCSCCCCCCC(=O)OC 62a_100000730899_100009815986 [2,0,0,0,0,0|2,0,0]=4 2209 B16R0.221 COCCCCSCCCCCCC(=O)OC 62a_100009815986_100000730899 [2,0,0,0,0,0|2,0,0]=4 2210 B16R0.221 COCCCNCCCCCCCC(=O)OC 34a_100150723488_100010004213 [2,0,0,0,0,0|2,0,0]=4 2211 B16R0.221 COCCCOCCCCCCCC(=O)OC 34a_100000740835_100010004213 [2,0,0,0,0,0|2,0,0]=4 2212 B16R0.221 COCCCOCCCCCCCC(=O)OC 34a_100011022521_100000740836 [2,0,0,0,0,0|2,0,0]=4 2213 B16R0.221 COCCCOCCCCCCCC(=O)OC 7a_100011022521_100000740836 [2,0,0,0,0,0|2,0,0]=4 2214 B16R0.221 COCCCSCCCCCCCC(=O)OC 62a_100000709357_100010004213 [2,0,0,0,0,0|2,0,0]=4 2215 B16R0.221 COCCCSCCCCCCCC(=O)OC 62a_100010004213_100000709357 [2,0,0,0,0,0|2,0,0]=4 2216 B16R0.221 COCCNCCCCCCCCC(=O)OC 2230a_100000209980_100010282707 [2,0,0,0,0,0|2,0,0]=4 2217 B16R0.221 COCCOCCCCCCCCC(=O)OC 34a_100000035544_100011201679 [2,0,0,0,0,0|2,0,0]=4 2218 B16R0.221 COCCOCCCCCCCCC(=O)OC 34a_100000210237_100010282707 [2,0,0,0,0,0|2,0,0]=4 2219 B16R0.221 COCCOCCCCCCCCC(=O)OC 7a_100000035544_100000233755 [2,0,0,0,0,0|2,0,0]=4 2220 B16R0.221 COCCSCCCCCCCCC(=O)OC 62a_100000233755_100010282707 [2,0,0,0,0,0|2,0,0]=4 2221 B16R0.221 COCCSCCCCCCCCC(=O)OC 62a_100010282707_100000233755 [2,0,0,0,0,0|2,0,0]=4 2222 B16R0.221 COCSCCCCCCCCCC(=O)OC 62a_100000766300_100009813843 [2,0,0,0,0,0|2,0,0]=4 2223 B16R0.221 O=C(CO)CCCCCCCCCCCCO 1458a_100000210174_100009813331 [2,0,0,0,0,0|2,0,0]=4 2224 B18R0.94 CCCCCCCCC(C)CNCCCOC(C)C 270004a_100000737246_100011995885 [1,1,0,0,0,0|1,0,1]=4 2225 B18R0.182 CCCCCCCCCCCCCNCC(C)(C)O 2230a_100000751335_100000210684 [1,1,0,0,0,0|2,0,0]=4 2226 B18R0.182 CCCCCCCCCCCCCNCC(C)(C)O 270004a_100000751335_200011215488 [1,1,0,0,0,0|2,0,0]=4 2227 B18R0.182 CCCCCCCCCCCCCNCC(C)(C)O 34a_100011215765_100000764493 [1,1,0,0,0,0|2,0,0]=4 2228 B18R0.182 CCCCCCCCCCCNCCOC(C)(C)C 2230a_100000747557_100011215454 [1,1,0,0,0,0|1,0,1]=4 2229 B18R0.182 CCCCCCCCCCNCCCOC(C)(C)C 2230a_100011250582_100000210320 [1,1,0,0,0,0|1,0,1]=4 2230 B18R0.233 CCCCCCCCCCNC(C)CCOC(C)C 270004a_100000684558_200011219172 [1,1,0,0,0,0|1,0,1]=4 2231 B18R0.11628 CCCCCCCCCC(C)CNCCOC(C)C 270004a_100000701111_200011218516 [1,1,0,0,0,0|1,0,1]=4 2232 B18R0.11628 CCCCCCCCCC(C)NCCCOC(C)C 270004a_100000737246_100011215753 [1,1,0,0,0,0|1,0,1]=4 2233 B18R0.17430 CCCCCCCCCCC(C)NCCOC(C)C 270004a_100000701111_200011219864 [1,1,0,0,0,0|1,0,1]=4 2234 B18R0.29 CCCC(C)CCOCCCCCC(=O)OC(C)C 34a_100011217855_200010986244 [1,1,0,0,0,0|1,0,0]=3 2235 B18R0.29 CCCC(C)CCOCCCCCC(=O)OC(C)C 7a_100011217855_200010986244 [1,1,0,0,0,0|1,0,0]=3 2236 B18R0.29 CCC[C@H](N)CCOCCCCCC(=O)OC(C)C 34a_100015193777_200010986244 [1,1,0,0,0,0|1,0,0]=3 2237 B18R0.47 CCCCCCCCC(C)CNCC(=O)NC(C)C 270004a_100000168517_100011995885 [1,1,0,0,0,0|2,0,0]=4 2238 B18R0.47 CCCCCCCCC(C)COCC(=O)NC(C)C 34a_200012125181_100000183996 [1,1,0,0,0,0|2,0,0]=4 2239 B18R0.47 CCCCCCCCC(C)COCC(=O)NC(C)C 7a_200012125181_100000183996 [1,1,0,0,0,0|2,0,0]=4 2240 B18R0.47 CCCCCCCCC(C)COCC(=O)OC(C)C 34a_200012125181_100011215430 [1,1,0,0,0,0|1,0,0]=3 2241 B18R0.47 CCCCCCCCC(C)COCC(=O)OC(C)C 7a_200012125181_100011215430 [1,1,0,0,0,0|1,0,0]=3 2242 B18R0.47 CCCCCCCCC(C)OCCC(=O)NC(C)C 7a_100000210740_100000737564 [1,1,0,0,0,0|2,0,0]=4 2243 B18R0.47 CCCCCCCCC(C)OCCC(=O)OC(C)C 7a_100000210740_100000760027 [1,1,0,0,0,0|1,0,0]=3 2244 B18R0.89 CC(C)OC(=O)CCCCCNC[C@H](C)CCCO 2230a_100160569302_200010986244 [1,1,0,0,0,0|2,0,0]=4 2245 B18R0.89 CC(C)OC(=O)CCCCCNC[C@H](C)CCCO 34a_100160569302_200010986244 [1,1,0,0,0,0|2,0,0]=4 2246 B18R0.89 CCCCC(C)CCCCOCCC(=O)NC(C)C 7a_200011021034_100000737564 [1,1,0,0,0,0|2,0,0]=4 2247 B18R0.89 CCCCC(C)CCCCOCCC(=O)OC(C)C 7a_200011021034_100000760027 [1,1,0,0,0,0|1,0,0]=3 2248 B18R0.89 CCCCC(C)COCCCCCC(=O)OC(C)C 34a_100011995851_200010986244 [1,1,0,0,0,0|1,0,0]=3 2249 B18R0.89 CCCCC(C)COCCCCCC(=O)OC(C)C 7a_100011995851_200010986244 [1,1,0,0,0,0|1,0,0]=3 2250 B18R0.89 CCCC[C@H](N)COCCCCCC(=O)OC(C)C 34a_100011934283_200010986244 [1,1,0,0,0,0|1,0,0]=3 2251 B18R0.89 CCCOC(C)CNCCCCCC(=O)OC(C)C 2230a_100015185124_200010986244 [1,1,0,0,0,0|2,0,0]=4 2252 B18R0.89 CCCOC(C)CNCCCCCC(=O)OC(C)C 34a_100015185124_200010986244 [1,1,0,0,0,0|2,0,0]=4 2253 B18R0.89 CCOCC(O)CNCCCCCC(=O)OC(C)C 2230a_102515437182_200010986244 [1,1,0,0,0,0|2,0,0]=4 2254 B18R0.89 CCOCC(O)CNCCCCCC(=O)OC(C)C 34a_102515437182_200010986244 [1,1,0,0,0,0|2,0,0]=4 2255 B18R0.89 CSCC[C@H](N)COCCCCCC(=O)OC(C)C 34a_100011827619_200010986244 [1,1,0,0,0,0|2,0,0]=4 2256 B18R0.118 CC(C)OC(=O)CCCCCOCCC[C@@H](C)CN 34a_100160569302_200010986244 [1,1,0,0,0,0|2,0,0]=4 2257 B18R0.118 CCC(C)CCCOCCCCCC(=O)OC(C)C 7a_100011216074_200010986244 [1,1,0,0,0,0|1,0,0]=3 2258 B18R0.118 CCN(C)CCCSCCCCCC(=O)OC(C)C 62a_200010986244_100015186262 [1,1,0,0,0,0|2,0,0]=4 2259 B18R0.121 CC(C)OC(=O)CCCCCC(=O)CCCCCO 1458a_100102619762_200010986244 [1,1,0,0,0,0|1,0,1]=4 2260 B18R0.121 CC(C)OC(=O)CCCCCN(C)CCCCCO 2230a_100000722520_200010986244 [1,1,0,0,0,0|2,0,0]=4 2261 B18R0.121 CC(C)OC(=O)CCCCCN(C)CCCCCO 269982a_100000722520_200010986244 [1,1,0,0,0,0|2,0,0]=4 2262 B18R0.121 CCCCCCC(=O)CCCCCC(=O)OC(C)C 1458a_100102632555_200010986244 [1,1,0,0,0,0|0,0,1]=3 2263 B18R0.121 CCCCCCC(C)CCOCCC(=O)NC(C)C 7a_200011024964_100000737564 [1,1,0,0,0,0|2,0,0]=4 2264 B18R0.121 CCCCCCC(C)CCOCCC(=O)OC(C)C 7a_200011024964_100000760027 [1,1,0,0,0,0|1,0,0]=3 2265 B18R0.121 CCCCCCN(C)CCCCCC(=O)OC(C)C 2230a_106256046315_200010986244 [1,1,0,0,0,0|1,0,0]=3 2266 B18R0.121 CCCCCCN(C)CCCCCC(=O)OC(C)C 269982a_106256046315_200010986244 [1,1,0,0,0,0|1,0,0]=3 2267 B18R0.121 CCCCOCC(=O)CCCCCC(=O)OC(C)C 1458a_100000757543_200010986244 [1,1,0,0,0,0|1,0,1]=4 2268 B18R0.121 CCCCSCC(=O)CCCCCC(=O)OC(C)C 1458a_100000191162_200010986244 [1,1,0,0,0,0|1,0,1]=4 2269 B18R0.175 C#CC(C)NC(=O)CCCCCCCCCCCC 11a_100000707721_100011215791 [1,1,0,0,0,0|1,0,1]=4 2270 B18R0.175 C#CC(C)NC(=O)CCCCCCCCCCCC 1626a_100000707721_100011215791 [1,1,0,0,0,0|1,0,1]=4 2271 B18R0.175 C#CC(C)NC(=O)CCCCCCCCCCCC 240690a_100000707721_100011215791 [1,1,0,0,0,0|1,0,1]=4 2272 B18R0.175 CCC(C)CC(=O)CCCCCCCCCCCO 1458a_100000708755_100009812471 [1,1,0,0,0,0|2,0,0]=4 2273 B18R0.175 CCC(C)NC(=O)CCCCCCCCCCCO 240690a_100000209981_100000037981 [1,1,0,0,0,0|2,0,0]=4 2274 B18R0.175 CCCCCCCCCCCCC(=O)CN(C)CC 1458a_100116209913_100000759014 [1,1,0,0,0,0|2,0,0]=4 2275 B18R0.175 CCCCCCCCCCCCC(=O)C[C@@H](C)CO 1458a_100011215791_100000059175 [1,1,0,0,0,0|1,0,0]=3 2276 B18R0.175 CCCCCCCCCCCCC(=O)NC(C)C#N 11a_100000737613_100011215791 [1,1,0,0,0,0|1,0,1]=4 2277 B18R0.175 CCCCCCCCCCCCC(=O)NC(C)C#N 1626a_100000737613_100011215791 [1,1,0,0,0,0|1,0,1]=4 2278 B18R0.175 CCCCCCCCCCCCC(=O)N[C@H](C)CF 11a_100102880703_100011215791 [1,1,0,0,0,0|1,0,0]=3 2279 B18R0.175 CCCCCCCCCCCCC(=O)N[C@H](C)CF 1626a_100102880703_100011215791 [1,1,0,0,0,0|1,0,0]=3 2280 B18R0.175 CCCCCCCCCCCCC(=O)N[C@H](C)CF 240690a_100102880703_100011215791 [1,1,0,0,0,0|1,0,0]=3 2281 B18R0.175 CCCCCCCCCCCCC(=O)N[C@H](C)CO 240690a_100000737577_100011215791 [1,1,0,0,0,0|1,0,0]=3 2282 B18R0.175 CCCCCCCCCCCNC(=O)NC(C)CC 2708a_100000209981_200011215754 [1,1,0,0,0,0|2,0,0]=4 2283 B18R0.175 CCCCCCCCCCCNC(=O)NC(C)CC 2708a_200011215754_100000209981 [1,1,0,0,0,0|2,0,0]=4 2284 B18R0.175 CCCCCCCCCCCNC(=O)NC(C)CC 273464a_100000209981_200011215754 [1,1,0,0,0,0|2,0,0]=4 2285 B18R0.175 CCCCCCCCCCCNC(=O)NC(C)CC 273464a_200011215754_100000209981 [1,1,0,0,0,0|2,0,0]=4 2286 B18R0.175 CCCCCCCCCCCNC(=O)NC(C)CC 512a_100000209981_200011215754 [1,1,0,0,0,0|2,0,0]=4 2287 B18R0.175 CCCCCCCCCCCNC(=O)NC(C)CC 512a_200011215754_100000209981 [1,1,0,0,0,0|2,0,0]=4 2288 B18R0.175 CCCCCCCCCCCNC(=O)N[C@H](C)CF 2708a_200011215754_100102880703 [1,1,0,0,0,0|2,0,0]=4 2289 B18R0.175 CCCCCCCCCCCNC(=O)N[C@H](C)CF 273464a_100102880703_200011215754 [1,1,0,0,0,0|2,0,0]=4 2290 B18R0.175 CCCCCCCCCCCNC(=O)N[C@H](C)CF 273464a_200011215754_100102880703 [1,1,0,0,0,0|2,0,0]=4 2291 B18R0.175 CCCCCCCCCCCNC(=O)N[C@H](C)CF 512a_100102880703_200011215754 [1,1,0,0,0,0|2,0,0]=4 2292 B18R0.175 CCCCCCCCCCCNC(=O)N[C@H](C)CF 512a_200011215754_100102880703 [1,1,0,0,0,0|2,0,0]=4 2293 B18R0.175 CCCCCCCCCCCNC(=O)N[C@H](C)CO 2708a_200011215754_100000737577 [1,1,0,0,0,0|2,0,0]=4 2294 B18R0.175 CCCCCCCCCCCNC(=O)N[C@H](C)CO 273464a_100000737577_200011215754 [1,1,0,0,0,0|2,0,0]=4 2295 B18R0.175 CCCCCCCCCCCNC(=O)N[C@H](C)CO 512a_100000737577_200011215754 [1,1,0,0,0,0|2,0,0]=4 2296 B18R0.175 CCCCCCCCCCCNC(=O)N[C@H](C)CO 512a_200011215754_100000737577 [1,1,0,0,0,0|2,0,0]=4 2297 B18R0.175 CCCCCCCCCCNCC(=O)NC(C)CC 2230a_100000684558_100000182745 [1,1,0,0,0,0|2,0,0]=4 2298 B18R0.175 CCCCCCCCCCNCC(=O)NC(C)CC 34a_100000684558_100000182745 [1,1,0,0,0,0|2,0,0]=4 2299 B18R0.175 CCCCCCCCCCOCC(=O)NC(C)CC 34a_100000210711_100000182745 [1,1,0,0,0,0|2,0,0]=4 2300 B18R0.175 CCCCCCCCCCOCC(=O)NC(C)CC 7a_100000210711_100000182745 [1,1,0,0,0,0|2,0,0]=4 2301 B18R0.175 CCCCCCCCCCSCC(=O)NC(C)CC 62a_100000182745_100000210320 [1,1,0,0,0,0|2,0,0]=4 2302 B18R0.175 C[C@H](CF)NC(=O)CCCCCCCCCCCO 240690a_100102880703_100000037981 [1,1,0,0,0,0|2,0,0]=4 2303 B18R0.175 C[C@H](CO)NC(=O)CCCCCCCCCCCO 240690a_100000737577_100000037981 [1,1,0,0,0,0|2,0,0]=4 2304 B18R0.188 CC(C)(C)CC(=O)CCCCCCCCCCCO 1458a_100000211214_100009812471 [1,1,0,0,0,0|2,0,0]=4 2305 B18R0.188 CC(C)(C)NC(=O)CCCCCCCCCCCO 240690a_100000715429_100000037981 [1,1,0,0,0,0|2,0,0]=4 2306 B18R0.188 CC(C)(C)OC(=O)CCCCCCCCNCCF 34a_100000724931_100134616357 [1,1,0,0,0,0|2,0,0]=4 2307 B18R0.188 CC(C)(C)OC(=O)CCCCCCCCNCCO 2230a_100016997473_100134616357 [1,1,0,0,0,0|2,0,0]=4 2308 B18R0.188 CC(C)(C)OC(=O)CCCCCCCCNCCO 34a_100016990907_100134616357 [1,1,0,0,0,0|2,0,0]=4 2309 B18R0.188 CC(C)(C)OC(=O)CCCCCCCCOCCBr 34a_100000211926_100134616357 [1,1,0,0,0,0|2,0,0]=4 2310 B18R0.188 CC(C)(C)OC(=O)CCCCCCCCOCCN 34a_100000210304_100134616357 [1,1,0,0,0,0|2,0,0]=4 2311 B18R0.188 CC(C)(C)OC(=O)CCCCCCCCSCCF 62a_100011217306_100134616357 [1,1,0,0,0,0|2,0,0]=4 2312 B18R0.188 CC(C)(C)OC(=O)CCCCCCCCSCCF 62a_100134616357_100011217306 [1,1,0,0,0,0|2,0,0]=4 2313 B18R0.188 CC(C)(C)OC(=O)CCCCCCCCSCCO 62a_100000211926_100134616357 [1,1,0,0,0,0|2,0,0]=4 2314 B18R0.188 CC(C)(C)OC(=O)CCCCCCCCSCCO 62a_100134616357_100000211926 [1,1,0,0,0,0|2,0,0]=4 2315 B18R0.188 CC(C)(C)OC(=O)CCCCCCCNCCCF 2230a_100015189416_100010978495 [1,1,0,0,0,0|2,0,0]=4 2316 B18R0.188 CC(C)(C)OC(=O)CCCCCCCNCCCF 34a_100015189416_100010978495 [1,1,0,0,0,0|2,0,0]=4 2317 B18R0.188 CC(C)(C)OC(=O)CCCCCCCOCCCBr 34a_100011217188_100010978495 [1,1,0,0,0,0|2,0,0]=4 2318 B18R0.188 CC(C)(C)OC(=O)CCCCCCCOCCCCl 34a_100000230001_100010978495 [1,1,0,0,0,0|2,0,0]=4 2319 B18R0.188 CC(C)(C)OC(=O)CCCCCCCOCCCF 34a_100000759539_100010978495 [1,1,0,0,0,0|2,0,0]=4 2320 B18R0.188 CC(C)(C)OC(=O)CCCCCCCOCCCF 34a_100032214103_100011934791 [1,1,0,0,0,0|2,0,0]=4 2321 B18R0.188 CC(C)(C)OC(=O)CCCCCCCOCCCF 7a_100032214103_100011934791 [1,1,0,0,0,0|2,0,0]=4 2322 B18R0.188 CC(C)(C)OC(=O)CCCCCCCOCCCN 34a_100000182051_100010978495 [1,1,0,0,0,0|2,0,0]=4 2323 B18R0.188 CC(C)(C)OC(=O)CCCCCCCOCCCO 34a_100032214103_100000230001 [1,1,0,0,0,0|2,0,0]=4 2324 B18R0.188 CC(C)(C)OC(=O)CCCCCCCOCCCO 7a_100032214103_100011215043 [1,1,0,0,0,0|2,0,0]=4 2325 B18R0.188 CC(C)(C)OC(=O)CCCCCCCSCCCF 62a_100010978495_100011934791 [1,1,0,0,0,0|2,0,0]=4 2326 B18R0.188 CC(C)(C)OC(=O)CCCCCCCSCCCF 62a_100011934791_100010978495 [1,1,0,0,0,0|2,0,0]=4 2327 B18R0.188 CC(C)(C)OC(=O)CCCCCCCSCCCO 62a_100010978495_100011215043 [1,1,0,0,0,0|2,0,0]=4 2328 B18R0.188 CC(C)(C)OC(=O)CCCCCCCSCCCO 62a_100011215043_100010978495 [1,1,0,0,0,0|2,0,0]=4 2329 B18R0.188 CC(C)(C)OC(=O)CCCCCCNCCCCO 2230a_100000750430_100010989376 [1,1,0,0,0,0|2,0,0]=4 2330 B18R0.188 CC(C)(C)OC(=O)CCCCCCNCCCCO 34a_100000750430_100010989376 [1,1,0,0,0,0|2,0,0]=4 2331 B18R0.188 CC(C)(C)OC(=O)CCCCCCOCCCCBr 34a_100011216708_100010989376 [1,1,0,0,0,0|2,0,0]=4 2332 B18R0.188 CC(C)(C)OC(=O)CCCCCCOCCCCCl 34a_100000210776_100010989376 [1,1,0,0,0,0|2,0,0]=4 2333 B18R0.188 CC(C)(C)OC(=O)CCCCCCOCCCCCl 7a_100000210776_100010989376 [1,1,0,0,0,0|2,0,0]=4 2334 B18R0.188 CC(C)(C)OC(=O)CCCCCCOCCCCF 34a_100011995726_100010989376 [1,1,0,0,0,0|2,0,0]=4 2335 B18R0.188 CC(C)(C)OC(=O)CCCCCCOCCCCF 34a_100048648013_100000729493 [1,1,0,0,0,0|2,0,0]=4 2336 B18R0.188 CC(C)(C)OC(=O)CCCCCCOCCCCF 7a_100011995726_100010989376 [1,1,0,0,0,0|2,0,0]=4 2337 B18R0.188 CC(C)(C)OC(=O)CCCCCCOCCCCF 7a_100048648013_100000729493 [1,1,0,0,0,0|2,0,0]=4 2338 B18R0.188 CC(C)(C)OC(=O)CCCCCCOCCCCI 34a_200012148704_100010989376 [1,1,0,0,0,0|2,0,0]=4 2339 B18R0.188 CC(C)(C)OC(=O)CCCCCCOCCCCN 34a_100000750430_100010989376 [1,1,0,0,0,0|2,0,0]=4 2340 B18R0.188 CC(C)(C)OC(=O)CCCCCCOCCCCO 34a_100048648013_100011216708 [1,1,0,0,0,0|2,0,0]=4 2341 B18R0.188 CC(C)(C)OC(=O)CCCCCCOCCCCO 7a_100048648013_100000210776 [1,1,0,0,0,0|2,0,0]=4 2342 B18R0.188 CC(C)(C)OC(=O)CCCCCCSCCCCF 62a_100000729493_100010989376 [1,1,0,0,0,0|2,0,0]=4 2343 B18R0.188 CC(C)(C)OC(=O)CCCCCCSCCCCF 62a_100010989376_100000729493 [1,1,0,0,0,0|2,0,0]=4 2344 B18R0.188 CC(C)(C)OC(=O)CCCCCCSCCCCO 62a_100000210776_100010989376 [1,1,0,0,0,0|2,0,0]=4 2345 B18R0.188 CC(C)(C)OC(=O)CCCCCCSCCCCO 62a_100010989376_100000210776 [1,1,0,0,0,0|2,0,0]=4 2346 B18R0.188 CC(C)(C)OC(=O)CCCCCNCCCCCO 2230a_100000762737_100010886488 [1,1,0,0,0,0|2,0,0]=4 2347 B18R0.188 CC(C)(C)OC(=O)CCCCCNCCCCCO 34a_100000762737_100010886488 [1,1,0,0,0,0|2,0,0]=4 2348 B18R0.188 CC(C)(C)OC(=O)CCCCCOCCCCCBr 34a_100000746331_100010886488 [1,1,0,0,0,0|2,0,0]=4 2349 B18R0.188 CC(C)(C)OC(=O)CCCCCOCCCCCBr 7a_100000746331_100010886488 [1,1,0,0,0,0|2,0,0]=4 2350 B18R0.188 CC(C)(C)OC(=O)CCCCCOCCCCCCl 34a_100000746330_100010886488 [1,1,0,0,0,0|2,0,0]=4 2351 B18R0.188 CC(C)(C)OC(=O)CCCCCOCCCCCCl 7a_100000746330_100010886488 [1,1,0,0,0,0|2,0,0]=4 2352 B18R0.188 CC(C)(C)OC(=O)CCCCCOCCCCCF 34a_100000097220_100000729378 [1,1,0,0,0,0|2,0,0]=4 2353 B18R0.188 CC(C)(C)OC(=O)CCCCCOCCCCCF 7a_100000097220_100000729378 [1,1,0,0,0,0|2,0,0]=4 2354 B18R0.188 CC(C)(C)OC(=O)CCCCCOCCCCCI 34a_200012148887_100010886488 [1,1,0,0,0,0|2,0,0]=4 2355 B18R0.188 CC(C)(C)OC(=O)CCCCCOCCCCCI 7a_200012148887_100010886488 [1,1,0,0,0,0|2,0,0]=4 2356 B18R0.188 CC(C)(C)OC(=O)CCCCCOCCCCCN 34a_100000762737_100010886488 [1,1,0,0,0,0|2,0,0]=4 2357 B18R0.188 CC(C)(C)OC(=O)CCCCCOCCCCCO 34a_100000097220_100000746330 [1,1,0,0,0,0|2,0,0]=4 2358 B18R0.188 CC(C)(C)OC(=O)CCCCCOCCCCCO 7a_100000097220_100000746330 [1,1,0,0,0,0|2,0,0]=4 2359 B18R0.188 CC(C)(C)OC(=O)CCCCCSCCCCCF 62a_100000729378_100010886488 [1,1,0,0,0,0|2,0,0]=4 2360 B18R0.188 CC(C)(C)OC(=O)CCCCCSCCCCCF 62a_100010886488_100000729378 [1,1,0,0,0,0|2,0,0]=4 2361 B18R0.188 CC(C)(C)OC(=O)CCCCCSCCCCCO 62a_100000746330_100010886488 [1,1,0,0,0,0|2,0,0]=4 2362 B18R0.188 CC(C)(C)OC(=O)CCCCCSCCCCCO 62a_100010886488_100000746330 [1,1,0,0,0,0|2,0,0]=4 2363 B18R0.188 CC(C)(C)OC(=O)CCCCNCCCCCCO 2230a_100000686447_100010889705 [1,1,0,0,0,0|2,0,0]=4 2364 B18R0.188 CC(C)(C)OC(=O)CCCCNCCCCCCO 34a_100000686447_100010889705 [1,1,0,0,0,0|2,0,0]=4 2365 B18R0.188 CC(C)(C)OC(=O)CCCCOCCCCCCBr 34a_100011215345_100010889705 [1,1,0,0,0,0|2,0,0]=4 2366 B18R0.188 CC(C)(C)OC(=O)CCCCOCCCCCCBr 7a_100011215345_100010889705 [1,1,0,0,0,0|2,0,0]=4 2367 B18R0.188 CC(C)(C)OC(=O)CCCCOCCCCCCCl 34a_100000766143_100010889705 [1,1,0,0,0,0|2,0,0]=4 2368 B18R0.188 CC(C)(C)OC(=O)CCCCOCCCCCCCl 7a_100000766143_100010889705 [1,1,0,0,0,0|2,0,0]=4 2369 B18R0.188 CC(C)(C)OC(=O)CCCCOCCCCCCF 34a_100000732779_100010889705 [1,1,0,0,0,0|2,0,0]=4 2370 B18R0.188 CC(C)(C)OC(=O)CCCCOCCCCCCF 7a_100000732779_100010889705 [1,1,0,0,0,0|2,0,0]=4 2371 B18R0.188 CC(C)(C)OC(=O)CCCCOCCCCCCN 34a_100000686447_100010889705 [1,1,0,0,0,0|2,0,0]=4 2372 B18R0.188 CC(C)(C)OC(=O)CCCCSCCCCCCF 62a_100010889705_100015922095 [1,1,0,0,0,0|2,0,0]=4 2373 B18R0.188 CC(C)(C)OC(=O)CCCCSCCCCCCF 62a_100015922095_100010889705 [1,1,0,0,0,0|2,0,0]=4 2374 B18R0.188 CC(C)(C)OC(=O)CCCCSCCCCCCO 62a_100000766143_100010889705 [1,1,0,0,0,0|2,0,0]=4 2375 B18R0.188 CC(C)(C)OC(=O)CCCCSCCCCCCO 62a_100010889705_100000766143 [1,1,0,0,0,0|2,0,0]=4 2376 B18R0.188 CC(C)(C)OC(=O)CCCNCCCCCCCO 2230a_100011996573_100000708543 [1,1,0,0,0,0|2,0,0]=4 2377 B18R0.188 CC(C)(C)OC(=O)CCCNCCCCCCCO 34a_100011996573_100000708543 [1,1,0,0,0,0|2,0,0]=4 2378 B18R0.188 CC(C)(C)OC(=O)CCCOCCCCCCCBr 34a_100000760002_100000708543 [1,1,0,0,0,0|2,0,0]=4 2379 B18R0.188 CC(C)(C)OC(=O)CCCOCCCCCCCBr 7a_100000760002_100000708543 [1,1,0,0,0,0|2,0,0]=4 2380 B18R0.188 CC(C)(C)OC(=O)CCCOCCCCCCCN 34a_100011996573_100000708543 [1,1,0,0,0,0|2,0,0]=4 2381 B18R0.188 CC(C)(C)OC(=O)CCCOCCCCCCCO 34a_100000067108_100000760002 [1,1,0,0,0,0|2,0,0]=4 2382 B18R0.188 CC(C)(C)OC(=O)CCCOCCCCCCCO 7a_100000067108_100000760002 [1,1,0,0,0,0|2,0,0]=4 2383 B18R0.188 CC(C)(C)OC(=O)CCCSCCCCCCCO 62a_100000708543_100000760002 [1,1,0,0,0,0|2,0,0]=4 2384 B18R0.188 CC(C)(C)OC(=O)CCCSCCCCCCCO 62a_100000760002_100000708543 [1,1,0,0,0,0|2,0,0]=4 2385 B18R0.188 CC(C)(C)OC(=O)CCNCCCCCCCCO 2230a_102515433106_100009816755 [1,1,0,0,0,0|2,0,0]=4 2386 B18R0.188 CC(C)(C)OC(=O)CCNCCCCCCCCO 34a_102515433106_100009816755 [1,1,0,0,0,0|2,0,0]=4 2387 B18R0.188 CC(C)(C)OC(=O)CCOCCCCCCCCBr 34a_100009813846_100009816755 [1,1,0,0,0,0|2,0,0]=4 2388 B18R0.188 CC(C)(C)OC(=O)CCOCCCCCCCCBr 7a_100009813846_100009816755 [1,1,0,0,0,0|2,0,0]=4 2389 B18R0.188 CC(C)(C)OC(=O)CCOCCCCCCCCCl 34a_100000033203_100009816755 [1,1,0,0,0,0|2,0,0]=4 2390 B18R0.188 CC(C)(C)OC(=O)CCOCCCCCCCCCl 7a_100000033203_100009816755 [1,1,0,0,0,0|2,0,0]=4 2391 B18R0.188 CC(C)(C)OC(=O)CCOCCCCCCCCN 34a_102515433106_100009816755 [1,1,0,0,0,0|2,0,0]=4 2392 B18R0.188 CC(C)(C)OC(=O)CCOCCCCCCCCO 34a_100011934494_100000033203 [1,1,0,0,0,0|2,0,0]=4 2393 B18R0.188 CC(C)(C)OC(=O)CCOCCCCCCCCO 7a_100011934494_100000033203 [1,1,0,0,0,0|2,0,0]=4 2394 B18R0.188 CC(C)(C)OC(=O)CCSCCCCCCCCO 62a_100000033203_100009816755 [1,1,0,0,0,0|2,0,0]=4 2395 B18R0.188 CC(C)(C)OC(=O)CCSCCCCCCCCO 62a_100009816755_100000033203 [1,1,0,0,0,0|2,0,0]=4 2396 B18R0.188 CC(C)(C)OC(=O)CNCCCCCCCCCO 2230a_100000078944_100000183872 [1,1,0,0,0,0|2,0,0]=4 2397 B18R0.188 CC(C)(C)OC(=O)CNCCCCCCCCCO 34a_100000078944_100000183872 [1,1,0,0,0,0|2,0,0]=4 2398 B18R0.188 CC(C)(C)OC(=O)COCCCCCCCCCBr 34a_100009813782_100000183872 [1,1,0,0,0,0|2,0,0]=4 2399 B18R0.188 CC(C)(C)OC(=O)COCCCCCCCCCBr 7a_100009813782_100000183872 [1,1,0,0,0,0|2,0,0]=4 2400 B18R0.188 CC(C)(C)OC(=O)COCCCCCCCCCCl 34a_100009868337_100000183872 [1,1,0,0,0,0|2,0,0]=4 2401 B18R0.188 CC(C)(C)OC(=O)COCCCCCCCCCCl 7a_100009868337_100000183872 [1,1,0,0,0,0|2,0,0]=4 2402 B18R0.188 CC(C)(C)OC(=O)COCCCCCCCCCN 34a_100000078944_100000183872 [1,1,0,0,0,0|2,0,0]=4 2403 B18R0.188 CC(C)(C)OC(=O)COCCCCCCCCCO 34a_100000752683_100009813782 [1,1,0,0,0,0|2,0,0]=4 2404 B18R0.188 CC(C)(C)OC(=O)CSCCCCCCCCCO 62a_100000183872_100009813782 [1,1,0,0,0,0|2,0,0]=4 2405 B18R0.188 CC(C)(C)OC(=O)CSCCCCCCCCCO 62a_100009813782_100000183872 [1,1,0,0,0,0|2,0,0]=4 2406 B18R0.188 CC(C)(C)OC(=O)NCCCCCCCCCO[13CH3] 34a_100010003631_200025704644 [1,1,0,0,0,0|2,0,0]=4 2407 B18R0.188 CC(C)(C)OC(=O)NCCCCCCCCCO[13CH3] 7a_100010003631_200025704644 [1,1,0,0,0,0|2,0,0]=4 2408 B18R0.188 CC(C)(O)CC(=O)CCCCCCCCCCCO 1458a_100000693243_100009812471 [1,1,0,0,0,0|2,0,0]=4 2409 B18R0.188 CCCCCCCCCCCCC(=O)C[N+](C)(C)C 1458a_100000033712_100000759014 [1,1,0,0,0,0|2,0,0]=4 2410 B18R0.188 CCCCCCCCCCCNC(=O)CC(C)(C)O 527a_200011215754_100000693243 [1,1,0,0,0,0|2,0,0]=4 2411 B18R0.188 CCCCCCCCCCCNC(=O)NC(C)(C)C 2708a_200011215754_100000715429 [1,1,0,0,0,0|2,0,0]=4 2412 B18R0.188 CCCCCCCCCCCNC(=O)NC(C)(C)C 273464a_100000715429_200011215754 [1,1,0,0,0,0|2,0,0]=4 2413 B18R0.188 CCCCCCCCCCCNC(=O)NC(C)(C)C 273464a_200011215754_100000715429 [1,1,0,0,0,0|2,0,0]=4 2414 B18R0.188 CCCCCCCCCCCNC(=O)NC(C)(C)C 512a_100000715429_200011215754 [1,1,0,0,0,0|2,0,0]=4 2415 B18R0.188 CCCCCCCCCCNCC(=O)NC(C)(C)C 2230a_100000174917_100000210320 [1,1,0,0,0,0|2,0,0]=4 2416 B18R0.188 CCCCCCCCCCNCC(=O)NC(C)(C)C 2230a_100000684558_100000182746 [1,1,0,0,0,0|2,0,0]=4 2417 B18R0.188 CCCCCCCCCCNCC(=O)NC(C)(C)C 34a_100000174917_100000210320 [1,1,0,0,0,0|2,0,0]=4 2418 B18R0.188 CCCCCCCCCCNCC(=O)NC(C)(C)C 34a_100000684558_100000182746 [1,1,0,0,0,0|2,0,0]=4 2419 B18R0.188 CCCCCCCCCCNCC(=O)OC(C)(C)C 2230a_100000684558_100000183872 [1,1,0,0,0,0|1,0,0]=3 2420 B18R0.188 CCCCCCCCCCNCC(=O)OC(C)(C)C 34a_100000684558_100000183872 [1,1,0,0,0,0|1,0,0]=3 2421 B18R0.188 CCCCCCCCCCNCC(=O)O[Si](C)(C)C 2230a_100000684558_200009813336 [1,1,0,0,0,0|1,1,0]=4 2422 B18R0.188 CCCCCCCCCCNCC(=O)O[Si](C)(C)C 34a_100000684558_200009813336 [1,1,0,0,0,0|1,1,0]=4 2423 B18R0.188 CCCCCCCCCCOCC(=O)NC(C)(C)C 34a_100000210711_100000182746 [1,1,0,0,0,0|2,0,0]=4 2424 B18R0.188 CCCCCCCCCCOCC(=O)NC(C)(C)C 7a_100000210711_100000182746 [1,1,0,0,0,0|2,0,0]=4 2425 B18R0.188 CCCCCCCCCCOCC(=O)OC(C)(C)C 34a_100000210711_100000183872 [1,1,0,0,0,0|1,0,0]=3 2426 B18R0.188 CCCCCCCCCCOCC(=O)OC(C)(C)C 34a_100000752683_100000210320 [1,1,0,0,0,0|1,0,0]=3 2427 B18R0.188 CCCCCCCCCCOCC(=O)OC(C)(C)C 7a_100000210711_100000183872 [1,1,0,0,0,0|1,0,0]=3 2428 B18R0.188 CCCCCCCCCCOCC(=O)O[Si](C)(C)C 34a_100000210711_200009813336 [1,1,0,0,0,0|1,1,0]=4 2429 B18R0.188 CCCCCCCCCCOCC(=O)O[Si](C)(C)C 7a_100000210711_200009813336 [1,1,0,0,0,0|1,1,0]=4 2430 B18R0.188 CCCCCCCCCCSCC(=O)NC(C)(C)C 62a_100000182746_100000210320 [1,1,0,0,0,0|2,0,0]=4 2431 B18R0.188 CCCCCCCCCNCCC(=O)NC(C)(C)C 2230a_100000212291_100011194433 [1,1,0,0,0,0|2,0,0]=4 2432 B18R0.188 CCCCCCCCCNCCC(=O)OC(C)(C)C 2230a_100000212291_100009816755 [1,1,0,0,0,0|1,0,0]=3 2433 B18R0.188 CCCCCCCCCNCCC(=O)OC(C)(C)C 34a_100000212291_100009816755 [1,1,0,0,0,0|1,0,0]=3 2434 B18R0.188 CCCCCCCCCOCCC(=O)NC(C)(C)C 7a_100000210712_100011194433 [1,1,0,0,0,0|2,0,0]=4 2435 B18R0.188 CCCCCCCCCOCCC(=O)OC(C)(C)C 34a_100000210712_100009816755 [1,1,0,0,0,0|1,0,0]=3 2436 B18R0.188 CCCCCCCCCOCCC(=O)OC(C)(C)C 34a_100011934494_100011214924 [1,1,0,0,0,0|1,0,0]=3 2437 B18R0.188 CCCCCCCCCOCCC(=O)OC(C)(C)C 7a_100000210712_100009816755 [1,1,0,0,0,0|1,0,0]=3 2438 B18R0.188 CCCCCCCCCOCCC(=O)OC(C)(C)C 7a_100011934494_100000210328 [1,1,0,0,0,0|1,0,0]=3 2439 B18R0.188 CCCCCCCCCSCCC(=O)NC(C)(C)C 62a_100011194433_100000210670 [1,1,0,0,0,0|2,0,0]=4 2440 B18R0.188 CCCCCCCCNCCCC(=O)NC(C)(C)C 2230a_100000229939_100011194434 [1,1,0,0,0,0|2,0,0]=4 2441 B18R0.188 CCCCCCCCNCCCC(=O)OC(C)(C)C 2230a_100000229939_100000708543 [1,1,0,0,0,0|1,0,0]=3 2442 B18R0.188 CCCCCCCCNCCCC(=O)OC(C)(C)C 34a_100000229939_100000708543 [1,1,0,0,0,0|1,0,0]=3 2443 B18R0.188 CCCCCCCCNCCNC(=O)OC(C)(C)C 2230a_100000229939_100000691259 [1,1,0,0,0,0|2,0,0]=4 2444 B18R0.188 CCCCCCCCOCCCC(=O)NC(C)(C)C 7a_100000210232_100011194434 [1,1,0,0,0,0|2,0,0]=4 2445 B18R0.188 CCCCCCCCOCCCC(=O)OC(C)(C)C 34a_100000067108_100000210759 [1,1,0,0,0,0|1,0,0]=3 2446 B18R0.188 CCCCCCCCOCCCC(=O)OC(C)(C)C 34a_100000210232_100000708543 [1,1,0,0,0,0|1,0,0]=3 2447 B18R0.188 CCCCCCCCOCCCC(=O)OC(C)(C)C 7a_100000067108_100000210759 [1,1,0,0,0,0|1,0,0]=3 2448 B18R0.188 CCCCCCCCOCCCC(=O)OC(C)(C)C 7a_100000210232_100000708543 [1,1,0,0,0,0|1,0,0]=3 2449 B18R0.188 CCCCCCCCOCCNC(=O)OC(C)(C)C 34a_100000743822_100000210759 [1,1,0,0,0,0|2,0,0]=4 2450 B18R0.188 CCCCCCCCOCCNC(=O)OC(C)(C)C 7a_100000210232_100000691259 [1,1,0,0,0,0|2,0,0]=4 2451 B18R0.188 CCCCCCCCOCCNC(=O)OC(C)(C)C 7a_100000743822_100000210759 [1,1,0,0,0,0|2,0,0]=4 2452 B18R0.188 CCCCCCCCSCCCC(=O)NC(C)(C)C 62a_100000210759_100011194434 [1,1,0,0,0,0|2,0,0]=4 2453 B18R0.188 CCCCCCCCSCCCC(=O)NC(C)(C)C 62a_100011194434_100000210317 [1,1,0,0,0,0|2,0,0]=4 2454 B18R0.188 CCCCCCCCSCCNC(=O)OC(C)(C)C 62a_100000210759_100000691259 [1,1,0,0,0,0|2,0,0]=4 2455 B18R0.188 CCCCCCCCSCCNC(=O)OC(C)(C)C 62a_100000691259_100000210317 [1,1,0,0,0,0|2,0,0]=4 2456 B18R0.188 CCCCCCCNCCCCC(=O)OC(C)(C)C 2230a_100000229938_100010889705 [1,1,0,0,0,0|1,0,0]=3 2457 B18R0.188 CCCCCCCNCCCNC(=O)OC(C)(C)C 2230a_100000229938_100000725178 [1,1,0,0,0,0|2,0,0]=4 2458 B18R0.188 CCCCCCCNCCOCC(=O)OC(C)(C)C 2230a_100000229938_100011092059 [1,1,0,0,0,0|2,0,0]=4 2459 B18R0.188 CCCCCCCOCCCCC(=O)OC(C)(C)C 34a_100000210272_100010889705 [1,1,0,0,0,0|1,0,0]=3 2460 B18R0.188 CCCCCCCOCCCCC(=O)OC(C)(C)C 7a_100000210272_100010889705 [1,1,0,0,0,0|1,0,0]=3 2461 B18R0.188 CCCCCCCOCCCNC(=O)OC(C)(C)C 34a_100000210272_100000725178 [1,1,0,0,0,0|2,0,0]=4 2462 B18R0.188 CCCCCCCOCCCNC(=O)OC(C)(C)C 34a_100000743756_100000210614 [1,1,0,0,0,0|2,0,0]=4 2463 B18R0.188 CCCCCCCOCCCNC(=O)OC(C)(C)C 7a_100000210272_100000725178 [1,1,0,0,0,0|2,0,0]=4 2464 B18R0.188 CCCCCCCOCCCNC(=O)OC(C)(C)C 7a_100000743756_100000210614 [1,1,0,0,0,0|2,0,0]=4 2465 B18R0.188 CCCCCCCOCCOCC(=O)OC(C)(C)C 34a_100000210272_100011092059 [1,1,0,0,0,0|2,0,0]=4 2466 B18R0.188 CCCCCCCOCCOCC(=O)OC(C)(C)C 34a_100010982675_100000210614 [1,1,0,0,0,0|2,0,0]=4 2467 B18R0.188 CCCCCCCOCCOCC(=O)OC(C)(C)C 7a_100000210272_100011092059 [1,1,0,0,0,0|2,0,0]=4 2468 B18R0.188 CCCCCCCOCCOCC(=O)OC(C)(C)C 7a_100010982675_100000210614 [1,1,0,0,0,0|2,0,0]=4 2469 B18R0.188 CCCCCCCSCCCNC(=O)OC(C)(C)C 62a_100000210614_100000725178 [1,1,0,0,0,0|2,0,0]=4 2470 B18R0.188 CCCCCCCSCCCNC(=O)OC(C)(C)C 62a_100000725178_100000210316 [1,1,0,0,0,0|2,0,0]=4 2471 B18R0.188 CCCCCCCSCCOCC(=O)OC(C)(C)C 62a_100000210614_100011092059 [1,1,0,0,0,0|2,0,0]=4 2472 B18R0.188 CCCCCCCSCCOCC(=O)OC(C)(C)C 62a_100011092059_100000210316 [1,1,0,0,0,0|2,0,0]=4 2473 B18R0.188 CCCCCCNCCCCCC(=O)OC(C)(C)C 2230a_100000210581_100010886488 [1,1,0,0,0,0|1,0,0]=3 2474 B18R0.188 CCCCCCNCCCCNC(=O)OC(C)(C)C 2230a_100000210581_100011218622 [1,1,0,0,0,0|2,0,0]=4 2475 B18R0.188 CCCCCCNCCOCCC(=O)OC(C)(C)C 2230a_100000210581_100161106493 [1,1,0,0,0,0|2,0,0]=4 2476 B18R0.188 CCCCCCOCCCCCC(=O)OC(C)(C)C 34a_100000097220_100000210314 [1,1,0,0,0,0|1,0,0]=3 2477 B18R0.188 CCCCCCOCCCCCC(=O)OC(C)(C)C 34a_100000210259_100010886488 [1,1,0,0,0,0|1,0,0]=3 2478 B18R0.188 CCCCCCOCCCCCC(=O)OC(C)(C)C 7a_100000097220_100000210314 [1,1,0,0,0,0|1,0,0]=3 2479 B18R0.188 CCCCCCOCCCCCC(=O)OC(C)(C)C 7a_100000210259_100010886488 [1,1,0,0,0,0|1,0,0]=3 2480 B18R0.188 CCCCCCOCCCCNC(=O)OC(C)(C)C 34a_100000210259_100011218622 [1,1,0,0,0,0|2,0,0]=4 2481 B18R0.188 CCCCCCOCCCCNC(=O)OC(C)(C)C 34a_100011218717_100000210314 [1,1,0,0,0,0|2,0,0]=4 2482 B18R0.188 CCCCCCOCCCCNC(=O)OC(C)(C)C 7a_100000210259_100011218622 [1,1,0,0,0,0|2,0,0]=4 2483 B18R0.188 CCCCCCOCCCCNC(=O)OC(C)(C)C 7a_100011218717_100000210314 [1,1,0,0,0,0|2,0,0]=4 2484 B18R0.188 CCCCCCOCCOCCC(=O)OC(C)(C)C 34a_100000210259_100010730554 [1,1,0,0,0,0|2,0,0]=4 2485 B18R0.188 CCCCCCOCCOCCC(=O)OC(C)(C)C 34a_100000691444_100009816755 [1,1,0,0,0,0|2,0,0]=4 2486 B18R0.188 CCCCCCOCCOCCC(=O)OC(C)(C)C 34a_100010341235_100000210314 [1,1,0,0,0,0|2,0,0]=4 2487 B18R0.188 CCCCCCOCCOCCC(=O)OC(C)(C)C 7a_100000210259_100010730554 [1,1,0,0,0,0|2,0,0]=4 2488 B18R0.188 CCCCCCOCCOCCC(=O)OC(C)(C)C 7a_100000691444_100009816755 [1,1,0,0,0,0|2,0,0]=4 2489 B18R0.188 CCCCCCOCCOCCC(=O)OC(C)(C)C 7a_100010341235_100000210314 [1,1,0,0,0,0|2,0,0]=4 2490 B18R0.188 CCCCCCSCCCCNC(=O)OC(C)(C)C 62a_100000210314_100011218622 [1,1,0,0,0,0|2,0,0]=4 2491 B18R0.188 CCCCCCSCCCCNC(=O)OC(C)(C)C 62a_100011218622_100000210757 [1,1,0,0,0,0|2,0,0]=4 2492 B18R0.188 CCCCCCSCCOCCC(=O)OC(C)(C)C 62a_100000210314_100161106493 [1,1,0,0,0,0|2,0,0]=4 2493 B18R0.188 CCCCCCSCCOCCC(=O)OC(C)(C)C 62a_100161106493_100000210757 [1,1,0,0,0,0|2,0,0]=4 2494 B18R0.188 CCCCCNCCCCCCC(=O)OC(C)(C)C 2230a_100000209983_100010989376 [1,1,0,0,0,0|1,0,0]=3 2495 B18R0.188 CCCCCNCCCCCNC(=O)OC(C)(C)C 2230a_100000209983_100012340521 [1,1,0,0,0,0|2,0,0]=4 2496 B18R0.188 CCCCCNCCOCCCC(=O)OC(C)(C)C 34a_100000224656_100000708543 [1,1,0,0,0,0|2,0,0]=4 2497 B18R0.188 CCCCCOCCCCCCC(=O)OC(C)(C)C 34a_100000210253_100010989376 [1,1,0,0,0,0|1,0,0]=3 2498 B18R0.188 CCCCCOCCCCCCC(=O)OC(C)(C)C 34a_100048648013_100000718602 [1,1,0,0,0,0|1,0,0]=3 2499 B18R0.188 CCCCCOCCCCCCC(=O)OC(C)(C)C 7a_100000210253_100010989376 [1,1,0,0,0,0|1,0,0]=3 2500 B18R0.188 CCCCCOCCCCCCC(=O)OC(C)(C)C 7a_100048648013_100000210326 [1,1,0,0,0,0|1,0,0]=3 2501 B18R0.188 CCCCCOCCCCCNC(=O)OC(C)(C)C 34a_100000210253_100012340521 [1,1,0,0,0,0|2,0,0]=4 2502 B18R0.188 CCCCCOCCCCCNC(=O)OC(C)(C)C 34a_100011218812_100000718602 [1,1,0,0,0,0|2,0,0]=4 2503 B18R0.188 CCCCCOCCCCCNC(=O)OC(C)(C)C 7a_100000210253_100012340521 [1,1,0,0,0,0|2,0,0]=4 2504 B18R0.188 CCCCCOCCCCCNC(=O)OC(C)(C)C 7a_100011218812_100000210326 [1,1,0,0,0,0|2,0,0]=4 2505 B18R0.188 CCCCCOCCCOCCC(=O)OC(C)(C)C 34a_100134710649_100000718602 [1,1,0,0,0,0|2,0,0]=4 2506 B18R0.188 CCCCCOCCCOCCC(=O)OC(C)(C)C 7a_100134710649_100000210326 [1,1,0,0,0,0|2,0,0]=4 2507 B18R0.188 CCCCCOCCOCCCC(=O)OC(C)(C)C 34a_100011215259_100000708543 [1,1,0,0,0,0|2,0,0]=4 2508 B18R0.188 CCCCCOCCOCCCC(=O)OC(C)(C)C 7a_100011215259_100000708543 [1,1,0,0,0,0|2,0,0]=4 2509 B18R0.188 CCCCCSCCCCCNC(=O)OC(C)(C)C 62a_100000210326_100012340521 [1,1,0,0,0,0|2,0,0]=4 2510 B18R0.188 CCCCCSCCCCCNC(=O)OC(C)(C)C 62a_100012340521_100000210326 [1,1,0,0,0,0|2,0,0]=4 2511 B18R0.188 CCCCNCCCCCCCC(=O)OC(C)(C)C 2230a_100000102301_100010978495 [1,1,0,0,0,0|1,0,0]=3 2512 B18R0.188 CCCCNCCCCCCCC(=O)OC(C)(C)C 7a_106832991798_100010978495 [1,1,0,0,0,0|1,0,0]=3 2513 B18R0.188 CCCCNCCCCCCNC(=O)OC(C)(C)C 2230a_100000102301_100000734191 [1,1,0,0,0,0|2,0,0]=4 2514 B18R0.188 CCCCNCCCCCCNC(=O)OC(C)(C)C 7a_106832991798_100000734191 [1,1,0,0,0,0|2,0,0]=4 2515 B18R0.188 CCCCNCCCCOCCC(=O)OC(C)(C)C 34a_200011216965_100009816755 [1,1,0,0,0,0|2,0,0]=4 2516 B18R0.188 CCCCOCCCCCCCC(=O)OC(C)(C)C 34a_100000210227_100010978495 [1,1,0,0,0,0|1,0,0]=3 2517 B18R0.188 CCCCOCCCCCCCC(=O)OC(C)(C)C 34a_100032214103_100000210210 [1,1,0,0,0,0|1,0,0]=3 2518 B18R0.188 CCCCOCCCCCCCC(=O)OC(C)(C)C 7a_100000210227_100010978495 [1,1,0,0,0,0|1,0,0]=3 2519 B18R0.188 CCCCOCCCCCCCC(=O)OC(C)(C)C 7a_100032214103_100000210211 [1,1,0,0,0,0|1,0,0]=3 2520 B18R0.188 CCCCOCCCCCCNC(=O)OC(C)(C)C 34a_100000210227_100000734191 [1,1,0,0,0,0|2,0,0]=4 2521 B18R0.188 CCCCOCCCCCCNC(=O)OC(C)(C)C 34a_100011215889_100000210210 [1,1,0,0,0,0|2,0,0]=4 2522 B18R0.188 CCCCOCCCCCCNC(=O)OC(C)(C)C 7a_100000210227_100000734191 [1,1,0,0,0,0|2,0,0]=4 2523 B18R0.188 CCCCOCCCCCCNC(=O)OC(C)(C)C 7a_100011215889_100000210211 [1,1,0,0,0,0|2,0,0]=4 2524 B18R0.188 CCCCOCCCCOCCC(=O)OC(C)(C)C 34a_200000760531_100009816755 [1,1,0,0,0,0|2,0,0]=4 2525 B18R0.188 CCCCOCCCCOCCC(=O)OC(C)(C)C 7a_200000760531_100009816755 [1,1,0,0,0,0|2,0,0]=4 2526 B18R0.188 CCCCOCCCNCCCC(=O)OC(C)(C)C 2230a_200000211371_100000708543 [1,1,0,0,0,0|2,0,0]=4 2527 B18R0.188 CCCCOCCCNCCCC(=O)OC(C)(C)C 34a_200000211371_100000708543 [1,1,0,0,0,0|2,0,0]=4 2528 B18R0.188 CCCCOCCCOCCCC(=O)OC(C)(C)C 34a_200011215613_100000708543 [1,1,0,0,0,0|2,0,0]=4 2529 B18R0.188 CCCCOCCCOCCCC(=O)OC(C)(C)C 7a_200011215613_100000708543 [1,1,0,0,0,0|2,0,0]=4 2530 B18R0.188 CCCCOCCOCCCCC(=O)OC(C)(C)C 34a_100000210238_100010889705 [1,1,0,0,0,0|2,0,0]=4 2531 B18R0.188 CCCCOCCOCCCCC(=O)OC(C)(C)C 7a_100000210238_100010889705 [1,1,0,0,0,0|2,0,0]=4 2532 B18R0.188 CCCCOCCSCCCCC(=O)OC(C)(C)C 62a_100000743108_100010889705 [1,1,0,0,0,0|2,0,0]=4 2533 B18R0.188 CCCCOCCSCCCCC(=O)OC(C)(C)C 62a_100010889705_100000743108 [1,1,0,0,0,0|2,0,0]=4 2534 B18R0.188 CCCCOCOCCCCCC(=O)OC(C)(C)C 34a_100000097220_100011995733 [1,1,0,0,0,0|2,0,0]=4 2535 B18R0.188 CCCCOCSCCCCCC(=O)OC(C)(C)C 62a_100010886488_100011995733 [1,1,0,0,0,0|2,0,0]=4 2536 B18R0.188 CCCCOCSCCCCCC(=O)OC(C)(C)C 62a_100011995733_100010886488 [1,1,0,0,0,0|2,0,0]=4 2537 B18R0.188 CCCCSCCCCCCNC(=O)OC(C)(C)C 62a_100000210211_100000734191 [1,1,0,0,0,0|2,0,0]=4 2538 B18R0.188 CCCCSCCCCCCNC(=O)OC(C)(C)C 62a_100000734191_100000210210 [1,1,0,0,0,0|2,0,0]=4 2539 B18R0.188 CCCCSCCNCCCCC(=O)OC(C)(C)C 2230a_100025743550_100010889705 [1,1,0,0,0,0|2,0,0]=4 2540 B18R0.188 CCCCSCCOCCCCC(=O)OC(C)(C)C 34a_200000230436_100010889705 [1,1,0,0,0,0|2,0,0]=4 2541 B18R0.188 CCCCSCCOCCCCC(=O)OC(C)(C)C 7a_200000230436_100010889705 [1,1,0,0,0,0|2,0,0]=4 2542 B18R0.188 CCCOCCCCCCCCC(=O)OC(C)(C)C 34a_100000210258_100134616357 [1,1,0,0,0,0|1,0,0]=3 2543 B18R0.188 CCCOCCCCCCCNC(=O)OC(C)(C)C 34a_100000210258_100000720311 [1,1,0,0,0,0|2,0,0]=4 2544 B18R0.188 CCCOCCCCCCCNC(=O)OC(C)(C)C 34a_100010409097_100000210303 [1,1,0,0,0,0|2,0,0]=4 2545 B18R0.188 CCCOCCCCCCCNC(=O)OC(C)(C)C 7a_100010409097_100000210303 [1,1,0,0,0,0|2,0,0]=4 2546 B18R0.188 CCCOCCCNCCCCC(=O)OC(C)(C)C 2230a_100011217757_100010889705 [1,1,0,0,0,0|2,0,0]=4 2547 B18R0.188 CCCOCCCNCCCCC(=O)OC(C)(C)C 34a_100011217757_100010889705 [1,1,0,0,0,0|2,0,0]=4 2548 B18R0.188 CCCOCCNCCCCCC(=O)OC(C)(C)C 2230a_100161115042_100010886488 [1,1,0,0,0,0|2,0,0]=4 2549 B18R0.188 CCCOCCNCCCCCC(=O)OC(C)(C)C 34a_100161115042_100010886488 [1,1,0,0,0,0|2,0,0]=4 2550 B18R0.188 CCCOCCOCCCCCC(=O)OC(C)(C)C 34a_100000097220_100011215938 [1,1,0,0,0,0|2,0,0]=4 2551 B18R0.188 CCCOCCOCCCCCC(=O)OC(C)(C)C 34a_100000752267_100010886488 [1,1,0,0,0,0|2,0,0]=4 2552 B18R0.188 CCCOCCOCCCCCC(=O)OC(C)(C)C 7a_100000097220_100011215938 [1,1,0,0,0,0|2,0,0]=4 2553 B18R0.188 CCCOCCOCCCCCC(=O)OC(C)(C)C 7a_100000752267_100010886488 [1,1,0,0,0,0|2,0,0]=4 2554 B18R0.188 CCCOCCSCCCCCC(=O)OC(C)(C)C 62a_100010886488_100011215938 [1,1,0,0,0,0|2,0,0]=4 2555 B18R0.188 CCCOCCSCCCCCC(=O)OC(C)(C)C 62a_100011215938_100010886488 [1,1,0,0,0,0|2,0,0]=4 2556 B18R0.188 CCCSCCCCCCCNC(=O)OC(C)(C)C 62a_100000210303_100000720311 [1,1,0,0,0,0|2,0,0]=4 2557 B18R0.188 CCCSCCCCCCCNC(=O)OC(C)(C)C 62a_100000720311_100000210303 [1,1,0,0,0,0|2,0,0]=4 2558 B18R0.188 CCCSCCNCCCCCC(=O)OC(C)(C)C 2230a_100020603323_100010886488 [1,1,0,0,0,0|2,0,0]=4 2559 B18R0.188 CCCSCCOCCCCCC(=O)OC(C)(C)C 34a_200000230433_100010886488 [1,1,0,0,0,0|2,0,0]=4 2560 B18R0.188 CCCSCCOCCCCCC(=O)OC(C)(C)C 7a_200000230433_100010886488 [1,1,0,0,0,0|2,0,0]=4 2561 B18R0.188 CCNCCCCCCCCCC(=O)OC(C)(C)C 2230a_100015525214_100134615940 [1,1,0,0,0,0|1,0,0]=3 2562 B18R0.188 CCNCCCCCCCCNC(=O)OC(C)(C)C 2230a_100015525214_100010416504 [1,1,0,0,0,0|2,0,0]=4 2563 B18R0.188 CCOCCCCCCCCCC(=O)OC(C)(C)C 34a_100121572206_100134615940 [1,1,0,0,0,0|1,0,0]=3 2564 B18R0.188 CCOCCCCCCCCNC(=O)OC(C)(C)C 34a_100000731605_100000210202 [1,1,0,0,0,0|2,0,0]=4 2565 B18R0.188 CCOCCCCCCCCNC(=O)OC(C)(C)C 34a_100121572206_100010416504 [1,1,0,0,0,0|2,0,0]=4 2566 B18R0.188 CCOCCCCCCCCNC(=O)OC(C)(C)C 7a_100000731605_100000210202 [1,1,0,0,0,0|2,0,0]=4 2567 B18R0.188 CCOCCCNCCCCCC(=O)OC(C)(C)C 2230a_100000210961_100010886488 [1,1,0,0,0,0|2,0,0]=4 2568 B18R0.188 CCOCCCNCCCCCC(=O)OC(C)(C)C 34a_100000210961_100010886488 [1,1,0,0,0,0|2,0,0]=4 2569 B18R0.188 CCOCCCOCCCCCC(=O)OC(C)(C)C 34a_100000097220_100012232248 [1,1,0,0,0,0|2,0,0]=4 2570 B18R0.188 CCOCCCOCCCCCC(=O)OC(C)(C)C 34a_100000757476_100010886488 [1,1,0,0,0,0|2,0,0]=4 2571 B18R0.188 CCOCCCOCCCCCC(=O)OC(C)(C)C 7a_100000097220_100012232248 [1,1,0,0,0,0|2,0,0]=4 2572 B18R0.188 CCOCCCOCCCCCC(=O)OC(C)(C)C 7a_100000757476_100010886488 [1,1,0,0,0,0|2,0,0]=4 2573 B18R0.188 CCOCCCSCCCCCC(=O)OC(C)(C)C 62a_100010886488_100012232248 [1,1,0,0,0,0|2,0,0]=4 2574 B18R0.188 CCOCCCSCCCCCC(=O)OC(C)(C)C 62a_100012232248_100010886488 [1,1,0,0,0,0|2,0,0]=4 2575 B18R0.188 CCOCCNCCCCCCC(=O)OC(C)(C)C 2230a_102516460346_100010989376 [1,1,0,0,0,0|2,0,0]=4 2576 B18R0.188 CCOCCNCCCCCCC(=O)OC(C)(C)C 34a_102516460346_100010989376 [1,1,0,0,0,0|2,0,0]=4 2577 B18R0.188 CCOCCOCCCCCCC(=O)OC(C)(C)C 34a_100000210136_100010989376 [1,1,0,0,0,0|2,0,0]=4 2578 B18R0.188 CCOCCOCCCCCCC(=O)OC(C)(C)C 34a_100048648013_100000210147 [1,1,0,0,0,0|2,0,0]=4 2579 B18R0.188 CCOCCOCCCCCCC(=O)OC(C)(C)C 7a_100000210136_100010989376 [1,1,0,0,0,0|2,0,0]=4 2580 B18R0.188 CCOCCOCCCCCCC(=O)OC(C)(C)C 7a_100048648013_100011215890 [1,1,0,0,0,0|2,0,0]=4 2581 B18R0.188 CCOCCSCCCCCCC(=O)OC(C)(C)C 62a_100000210147_100010989376 [1,1,0,0,0,0|2,0,0]=4 2582 B18R0.188 CCOCCSCCCCCCC(=O)OC(C)(C)C 62a_100010989376_100011215890 [1,1,0,0,0,0|2,0,0]=4 2583 B18R0.188 CCOCSCCCCCCCC(=O)OC(C)(C)C 62a_100000739092_100010978495 [1,1,0,0,0,0|2,0,0]=4 2584 B18R0.188 CCOCSCCCCCCCC(=O)OC(C)(C)C 62a_100010978495_100000739092 [1,1,0,0,0,0|2,0,0]=4 2585 B18R0.188 CCSCCCCCCCCNC(=O)OC(C)(C)C 62a_100000210202_100010416504 [1,1,0,0,0,0|2,0,0]=4 2586 B18R0.188 CCSCCCCCCCCNC(=O)OC(C)(C)C 62a_100010416504_100000210202 [1,1,0,0,0,0|2,0,0]=4 2587 B18R0.188 CCSCCCOCCCCCC(=O)OC(C)(C)C 34a_100011216438_100010886488 [1,1,0,0,0,0|2,0,0]=4 2588 B18R0.188 CCSCCCOCCCCCC(=O)OC(C)(C)C 7a_100011216438_100010886488 [1,1,0,0,0,0|2,0,0]=4 2589 B18R0.188 CCSCCNCCCCCCC(=O)OC(C)(C)C 2230a_100000106463_100010989376 [1,1,0,0,0,0|2,0,0]=4 2590 B18R0.188 CCSCCOCCCCCCC(=O)OC(C)(C)C 34a_100000212035_100010989376 [1,1,0,0,0,0|2,0,0]=4 2591 B18R0.188 CCSCCOCCCCCCC(=O)OC(C)(C)C 34a_100048648013_100000757381 [1,1,0,0,0,0|2,0,0]=4 2592 B18R0.188 CCSCCOCCCCCCC(=O)OC(C)(C)C 7a_100000212035_100010989376 [1,1,0,0,0,0|2,0,0]=4 2593 B18R0.188 CCSCCOCCCCCCC(=O)OC(C)(C)C 7a_100048648013_100000757381 [1,1,0,0,0,0|2,0,0]=4 2594 B18R0.188 CCSCCSCCCCCCC(=O)OC(C)(C)C 62a_100000757381_100010989376 [1,1,0,0,0,0|2,0,0]=4 2595 B18R0.188 CCSCCSCCCCCCC(=O)OC(C)(C)C 62a_100010989376_100000757381 [1,1,0,0,0,0|2,0,0]=4 2596 B18R0.188 CNCCCCCCCCCCC(=O)OC(C)(C)C 2230a_106832991635_100134614586 [1,1,0,0,0,0|1,0,0]=3 2597 B18R0.188 CNCCCCCCCCCCC(=O)OC(C)(C)C 34a_100102657272_100134614586 [1,1,0,0,0,0|1,0,0]=3 2598 B18R0.188 CNCCCCCCCCCCC(=O)OC(C)(C)C 7a_106832991635_100134614586 [1,1,0,0,0,0|1,0,0]=3 2599 B18R0.188 CNCCCCCOCCCCC(=O)OC(C)(C)C 34a_100000722520_100010889705 [1,1,0,0,0,0|2,0,0]=4 2600 B18R0.188 CNCCCOCCCCCCC(=O)OC(C)(C)C 34a_100000213112_100010989376 [1,1,0,0,0,0|2,0,0]=4 2601 B18R0.188 COCCCCCCCCCCC(=O)OC(C)(C)C 34a_100138415774_100134614586 [1,1,0,0,0,0|1,0,0]=3 2602 B18R0.188 COCCCCCCCCCNC(=O)OC(C)(C)C 34a_100010003631_200000210301 [1,1,0,0,0,0|2,0,0]=4 2603 B18R0.188 COCCCCCCCCCNC(=O)OC(C)(C)C 7a_100010003631_200000210301 [1,1,0,0,0,0|2,0,0]=4 2604 B18R0.188 COCCCCCCOCCCC(=O)OC(C)(C)C 34a_100000067108_100011998445 [1,1,0,0,0,0|2,0,0]=4 2605 B18R0.188 COCCCCCCOCCCC(=O)OC(C)(C)C 34a_200012092642_100000708543 [1,1,0,0,0,0|2,0,0]=4 2606 B18R0.188 COCCCCCCOCCCC(=O)OC(C)(C)C 7a_100000067108_100011998445 [1,1,0,0,0,0|2,0,0]=4 2607 B18R0.188 COCCCCCCOCCCC(=O)OC(C)(C)C 7a_200012092642_100000708543 [1,1,0,0,0,0|2,0,0]=4 2608 B18R0.188 COCCCCCCSCCCC(=O)OC(C)(C)C 62a_100000708543_100011998445 [1,1,0,0,0,0|2,0,0]=4 2609 B18R0.188 COCCCCCCSCCCC(=O)OC(C)(C)C 62a_100011998445_100000708543 [1,1,0,0,0,0|2,0,0]=4 2610 B18R0.188 COCCCCCNCCCCC(=O)OC(C)(C)C 2230a_100000747528_100010889705 [1,1,0,0,0,0|2,0,0]=4 2611 B18R0.188 COCCCCCNCCCCC(=O)OC(C)(C)C 34a_100000747528_100010889705 [1,1,0,0,0,0|2,0,0]=4 2612 B18R0.188 COCCCCOCCCCCC(=O)OC(C)(C)C 34a_100000097220_100000755781 [1,1,0,0,0,0|2,0,0]=4 2613 B18R0.188 COCCCCOCCCCCC(=O)OC(C)(C)C 34a_100000740925_100010886488 [1,1,0,0,0,0|2,0,0]=4 2614 B18R0.188 COCCCCOCCCCCC(=O)OC(C)(C)C 7a_100000097220_100000730899 [1,1,0,0,0,0|2,0,0]=4 2615 B18R0.188 COCCCCSCCCCCC(=O)OC(C)(C)C 62a_100000730899_100010886488 [1,1,0,0,0,0|2,0,0]=4 2616 B18R0.188 COCCCCSCCCCCC(=O)OC(C)(C)C 62a_100010886488_100000730899 [1,1,0,0,0,0|2,0,0]=4 2617 B18R0.188 COCCCNCCCCCCC(=O)OC(C)(C)C 34a_100150723488_100010989376 [1,1,0,0,0,0|2,0,0]=4 2618 B18R0.188 COCCCOCCCCCCC(=O)OC(C)(C)C 34a_100000740835_100010989376 [1,1,0,0,0,0|2,0,0]=4 2619 B18R0.188 COCCCOCCCCCCC(=O)OC(C)(C)C 34a_100048648013_100000740836 [1,1,0,0,0,0|2,0,0]=4 2620 B18R0.188 COCCCOCCCCCCC(=O)OC(C)(C)C 7a_100048648013_100000740836 [1,1,0,0,0,0|2,0,0]=4 2621 B18R0.188 COCCCSCCCCCCC(=O)OC(C)(C)C 62a_100000709357_100010989376 [1,1,0,0,0,0|2,0,0]=4 2622 B18R0.188 COCCCSCCCCCCC(=O)OC(C)(C)C 62a_100010989376_100000709357 [1,1,0,0,0,0|2,0,0]=4 2623 B18R0.188 COCCNCCCCCCCC(=O)OC(C)(C)C 2230a_100000209980_100010978495 [1,1,0,0,0,0|2,0,0]=4 2624 B18R0.188 COCCOCCCCCCCC(=O)OC(C)(C)C 34a_100000210237_100010978495 [1,1,0,0,0,0|2,0,0]=4 2625 B18R0.188 COCCOCCCCCCCC(=O)OC(C)(C)C 34a_100032214103_100011201679 [1,1,0,0,0,0|2,0,0]=4 2626 B18R0.188 COCCOCCCCCCCC(=O)OC(C)(C)C 7a_100032214103_100000233755 [1,1,0,0,0,0|2,0,0]=4 2627 B18R0.188 COCCSCCCCCCCC(=O)OC(C)(C)C 62a_100000233755_100010978495 [1,1,0,0,0,0|2,0,0]=4 2628 B18R0.188 COCCSCCCCCCCC(=O)OC(C)(C)C 62a_100010978495_100000233755 [1,1,0,0,0,0|2,0,0]=4 2629 B18R0.188 COCSCCCCCCCCC(=O)OC(C)(C)C 62a_100000766300_100134616357 [1,1,0,0,0,0|2,0,0]=4 2630 B18R0.188 COCSCCCCCCCCC(=O)OC(C)(C)C 62a_100134616357_100000766300 [1,1,0,0,0,0|2,0,0]=4 2631 B18R0.188 CSCCCCOCCCCCC(=O)OC(C)(C)C 34a_100011217163_100010886488 [1,1,0,0,0,0|2,0,0]=4 2632 B18R0.188 CSCCCCOCCCCCC(=O)OC(C)(C)C 7a_100011217163_100010886488 [1,1,0,0,0,0|2,0,0]=4 2633 B18R0.188 CSCCCNCCCCCCC(=O)OC(C)(C)C 2230a_100000749238_100010989376 [1,1,0,0,0,0|2,0,0]=4 2634 B18R0.188 CSCCCOCCCCCCC(=O)OC(C)(C)C 34a_100000690336_100010989376 [1,1,0,0,0,0|2,0,0]=4 2635 B18R0.188 CSCCCOCCCCCCC(=O)OC(C)(C)C 7a_100000690336_100010989376 [1,1,0,0,0,0|2,0,0]=4 2636 B18R0.188 CSCCNCCCCCCCC(=O)OC(C)(C)C 2230a_100020590264_100010978495 [1,1,0,0,0,0|2,0,0]=4 2637 B18R0.188 CSCCOCCCCCCCC(=O)OC(C)(C)C 34a_100000230434_100010978495 [1,1,0,0,0,0|2,0,0]=4 2638 B18R0.188 CSCCOCCCCCCCC(=O)OC(C)(C)C 34a_100032214103_100000212216 [1,1,0,0,0,0|2,0,0]=4 2639 B18R0.188 CSCCOCCCCCCCC(=O)OC(C)(C)C 7a_100000230434_100010978495 [1,1,0,0,0,0|2,0,0]=4 2640 B18R0.188 CSCCOCCCCCCCC(=O)OC(C)(C)C 7a_100032214103_100000212216 [1,1,0,0,0,0|2,0,0]=4 2641 B18R0.188 CSCCSCCCCCCCC(=O)OC(C)(C)C 62a_100000212216_100010978495 [1,1,0,0,0,0|2,0,0]=4 2642 B18R0.188 CSCCSCCCCCCCC(=O)OC(C)(C)C 62a_100010978495_100000751147 [1,1,0,0,0,0|2,0,0]=4 2643 B18R0.218 CC(C)OC(=O)CC(=O)CCCCCCCCCF 1458a_200009909015_100011215430 [1,1,0,0,0,0|1,0,1]=4 2644 B18R0.218 CCCCCCCCCCC(=O)CC(=O)NC(C)C 1458a_100000210375_100000183996 [1,1,0,0,0,0|1,0,1]=4 2645 B18R0.218 CCCCCCCCCCC(=O)CC(=O)OC(C)C 1458a_100000210375_100011215430 [1,1,0,0,0,0|0,0,1]=3 2646 B18R0.218 CCCCCCCCCCN(C)CC(=O)NC(C)C 2230a_100000168146_100000210320 [1,1,0,0,0,0|2,0,0]=4 2647 B18R0.218 CCCCCCCCCCN(C)CC(=O)NC(C)C 2230a_100000207566_100000183996 [1,1,0,0,0,0|2,0,0]=4 2648 B18R0.218 CCCCCCCCCCN(C)CC(=O)NC(C)C 269982a_100000168146_100000210320 [1,1,0,0,0,0|2,0,0]=4 2649 B18R0.218 CCCCCCCCCCN(C)CC(=O)NC(C)C 269982a_100000207566_100000183996 [1,1,0,0,0,0|2,0,0]=4 2650 B18R0.218 CCCCCCCCCCN(C)CC(=O)OC(C)C 2230a_100000207566_100011215430 [1,1,0,0,0,0|1,0,0]=3 2651 B18R0.218 CCCCCCCCCCN(C)CC(=O)OC(C)C 269982a_100000207566_100011215430 [1,1,0,0,0,0|1,0,0]=3 2652 B18R0.218 CCCCCCCCCOC(C)OC(=O)OC(C)C 7a_100000210712_100000067433 [1,1,0,0,0,0|2,0,0]=4 2653 B18R0.218 CCCCCCCCOCC(=O)CC(=O)OC(C)C 1458a_100000759886_100011215430 [1,1,0,0,0,0|1,0,1]=4 2654 B18R0.3148 CC(=O)CCCCSCCCCCC(=O)OC(C)C 62a_100000735457_200010986244 [1,1,0,0,0,0|1,0,1]=4 2655 B18R0.3148 CC(=O)CCCCSCCCCCC(=O)OC(C)C 62a_200010986244_100000735457 [1,1,0,0,0,0|1,0,1]=4 2656 B18R0.3148 CC(C)CCCCCCCOCCC(=O)NC(C)C 7a_200000210741_100000737564 [1,1,0,0,0,0|2,0,0]=4 2657 B18R0.3148 CC(C)CCCCCCCOCCC(=O)OC(C)C 7a_200000210741_100000760027 [1,1,0,0,0,0|1,0,0]=3 2658 B18R0.3148 CC(C)CCCCOCCCCCC(=O)OC(C)C 34a_100011214890_200010986244 [1,1,0,0,0,0|1,0,0]=3 2659 B18R0.3148 CC(C)CCCCOCCCCCC(=O)OC(C)C 7a_100011214890_200010986244 [1,1,0,0,0,0|1,0,0]=3 2660 B18R0.3148 CC(C)CNCCOCCCCCC(=O)OC(C)C 34a_100015185251_200010986244 [1,1,0,0,0,0|2,0,0]=4 2661 B18R0.3148 CC(C)COCCOCCCCCC(=O)OC(C)C 34a_100000703358_200010986244 [1,1,0,0,0,0|2,0,0]=4 2662 B18R0.3148 CC(C)COCCOCCCCCC(=O)OC(C)C 7a_100000703358_200010986244 [1,1,0,0,0,0|2,0,0]=4 2663 B18R0.3148 CC(C)CSCCOCCCCCC(=O)OC(C)C 34a_200000230437_200010986244 [1,1,0,0,0,0|2,0,0]=4 2664 B18R0.3148 CC(C)CSCCOCCCCCC(=O)OC(C)C 7a_200000230437_200010986244 [1,1,0,0,0,0|2,0,0]=4 2665 B18R0.3148 CC(C)NCCCOCCCCCC(=O)OC(C)C 34a_100000182298_200010986244 [1,1,0,0,0,0|2,0,0]=4 2666 B18R0.3148 CC(C)OC(=O)CCCCCSCCCCN(C)C 62a_200010986244_100000690147 [1,1,0,0,0,0|2,0,0]=4 2667 B18R0.3148 CC(C)OCCCNCCCCCC(=O)OC(C)C 2230a_100000737246_200010986244 [1,1,0,0,0,0|2,0,0]=4 2668 B18R0.3148 CC(C)OCCCNCCCCCC(=O)OC(C)C 34a_100000737246_200010986244 [1,1,0,0,0,0|2,0,0]=4 2669 B18R0.6543 CC(C)OC(=O)[C@@H](C)OCCCCCCCCCO 34a_100015307928_100009813782 [1,1,0,0,0,0|2,0,0]=4 2670 B18R0.6543 CC(C)OC(=O)[C@@H](C)OCCCCCCCCCO 7a_100015307928_100009813782 [1,1,0,0,0,0|2,0,0]=4 2671 B18R0.6543 CC(C)OC(=O)[C@@H](N)COCCCCCCCCO 34a_100121572844_100000033203 [1,1,0,0,0,0|2,0,0]=4 2672 B18R0.6543 CCCCCCCCCCCC(=O)C(=O)NC(C)C 1458a_100011220036_100011215454 [1,1,0,0,0,0|1,0,1]=4 2673 B18R0.6543 CCCCCCCCCCNC(C)C(=O)NC(C)C 2230a_100000684558_100000195394 [1,1,0,0,0,0|2,0,0]=4 2674 B18R0.6543 CCCCCCCCCCNC(C)C(=O)NC(C)C 2230a_100015205314_100000210320 [1,1,0,0,0,0|2,0,0]=4 2675 B18R0.6543 CCCCCCCCCCNC(C)C(=O)NC(C)C 34a_100000684558_100000195394 [1,1,0,0,0,0|2,0,0]=4 2676 B18R0.6543 CCCCCCCCCCNC(C)C(=O)NC(C)C 34a_100015205314_100000210320 [1,1,0,0,0,0|2,0,0]=4 2677 B18R0.6543 CCCCCCCCCCOC(C)C(=O)NC(C)C 34a_100000210711_100000195394 [1,1,0,0,0,0|2,0,0]=4 2678 B18R0.6543 CCCCCCCCCCOC(C)C(=O)NC(C)C 7a_100000210711_100000195394 [1,1,0,0,0,0|2,0,0]=4 2679 B18R0.6543 CCCCCCCCCCO[C@H](C)C(=O)OC(C)C 34a_100015307928_100000210320 [1,1,0,0,0,0|1,0,0]=3 2680 B18R0.6543 CCCCCCCCCCO[C@H](C)C(=O)OC(C)C 7a_100015307928_100000210320 [1,1,0,0,0,0|1,0,0]=3 2681 B18R0.6543 CCCCCCCCCCSC(C)C(=O)NC(C)C 62a_100000195394_100000210320 [1,1,0,0,0,0|2,0,0]=4 2682 B18R0.6543 CCCCCCCCCOC[C@H](N)C(=O)OC(C)C 34a_100121572844_100011214924 [1,1,0,0,0,0|1,0,0]=3 2683 B18R0.11622 CCCCCCCCCC(=O)CCC(=O)NC(C)C 1458a_100000210558_100000737564 [1,1,0,0,0,0|1,0,1]=4 2684 B18R0.11622 CCCCCCCCCC(=O)CCC(=O)OC(C)C 1458a_100000210558_100000760027 [1,1,0,0,0,0|0,0,1]=3 2685 B18R0.11622 CCCCCCCCCC(=O)COC(=O)OC(C)C 1458a_100000210558_100000003507 [1,1,0,0,0,0|1,0,1]=4 2686 B18R0.11622 CCCCCCCCCC(C)NCC(=O)NC(C)C 270004a_100000168517_100011215753 [1,1,0,0,0,0|2,0,0]=4 2687 B18R0.11622 CCCCCCCCCC(C)OCC(=O)NC(C)C 34a_100011218016_100000183996 [1,1,0,0,0,0|2,0,0]=4 2688 B18R0.11622 CCCCCCCCCC(C)OCC(=O)NC(C)C 7a_100011218016_100000183996 [1,1,0,0,0,0|2,0,0]=4 2689 B18R0.11622 CCCCCCCCCC(C)OCC(=O)OC(C)C 34a_100011218016_100011215430 [1,1,0,0,0,0|1,0,0]=3 2690 B18R0.11622 CCCCCCCCCC(C)OCC(=O)OC(C)C 7a_100011218016_100011215430 [1,1,0,0,0,0|1,0,0]=3 2691 B18R0.11622 CCCCCCCCCN(C)CCC(=O)NC(C)C 2230a_100000232482_100000737564 [1,1,0,0,0,0|2,0,0]=4 2692 B18R0.11622 CCCCCCCCCN(C)CCC(=O)NC(C)C 269982a_100000232482_100000737564 [1,1,0,0,0,0|2,0,0]=4 2693 B18R0.11622 CCCCCCCCCN(C)CCC(=O)OC(C)C 2230a_100000232482_100000760027 [1,1,0,0,0,0|1,0,0]=3 2694 B18R0.11622 CCCCCCCCCN(C)CCC(=O)OC(C)C 269982a_100000232482_100000760027 [1,1,0,0,0,0|1,0,0]=3 2695 B18R0.11622 CCCCCCCCCN(C)COC(=O)OC(C)C 269982a_100000232482_100010125566 [1,1,0,0,0,0|2,0,0]=4 2696 B18R0.13761 CCCCCCCCCCCCS(=O)(=O)NC(C)C 270084a_100138425928_100011216125 [1,1,0,0,0,0|2,0,0]=4 2697 B18R0.13761 CCCCCCCCCCCCS(=O)(=O)NC(C)C 274078a_100138425928_100011216125 [1,1,0,0,0,0|2,0,0]=4 2698 B18R0.19787 CC(C)C(C)C(=O)CCCCCCCCCCCO 1458a_100000755409_100009812471 [1,1,0,0,0,0|2,0,0]=4 2699 B18R0.19787 CC(C)N(C)C(=O)CCCCCCCCCCCO 240690a_200000211004_100000037981 [1,1,0,0,0,0|2,0,0]=4 2700 B18R0.19787 CC(C)[C@@H](O)C(=O)CCCCCCCCCCCO 1458a_100000691806_100009812471 [1,1,0,0,0,0|2,0,0]=4 2701 B18R0.19787 CCCCCCCCCCCCC(=O)C(=O)N(C)C 1458a_100011218876_100000759014 [1,1,0,0,0,0|2,0,0]=4 2702 B18R0.19787 CCCCCCCCCCCCC(=O)[C@H](C)N(C)C 1458a_100009822176_100000759014 [1,1,0,0,0,0|2,0,0]=4 2703 B18R0.19787 CCCCCCCCCCCCC(=O)[C@H](O)C(C)C 1458a_100000691806_100000759014 [1,1,0,0,0,0|1,0,0]=3 2704 B18R0.19787 CCCCCCCCCCCNC(=O)C(C)C(C)C 11a_200011215754_100000755409 [1,1,0,0,0,0|2,0,0]=4 2705 B18R0.19787 CCCCCCCCCCCNC(=O)C(C)C(C)C 1626a_200011215754_100000755409 [1,1,0,0,0,0|2,0,0]=4 2706 B18R0.19787 CCCCCCCCCCCNC(=O)C(C)C(C)C 240690a_200011215754_100000755409 [1,1,0,0,0,0|2,0,0]=4 2707 B18R0.19787 CCCCCCCCCCCNC(=O)C(C)C(C)C 527a_200011215754_100000755409 [1,1,0,0,0,0|2,0,0]=4 2708 B18R0.19787 CCCCCCCCCCCNC(=O)N(C)C(C)C 2708a_200011215754_200000211004 [1,1,0,0,0,0|2,0,0]=4 2709 B18R0.19787 CCCCCCCCCCCNC(=O)N(C)C(C)C 273464a_200011215754_200000211004 [1,1,0,0,0,0|2,0,0]=4 2710 B18R0.19787 CCCCCCCCCCCNC(=O)[C@H](O)C(C)C 240690a_200011215754_100000691806 [1,1,0,0,0,0|2,0,0]=4 2711 B18R0.19787 CCCCCCCCCCNCC(=O)N(C)C(C)C 2230a_100000684558_100000230190 [1,1,0,0,0,0|2,0,0]=4 2712 B18R0.19787 CCCCCCCCCCNCC(=O)N(C)C(C)C 34a_100000684558_100000230190 [1,1,0,0,0,0|2,0,0]=4 2713 B18R0.19787 CCCCCCCCCCOCC(=O)N(C)C(C)C 34a_100000210711_100000230190 [1,1,0,0,0,0|2,0,0]=4 2714 B18R0.19787 CCCCCCCCCCOCC(=O)N(C)C(C)C 7a_100000210711_100000230190 [1,1,0,0,0,0|2,0,0]=4 2715 B18R0.19787 CCCCCCCCCCSCC(=O)N(C)C(C)C 62a_100000230190_100000210320 [1,1,0,0,0,0|2,0,0]=4 2716 B18R0.20055 CCCCCC(C)NCCCCCC(=O)OC(C)C 2230a_100000211957_200010986244 [1,1,0,0,0,0|1,0,0]=3 2717 B18R0.20055 CCCCCC(C)OCCCCCC(=O)OC(C)C 34a_100011215632_200010986244 [1,1,0,0,0,0|1,0,0]=3 2718 B18R0.20055 CCCCCC(C)OCCCCCC(=O)OC(C)C 7a_100011215632_200010986244 [1,1,0,0,0,0|1,0,0]=3 2719 B18R0.20055 COCCCC(C)OCCCCCC(=O)OC(C)C 34a_200011539412_200010986244 [1,1,0,0,0,0|2,0,0]=4 2720 B18R0.20055 COCCCC(C)OCCCCCC(=O)OC(C)C 7a_200011539412_200010986244 [1,1,0,0,0,0|2,0,0]=4 2721 B18R0.41 CCCCCCCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100000210614 [1,1,0,0,0,0|0,0,1]=3 2722 B18R0.41 CCCCCCCC(=O)CCCCCC(=O)OCC 1458a_100000211969_100000755133 [1,1,0,0,0,0|0,0,1]=3 2723 B18R0.41 CCCCCCCC(=O)CCCOCC(=O)OCC 1458a_100000211969_100009893628 [1,1,0,0,0,0|1,0,1]=4 2724 B18R0.41 CCCCCCCC(=O)NCCCCC(=O)OCC 188690a_100000718961_100000211969 [1,1,0,0,0,0|1,0,1]=4 2725 B18R0.41 CCCCCCCC(C)OCCCCC(=O)OCC 34a_200011215852_100000750268 [1,1,0,0,0,0|1,0,0]=3 2726 B18R0.41 CCCCCCCC(C)OCCCCC(=O)OCC 7a_200011215852_100000750268 [1,1,0,0,0,0|1,0,0]=3 2727 B18R0.41 CCCCCCCC(C)OCCOCC(=O)OCC 34a_200011215852_100000088970 [1,1,0,0,0,0|2,0,0]=4 2728 B18R0.41 CCCCCCCC(C)OCCOCC(=O)OCC 7a_200011215852_100000088970 [1,1,0,0,0,0|2,0,0]=4 2729 B18R0.41 CCCCCCCC(C)OCCSCC(=O)OCC 7a_200000230590_200011218727 [1,1,0,0,0,0|2,0,0]=4 2730 B18R0.41 CCCCCCCC(C)SCCOCC(=O)OCC 62a_100000088970_200011218727 [1,1,0,0,0,0|2,0,0]=4 2731 B18R0.41 CCCCCCCC(C)SCCOCC(=O)OCC 62a_200011218727_100000088970 [1,1,0,0,0,0|2,0,0]=4 2732 B18R0.41 CCCCCCCN(C)CCCCCC(=O)OCC 2230a_100000228206_100000755133 [1,1,0,0,0,0|1,0,0]=3 2733 B18R0.41 CCCCCCCN(C)CCCCCC(=O)OCC 269982a_100000228206_100000755133 [1,1,0,0,0,0|1,0,0]=3 2734 B18R0.41 CCCCCCCN(C)CCCOCC(=O)OCC 2230a_100000228206_100009893628 [1,1,0,0,0,0|2,0,0]=4 2735 B18R0.41 CCCCCCCN(C)CCCOCC(=O)OCC 269982a_100000228206_100009893628 [1,1,0,0,0,0|2,0,0]=4 2736 B18R0.41 CCCCCCNC(=O)CCCCCC(=O)OCC 11a_100000210581_100000037472 [1,1,0,0,0,0|1,0,1]=4 2737 B18R0.41 CCCCCCNC(=O)CCCCCC(=O)OCC 1626a_100000210581_100000037472 [1,1,0,0,0,0|1,0,1]=4 2738 B18R0.41 CCCCCCNC(=O)CCCCCC(=O)OCC 240690a_100000210581_100000037472 [1,1,0,0,0,0|1,0,1]=4 2739 B18R0.41 CCCCCCNC(=O)CCCCCC(=O)OCC 527a_100000210581_100000037472 [1,1,0,0,0,0|1,0,1]=4 2740 B18R0.41 CCCCOCCC(=O)CCCCCC(=O)OCC 1458a_100000037472_100000743108 [1,1,0,0,0,0|1,0,1]=4 2741 B18R0.41 CCOC(=O)CCCCCC(=O)CCCCCCF 1458a_100000037472_100015922095 [1,1,0,0,0,0|1,0,1]=4 2742 B18R0.41 CCOC(=O)CCCCCC(=O)CCCCCCO 1458a_100000037472_100000766143 [1,1,0,0,0,0|1,0,1]=4 2743 B18R0.41 CCOC(=O)CCCCCC(=O)CCCCCCO 1458a_100011996774_100000755133 [1,1,0,0,0,0|1,0,1]=4 2744 B18R0.41 CCOC(=O)CCCCCC(=O)CCCCCOC 1458a_100011935119_100000755133 [1,1,0,0,0,0|1,0,1]=4 2745 B18R0.45 CCCCCCCCCCCC(=O)CC(=O)NCC 1458a_100000210736_100000183381 [1,1,0,0,0,0|1,0,1]=4 2746 B18R0.45 CCCCCCCCCCCC(=O)CC(=O)OCC 1458a_100000210736_100000188475 [1,1,0,0,0,0|0,0,1]=3 2747 B18R0.45 CCCCCCCCCCCC(=O)CC(=O)OCC 1458a_100000243816_100011215454 [1,1,0,0,0,0|0,0,1]=3 2748 B18R0.45 CCCCCCCCCCCC(O)CC(=O)NCC 240690a_100015525214_100000082106 [1,1,0,0,0,0|1,0,0]=3 2749 B18R0.45 CCCCCCCCCCCC(O)CC(=O)NNC 22a_100016993582_100000082106 [1,1,0,0,0,0|2,0,0]=4 2750 B18R0.45 CCCCCCCCCCCN(C)CC(=O)NCC 2230a_100000741943_100011215454 [1,1,0,0,0,0|2,0,0]=4 2751 B18R0.45 CCCCCCCCCCCN(C)CC(=O)NCC 269982a_100000741943_100011215454 [1,1,0,0,0,0|2,0,0]=4 2752 B18R0.45 CCCCCCCCCCCN(C)CC(=O)OCC 2230a_100000220588_100011215454 [1,1,0,0,0,0|1,0,0]=3 2753 B18R0.45 CCCCCCCCCCNC(=O)CC(=O)OCC 240690a_100000684558_100000243816 [1,1,0,0,0,0|1,0,1]=4 2754 B18R0.45 CCCCCCCCCCNC(C)CC(=O)OCC 2230a_100000684558_100009817359 [1,1,0,0,0,0|1,0,0]=3 2755 B18R0.45 CCCCCCCCCCOC(C)CC(=O)OCC 7a_100000210711_100009817359 [1,1,0,0,0,0|1,0,0]=3 2756 B18R0.45 CCCCCCCCCCO[C@H](C)CC(=O)OCC 7a_100009816390_100000210320 [1,1,0,0,0,0|1,0,0]=3 2757 B18R0.45 CCCCCCCCCNC[C@@H](O)CC(=O)OCC 34a_100000212291_100000688340 [1,1,0,0,0,0|1,0,0]=3 2758 B18R0.45 CCCCCCCCCOC[C@@H](O)CC(=O)OCC 34a_100000210712_100000688340 [1,1,0,0,0,0|1,0,0]=3 2759 B18R0.45 CCCCCCCCCOC[C@@H](O)CC(=O)OCC 7a_100000210712_100000688340 [1,1,0,0,0,0|1,0,0]=3 2760 B18R0.45 CCCCCCCCCSCC(=O)CC(=O)OCC 62a_100000210311_100000210670 [1,1,0,0,0,0|1,0,1]=4 2761 B18R0.45 CCCCCCCCCSC[C@@H](O)CC(=O)OCC 62a_100000688340_100000210670 [1,1,0,0,0,0|1,0,0]=3 2762 B18R0.45 CCCCCCOCCOC[C@@H](O)CC(=O)OCC 34a_100000691444_100000688340 [1,1,0,0,0,0|2,0,0]=4 2763 B18R0.45 CCCCCCOCCOC[C@@H](O)CC(=O)OCC 7a_100000691444_100000688340 [1,1,0,0,0,0|2,0,0]=4 2764 B18R0.45 CCCCNCCCCOC[C@@H](O)CC(=O)OCC 34a_200011216965_100000688340 [1,1,0,0,0,0|2,0,0]=4 2765 B18R0.45 CCCCOCCCCOC[C@@H](O)CC(=O)OCC 34a_200000760531_100000688340 [1,1,0,0,0,0|2,0,0]=4 2766 B18R0.45 CCCCOCCCCOC[C@@H](O)CC(=O)OCC 7a_200000760531_100000688340 [1,1,0,0,0,0|2,0,0]=4 2767 B18R0.45 CCOC(=O)CC(=O)CCCCCCCCCCO 1458a_100000243816_100009813290 [1,1,0,0,0,0|1,0,1]=4 2768 B18R0.45 CCOC(=O)CC(C)NCCCCCCCCCO 2230a_100000078944_100009817359 [1,1,0,0,0,0|2,0,0]=4 2769 B18R0.45 CCOC(=O)CC(C)OCCCCCCCCCBr 7a_100009813782_100009817359 [1,1,0,0,0,0|2,0,0]=4 2770 B18R0.45 CCOC(=O)CC(C)OCCCCCCCCCCl 7a_100009868337_100009817359 [1,1,0,0,0,0|2,0,0]=4 2771 B18R0.45 CCOC(=O)CC(C)SCCCCCCCCCO 62a_100009813782_100009817359 [1,1,0,0,0,0|2,0,0]=4 2772 B18R0.45 CCOC(=O)CC(C)SCCCCCCCCCO 62a_100009817359_100009813782 [1,1,0,0,0,0|2,0,0]=4 2773 B18R0.45 CCOC(=O)CN(C)CCCCCCCCCCO 2230a_100000220588_100009813290 [1,1,0,0,0,0|2,0,0]=4 2774 B18R0.45 CCOC(=O)C[C@@H](C)OCCCCCCCCCO 7a_100009816390_100009813782 [1,1,0,0,0,0|2,0,0]=4 2775 B18R0.45 CCOC(=O)C[C@H](O)CNCCCCCCCCO 34a_102515433106_100000688340 [1,1,0,0,0,0|2,0,0]=4 2776 B18R0.45 CCOC(=O)C[C@H](O)COCCCCCCCCBr 34a_100009813846_100000688340 [1,1,0,0,0,0|2,0,0]=4 2777 B18R0.45 CCOC(=O)C[C@H](O)COCCCCCCCCBr 7a_100009813846_100000688340 [1,1,0,0,0,0|2,0,0]=4 2778 B18R0.45 CCOC(=O)C[C@H](O)COCCCCCCCCCl 34a_100000033203_100000688340 [1,1,0,0,0,0|2,0,0]=4 2779 B18R0.45 CCOC(=O)C[C@H](O)COCCCCCCCCCl 7a_100000033203_100000688340 [1,1,0,0,0,0|2,0,0]=4 2780 B18R0.45 CCOC(=O)C[C@H](O)COCCCCCCCCN 34a_102515433106_100000688340 [1,1,0,0,0,0|2,0,0]=4 2781 B18R0.45 CCOC(=O)C[C@H](O)CSCCCCCCCCO 62a_100000033203_100000688340 [1,1,0,0,0,0|2,0,0]=4 2782 B18R0.45 CCOC(=O)C[C@H](O)CSCCCCCCCCO 62a_100000688340_100000033203 [1,1,0,0,0,0|2,0,0]=4 2783 B18R0.73 CCCC(=O)CCCCCCCCCC(=O)OCC 1458a_100000211992_100009828014 [1,1,0,0,0,0|0,0,1]=3 2784 B18R0.73 CCCC(=O)CSCCCCCCCC(=O)OCC 62a_100000747444_100009991516 [1,1,0,0,0,0|1,0,1]=4 2785 B18R0.73 CCCC(C)CCCOCCCCCC(=O)OCC 34a_100011713154_100000755133 [1,1,0,0,0,0|1,0,0]=3 2786 B18R0.73 CCCC(C)CCCOCCCCCC(=O)OCC 7a_100011713154_100000755133 [1,1,0,0,0,0|1,0,0]=3 2787 B18R0.73 CCCC(C)CCCOCCCOCC(=O)OCC 34a_100011713154_100009893628 [1,1,0,0,0,0|2,0,0]=4 2788 B18R0.73 CCCC(C)CCCOCCCOCC(=O)OCC 7a_100011713154_100009893628 [1,1,0,0,0,0|2,0,0]=4 2789 B18R0.73 CCCC(C)CCOCCCCCCC(=O)OCC 34a_100011217855_100009814379 [1,1,0,0,0,0|1,0,0]=3 2790 B18R0.73 CCCC(C)CCOCCCCCCC(=O)OCC 7a_100011217855_100009814379 [1,1,0,0,0,0|1,0,0]=3 2791 B18R0.73 CCCC(C)COCCCCCCCC(=O)OCC 34a_100000688023_100009991516 [1,1,0,0,0,0|1,0,0]=3 2792 B18R0.73 CCCC(C)COCCCCCCCC(=O)OCC 7a_100000688023_100009991516 [1,1,0,0,0,0|1,0,0]=3 2793 B18R0.73 CCCC(C)NCCCCCCCCC(=O)OCC 2230a_100000741246_100010175975 [1,1,0,0,0,0|1,0,0]=3 2794 B18R0.73 CCCC(C)OCCCCCCCCC(=O)OCC 34a_100000764384_100010175975 [1,1,0,0,0,0|1,0,0]=3 2795 B18R0.73 CCCC(C)OCCCCCCCCC(=O)OCC 7a_100000764384_100010175975 [1,1,0,0,0,0|1,0,0]=3 2796 B18R0.73 CCCN(C)CCCCCCCCCC(=O)OCC 2230a_100000747261_100009828014 [1,1,0,0,0,0|1,0,0]=3 2797 B18R0.73 CCCN(C)CCCCCCCCCC(=O)OCC 269982a_100000747261_100009828014 [1,1,0,0,0,0|1,0,0]=3 2798 B18R0.73 CCC[C@H](N)CCOCCCCCCC(=O)OCC 34a_100015193777_100009814379 [1,1,0,0,0,0|1,0,0]=3 2799 B18R0.73 CCC[C@H](N)COCCCCCCCC(=O)OCC 34a_100000732646_100009991516 [1,1,0,0,0,0|1,0,0]=3 2800 B18R0.73 CCOC(=O)CCCCCCCCCC(=O)CCO 1458a_100011216618_100009828014 [1,1,0,0,0,0|1,0,1]=4 2801 B18R0.73 CCOC(=O)CCCCCCCCCC(=O)COC 1458a_100000210968_100009828014 [1,1,0,0,0,0|1,0,1]=4 2802 B18R0.73 CCOC(=O)CCCCCCCCCC(=O)CSC 1458a_100000184570_100009828014 [1,1,0,0,0,0|1,0,1]=4 2803 B18R0.73 CCOC(=O)CCCCCCCCCN(C)CCO 2230a_100000210263_100009828014 [1,1,0,0,0,0|2,0,0]=4 2804 B18R0.73 CCOC(=O)CCCCCCCCCN(C)CCO 269982a_100000210263_100009828014 [1,1,0,0,0,0|2,0,0]=4 2805 B18R0.73 CCOC(=O)CCCCCCCCN[C@H](C)CCO 2230a_100000706166_100010175975 [1,1,0,0,0,0|2,0,0]=4 2806 B18R0.73 CCOC(=O)CCCCCCCCN[C@H](C)CCO 34a_100000706166_100010175975 [1,1,0,0,0,0|2,0,0]=4 2807 B18R0.73 CCOC(=O)CCCCCCCCN[C@H](C)COC 2230a_100000764878_100010175975 [1,1,0,0,0,0|2,0,0]=4 2808 B18R0.73 CCOC(=O)CCCCCCCCOC(C)CCBr 34a_100012276601_100010175975 [1,1,0,0,0,0|2,0,0]=4 2809 B18R0.73 CCOC(=O)CCCCCCCCO[C@H](C)COC 34a_100011934205_100010175975 [1,1,0,0,0,0|2,0,0]=4 2810 B18R0.73 CCOC(=O)CCCCCCCCSC(C)CCO 62a_100009893172_100010175975 [1,1,0,0,0,0|2,0,0]=4 2811 B18R0.73 CCOC(=O)CCCCCCCCSC(C)COC 62a_100000765312_100010175975 [1,1,0,0,0,0|2,0,0]=4 2812 B18R0.73 CCOC(=O)CCCCCCCNCC(O)COC 2230a_100000756049_100009991516 [1,1,0,0,0,0|2,0,0]=4 2813 B18R0.73 CCOC(=O)CCCCCCCNCC(O)COC 34a_100000756049_100009991516 [1,1,0,0,0,0|2,0,0]=4 2814 B18R0.73 CCOC(=O)CCCCCCCOCC(C)CCN 34a_106354213184_100009991516 [1,1,0,0,0,0|2,0,0]=4 2815 B18R0.73 CCOC(=O)CCCCCCCOCC(N)COC 34a_100000724102_100009991516 [1,1,0,0,0,0|2,0,0]=4 2816 B18R0.73 CCOC(=O)CCCCCCCSCC(O)COC 62a_100011215053_100009991516 [1,1,0,0,0,0|2,0,0]=4 2817 B18R0.100 CCCCCCCCC(=O)CCCCC(=O)OCC 1458a_100000210188_100000750268 [1,1,0,0,0,0|0,0,1]=3 2818 B18R0.100 CCCCCCCCC(=O)CCCCC(=O)OCC 1458a_100011217402_100000210759 [1,1,0,0,0,0|0,0,1]=3 2819 B18R0.100 CCCCCCCCC(=O)CCOCC(=O)OCC 1458a_100000210188_100000088970 [1,1,0,0,0,0|1,0,1]=4 2820 B18R0.100 CCCCCCCCC(=O)NCCCC(=O)OCC 188690a_100000211256_100000210188 [1,1,0,0,0,0|1,0,1]=4 2821 B18R0.100 CCCCCCCCC(C)CNCCC(=O)NCC 270004a_100025743525_100011995885 [1,1,0,0,0,0|2,0,0]=4 2822 B18R0.100 CCCCCCCCC(C)COCCC(=O)NCC 7a_200012125181_100000737597 [1,1,0,0,0,0|2,0,0]=4 2823 B18R0.100 CCCCCCCCC(C)COCCC(=O)OCC 34a_200012125181_100000765890 [1,1,0,0,0,0|1,0,0]=3 2824 B18R0.100 CCCCCCCCC(C)COCCC(=O)OCC 7a_200012125181_100011206558 [1,1,0,0,0,0|1,0,0]=3 2825 B18R0.100 CCCCCCCCC(C)OCCCC(=O)OCC 34a_100000210740_100009991533 [1,1,0,0,0,0|1,0,0]=3 2826 B18R0.100 CCCCCCCCC(C)OCCCC(=O)OCC 7a_100000210740_100011215271 [1,1,0,0,0,0|1,0,0]=3 2827 B18R0.100 CCCCCCCCC(C)OCCNC(=O)OCC 7a_100000210740_200011445536 [1,1,0,0,0,0|2,0,0]=4 2828 B18R0.100 CCCCCCCCN(C)CCCCC(=O)OCC 2230a_100000207567_100000750268 [1,1,0,0,0,0|1,0,0]=3 2829 B18R0.100 CCCCCCCCN(C)CCCCC(=O)OCC 269982a_100000207567_100000750268 [1,1,0,0,0,0|1,0,0]=3 2830 B18R0.100 CCCCCCCCN(C)CCOCC(=O)OCC 2230a_100000207567_100000088970 [1,1,0,0,0,0|2,0,0]=4 2831 B18R0.100 CCCCCCCCN(C)CCOCC(=O)OCC 269982a_100000207567_100000088970 [1,1,0,0,0,0|2,0,0]=4 2832 B18R0.100 CCCCCCCNC(=O)CCCCC(=O)OCC 11a_100000229938_100011217402 [1,1,0,0,0,0|1,0,1]=4 2833 B18R0.100 CCCCCCCNC(=O)CCCCC(=O)OCC 1626a_100000229938_100011217402 [1,1,0,0,0,0|1,0,1]=4 2834 B18R0.100 CCCCCCCNC(=O)CCCCC(=O)OCC 240690a_100000229938_100011217402 [1,1,0,0,0,0|1,0,1]=4 2835 B18R0.100 CCCCCCCNC(=O)CCCCC(=O)OCC 527a_100000229938_100011217402 [1,1,0,0,0,0|1,0,1]=4 2836 B18R0.100 CCOC(=O)CCCCC(=O)CCCCCCCO 1458a_100011217402_100000760002 [1,1,0,0,0,0|1,0,1]=4 2837 B18R0.100 CCOC(=O)CCCCC(=O)CCCCCCCO 1458a_100011219782_100000750268 [1,1,0,0,0,0|1,0,1]=4 2838 B18R0.100 CCOC(=O)CCCCC(=O)CCCCCCOC 1458a_100011217402_100011998445 [1,1,0,0,0,0|1,0,1]=4 2839 B18R0.110 C#CCCCCCCCCCCOCC(=O)OCC 34a_100000054667_100000188475 [1,1,0,0,0,0|0,0,2]=4 2840 B18R0.110 C#CCCCCCCCCCCOCC(=O)OCC 7a_100000054667_100000188475 [1,1,0,0,0,0|0,0,2]=4 2841 B18R0.110 C#CCCCCCCCCCOCCC(=O)OCC 34a_100000034437_100000765890 [1,1,0,0,0,0|0,0,2]=4 2842 B18R0.110 C#CCCCCCCCCCOCCC(=O)OCC 7a_100000034437_100011206558 [1,1,0,0,0,0|0,0,2]=4 2843 B18R0.110 C#CCCCCCCCCOCCCC(=O)OCC 34a_100000065265_100009991533 [1,1,0,0,0,0|0,0,2]=4 2844 B18R0.110 C#CCCCCCCCCOCCCC(=O)OCC 7a_100000065265_100011215271 [1,1,0,0,0,0|0,0,2]=4 2845 B18R0.110 C#CCCCCCCCOCCCCC(=O)OCC 34a_100000054614_100000750268 [1,1,0,0,0,0|0,0,2]=4 2846 B18R0.110 C#CCCCCCCCOCCCCC(=O)OCC 7a_100000054614_100000750268 [1,1,0,0,0,0|0,0,2]=4 2847 B18R0.110 C#CCCCCCCCSCCCCC(=O)OCC 62a_100000750268_100153394163 [1,1,0,0,0,0|0,0,2]=4 2848 B18R0.110 C#CCCCCCCCSCCCCC(=O)OCC 62a_100153394163_100000750268 [1,1,0,0,0,0|0,0,2]=4 2849 B18R0.110 C#CCCCCCCOCCCCCC(=O)OCC 34a_100011217361_100000755133 [1,1,0,0,0,0|0,0,2]=4 2850 B18R0.110 C#CCCCCCCOCCCCCC(=O)OCC 7a_100011214988_100012276617 [1,1,0,0,0,0|0,0,2]=4 2851 B18R0.110 C#CCCCCCCOCCCCCC(=O)OCC 7a_100011217361_100000755133 [1,1,0,0,0,0|0,0,2]=4 2852 B18R0.110 C#CCCCCCCSCCCCCC(=O)OCC 62a_100000755133_100012276617 [1,1,0,0,0,0|0,0,2]=4 2853 B18R0.110 C#CCCCCCCSCCCCCC(=O)OCC 62a_100012276617_100000755133 [1,1,0,0,0,0|0,0,2]=4 2854 B18R0.110 C#CCCCCCOCCCCCCC(=O)OCC 34a_100000766912_100009814379 [1,1,0,0,0,0|0,0,2]=4 2855 B18R0.110 C#CCCCCCOCCCCCCC(=O)OCC 7a_100000766912_100009814379 [1,1,0,0,0,0|0,0,2]=4 2856 B18R0.110 C#CCCCCCSCCCCCCC(=O)OCC 62a_100012094781_100009814379 [1,1,0,0,0,0|0,0,2]=4 2857 B18R0.110 C#CCCCCNCCCCCCCC(=O)OCC 2230a_100000706060_100009991516 [1,1,0,0,0,0|0,0,2]=4 2858 B18R0.110 C#CCCCCNCCCCCCCC(=O)OCC 34a_100000706060_100009991516 [1,1,0,0,0,0|0,0,2]=4 2859 B18R0.110 C#CCCCCOCCCCCCCC(=O)OCC 34a_100000766709_100009991516 [1,1,0,0,0,0|0,0,2]=4 2860 B18R0.110 C#CCCCCOCCCCCCCC(=O)OCC 7a_100000766709_100009991516 [1,1,0,0,0,0|0,0,2]=4 2861 B18R0.110 C#CCCCCSCCCCCCCC(=O)OCC 62a_100010269958_100009991516 [1,1,0,0,0,0|0,0,2]=4 2862 B18R0.110 C#CCCCNCCCCCCCCC(=O)OCC 34a_100000718082_100010175975 [1,1,0,0,0,0|0,0,2]=4 2863 B18R0.110 C#CCCCOCCCCCCCCC(=O)OCC 34a_100000215630_100010175975 [1,1,0,0,0,0|0,0,2]=4 2864 B18R0.110 C#CCCCOCCCCCCCCC(=O)OCC 7a_100000215630_100010175975 [1,1,0,0,0,0|0,0,2]=4 2865 B18R0.110 C#CCCCSCCCCCCCCC(=O)OCC 62a_100011215417_100010175975 [1,1,0,0,0,0|0,0,2]=4 2866 B18R0.110 C#CCCNCCCCCCCCCC(=O)OCC 34a_100000755551_100009828014 [1,1,0,0,0,0|0,0,2]=4 2867 B18R0.110 C#CCCOCCCCCCCCCC(=O)OCC 34a_100011215631_100009828014 [1,1,0,0,0,0|0,0,2]=4 2868 B18R0.110 C#CCCSCCCCCCCCCC(=O)OCC 62a_100000688953_100009828014 [1,1,0,0,0,0|0,0,2]=4 2869 B18R0.110 C#CCNCCCCCCCCCCC(=O)OCC 34a_100000212058_100009827693 [1,1,0,0,0,0|0,0,2]=4 2870 B18R0.110 C#CCOCCCCCCCCCCC(=O)OCC 34a_100000210247_100009827693 [1,1,0,0,0,0|0,0,2]=4 2871 B18R0.110 C#CCSCCCCCCCCCCC(=O)OCC 62a_100000038162_100009827693 [1,1,0,0,0,0|0,0,2]=4 2872 B18R0.110 C/C=C/CCOCCCCCCCCC(=O)OCC 34a_100016278192_100010175975 [1,1,0,0,0,0|0,0,2]=4 2873 B18R0.110 C/C=C/COCCCCCCCCCC(=O)OCC 34a_100016270725_100009828014 [1,1,0,0,0,0|0,0,2]=4 2874 B18R0.110 C/C=C/CSCCCCCCCCCC(=O)OCC 62a_100102629194_100009828014 [1,1,0,0,0,0|0,0,2]=4 2875 B18R0.110 C=CCCCCCCCCCCSCC(=O)OCC 62a_100000188475_100011093070 [1,1,0,0,0,0|0,0,2]=4 2876 B18R0.110 C=CCCCCCCCCCCSCC(=O)OCC 62a_100011093070_100000188475 [1,1,0,0,0,0|0,0,2]=4 2877 B18R0.110 C=CCCCCCCCCCNCCC(=O)OCC 2230a_100000081888_100011206558 [1,1,0,0,0,0|0,0,2]=4 2878 B18R0.110 C=CCCCCCCCCCNCCC(=O)OCC 34a_100000081888_100000765890 [1,1,0,0,0,0|0,0,2]=4 2879 B18R0.110 C=CCCCCCCCCCOCCC(=O)OCC 34a_100000038209_100000765890 [1,1,0,0,0,0|0,0,2]=4 2880 B18R0.110 C=CCCCCCCCCCOCCC(=O)OCC 7a_100000038209_100011206558 [1,1,0,0,0,0|0,0,2]=4 2881 B18R0.110 C=CCCCCCCCCCSCCC(=O)OCC 62a_100000765890_100009814027 [1,1,0,0,0,0|0,0,2]=4 2882 B18R0.110 C=CCCCCCCCCCSCCC(=O)OCC 62a_100009814027_100000765890 [1,1,0,0,0,0|0,0,2]=4 2883 B18R0.110 C=CCCCCCCCCOCCCC(=O)OCC 34a_100011215194_100009991533 [1,1,0,0,0,0|0,0,2]=4 2884 B18R0.110 C=CCCCCCCCCOCCCC(=O)OCC 7a_100011215194_100011215271 [1,1,0,0,0,0|0,0,2]=4 2885 B18R0.110 C=CCCCCCCCCOCCCC(=O)OCC 7a_100012001163_100011933949 [1,1,0,0,0,0|0,0,2]=4 2886 B18R0.110 C=CCCCCCCCCSCCCC(=O)OCC 62a_100009991533_100011933949 [1,1,0,0,0,0|0,0,2]=4 2887 B18R0.110 C=CCCCCCCCCSCCCC(=O)OCC 62a_100011933949_100009991533 [1,1,0,0,0,0|0,0,2]=4 2888 B18R0.110 C=CCCCCCCCOCCCCC(=O)OCC 34a_100000730831_100000750268 [1,1,0,0,0,0|0,0,2]=4 2889 B18R0.110 C=CCCCCCCCOCCCCC(=O)OCC 7a_100000730831_100000750268 [1,1,0,0,0,0|0,0,2]=4 2890 B18R0.110 C=CCCCCCCCSCCCCC(=O)OCC 62a_100000750268_100012355270 [1,1,0,0,0,0|0,0,2]=4 2891 B18R0.110 C=CCCCCCCCSCCCCC(=O)OCC 62a_100012355270_100000750268 [1,1,0,0,0,0|0,0,2]=4 2892 B18R0.110 C=CCCCCCCOCCCCCC(=O)OCC 34a_200011216477_100000755133 [1,1,0,0,0,0|0,0,2]=4 2893 B18R0.110 C=CCCCCCCOCCCCCC(=O)OCC 7a_100011214988_100011215473 [1,1,0,0,0,0|0,0,2]=4 2894 B18R0.110 C=CCCCCCCOCCCCCC(=O)OCC 7a_200011216477_100000755133 [1,1,0,0,0,0|0,0,2]=4 2895 B18R0.110 C=CCCCCCCSCCCCCC(=O)OCC 62a_100000755133_100011215473 [1,1,0,0,0,0|0,0,2]=4 2896 B18R0.110 C=CCCCCCCSCCCCCC(=O)OCC 62a_100011215473_100000755133 [1,1,0,0,0,0|0,0,2]=4 2897 B18R0.110 C=CCCCCCOCCCCCCC(=O)OCC 34a_100011216702_100009814379 [1,1,0,0,0,0|0,0,2]=4 2898 B18R0.110 C=CCCCCCOCCCCCCC(=O)OCC 7a_100011216702_100009814379 [1,1,0,0,0,0|0,0,2]=4 2899 B18R0.110 C=CCCCCCSCCCCCCC(=O)OCC 62a_100000700193_100009814379 [1,1,0,0,0,0|0,0,2]=4 2900 B18R0.110 C=CCCCCNCCCCCCCC(=O)OCC 2230a_100000703577_100009991516 [1,1,0,0,0,0|0,0,2]=4 2901 B18R0.110 C=CCCCCNCCCCCCCC(=O)OCC 34a_100000703577_100009991516 [1,1,0,0,0,0|0,0,2]=4 2902 B18R0.110 C=CCCCCOCCCCCCCC(=O)OCC 34a_100000766645_100009991516 [1,1,0,0,0,0|0,0,2]=4 2903 B18R0.110 C=CCCCCOCCCCCCCC(=O)OCC 7a_100000766645_100009991516 [1,1,0,0,0,0|0,0,2]=4 2904 B18R0.110 C=CCCCCSCCCCCCCC(=O)OCC 62a_100011215482_100009991516 [1,1,0,0,0,0|0,0,2]=4 2905 B18R0.110 C=CCCCNCCCCCCCCC(=O)OCC 2230a_100000700776_100010175975 [1,1,0,0,0,0|0,0,2]=4 2906 B18R0.110 C=CCCCNCCCCCCCCC(=O)OCC 34a_100000700776_100010175975 [1,1,0,0,0,0|0,0,2]=4 2907 B18R0.110 C=CCCCOCCCCCCCCC(=O)OCC 34a_100000758997_100010175975 [1,1,0,0,0,0|0,0,2]=4 2908 B18R0.110 C=CCCCOCCCCCCCCC(=O)OCC 7a_100000758997_100010175975 [1,1,0,0,0,0|0,0,2]=4 2909 B18R0.110 C=CCCCSCCCCCCCCC(=O)OCC 62a_100011713584_100010175975 [1,1,0,0,0,0|0,0,2]=4 2910 B18R0.110 C=CCCNCCCCCCCCCC(=O)OCC 2230a_100015191253_100009828014 [1,1,0,0,0,0|0,0,2]=4 2911 B18R0.110 C=CCCOCCCCCCCCCC(=O)OCC 34a_100011205117_100009828014 [1,1,0,0,0,0|0,0,2]=4 2912 B18R0.110 C=CCCSCCCCCCCCCC(=O)OCC 62a_100000754431_100009828014 [1,1,0,0,0,0|0,0,2]=4 2913 B18R0.110 C=CCNCCCCCCCCCCC(=O)OCC 2230a_100020586998_100009827693 [1,1,0,0,0,0|0,0,2]=4 2914 B18R0.110 C=CCOCCCCCCCCCCC(=O)OCC 34a_200000210373_100009827693 [1,1,0,0,0,0|0,0,2]=4 2915 B18R0.110 C=CCSCCCCCCCCCCC(=O)OCC 62a_100000210623_100009827693 [1,1,0,0,0,0|0,0,2]=4 2916 B18R0.110 C=COC(=O)CNCCCCCCCCCCCC 2230a_100000210451_100000036128 [1,1,0,0,0,0|0,0,2]=4 2917 B18R0.110 C=COC(=O)CNCCCCCCCCCCCC 34a_100000210451_100000036128 [1,1,0,0,0,0|0,0,2]=4 2918 B18R0.110 C=COC(=O)COCCCCCCCCCCCC 34a_100000210810_100000036128 [1,1,0,0,0,0|0,0,2]=4 2919 B18R0.110 CC#CC(=O)CCCCCCCCCCCCCO 1458a_100000763181_100009812470 [1,1,0,0,0,0|1,0,1]=4 2920 B18R0.110 CC#CCCOCCCCCCCCC(=O)OCC 34a_100000750427_100010175975 [1,1,0,0,0,0|0,0,2]=4 2921 B18R0.110 CC#CCNCCCCCCCCCC(=O)OCC 2230a_100000685387_100009828014 [1,1,0,0,0,0|0,0,2]=4 2922 B18R0.110 CC#CCNCCCCCCCCCC(=O)OCC 34a_100000685387_100009828014 [1,1,0,0,0,0|0,0,2]=4 2923 B18R0.110 CC#CCOCCCCCCCCCC(=O)OCC 34a_100000761923_100009828014 [1,1,0,0,0,0|0,0,2]=4 2924 B18R0.110 CC#CCSCCCCCCCCCC(=O)OCC 62a_100000748600_100009828014 [1,1,0,0,0,0|0,0,2]=4 2925 B18R0.110 CC/C=C/CCCOCCCCCCC(=O)OCC 34a_100016287902_100009814379 [1,1,0,0,0,0|0,0,2]=4 2926 B18R0.110 CC/C=C/CCCOCCCCCCC(=O)OCC 7a_100016287902_100009814379 [1,1,0,0,0,0|0,0,2]=4 2927 B18R0.110 CC/C=C\CCCCCOCCCCC(=O)OCC 34a_100016268722_100000750268 [1,1,0,0,0,0|0,0,2]=4 2928 B18R0.110 CC/C=C\CCCCCOCCCCC(=O)OCC 7a_100016268722_100000750268 [1,1,0,0,0,0|0,0,2]=4 2929 B18R0.110 CC/C=C\CCCCOCCCCCC(=O)OCC 34a_100016287862_100000755133 [1,1,0,0,0,0|0,0,2]=4 2930 B18R0.110 CC/C=C\CCCCOCCCCCC(=O)OCC 7a_100016287862_100000755133 [1,1,0,0,0,0|0,0,2]=4 2931 B18R0.110 CC/C=C\CCOCCCCCCCC(=O)OCC 34a_100016288707_100009991516 [1,1,0,0,0,0|0,0,2]=4 2932 B18R0.110 CC/C=C\CCOCCCCCCCC(=O)OCC 7a_100016288707_100009991516 [1,1,0,0,0,0|0,0,2]=4 2933 B18R0.110 CC/C=C\CCSCCCCCCCC(=O)OCC 62a_100015370543_100009991516 [1,1,0,0,0,0|0,0,2]=4 2934 B18R0.110 CC/C=C\COCCCCCCCCC(=O)OCC 34a_100016268518_100010175975 [1,1,0,0,0,0|0,0,2]=4 2935 B18R0.110 CC/C=C\CSCCCCCCCCC(=O)OCC 62a_100103147603_100010175975 [1,1,0,0,0,0|0,0,2]=4 2936 B18R0.110 CC=CC(=O)CCCCCCCCCCCCCO 1458a_100000210699_100009812470 [1,1,0,0,0,0|1,0,1]=4 2937 B18R0.110 CC=CC(=O)NCCCCCCCCCCCCC 11a_100011215765_100000210699 [1,1,0,0,0,0|1,0,1]=4 2938 B18R0.110 CC=CC(=O)NCCCCCCCCCCCCC 1626a_100011215765_100000210699 [1,1,0,0,0,0|1,0,1]=4 2939 B18R0.110 CC=CC(=O)NCCCCCCCCCCCCC 240690a_100011215765_100000210699 [1,1,0,0,0,0|1,0,1]=4 2940 B18R0.110 CC=CCCCOCCCCCCCC(=O)OCC 34a_100020645299_100009991516 [1,1,0,0,0,0|0,0,2]=4 2941 B18R0.110 CC=CCSCCCCCCCCCC(=O)OCC 62a_100000070051_100009828014 [1,1,0,0,0,0|0,0,2]=4 2942 B18R0.110 CCC#CCCCCCCCCOCC(=O)OCC 34a_200000031908_100000188475 [1,1,0,0,0,0|0,0,2]=4 2943 B18R0.110 CCC#CCCCCCCCCOCC(=O)OCC 7a_200000031908_100000188475 [1,1,0,0,0,0|0,0,2]=4 2944 B18R0.110 CCC#CCCCCCCOCCCC(=O)OCC 7a_100012001163_200000036426 [1,1,0,0,0,0|0,0,2]=4 2945 B18R0.110 CCC#CCCCCCCSCCCC(=O)OCC 62a_100009991533_200000036426 [1,1,0,0,0,0|0,0,2]=4 2946 B18R0.110 CCC#CCCCCCCSCCCC(=O)OCC 62a_200000036426_100009991533 [1,1,0,0,0,0|0,0,2]=4 2947 B18R0.110 CCC#CCCOCCCCCCCC(=O)OCC 34a_100000036655_100009991516 [1,1,0,0,0,0|0,0,2]=4 2948 B18R0.110 CCC#CCCOCCCCCCCC(=O)OCC 7a_100000036655_100009991516 [1,1,0,0,0,0|0,0,2]=4 2949 B18R0.110 CCC#CCOCCCCCCCCC(=O)OCC 34a_100000032950_100010175975 [1,1,0,0,0,0|0,0,2]=4 2950 B18R0.110 CCC#CCSCCCCCCCCC(=O)OCC 62a_100009813939_100010175975 [1,1,0,0,0,0|0,0,2]=4 2951 B18R0.110 CCC/C=C/COCCCCCCCC(=O)OCC 34a_100016278788_100009991516 [1,1,0,0,0,0|0,0,2]=4 2952 B18R0.110 CCC/C=C/COCCCCCCCC(=O)OCC 7a_100016278788_100009991516 [1,1,0,0,0,0|0,0,2]=4 2953 B18R0.110 CCCC#CCCOCCCCCCC(=O)OCC 34a_100000042726_100009814379 [1,1,0,0,0,0|0,0,2]=4 2954 B18R0.110 CCCC#CCCOCCCCCCC(=O)OCC 7a_100000042726_100009814379 [1,1,0,0,0,0|0,0,2]=4 2955 B18R0.110 CCCC#CCOCCCCCCCC(=O)OCC 34a_100000034806_100009991516 [1,1,0,0,0,0|0,0,2]=4 2956 B18R0.110 CCCC#CCOCCCCCCCC(=O)OCC 7a_100000034806_100009991516 [1,1,0,0,0,0|0,0,2]=4 2957 B18R0.110 CCCC(=O)NCCCCCCCCCCCCO 240690a_100000066677_100000211992 [1,1,0,0,0,0|2,0,0]=4 2958 B18R0.110 CCCC/C=C/CCCCOCCCC(=O)OCC 34a_200020645093_100009991533 [1,1,0,0,0,0|0,0,2]=4 2959 B18R0.110 CCCC/C=C/CCCCOCCCC(=O)OCC 7a_200020645093_100011215271 [1,1,0,0,0,0|0,0,2]=4 2960 B18R0.110 CCCC/C=C/COCCCCCCC(=O)OCC 34a_200016272032_100009814379 [1,1,0,0,0,0|0,0,2]=4 2961 B18R0.110 CCCC/C=C/COCCCCCCC(=O)OCC 7a_200016272032_100009814379 [1,1,0,0,0,0|0,0,2]=4 2962 B18R0.110 CCCC/C=C\CCOCCCCCC(=O)OCC 34a_200016286491_100000755133 [1,1,0,0,0,0|0,0,2]=4 2963 B18R0.110 CCCC/C=C\CCOCCCCCC(=O)OCC 7a_200016286491_100000755133 [1,1,0,0,0,0|0,0,2]=4 2964 B18R0.110 CCCCC#CCCCCCCSCC(=O)OCC 62a_100000188475_200000043322 [1,1,0,0,0,0|0,0,2]=4 2965 B18R0.110 CCCCC#CCCCCCCSCC(=O)OCC 62a_200000043322_100000188475 [1,1,0,0,0,0|0,0,2]=4 2966 B18R0.110 CCCCC#CCCCCOCCCC(=O)OCC 34a_200000066234_100009991533 [1,1,0,0,0,0|0,0,2]=4 2967 B18R0.110 CCCCC#CCCCCOCCCC(=O)OCC 7a_200000066234_100011215271 [1,1,0,0,0,0|0,0,2]=4 2968 B18R0.110 CCCCC#CCCCSCCCCC(=O)OCC 62a_100000750268_200000047210 [1,1,0,0,0,0|0,0,2]=4 2969 B18R0.110 CCCCC#CCCCSCCCCC(=O)OCC 62a_200000047210_100000750268 [1,1,0,0,0,0|0,0,2]=4 2970 B18R0.110 CCCCC#CCCOCCCCCC(=O)OCC 34a_100000037610_100000755133 [1,1,0,0,0,0|0,0,2]=4 2971 B18R0.110 CCCCC#CCCOCCCCCC(=O)OCC 7a_100000037610_100000755133 [1,1,0,0,0,0|0,0,2]=4 2972 B18R0.110 CCCCC#CCOCCCCCCC(=O)OCC 34a_200000034558_100009814379 [1,1,0,0,0,0|0,0,2]=4 2973 B18R0.110 CCCCC#CCOCCCCCCC(=O)OCC 7a_200000034558_100009814379 [1,1,0,0,0,0|0,0,2]=4 2974 B18R0.110 CCCCC/C=C/COCCCCCC(=O)OCC 34a_100016258190_100000755133 [1,1,0,0,0,0|0,0,2]=4 2975 B18R0.110 CCCCC/C=C/COCCCCCC(=O)OCC 7a_100016258190_100000755133 [1,1,0,0,0,0|0,0,2]=4 2976 B18R0.110 CCCCC/C=C\CCCOCCCC(=O)OCC 34a_100020655193_100009991533 [1,1,0,0,0,0|0,0,2]=4 2977 B18R0.110 CCCCC/C=C\CCCOCCCC(=O)OCC 7a_100020655193_100011215271 [1,1,0,0,0,0|0,0,2]=4 2978 B18R0.110 CCCCC/C=C\CCOCCCCC(=O)OCC 34a_100016277358_100000750268 [1,1,0,0,0,0|0,0,2]=4 2979 B18R0.110 CCCCC/C=C\CCOCCCCC(=O)OCC 7a_100016277358_100000750268 [1,1,0,0,0,0|0,0,2]=4 2980 B18R0.110 CCCCCC#CCCOCCCCC(=O)OCC 34a_200000042877_100000750268 [1,1,0,0,0,0|0,0,2]=4 2981 B18R0.110 CCCCCC#CCCOCCCCC(=O)OCC 7a_200000042877_100000750268 [1,1,0,0,0,0|0,0,2]=4 2982 B18R0.110 CCCCCC#CCOCCCCCC(=O)OCC 34a_200000033628_100000755133 [1,1,0,0,0,0|0,0,2]=4 2983 B18R0.110 CCCCCC#CCOCCCCCC(=O)OCC 7a_100011214988_100009816472 [1,1,0,0,0,0|0,0,2]=4 2984 B18R0.110 CCCCCC#CCOCCCCCC(=O)OCC 7a_200000033628_100000755133 [1,1,0,0,0,0|0,0,2]=4 2985 B18R0.110 CCCCCC#CCSCCCCCC(=O)OCC 62a_100000755133_100009816472 [1,1,0,0,0,0|0,0,2]=4 2986 B18R0.110 CCCCCC#CCSCCCCCC(=O)OCC 62a_100009816472_100000755133 [1,1,0,0,0,0|0,0,2]=4 2987 B18R0.110 CCCCCC/C=C/COCCCCC(=O)OCC 34a_200016276170_100000750268 [1,1,0,0,0,0|0,0,2]=4 2988 B18R0.110 CCCCCC/C=C/COCCCCC(=O)OCC 7a_200016276170_100000750268 [1,1,0,0,0,0|0,0,2]=4 2989 B18R0.110 CCCCCCC#CCCOCCCC(=O)OCC 34a_200000033163_100009991533 [1,1,0,0,0,0|0,0,2]=4 2990 B18R0.110 CCCCCCC#CCCOCCCC(=O)OCC 7a_200000033163_100011215271 [1,1,0,0,0,0|0,0,2]=4 2991 B18R0.110 CCCCCCC#CCOCCCCC(=O)OCC 34a_200000037284_100000750268 [1,1,0,0,0,0|0,0,2]=4 2992 B18R0.110 CCCCCCC#CCOCCCCC(=O)OCC 7a_200000037284_100000750268 [1,1,0,0,0,0|0,0,2]=4 2993 B18R0.110 CCCCCCCC#CCOCCCC(=O)OCC 34a_200000061759_100009991533 [1,1,0,0,0,0|0,0,2]=4 2994 B18R0.110 CCCCCCCC#CCOCCCC(=O)OCC 7a_200000061759_100011215271 [1,1,0,0,0,0|0,0,2]=4 2995 B18R0.110 CCCCCCCC/C=C/COCCC(=O)OCC 34a_200020667288_100000765890 [1,1,0,0,0,0|0,0,2]=4 2996 B18R0.110 CCCCCCCC/C=C/COCCC(=O)OCC 7a_200020667288_100011206558 [1,1,0,0,0,0|0,0,2]=4 2997 B18R0.110 CCCCCCCCC/C=C/COCC(=O)OCC 34a_100015232335_100000188475 [1,1,0,0,0,0|0,0,2]=4 2998 B18R0.110 CCCCCCCCC/C=C/COCC(=O)OCC 7a_100015232335_100000188475 [1,1,0,0,0,0|0,0,2]=4 2999 B18R0.110 CCCCCCCCCCCCCCC(=O)NNC 22a_100016993582_100000297455 [1,1,0,0,0,0|2,0,0]=4 3000 B18R0.110 CCCCCCCCCCCCCNC(=O)CCO 240690a_100011215765_100011216618 [1,1,0,0,0,0|2,0,0]=4 3001 B18R0.110 CCCCCCCCCCCCCNC(=O)COC 11a_100011215765_100000210968 [1,1,0,0,0,0|2,0,0]=4 3002 B18R0.110 CCCCCCCCCCCCCNC(=O)COC 1626a_100011215765_100000210968 [1,1,0,0,0,0|2,0,0]=4 3003 B18R0.110 CCCCCCCCCCCCCNC(=O)COC 240690a_100011215765_100000210968 [1,1,0,0,0,0|2,0,0]=4 3004 B18R0.110 CCCCCCCCCCCCCNC(=O)COC 527a_100011215765_100000210968 [1,1,0,0,0,0|2,0,0]=4 3005 B18R0.110 CCCCCCCCCCCCCNC(=O)CSC 11a_100011215765_100000184570 [1,1,0,0,0,0|2,0,0]=4 3006 B18R0.110 CCCCCCCCCCCCCNC(=O)CSC 1626a_100011215765_100000184570 [1,1,0,0,0,0|2,0,0]=4 3007 B18R0.110 CCCCCCCCCCCCCNC(=O)CSC 240690a_100011215765_100000184570 [1,1,0,0,0,0|2,0,0]=4 3008 B18R0.110 CCCCCCCCCCCCCNC(=O)CSC 527a_100011215765_100000184570 [1,1,0,0,0,0|2,0,0]=4 3009 B18R0.110 CCCCCCCCCCCCCNC(=O)NCC 2708a_100011215765_100015525214 [1,1,0,0,0,0|1,0,0]=3 3010 B18R0.110 CCCCCCCCCCCCCNC(=O)NCC 2708a_100015525214_100011215765 [1,1,0,0,0,0|1,0,0]=3 3011 B18R0.110 CCCCCCCCCCCCCNC(=O)NCC 273464a_100011215765_100015525214 [1,1,0,0,0,0|1,0,0]=3 3012 B18R0.110 CCCCCCCCCCCCCNC(=O)NCC 273464a_100015525214_100011215765 [1,1,0,0,0,0|1,0,0]=3 3013 B18R0.110 CCCCCCCCCCCCCNC(=O)NCC 512a_100011215765_100015525214 [1,1,0,0,0,0|1,0,0]=3 3014 B18R0.110 CCCCCCCCCCCCCNC(=O)NCC 512a_100015525214_100011215765 [1,1,0,0,0,0|1,0,0]=3 3015 B18R0.110 CCCCCCCCCCCCCNC(=O)NNC 273464a_100011215765_100016993582 [1,1,0,0,0,0|2,0,0]=4 3016 B18R0.110 CCCCCCCCCCCCCNC(=O)NNC 512a_100011215765_100016993582 [1,1,0,0,0,0|2,0,0]=4 3017 B18R0.110 CCCCCCCCCCCCCNC(=O)NNC 512a_100016993582_100011215765 [1,1,0,0,0,0|2,0,0]=4 3018 B18R0.110 CCCCCCCCCCCCNCC(=O)NCC 2230a_100000210451_100000183381 [1,1,0,0,0,0|1,0,0]=3 3019 B18R0.110 CCCCCCCCCCCCNCC(=O)NCC 2230a_100016988866_100011215052 [1,1,0,0,0,0|1,0,0]=3 3020 B18R0.110 CCCCCCCCCCCCNCC(=O)NCC 270004a_100016988866_100011218549 [1,1,0,0,0,0|1,0,0]=3 3021 B18R0.110 CCCCCCCCCCCCNCC(=O)NCC 34a_100000210451_100000183381 [1,1,0,0,0,0|1,0,0]=3 3022 B18R0.110 CCCCCCCCCCCCNCC(=O)NCO 2230a_100000210451_100000185155 [1,1,0,0,0,0|2,0,0]=4 3023 B18R0.110 CCCCCCCCCCCCNCC(=O)NCO 34a_100000210451_100000185155 [1,1,0,0,0,0|2,0,0]=4 3024 B18R0.110 CCCCCCCCCCCCNCC(=O)OCC 2230a_100000210451_100000188475 [1,1,0,0,0,0|0,0,0]=2 3025 B18R0.110 CCCCCCCCCCCCNCC(=O)OCC 34a_100000210451_100000188475 [1,1,0,0,0,0|0,0,0]=2 3026 B18R0.110 CCCCCCCCCCCCOCC(=O)NCC 34a_100000210810_100000183381 [1,1,0,0,0,0|1,0,0]=3 3027 B18R0.110 CCCCCCCCCCCCOCC(=O)NCC 7a_100000210810_100000183381 [1,1,0,0,0,0|1,0,0]=3 3028 B18R0.110 CCCCCCCCCCCCOCC(=O)NCO 34a_100000210810_100000185155 [1,1,0,0,0,0|2,0,0]=4 3029 B18R0.110 CCCCCCCCCCCCOCC(=O)NCO 7a_100000210810_100000185155 [1,1,0,0,0,0|2,0,0]=4 3030 B18R0.110 CCCCCCCCCCCCOCC(=O)OCC 34a_100000210810_100000188475 [1,1,0,0,0,0|0,0,0]=2 3031 B18R0.110 CCCCCCCCCCCCOCC(=O)OCC 7a_100000210810_100000188475 [1,1,0,0,0,0|0,0,0]=2 3032 B18R0.110 CCCCCCCCCCCCSCC(=O)NCC 62a_100000183381_100000759014 [1,1,0,0,0,0|1,0,0]=3 3033 B18R0.110 CCCCCCCCCCCCSCC(=O)NCO 62a_100000185155_100000759014 [1,1,0,0,0,0|2,0,0]=4 3034 B18R0.110 CCCCCCCCCCCNCCC(=O)NCC 2230a_200011215754_100000737597 [1,1,0,0,0,0|1,0,0]=3 3035 B18R0.110 CCCCCCCCCCCNCCC(=O)NCC 34a_100025743525_100011215454 [1,1,0,0,0,0|1,0,0]=3 3036 B18R0.110 CCCCCCCCCCCNCCC(=O)OCC 2230a_200011215754_100011206558 [1,1,0,0,0,0|0,0,0]=2 3037 B18R0.110 CCCCCCCCCCCNCCC(=O)OCC 34a_200011215754_100000765890 [1,1,0,0,0,0|0,0,0]=2 3038 B18R0.110 CCCCCCCCCCCNCOC(=O)CCC 2230a_200011215754_100000034017 [1,1,0,0,0,0|2,0,0]=4 3039 B18R0.110 CCCCCCCCCCCNCOC(=O)CCC 34a_200011215754_100000034017 [1,1,0,0,0,0|2,0,0]=4 3040 B18R0.110 CCCCCCCCCCCOCCC(=O)NCC 7a_100000210809_100000737597 [1,1,0,0,0,0|1,0,0]=3 3041 B18R0.110 CCCCCCCCCCCOCCC(=O)OCC 34a_100000210809_100000765890 [1,1,0,0,0,0|0,0,0]=2 3042 B18R0.110 CCCCCCCCCCCOCCC(=O)OCC 7a_100000210809_100011206558 [1,1,0,0,0,0|0,0,0]=2 3043 B18R0.110 CCCCCCCCCCCOCOC(=O)CCC 34a_100000210809_100000034017 [1,1,0,0,0,0|2,0,0]=4 3044 B18R0.110 CCCCCCCCCCCSCCC(=O)NCC 62a_100000737597_100011215454 [1,1,0,0,0,0|1,0,0]=3 3045 B18R0.110 CCCCCCCCCCNC/C=C/C(=O)OCC 2230a_100000684558_100016267167 [1,1,0,0,0,0|0,0,2]=4 3046 B18R0.110 CCCCCCCCCCNC/C=C/C(=O)OCC 34a_100000684558_100016267167 [1,1,0,0,0,0|0,0,2]=4 3047 B18R0.110 CCCCCCCCCCNCCCC(=O)OCC 2230a_100000684558_100009991533 [1,1,0,0,0,0|0,0,0]=2 3048 B18R0.110 CCCCCCCCCCNCCCC(=O)OCC 34a_100000684558_100009991533 [1,1,0,0,0,0|0,0,0]=2 3049 B18R0.110 CCCCCCCCCCOC/C=C/C(=O)OCC 34a_100000210711_100016267167 [1,1,0,0,0,0|0,0,2]=4 3050 B18R0.110 CCCCCCCCCCOC/C=C/C(=O)OCC 7a_100000210711_100016267167 [1,1,0,0,0,0|0,0,2]=4 3051 B18R0.110 CCCCCCCCCCOCCCC(=O)OCC 34a_100000210711_100009991533 [1,1,0,0,0,0|0,0,0]=2 3052 B18R0.110 CCCCCCCCCCOCCCC(=O)OCC 7a_100000210711_100011215271 [1,1,0,0,0,0|0,0,0]=2 3053 B18R0.110 CCCCCCCCCCOCCCC(=O)OCC 7a_100012001163_100000210320 [1,1,0,0,0,0|0,0,0]=2 3054 B18R0.110 CCCCCCCCCCOCCNC(=O)OCC 34a_100000158857_100000210320 [1,1,0,0,0,0|1,0,0]=3 3055 B18R0.110 CCCCCCCCCCOCCNC(=O)OCC 7a_100000210711_200011445536 [1,1,0,0,0,0|1,0,0]=3 3056 B18R0.110 CCCCCCCCCCSC/C=C/C(=O)OCC 62a_100016267167_100000210320 [1,1,0,0,0,0|0,0,2]=4 3057 B18R0.110 CCCCCCCCCNCCCCC(=O)OCC 2230a_100000212291_100000750268 [1,1,0,0,0,0|0,0,0]=2 3058 B18R0.110 CCCCCCCCCNCCCCC(=O)OCC 34a_100000212291_100000750268 [1,1,0,0,0,0|0,0,0]=2 3059 B18R0.110 CCCCCCCCCNCCOCC(=O)OCC 2230a_100000212291_100000088970 [1,1,0,0,0,0|1,0,0]=3 3060 B18R0.110 CCCCCCCCCNCCOCC(=O)OCC 34a_100000212291_100000088970 [1,1,0,0,0,0|1,0,0]=3 3061 B18R0.110 CCCCCCCCCOCCCCC(=O)OCC 34a_100000210712_100000750268 [1,1,0,0,0,0|0,0,0]=2 3062 B18R0.110 CCCCCCCCCOCCCCC(=O)OCC 7a_100000210712_100000750268 [1,1,0,0,0,0|0,0,0]=2 3063 B18R0.110 CCCCCCCCCOCCOCC(=O)OCC 34a_100000210712_100000088970 [1,1,0,0,0,0|1,0,0]=3 3064 B18R0.110 CCCCCCCCCOCCOCC(=O)OCC 7a_100000210712_100000088970 [1,1,0,0,0,0|1,0,0]=3 3065 B18R0.110 CCCCCCCCCOCCSCC(=O)OCC 7a_200000230590_100000210328 [1,1,0,0,0,0|1,0,0]=3 3066 B18R0.110 CCCCCCCCCSCCOCC(=O)OCC 62a_100000088970_100000210670 [1,1,0,0,0,0|1,0,0]=3 3067 B18R0.110 CCCCCCCCNCCCCCC(=O)OCC 2230a_100000229939_100000755133 [1,1,0,0,0,0|0,0,0]=2 3068 B18R0.110 CCCCCCCCNCCCCCC(=O)OCC 34a_100000229939_100000755133 [1,1,0,0,0,0|0,0,0]=2 3069 B18R0.110 CCCCCCCCNCCCOCC(=O)OCC 2230a_100000229939_100009893628 [1,1,0,0,0,0|1,0,0]=3 3070 B18R0.110 CCCCCCCCNCCCOCC(=O)OCC 34a_100000229939_100009893628 [1,1,0,0,0,0|1,0,0]=3 3071 B18R0.110 CCCCCCCCOCCCCCC(=O)OCC 34a_100000210232_100000755133 [1,1,0,0,0,0|0,0,0]=2 3072 B18R0.110 CCCCCCCCOCCCCCC(=O)OCC 7a_100000210232_100000755133 [1,1,0,0,0,0|0,0,0]=2 3073 B18R0.110 CCCCCCCCOCCCCCC(=O)OCC 7a_100011214988_100000210759 [1,1,0,0,0,0|0,0,0]=2 3074 B18R0.110 CCCCCCCCOCCCOCC(=O)OCC 34a_100000210232_100009893628 [1,1,0,0,0,0|1,0,0]=3 3075 B18R0.110 CCCCCCCCOCCCOCC(=O)OCC 7a_100000210232_100009893628 [1,1,0,0,0,0|1,0,0]=3 3076 B18R0.110 CCCCCCCCSCCCOCC(=O)OCC 62a_100000210759_100009893628 [1,1,0,0,0,0|1,0,0]=3 3077 B18R0.110 CCCCCCCCSCCCOCC(=O)OCC 62a_100009893628_100000210317 [1,1,0,0,0,0|1,0,0]=3 3078 B18R0.110 CCCCCCCNCCCCCCC(=O)OCC 2230a_100000229938_100009814379 [1,1,0,0,0,0|0,0,0]=2 3079 B18R0.110 CCCCCCCOCCCCCCC(=O)OCC 34a_100000210272_100009814379 [1,1,0,0,0,0|0,0,0]=2 3080 B18R0.110 CCCCCCCOCCCCCCC(=O)OCC 7a_100000210272_100009814379 [1,1,0,0,0,0|0,0,0]=2 3081 B18R0.110 CCCCCCNCCCCCCCC(=O)OCC 2230a_100000210581_100009991516 [1,1,0,0,0,0|0,0,0]=2 3082 B18R0.110 CCCCCCOCCCCCCCC(=O)OCC 34a_100000210259_100009991516 [1,1,0,0,0,0|0,0,0]=2 3083 B18R0.110 CCCCCCOCCCCCCCC(=O)OCC 7a_100000210259_100009991516 [1,1,0,0,0,0|0,0,0]=2 3084 B18R0.110 CCCCCCOCCOCCCCC(=O)OCC 34a_100000691444_100000750268 [1,1,0,0,0,0|1,0,0]=3 3085 B18R0.110 CCCCCCOCCOCCCCC(=O)OCC 7a_100000691444_100000750268 [1,1,0,0,0,0|1,0,0]=3 3086 B18R0.110 CCCCCCOCCOCCOCC(=O)OCC 34a_100000032842_100000188475 [1,1,0,0,0,0|2,0,0]=4 3087 B18R0.110 CCCCCCOCCOCCOCC(=O)OCC 34a_100000691444_100000088970 [1,1,0,0,0,0|2,0,0]=4 3088 B18R0.110 CCCCCCOCCOCCOCC(=O)OCC 7a_100000032842_100000188475 [1,1,0,0,0,0|2,0,0]=4 3089 B18R0.110 CCCCCCOCCOCCOCC(=O)OCC 7a_100000691444_100000088970 [1,1,0,0,0,0|2,0,0]=4 3090 B18R0.110 CCCCCNCCCCCCCCC(=O)OCC 2230a_100000209983_100010175975 [1,1,0,0,0,0|0,0,0]=2 3091 B18R0.110 CCCCCNCCOCCCCCC(=O)OCC 34a_100000224656_100000755133 [1,1,0,0,0,0|1,0,0]=3 3092 B18R0.110 CCCCCNCCOCCCOCC(=O)OCC 34a_100000224656_100009893628 [1,1,0,0,0,0|2,0,0]=4 3093 B18R0.110 CCCCCOCCCCCCCCC(=O)OCC 34a_100000210253_100010175975 [1,1,0,0,0,0|0,0,0]=2 3094 B18R0.110 CCCCCOCCCCCCCCC(=O)OCC 7a_100000210253_100010175975 [1,1,0,0,0,0|0,0,0]=2 3095 B18R0.110 CCCCCOCCOCCCCCC(=O)OCC 34a_100011215259_100000755133 [1,1,0,0,0,0|1,0,0]=3 3096 B18R0.110 CCCCCOCCOCCCCCC(=O)OCC 7a_100011215259_100000755133 [1,1,0,0,0,0|1,0,0]=3 3097 B18R0.110 CCCCCOCCOCCCOCC(=O)OCC 34a_100011215259_100009893628 [1,1,0,0,0,0|2,0,0]=4 3098 B18R0.110 CCCCCOCCOCCCOCC(=O)OCC 7a_100011215259_100009893628 [1,1,0,0,0,0|2,0,0]=4 3099 B18R0.110 CCCCCOCCOCCOCCC(=O)OCC 34a_100010737887_100000718602 [1,1,0,0,0,0|2,0,0]=4 3100 B18R0.110 CCCCCOCCOCCOCCC(=O)OCC 7a_100010737887_100000210326 [1,1,0,0,0,0|2,0,0]=4 3101 B18R0.110 CCCCNCCCCCCCCCC(=O)OCC 2230a_100000102301_100009828014 [1,1,0,0,0,0|0,0,0]=2 3102 B18R0.110 CCCCNCCCCCCCCCC(=O)OCC 7a_106832991798_100009828014 [1,1,0,0,0,0|0,0,0]=2 3103 B18R0.110 CCCCNCCCCOCCCCC(=O)OCC 34a_200011216965_100000750268 [1,1,0,0,0,0|1,0,0]=3 3104 B18R0.110 CCCCNCCCCOCCOCC(=O)OCC 34a_200011216965_100000088970 [1,1,0,0,0,0|2,0,0]=4 3105 B18R0.110 CCCCNN=CCCCCCCCC(=O)OCC 4a_100025702795_100102623289 [1,1,0,0,0,0|1,0,1]=4 3106 B18R0.110 CCCCOCCCCCCCCCC(=O)OCC 34a_100000210227_100009828014 [1,1,0,0,0,0|0,0,0]=2 3107 B18R0.110 CCCCOCCCCCCCCCC(=O)OCC 7a_100000210227_100009828014 [1,1,0,0,0,0|0,0,0]=2 3108 B18R0.110 CCCCOCCCCOCCCCC(=O)OCC 34a_200000760531_100000750268 [1,1,0,0,0,0|1,0,0]=3 3109 B18R0.110 CCCCOCCCCOCCCCC(=O)OCC 7a_200000760531_100000750268 [1,1,0,0,0,0|1,0,0]=3 3110 B18R0.110 CCCCOCCCCOCCOCC(=O)OCC 34a_200000760531_100000088970 [1,1,0,0,0,0|2,0,0]=4 3111 B18R0.110 CCCCOCCCCOCCOCC(=O)OCC 7a_200000760531_100000088970 [1,1,0,0,0,0|2,0,0]=4 3112 B18R0.110 CCCCOCCCNCCCCCC(=O)OCC 2230a_200000211371_100000755133 [1,1,0,0,0,0|1,0,0]=3 3113 B18R0.110 CCCCOCCCNCCCCCC(=O)OCC 34a_200000211371_100000755133 [1,1,0,0,0,0|1,0,0]=3 3114 B18R0.110 CCCCOCCCNCCCOCC(=O)OCC 2230a_200000211371_100009893628 [1,1,0,0,0,0|2,0,0]=4 3115 B18R0.110 CCCCOCCCNCCCOCC(=O)OCC 34a_200000211371_100009893628 [1,1,0,0,0,0|2,0,0]=4 3116 B18R0.110 CCCCOCCCOCCCCCC(=O)OCC 34a_200011215613_100000755133 [1,1,0,0,0,0|1,0,0]=3 3117 B18R0.110 CCCCOCCCOCCCCCC(=O)OCC 7a_200011215613_100000755133 [1,1,0,0,0,0|1,0,0]=3 3118 B18R0.110 CCCCOCCCOCCCOCC(=O)OCC 34a_200011215613_100009893628 [1,1,0,0,0,0|2,0,0]=4 3119 B18R0.110 CCCCOCCCOCCCOCC(=O)OCC 7a_200011215613_100009893628 [1,1,0,0,0,0|2,0,0]=4 3120 B18R0.110 CCCCOCCOCCCCCCC(=O)OCC 34a_100000210238_100009814379 [1,1,0,0,0,0|1,0,0]=3 3121 B18R0.110 CCCCOCCOCCCCCCC(=O)OCC 7a_100000210238_100009814379 [1,1,0,0,0,0|1,0,0]=3 3122 B18R0.110 CCCCOCCOCCOCCCC(=O)OCC 34a_100011215186_100009991533 [1,1,0,0,0,0|2,0,0]=4 3123 B18R0.110 CCCCOCCOCCOCCCC(=O)OCC 7a_100011215186_100011215271 [1,1,0,0,0,0|2,0,0]=4 3124 B18R0.110 CCCCOCCSCCCCCCC(=O)OCC 62a_100000743108_100009814379 [1,1,0,0,0,0|1,0,0]=3 3125 B18R0.110 CCCCOCSCCCCCCCC(=O)OCC 62a_100011995733_100009991516 [1,1,0,0,0,0|1,0,0]=3 3126 B18R0.110 CCCCSCCNCCCCCCC(=O)OCC 2230a_100025743550_100009814379 [1,1,0,0,0,0|1,0,0]=3 3127 B18R0.110 CCCCSCCOCCCCCCC(=O)OCC 34a_200000230436_100009814379 [1,1,0,0,0,0|1,0,0]=3 3128 B18R0.110 CCCCSCCOCCCCCCC(=O)OCC 7a_200000230436_100009814379 [1,1,0,0,0,0|1,0,0]=3 3129 B18R0.110 CCCOCCCCCCCCCCC(=O)OCC 34a_100000210258_100009827693 [1,1,0,0,0,0|0,0,0]=2 3130 B18R0.110 CCCOCCCNCCCCCCC(=O)OCC 2230a_100011217757_100009814379 [1,1,0,0,0,0|1,0,0]=3 3131 B18R0.110 CCCOCCCNCCCCCCC(=O)OCC 34a_100011217757_100009814379 [1,1,0,0,0,0|1,0,0]=3 3132 B18R0.110 CCCOCCNCCCCCCCC(=O)OCC 2230a_100161115042_100009991516 [1,1,0,0,0,0|1,0,0]=3 3133 B18R0.110 CCCOCCNCCCCCCCC(=O)OCC 34a_100161115042_100009991516 [1,1,0,0,0,0|1,0,0]=3 3134 B18R0.110 CCCOCCOCCCCCCCC(=O)OCC 34a_100000752267_100009991516 [1,1,0,0,0,0|1,0,0]=3 3135 B18R0.110 CCCOCCOCCCCCCCC(=O)OCC 7a_100000752267_100009991516 [1,1,0,0,0,0|1,0,0]=3 3136 B18R0.110 CCCOCCOCCNCCCCC(=O)OCC 2230a_200011904461_100000750268 [1,1,0,0,0,0|2,0,0]=4 3137 B18R0.110 CCCOCCOCCNCCCCC(=O)OCC 34a_200011904461_100000750268 [1,1,0,0,0,0|2,0,0]=4 3138 B18R0.110 CCCOCCSCCCCCCCC(=O)OCC 62a_100011215938_100009991516 [1,1,0,0,0,0|1,0,0]=3 3139 B18R0.110 CCCSCCNCCCCCCCC(=O)OCC 2230a_100020603323_100009991516 [1,1,0,0,0,0|1,0,0]=3 3140 B18R0.110 CCCSCCOCCCCCCCC(=O)OCC 34a_200000230433_100009991516 [1,1,0,0,0,0|1,0,0]=3 3141 B18R0.110 CCCSCCOCCCCCCCC(=O)OCC 7a_200000230433_100009991516 [1,1,0,0,0,0|1,0,0]=3 3142 B18R0.110 CCNC(=O)CCCCCCCCCCCCCO 240690a_100015525214_100020644313 [1,1,0,0,0,0|1,0,0]=3 3143 B18R0.110 CCNC(=O)CCNCCCCCCCCCCO 2230a_100000066964_100000737597 [1,1,0,0,0,0|2,0,0]=4 3144 B18R0.110 CCNC(=O)CCNCCCCCCCCCCO 34a_100025743525_100009813290 [1,1,0,0,0,0|2,0,0]=4 3145 B18R0.110 CCNC(=O)CCOCCCCCCCCCCBr 7a_100009813290_100000737597 [1,1,0,0,0,0|2,0,0]=4 3146 B18R0.110 CCNC(=O)CCOCCCCCCCCCCCl 7a_200000033068_100000737597 [1,1,0,0,0,0|2,0,0]=4 3147 B18R0.110 CCNC(=O)CCSCCCCCCCCCCO 62a_100000737597_200000033068 [1,1,0,0,0,0|2,0,0]=4 3148 B18R0.110 CCNC(=O)CCSCCCCCCCCCCO 62a_100009813290_100000737597 [1,1,0,0,0,0|2,0,0]=4 3149 B18R0.110 CCNC(=O)CNCCCCCCCCCCCO 2230a_100016988866_100009812471 [1,1,0,0,0,0|2,0,0]=4 3150 B18R0.110 CCNC(=O)COCCCCCCCCCCCBr 34a_100009812471_100000183381 [1,1,0,0,0,0|2,0,0]=4 3151 B18R0.110 CCNC(=O)COCCCCCCCCCCCBr 7a_100009812471_100000183381 [1,1,0,0,0,0|2,0,0]=4 3152 B18R0.110 CCNC(=O)COCCCCCCCCCOCC 34a_100009875440_100000183381 [1,1,0,0,0,0|2,0,0]=4 3153 B18R0.110 CCNC(=O)COCCCCCCCCCOCC 7a_100009875440_100000183381 [1,1,0,0,0,0|2,0,0]=4 3154 B18R0.110 CCNC(=O)CSCCCCCCCCCCCO 62a_100009812471_100000183381 [1,1,0,0,0,0|2,0,0]=4 3155 B18R0.110 CCNC(=O)NCCCCCCCCCCCCO 2708a_100000066677_100015525214 [1,1,0,0,0,0|2,0,0]=4 3156 B18R0.110 CCNC(=O)NCCCCCCCCCCCCO 2708a_100015525214_100000066677 [1,1,0,0,0,0|2,0,0]=4 3157 B18R0.110 CCNC(=O)NCCCCCCCCCCCCO 273464a_100000066677_100015525214 [1,1,0,0,0,0|2,0,0]=4 3158 B18R0.110 CCNC(=O)NCCCCCCCCCCCCO 273464a_100015525214_100000066677 [1,1,0,0,0,0|2,0,0]=4 3159 B18R0.110 CCNC(=O)NCCCCCCCCCCCCO 512a_100000066677_100015525214 [1,1,0,0,0,0|2,0,0]=4 3160 B18R0.110 CCNC(=O)NCCCCCCCCCCCCO 512a_100015525214_100000066677 [1,1,0,0,0,0|2,0,0]=4 3161 B18R0.110 CCNCCCCCCCCCCCC(=O)OCC 2230a_100015525214_100103168309 [1,1,0,0,0,0|0,0,0]=2 3162 B18R0.110 CCOC(=O)CCCCCCCCCCNCCF 34a_100000724931_100009827693 [1,1,0,0,0,0|1,0,0]=3 3163 B18R0.110 CCOC(=O)CCCCCCCCCCNCCO 2230a_100016997473_100009827693 [1,1,0,0,0,0|1,0,0]=3 3164 B18R0.110 CCOC(=O)CCCCCCCCCCNCCO 34a_100016990907_100009827693 [1,1,0,0,0,0|1,0,0]=3 3165 B18R0.110 CCOC(=O)CCCCCCCCCCOCCBr 34a_100000211926_100009827693 [1,1,0,0,0,0|1,0,0]=3 3166 B18R0.110 CCOC(=O)CCCCCCCCCCOCCN 34a_100000210304_100009827693 [1,1,0,0,0,0|1,0,0]=3 3167 B18R0.110 CCOC(=O)CCCCCCCCCCSCC#N 62a_100011215382_100009827693 [1,1,0,0,0,0|1,0,1]=4 3168 B18R0.110 CCOC(=O)CCCCCCCCCCSCC=O 62a_200015260668_100009827693 [1,1,0,0,0,0|1,0,1]=4 3169 B18R0.110 CCOC(=O)CCCCCCCCCCSCCF 62a_100011217306_100009827693 [1,1,0,0,0,0|1,0,0]=3 3170 B18R0.110 CCOC(=O)CCCCCCCCCCSCCO 62a_100000211926_100009827693 [1,1,0,0,0,0|1,0,0]=3 3171 B18R0.110 CCOC(=O)CCCCCCCCCCSCOC 62a_100000766300_100009827693 [1,1,0,0,0,0|1,0,0]=3 3172 B18R0.110 CCOC(=O)CCCCCCCCCNCCCF 2230a_100015189416_100009828014 [1,1,0,0,0,0|1,0,0]=3 3173 B18R0.110 CCOC(=O)CCCCCCCCCNCCCF 34a_100015189416_100009828014 [1,1,0,0,0,0|1,0,0]=3 3174 B18R0.110 CCOC(=O)CCCCCCCCCNCCOC 2230a_100000209980_100009828014 [1,1,0,0,0,0|1,0,0]=3 3175 B18R0.110 CCOC(=O)CCCCCCCCCNCCSC 2230a_100020590264_100009828014 [1,1,0,0,0,0|1,0,0]=3 3176 B18R0.110 CCOC(=O)CCCCCCCCCOCCCBr 34a_100011217188_100009828014 [1,1,0,0,0,0|1,0,0]=3 3177 B18R0.110 CCOC(=O)CCCCCCCCCOCCCCl 34a_100000230001_100009828014 [1,1,0,0,0,0|1,0,0]=3 3178 B18R0.110 CCOC(=O)CCCCCCCCCOCCCF 34a_100000759539_100009828014 [1,1,0,0,0,0|1,0,0]=3 3179 B18R0.110 CCOC(=O)CCCCCCCCCOCCCN 34a_100000182051_100009828014 [1,1,0,0,0,0|1,0,0]=3 3180 B18R0.110 CCOC(=O)CCCCCCCCCOCCOC 34a_100000210237_100009828014 [1,1,0,0,0,0|1,0,0]=3 3181 B18R0.110 CCOC(=O)CCCCCCCCCOCCON 34a_100000700252_100009828014 [1,1,0,0,0,0|2,0,0]=4 3182 B18R0.110 CCOC(=O)CCCCCCCCCOCCSC 34a_100000230434_100009828014 [1,1,0,0,0,0|1,0,0]=3 3183 B18R0.110 CCOC(=O)CCCCCCCCCOCCSC 7a_100000230434_100009828014 [1,1,0,0,0,0|1,0,0]=3 3184 B18R0.110 CCOC(=O)CCCCCCCCCSCCC#N 62a_100011215226_100009828014 [1,1,0,0,0,0|1,0,1]=4 3185 B18R0.110 CCOC(=O)CCCCCCCCCSCCCF 62a_100011934791_100009828014 [1,1,0,0,0,0|1,0,0]=3 3186 B18R0.110 CCOC(=O)CCCCCCCCCSCCCO 62a_100011215043_100009828014 [1,1,0,0,0,0|1,0,0]=3 3187 B18R0.110 CCOC(=O)CCCCCCCCCSCCOC 62a_100000233755_100009828014 [1,1,0,0,0,0|1,0,0]=3 3188 B18R0.110 CCOC(=O)CCCCCCCCCSCCSC 62a_100000212216_100009828014 [1,1,0,0,0,0|1,0,0]=3 3189 B18R0.110 CCOC(=O)CCCCCCCCNCCCCO 2230a_100000750430_100010175975 [1,1,0,0,0,0|1,0,0]=3 3190 B18R0.110 CCOC(=O)CCCCCCCCNCCCCO 34a_100000750430_100010175975 [1,1,0,0,0,0|1,0,0]=3 3191 B18R0.110 CCOC(=O)CCCCCCCCNCCCOC 34a_100150723488_100010175975 [1,1,0,0,0,0|1,0,0]=3 3192 B18R0.110 CCOC(=O)CCCCCCCCNCCCSC 2230a_100000749238_100010175975 [1,1,0,0,0,0|1,0,0]=3 3193 B18R0.110 CCOC(=O)CCCCCCCCNCCSCC 2230a_100000106463_100010175975 [1,1,0,0,0,0|1,0,0]=3 3194 B18R0.110 CCOC(=O)CCCCCCCCOCCCCBr 34a_100011216708_100010175975 [1,1,0,0,0,0|1,0,0]=3 3195 B18R0.110 CCOC(=O)CCCCCCCCOCCCCCl 34a_100000210776_100010175975 [1,1,0,0,0,0|1,0,0]=3 3196 B18R0.110 CCOC(=O)CCCCCCCCOCCCCCl 7a_100000210776_100010175975 [1,1,0,0,0,0|1,0,0]=3 3197 B18R0.110 CCOC(=O)CCCCCCCCOCCCCF 34a_100011995726_100010175975 [1,1,0,0,0,0|1,0,0]=3 3198 B18R0.110 CCOC(=O)CCCCCCCCOCCCCF 7a_100011995726_100010175975 [1,1,0,0,0,0|1,0,0]=3 3199 B18R0.110 CCOC(=O)CCCCCCCCOCCCCI 34a_200012148704_100010175975 [1,1,0,0,0,0|1,0,0]=3 3200 B18R0.110 CCOC(=O)CCCCCCCCOCCCCN 34a_100000750430_100010175975 [1,1,0,0,0,0|1,0,0]=3 3201 B18R0.110 CCOC(=O)CCCCCCCCOCCCNC 34a_100000213112_100010175975 [1,1,0,0,0,0|1,0,0]=3 3202 B18R0.110 CCOC(=O)CCCCCCCCOCCCOC 34a_100000740835_100010175975 [1,1,0,0,0,0|1,0,0]=3 3203 B18R0.110 CCOC(=O)CCCCCCCCOCCCSC 34a_100000690336_100010175975 [1,1,0,0,0,0|1,0,0]=3 3204 B18R0.110 CCOC(=O)CCCCCCCCOCCCSC 7a_100000690336_100010175975 [1,1,0,0,0,0|1,0,0]=3 3205 B18R0.110 CCOC(=O)CCCCCCCCOCCSCC 34a_100000212035_100010175975 [1,1,0,0,0,0|1,0,0]=3 3206 B18R0.110 CCOC(=O)CCCCCCCCOCCSCC 7a_100000212035_100010175975 [1,1,0,0,0,0|1,0,0]=3 3207 B18R0.110 CCOC(=O)CCCCCCCCSCCCC#N 62a_100000687738_100010175975 [1,1,0,0,0,0|1,0,1]=4 3208 B18R0.110 CCOC(=O)CCCCCCCCSCCCC=O 62a_200011292268_100010175975 [1,1,0,0,0,0|1,0,1]=4 3209 B18R0.110 CCOC(=O)CCCCCCCCSCCCCF 62a_100000729493_100010175975 [1,1,0,0,0,0|1,0,0]=3 3210 B18R0.110 CCOC(=O)CCCCCCCCSCCCCO 62a_100000210776_100010175975 [1,1,0,0,0,0|1,0,0]=3 3211 B18R0.110 CCOC(=O)CCCCCCCCSCCCOC 62a_100000709357_100010175975 [1,1,0,0,0,0|1,0,0]=3 3212 B18R0.110 CCOC(=O)CCCCCCCCSCCSCC 62a_100000757381_100010175975 [1,1,0,0,0,0|1,0,0]=3 3213 B18R0.110 CCOC(=O)CCCCCCCNCCCCCO 2230a_100000762737_100009991516 [1,1,0,0,0,0|1,0,0]=3 3214 B18R0.110 CCOC(=O)CCCCCCCNCCCCCO 34a_100000762737_100009991516 [1,1,0,0,0,0|1,0,0]=3 3215 B18R0.110 CCOC(=O)CCCCCCCNCCOCCO 2230a_100000211614_100009991516 [1,1,0,0,0,0|2,0,0]=4 3216 B18R0.110 CCOC(=O)CCCCCCCNCCOCCO 34a_100000211614_100009991516 [1,1,0,0,0,0|2,0,0]=4 3217 B18R0.110 CCOC(=O)CCCCCCCNCCSCCO 2230a_100011219999_100009991516 [1,1,0,0,0,0|2,0,0]=4 3218 B18R0.110 CCOC(=O)CCCCCCCOCCCCCBr 34a_100000746331_100009991516 [1,1,0,0,0,0|1,0,0]=3 3219 B18R0.110 CCOC(=O)CCCCCCCOCCCCCBr 7a_100000746331_100009991516 [1,1,0,0,0,0|1,0,0]=3 3220 B18R0.110 CCOC(=O)CCCCCCCOCCCCCCl 34a_100000746330_100009991516 [1,1,0,0,0,0|1,0,0]=3 3221 B18R0.110 CCOC(=O)CCCCCCCOCCCCCCl 7a_100000746330_100009991516 [1,1,0,0,0,0|1,0,0]=3 3222 B18R0.110 CCOC(=O)CCCCCCCOCCCCCI 34a_200012148887_100009991516 [1,1,0,0,0,0|1,0,0]=3 3223 B18R0.110 CCOC(=O)CCCCCCCOCCCCCI 7a_200012148887_100009991516 [1,1,0,0,0,0|1,0,0]=3 3224 B18R0.110 CCOC(=O)CCCCCCCOCCCCCN 34a_100000762737_100009991516 [1,1,0,0,0,0|1,0,0]=3 3225 B18R0.110 CCOC(=O)CCCCCCCOCCCCOC 34a_100000740925_100009991516 [1,1,0,0,0,0|1,0,0]=3 3226 B18R0.110 CCOC(=O)CCCCCCCOCCCCSC 34a_100011217163_100009991516 [1,1,0,0,0,0|1,0,0]=3 3227 B18R0.110 CCOC(=O)CCCCCCCOCCCCSC 7a_100011217163_100009991516 [1,1,0,0,0,0|1,0,0]=3 3228 B18R0.110 CCOC(=O)CCCCCCCOCCCSCC 34a_100011216438_100009991516 [1,1,0,0,0,0|1,0,0]=3 3229 B18R0.110 CCOC(=O)CCCCCCCOCCCSCC 7a_100011216438_100009991516 [1,1,0,0,0,0|1,0,0]=3 3230 B18R0.110 CCOC(=O)CCCCCCCOCCOCCBr 34a_100000692535_100009991516 [1,1,0,0,0,0|2,0,0]=4 3231 B18R0.110 CCOC(=O)CCCCCCCOCCOCCBr 7a_100000692535_100009991516 [1,1,0,0,0,0|2,0,0]=4 3232 B18R0.110 CCOC(=O)CCCCCCCOCCOCCCl 34a_100011215305_100009991516 [1,1,0,0,0,0|2,0,0]=4 3233 B18R0.110 CCOC(=O)CCCCCCCOCCOCCCl 7a_100011215305_100009991516 [1,1,0,0,0,0|2,0,0]=4 3234 B18R0.110 CCOC(=O)CCCCCCCOCCOCCF 34a_200015357709_100009991516 [1,1,0,0,0,0|2,0,0]=4 3235 B18R0.110 CCOC(=O)CCCCCCCOCCOCCF 7a_200015357709_100009991516 [1,1,0,0,0,0|2,0,0]=4 3236 B18R0.110 CCOC(=O)CCCCCCCOCCOCCI 34a_100012149058_100009991516 [1,1,0,0,0,0|2,0,0]=4 3237 B18R0.110 CCOC(=O)CCCCCCCOCCOCCI 7a_100012149058_100009991516 [1,1,0,0,0,0|2,0,0]=4 3238 B18R0.110 CCOC(=O)CCCCCCCOCCOCCN 34a_100000211614_100009991516 [1,1,0,0,0,0|2,0,0]=4 3239 B18R0.110 CCOC(=O)CCCCCCCSCCCCC#N 62a_100011219923_100009991516 [1,1,0,0,0,0|1,0,1]=4 3240 B18R0.110 CCOC(=O)CCCCCCCSCCCCC=O 62a_100000139335_100009991516 [1,1,0,0,0,0|1,0,1]=4 3241 B18R0.110 CCOC(=O)CCCCCCCSCCCCCF 62a_100000729378_100009991516 [1,1,0,0,0,0|1,0,0]=3 3242 B18R0.110 CCOC(=O)CCCCCCCSCCCCCO 62a_100000746330_100009991516 [1,1,0,0,0,0|1,0,0]=3 3243 B18R0.110 CCOC(=O)CCCCCCCSCCCCOC 62a_100000730899_100009991516 [1,1,0,0,0,0|1,0,0]=3 3244 B18R0.110 CCOC(=O)CCCCCCCSCCOCCO 62a_100011215305_100009991516 [1,1,0,0,0,0|2,0,0]=4 3245 B18R0.110 CCOC(=O)CCCCCCCSCOCCOC 62a_100000231047_100009991516 [1,1,0,0,0,0|2,0,0]=4 3246 B18R0.110 CCOC(=O)CCCCCCNCCCCCCO 2230a_100000686447_100009814379 [1,1,0,0,0,0|1,0,0]=3 3247 B18R0.110 CCOC(=O)CCCCCCNCCCCCCO 34a_100000686447_100009814379 [1,1,0,0,0,0|1,0,0]=3 3248 B18R0.110 CCOC(=O)CCCCCCNCCCCCOC 2230a_100000747528_100009814379 [1,1,0,0,0,0|1,0,0]=3 3249 B18R0.110 CCOC(=O)CCCCCCNCCCCCOC 34a_100000747528_100009814379 [1,1,0,0,0,0|1,0,0]=3 3250 B18R0.110 CCOC(=O)CCCCCCNCCOCCOC 2230a_100000745349_100009814379 [1,1,0,0,0,0|2,0,0]=4 3251 B18R0.110 CCOC(=O)CCCCCCNCCOCCOC 34a_100000745349_100009814379 [1,1,0,0,0,0|2,0,0]=4 3252 B18R0.110 CCOC(=O)CCCCCCOCCCCCCBr 34a_100011215345_100009814379 [1,1,0,0,0,0|1,0,0]=3 3253 B18R0.110 CCOC(=O)CCCCCCOCCCCCCBr 7a_100011215345_100009814379 [1,1,0,0,0,0|1,0,0]=3 3254 B18R0.110 CCOC(=O)CCCCCCOCCCCCCCl 34a_100000766143_100009814379 [1,1,0,0,0,0|1,0,0]=3 3255 B18R0.110 CCOC(=O)CCCCCCOCCCCCCCl 7a_100000766143_100009814379 [1,1,0,0,0,0|1,0,0]=3 3256 B18R0.110 CCOC(=O)CCCCCCOCCCCCCF 34a_100000732779_100009814379 [1,1,0,0,0,0|1,0,0]=3 3257 B18R0.110 CCOC(=O)CCCCCCOCCCCCCF 7a_100000732779_100009814379 [1,1,0,0,0,0|1,0,0]=3 3258 B18R0.110 CCOC(=O)CCCCCCOCCCCCCN 34a_100000686447_100009814379 [1,1,0,0,0,0|1,0,0]=3 3259 B18R0.110 CCOC(=O)CCCCCCOCCCCCNC 34a_100000722520_100009814379 [1,1,0,0,0,0|1,0,0]=3 3260 B18R0.110 CCOC(=O)CCCCCCOCCOCCNC 34a_100000228057_100009814379 [1,1,0,0,0,0|2,0,0]=4 3261 B18R0.110 CCOC(=O)CCCCCCOCCOCCOC 34a_100011215163_100009814379 [1,1,0,0,0,0|2,0,0]=4 3262 B18R0.110 CCOC(=O)CCCCCCOCCOCCOC 7a_100011215163_100009814379 [1,1,0,0,0,0|2,0,0]=4 3263 B18R0.110 CCOC(=O)CCCCCCSCCCCCC#N 62a_100009813376_100009814379 [1,1,0,0,0,0|1,0,1]=4 3264 B18R0.110 CCOC(=O)CCCCCCSCCCCCC=O 62a_100000139337_100009814379 [1,1,0,0,0,0|1,0,1]=4 3265 B18R0.110 CCOC(=O)CCCCCCSCCCCCCF 62a_100015922095_100009814379 [1,1,0,0,0,0|1,0,0]=3 3266 B18R0.110 CCOC(=O)CCCCCCSCCCCCCO 62a_100000766143_100009814379 [1,1,0,0,0,0|1,0,0]=3 3267 B18R0.110 CCOC(=O)CCCCCCSCCOCCOC 62a_100000695917_100009814379 [1,1,0,0,0,0|2,0,0]=4 3268 B18R0.110 CCOC(=O)CCCCCNCCCCCCCO 2230a_100011996573_100000755133 [1,1,0,0,0,0|1,0,0]=3 3269 B18R0.110 CCOC(=O)CCCCCNCCCCCCCO 34a_100011996573_100000755133 [1,1,0,0,0,0|1,0,0]=3 3270 B18R0.110 CCOC(=O)CCCCCNCCCOCCCO 2230a_100011310245_100000755133 [1,1,0,0,0,0|2,0,0]=4 3271 B18R0.110 CCOC(=O)CCCCCNCCCOCCCO 34a_100011310245_100000755133 [1,1,0,0,0,0|2,0,0]=4 3272 B18R0.110 CCOC(=O)CCCCCNCCCOCCOC 2230a_100000206027_100000755133 [1,1,0,0,0,0|2,0,0]=4 3273 B18R0.110 CCOC(=O)CCCCCNCCCOCCOC 34a_100000206027_100000755133 [1,1,0,0,0,0|2,0,0]=4 3274 B18R0.110 CCOC(=O)CCCCCOCCCCCCC#N 7a_100011214988_100009813337 [1,1,0,0,0,0|1,0,1]=4 3275 B18R0.110 CCOC(=O)CCCCCOCCCCCCCBr 34a_100000760002_100000755133 [1,1,0,0,0,0|1,0,0]=3 3276 B18R0.110 CCOC(=O)CCCCCOCCCCCCCBr 7a_100000760002_100000755133 [1,1,0,0,0,0|1,0,0]=3 3277 B18R0.110 CCOC(=O)CCCCCOCCCCCCCN 34a_100011996573_100000755133 [1,1,0,0,0,0|1,0,0]=3 3278 B18R0.110 CCOC(=O)CCCCCOCCCCCCCO 7a_100011214988_100000760002 [1,1,0,0,0,0|1,0,0]=3 3279 B18R0.110 CCOC(=O)CCCCCOCCCCCCOC 34a_200012092642_100000755133 [1,1,0,0,0,0|1,0,0]=3 3280 B18R0.110 CCOC(=O)CCCCCOCCCCCCOC 7a_100011214988_100011998445 [1,1,0,0,0,0|1,0,0]=3 3281 B18R0.110 CCOC(=O)CCCCCOCCCCCCOC 7a_200012092642_100000755133 [1,1,0,0,0,0|1,0,0]=3 3282 B18R0.110 CCOC(=O)CCCCCOCCCOCCCN 34a_100011310245_100000755133 [1,1,0,0,0,0|2,0,0]=4 3283 B18R0.110 CCOC(=O)CCCCCOCCCOCCOC 7a_100011214988_100011216529 [1,1,0,0,0,0|2,0,0]=4 3284 B18R0.110 CCOC(=O)CCCCCSCCCCCCC#N 62a_100000755133_100009813337 [1,1,0,0,0,0|1,0,1]=4 3285 B18R0.110 CCOC(=O)CCCCCSCCCCCCC#N 62a_100009813337_100000755133 [1,1,0,0,0,0|1,0,1]=4 3286 B18R0.110 CCOC(=O)CCCCCSCCCCCCCO 62a_100000755133_100000760002 [1,1,0,0,0,0|1,0,0]=3 3287 B18R0.110 CCOC(=O)CCCCCSCCCCCCCO 62a_100000760002_100000755133 [1,1,0,0,0,0|1,0,0]=3 3288 B18R0.110 CCOC(=O)CCCCCSCCCCCCOC 62a_100000755133_100011998445 [1,1,0,0,0,0|1,0,0]=3 3289 B18R0.110 CCOC(=O)CCCCCSCCCCCCOC 62a_100011998445_100000755133 [1,1,0,0,0,0|1,0,0]=3 3290 B18R0.110 CCOC(=O)CCCCCSCCCOCCOC 62a_100000755133_100011216529 [1,1,0,0,0,0|2,0,0]=4 3291 B18R0.110 CCOC(=O)CCCCCSCCCOCCOC 62a_100011216529_100000755133 [1,1,0,0,0,0|2,0,0]=4 3292 B18R0.110 CCOC(=O)CCCCNCCCCCCCCO 2230a_102515433106_100000750268 [1,1,0,0,0,0|1,0,0]=3 3293 B18R0.110 CCOC(=O)CCCCNCCCCCCCCO 34a_102515433106_100000750268 [1,1,0,0,0,0|1,0,0]=3 3294 B18R0.110 CCOC(=O)CCCCOCCCCCCCCBr 34a_100009813846_100000750268 [1,1,0,0,0,0|1,0,0]=3 3295 B18R0.110 CCOC(=O)CCCCOCCCCCCCCBr 7a_100009813846_100000750268 [1,1,0,0,0,0|1,0,0]=3 3296 B18R0.110 CCOC(=O)CCCCOCCCCCCCCCl 34a_100000033203_100000750268 [1,1,0,0,0,0|1,0,0]=3 3297 B18R0.110 CCOC(=O)CCCCOCCCCCCCCCl 7a_100000033203_100000750268 [1,1,0,0,0,0|1,0,0]=3 3298 B18R0.110 CCOC(=O)CCCCOCCCCCCCCN 34a_102515433106_100000750268 [1,1,0,0,0,0|1,0,0]=3 3299 B18R0.110 CCOC(=O)CCCCOCCCCCNCCN 34a_103619048469_100000750268 [1,1,0,0,0,0|2,0,0]=4 3300 B18R0.110 CCOC(=O)CCCCOCCCOCCCOC 34a_200011215475_100000750268 [1,1,0,0,0,0|2,0,0]=4 3301 B18R0.110 CCOC(=O)CCCCOCCCOCCCOC 7a_200011215475_100000750268 [1,1,0,0,0,0|2,0,0]=4 3302 B18R0.110 CCOC(=O)CCCCSCCCCCCCCO 62a_100000033203_100000750268 [1,1,0,0,0,0|1,0,0]=3 3303 B18R0.110 CCOC(=O)CCCCSCCCCCCCCO 62a_100000750268_100000033203 [1,1,0,0,0,0|1,0,0]=3 3304 B18R0.110 CCOC(=O)CCCNCCCCCCCCCO 2230a_100000078944_100009991533 [1,1,0,0,0,0|1,0,0]=3 3305 B18R0.110 CCOC(=O)CCCNCCCCCCCCCO 34a_100000078944_100009991533 [1,1,0,0,0,0|1,0,0]=3 3306 B18R0.110 CCOC(=O)CCCOCCCCCCCCCBr 34a_100009813782_100009991533 [1,1,0,0,0,0|1,0,0]=3 3307 B18R0.110 CCOC(=O)CCCOCCCCCCCCCBr 7a_100009813782_100011215271 [1,1,0,0,0,0|1,0,0]=3 3308 B18R0.110 CCOC(=O)CCCOCCCCCCCCCCl 34a_100009868337_100009991533 [1,1,0,0,0,0|1,0,0]=3 3309 B18R0.110 CCOC(=O)CCCOCCCCCCCCCCl 7a_100009868337_100011215271 [1,1,0,0,0,0|1,0,0]=3 3310 B18R0.110 CCOC(=O)CCCOCCCCCCCCCN 34a_100000078944_100009991533 [1,1,0,0,0,0|1,0,0]=3 3311 B18R0.110 CCOC(=O)CCCOCCCCCCCCCO 7a_100012001163_100009813782 [1,1,0,0,0,0|1,0,0]=3 3312 B18R0.110 CCOC(=O)CCCSCCCCCCCCCO 62a_100009813782_100009991533 [1,1,0,0,0,0|1,0,0]=3 3313 B18R0.110 CCOC(=O)CCCSCCCCCCCCCO 62a_100009991533_100009813782 [1,1,0,0,0,0|1,0,0]=3 3314 B18R0.110 CCOC(=O)CCNCCCCCCCCCCO 2230a_100000066964_100011206558 [1,1,0,0,0,0|1,0,0]=3 3315 B18R0.110 CCOC(=O)CCNCCCCCCCCCCO 34a_100000066964_100000765890 [1,1,0,0,0,0|1,0,0]=3 3316 B18R0.110 CCOC(=O)CCOCCCCCCCCCCBr 34a_100009813290_100000765890 [1,1,0,0,0,0|1,0,0]=3 3317 B18R0.110 CCOC(=O)CCOCCCCCCCCCCBr 7a_100009813290_100011206558 [1,1,0,0,0,0|1,0,0]=3 3318 B18R0.110 CCOC(=O)CCOCCCCCCCCCCCl 34a_200000033068_100000765890 [1,1,0,0,0,0|1,0,0]=3 3319 B18R0.110 CCOC(=O)CCOCCCCCCCCCCCl 7a_200000033068_100011206558 [1,1,0,0,0,0|1,0,0]=3 3320 B18R0.110 CCOC(=O)CCOCCCCCCCCCCN 34a_100000066964_100000765890 [1,1,0,0,0,0|1,0,0]=3 3321 B18R0.110 CCOC(=O)CCSCCCCCCCCCCO 62a_100000765890_200000033068 [1,1,0,0,0,0|1,0,0]=3 3322 B18R0.110 CCOC(=O)CCSCCCCCCCCCCO 62a_100009813290_100000765890 [1,1,0,0,0,0|1,0,0]=3 3323 B18R0.110 CCOC(=O)COCCCCCCCCCCCBr 34a_100009812471_100000188475 [1,1,0,0,0,0|1,0,0]=3 3324 B18R0.110 CCOC(=O)COCCCCCCCCCCCBr 7a_100009812471_100000188475 [1,1,0,0,0,0|1,0,0]=3 3325 B18R0.110 CCOC(=O)COCCCNCCCCCCCO 2230a_100011996573_100009893628 [1,1,0,0,0,0|2,0,0]=4 3326 B18R0.110 CCOC(=O)COCCCNCCCCCCCO 34a_100011996573_100009893628 [1,1,0,0,0,0|2,0,0]=4 3327 B18R0.110 CCOC(=O)COCCCOCCCCCCCBr 34a_100000760002_100009893628 [1,1,0,0,0,0|2,0,0]=4 3328 B18R0.110 CCOC(=O)COCCCOCCCCCCCBr 7a_100000760002_100009893628 [1,1,0,0,0,0|2,0,0]=4 3329 B18R0.110 CCOC(=O)COCCCOCCCCCCCN 34a_100011996573_100009893628 [1,1,0,0,0,0|2,0,0]=4 3330 B18R0.110 CCOC(=O)COCCCOCCCCCCOC 34a_200012092642_100009893628 [1,1,0,0,0,0|2,0,0]=4 3331 B18R0.110 CCOC(=O)COCCCOCCCCCCOC 7a_200012092642_100009893628 [1,1,0,0,0,0|2,0,0]=4 3332 B18R0.110 CCOC(=O)COCCCSCCCCCCCO 62a_100000760002_100009893628 [1,1,0,0,0,0|2,0,0]=4 3333 B18R0.110 CCOC(=O)COCCCSCCCCCCCO 62a_100009893628_100000760002 [1,1,0,0,0,0|2,0,0]=4 3334 B18R0.110 CCOC(=O)COCCCSCCCCCCOC 62a_100009893628_100011998445 [1,1,0,0,0,0|2,0,0]=4 3335 B18R0.110 CCOC(=O)COCCCSCCCCCCOC 62a_100011998445_100009893628 [1,1,0,0,0,0|2,0,0]=4 3336 B18R0.110 CCOC(=O)COCCNCCCCCCCCO 2230a_102515433106_100000088970 [1,1,0,0,0,0|2,0,0]=4 3337 B18R0.110 CCOC(=O)COCCNCCCCCCCCO 34a_102515433106_100000088970 [1,1,0,0,0,0|2,0,0]=4 3338 B18R0.110 CCOC(=O)COCCOCCCCCCCCBr 34a_100009813846_100000088970 [1,1,0,0,0,0|2,0,0]=4 3339 B18R0.110 CCOC(=O)COCCOCCCCCCCCBr 7a_100009813846_100000088970 [1,1,0,0,0,0|2,0,0]=4 3340 B18R0.110 CCOC(=O)COCCOCCCCCCCCCl 34a_100000033203_100000088970 [1,1,0,0,0,0|2,0,0]=4 3341 B18R0.110 CCOC(=O)COCCOCCCCCCCCCl 7a_100000033203_100000088970 [1,1,0,0,0,0|2,0,0]=4 3342 B18R0.110 CCOC(=O)COCCOCCCCCCCCN 34a_102515433106_100000088970 [1,1,0,0,0,0|2,0,0]=4 3343 B18R0.110 CCOC(=O)COCCSCCCCCCCCO 62a_100000033203_100000088970 [1,1,0,0,0,0|2,0,0]=4 3344 B18R0.110 CCOC(=O)COCCSCCCCCCCCO 62a_100000088970_100000033203 [1,1,0,0,0,0|2,0,0]=4 3345 B18R0.110 CCOC(=O)CSCCCCCCCCCCCO 62a_100009812471_100000188475 [1,1,0,0,0,0|1,0,0]=3 3346 B18R0.110 CCOC(=O)CSCCOCCCCCCCCO 7a_200000230590_100000033203 [1,1,0,0,0,0|2,0,0]=4 3347 B18R0.110 CCOC(=O)NCCOCCCCCCCCCBr 7a_100009813782_200011445536 [1,1,0,0,0,0|2,0,0]=4 3348 B18R0.110 CCOC(=O)NCCOCCCCCCCCCCl 7a_100009868337_200011445536 [1,1,0,0,0,0|2,0,0]=4 3349 B18R0.110 CCOC(=O)NCCOCCCCCCCCCO 34a_100000158857_100009813782 [1,1,0,0,0,0|2,0,0]=4 3350 B18R0.110 CCOC(=O)NCCSCCCCCCCCCO 62a_100009813782_200011445536 [1,1,0,0,0,0|2,0,0]=4 3351 B18R0.110 CCOC(=O)OCSCCCCCCCCCCO 62a_100009813290_100000075025 [1,1,0,0,0,0|2,0,0]=4 3352 B18R0.110 CCOCCCCCCCCCCCC(=O)OCC 34a_100121572206_100103168309 [1,1,0,0,0,0|0,0,0]=2 3353 B18R0.110 CCOCCCCCCCCCOCC(=O)OCC 34a_100009875440_100000188475 [1,1,0,0,0,0|1,0,0]=3 3354 B18R0.110 CCOCCCCCCCCCOCC(=O)OCC 7a_100009875440_100000188475 [1,1,0,0,0,0|1,0,0]=3 3355 B18R0.110 CCOCCCNCCCCCCCC(=O)OCC 2230a_100000210961_100009991516 [1,1,0,0,0,0|1,0,0]=3 3356 B18R0.110 CCOCCCNCCCCCCCC(=O)OCC 34a_100000210961_100009991516 [1,1,0,0,0,0|1,0,0]=3 3357 B18R0.110 CCOCCCOCCCCCCCC(=O)OCC 34a_100000757476_100009991516 [1,1,0,0,0,0|1,0,0]=3 3358 B18R0.110 CCOCCCOCCCCCCCC(=O)OCC 7a_100000757476_100009991516 [1,1,0,0,0,0|1,0,0]=3 3359 B18R0.110 CCOCCCSCCCCCCCC(=O)OCC 62a_100012232248_100009991516 [1,1,0,0,0,0|1,0,0]=3 3360 B18R0.110 CCOCCNCCCCCCCCC(=O)OCC 2230a_102516460346_100010175975 [1,1,0,0,0,0|1,0,0]=3 3361 B18R0.110 CCOCCNCCCCCCCCC(=O)OCC 34a_102516460346_100010175975 [1,1,0,0,0,0|1,0,0]=3 3362 B18R0.110 CCOCCOCCCCCCCCC(=O)OCC 34a_100000210136_100010175975 [1,1,0,0,0,0|1,0,0]=3 3363 B18R0.110 CCOCCOCCCCCCCCC(=O)OCC 7a_100000210136_100010175975 [1,1,0,0,0,0|1,0,0]=3 3364 B18R0.110 CCOCCOCCNCCCCCC(=O)OCC 2230a_100102712874_100000755133 [1,1,0,0,0,0|2,0,0]=4 3365 B18R0.110 CCOCCOCCNCCCCCC(=O)OCC 34a_100102712874_100000755133 [1,1,0,0,0,0|2,0,0]=4 3366 B18R0.110 CCOCCOCCOCCCCCC(=O)OCC 34a_100000210240_100000755133 [1,1,0,0,0,0|2,0,0]=4 3367 B18R0.110 CCOCCOCCOCCCCCC(=O)OCC 7a_100000210240_100000755133 [1,1,0,0,0,0|2,0,0]=4 3368 B18R0.110 CCOCCOCCOCCCCCC(=O)OCC 7a_100011214988_100011211534 [1,1,0,0,0,0|2,0,0]=4 3369 B18R0.110 CCOCCOCCSCCCCCC(=O)OCC 62a_100000755133_100011211534 [1,1,0,0,0,0|2,0,0]=4 3370 B18R0.110 CCOCCOCCSCCCCCC(=O)OCC 62a_100011211534_100000755133 [1,1,0,0,0,0|2,0,0]=4 3371 B18R0.110 CCOCCSCCCCCCCCC(=O)OCC 62a_100000210147_100010175975 [1,1,0,0,0,0|1,0,0]=3 3372 B18R0.110 CCOCSCCCCCCCCCC(=O)OCC 62a_100000739092_100009828014 [1,1,0,0,0,0|1,0,0]=3 3373 B18R0.110 CNNC(=O)CCCCCCCCCCCCCO 22a_100016993582_100020644313 [1,1,0,0,0,0|2,0,0]=4 3374 B18R0.137 CCCCCCC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100000210757 [1,1,0,0,0,0|0,0,1]=3 3375 B18R0.137 CCCCCCC(=O)CCCCCCC(=O)OCC 1458a_100102632555_100009814379 [1,1,0,0,0,0|0,0,1]=3 3376 B18R0.137 CCCCCCC(=O)NCCCCCC(=O)OCC 188690a_100000062434_100102632555 [1,1,0,0,0,0|1,0,1]=4 3377 B18R0.137 CCCCCCC(C)CCOCCCC(=O)OCC 34a_200011024964_100009991533 [1,1,0,0,0,0|1,0,0]=3 3378 B18R0.137 CCCCCCC(C)CCOCCCC(=O)OCC 7a_200011024964_100011215271 [1,1,0,0,0,0|1,0,0]=3 3379 B18R0.137 CCCCCCC(C)CCOCCNC(=O)OCC 7a_200011024964_200011445536 [1,1,0,0,0,0|2,0,0]=4 3380 B18R0.137 CCCCCCC(C)NCCCCCC(=O)OCC 2230a_100000210919_100000755133 [1,1,0,0,0,0|1,0,0]=3 3381 B18R0.137 CCCCCCC(C)NCCCCCC(=O)OCC 34a_100000210919_100000755133 [1,1,0,0,0,0|1,0,0]=3 3382 B18R0.137 CCCCCCC(C)NCCCOCC(=O)OCC 2230a_100000210919_100009893628 [1,1,0,0,0,0|2,0,0]=4 3383 B18R0.137 CCCCCCC(C)NCCCOCC(=O)OCC 34a_100000210919_100009893628 [1,1,0,0,0,0|2,0,0]=4 3384 B18R0.137 CCCCCCC(C)OCCCCCC(=O)OCC 34a_100000210265_100000755133 [1,1,0,0,0,0|1,0,0]=3 3385 B18R0.137 CCCCCCC(C)OCCCCCC(=O)OCC 7a_100000210265_100000755133 [1,1,0,0,0,0|1,0,0]=3 3386 B18R0.137 CCCCCCC(C)OCCCCCC(=O)OCC 7a_100011214988_100011215978 [1,1,0,0,0,0|1,0,0]=3 3387 B18R0.137 CCCCCCC(C)OCCCOCC(=O)OCC 34a_100000210265_100009893628 [1,1,0,0,0,0|2,0,0]=4 3388 B18R0.137 CCCCCCC(C)OCCCOCC(=O)OCC 7a_100000210265_100009893628 [1,1,0,0,0,0|2,0,0]=4 3389 B18R0.137 CCCCCCC(C)SCCCOCC(=O)OCC 62a_100009893628_100011215978 [1,1,0,0,0,0|2,0,0]=4 3390 B18R0.137 CCCCCCC(C)SCCCOCC(=O)OCC 62a_100011215978_100009893628 [1,1,0,0,0,0|2,0,0]=4 3391 B18R0.137 CCCCCCN(C)CCCCCCC(=O)OCC 2230a_106256046315_100009814379 [1,1,0,0,0,0|1,0,0]=3 3392 B18R0.137 CCCCCCN(C)CCCCCCC(=O)OCC 269982a_106256046315_100009814379 [1,1,0,0,0,0|1,0,0]=3 3393 B18R0.137 CCCCCNC(=O)CCCCCCC(=O)OCC 11a_100000209983_100000031895 [1,1,0,0,0,0|1,0,1]=4 3394 B18R0.137 CCCCCNC(=O)CCCCCCC(=O)OCC 1626a_100000209983_100000031895 [1,1,0,0,0,0|1,0,1]=4 3395 B18R0.137 CCCCCNC(=O)CCCCCCC(=O)OCC 240690a_100000209983_100000031895 [1,1,0,0,0,0|1,0,1]=4 3396 B18R0.137 CCCCCNC(=O)CCCCCCC(=O)OCC 527a_100000209983_100000031895 [1,1,0,0,0,0|1,0,1]=4 3397 B18R0.137 CCCCOCC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100011995733 [1,1,0,0,0,0|1,0,1]=4 3398 B18R0.137 CCCCOCC(=O)CCCCCCC(=O)OCC 1458a_100000757543_100009814379 [1,1,0,0,0,0|1,0,1]=4 3399 B18R0.137 CCCCOCC(C)OCCCCCC(=O)OCC 34a_100011217071_100000755133 [1,1,0,0,0,0|2,0,0]=4 3400 B18R0.137 CCCCOCC(C)OCCCCCC(=O)OCC 7a_100011217071_100000755133 [1,1,0,0,0,0|2,0,0]=4 3401 B18R0.137 CCCCSCC(=O)CCCCCCC(=O)OCC 1458a_100000191162_100009814379 [1,1,0,0,0,0|1,0,1]=4 3402 B18R0.137 CCCOCCC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100011215938 [1,1,0,0,0,0|1,0,1]=4 3403 B18R0.137 CCOC(=O)CCCCCCC(=O)CCCCCF 1458a_100000031895_100000729378 [1,1,0,0,0,0|1,0,1]=4 3404 B18R0.137 CCOC(=O)CCCCCCC(=O)CCCCCO 1458a_100000031895_100000746330 [1,1,0,0,0,0|1,0,1]=4 3405 B18R0.137 CCOC(=O)CCCCCCC(=O)CCCCCO 1458a_100102619762_100009814379 [1,1,0,0,0,0|1,0,1]=4 3406 B18R0.137 CCOC(=O)CCCCCCC(=O)CCCCOC 1458a_100000031895_100000755781 [1,1,0,0,0,0|1,0,1]=4 3407 B18R0.137 CCOC(=O)CCCCCCN(C)CCCCCO 2230a_100000722520_100009814379 [1,1,0,0,0,0|2,0,0]=4 3408 B18R0.137 CCOC(=O)CCCCCCN(C)CCCCCO 269982a_100000722520_100009814379 [1,1,0,0,0,0|2,0,0]=4 3409 B18R0.137 CCOCCCC(=O)CCCCCCC(=O)OCC 1458a_100000031895_100012232248 [1,1,0,0,0,0|1,0,1]=4 3410 B18R0.161 CCCCC(=O)CCCCCCCCC(=O)OCC 1458a_100000210183_100010175975 [1,1,0,0,0,0|0,0,1]=3 3411 B18R0.161 CCCCC(=O)CCCCCCCCC(=O)OCC 1458a_200000016031_100000210211 [1,1,0,0,0,0|0,0,1]=3 3412 B18R0.161 CCCCC(C)CCCCOCCCC(=O)OCC 34a_200011021034_100009991533 [1,1,0,0,0,0|1,0,0]=3 3413 B18R0.161 CCCCC(C)CCCCOCCCC(=O)OCC 7a_200011021034_100011215271 [1,1,0,0,0,0|1,0,0]=3 3414 B18R0.161 CCCCC(C)CCCCOCCNC(=O)OCC 7a_200011021034_200011445536 [1,1,0,0,0,0|2,0,0]=4 3415 B18R0.161 CCCCC(C)COCCCCCCC(=O)OCC 34a_100011995851_100009814379 [1,1,0,0,0,0|1,0,0]=3 3416 B18R0.161 CCCCC(C)COCCCCCCC(=O)OCC 7a_100011995851_100009814379 [1,1,0,0,0,0|1,0,0]=3 3417 B18R0.161 CCCCC(C)NCCCCCCCC(=O)OCC 2230a_100000126638_100009991516 [1,1,0,0,0,0|1,0,0]=3 3418 B18R0.161 CCCCC(C)OCCCCCCCC(=O)OCC 34a_100000687866_100009991516 [1,1,0,0,0,0|1,0,0]=3 3419 B18R0.161 CCCCC(C)OCCCCCCCC(=O)OCC 7a_100000687866_100009991516 [1,1,0,0,0,0|1,0,0]=3 3420 B18R0.161 CCCCN(C)CCCCCCCCC(=O)OCC 2230a_100000207549_100010175975 [1,1,0,0,0,0|1,0,0]=3 3421 B18R0.161 CCCCN(C)CCCCCCCCC(=O)OCC 269982a_100000207549_100010175975 [1,1,0,0,0,0|1,0,0]=3 3422 B18R0.161 CCCC[C@H](N)COCCCCCCC(=O)OCC 34a_100011934283_100009814379 [1,1,0,0,0,0|1,0,0]=3 3423 B18R0.161 CCCNC(=O)CCCCCCCCC(=O)OCC 11a_100020643023_200000016031 [1,1,0,0,0,0|1,0,1]=4 3424 B18R0.161 CCCNC(=O)CCCCCCCCC(=O)OCC 1626a_100020643023_200000016031 [1,1,0,0,0,0|1,0,1]=4 3425 B18R0.161 CCCNC(=O)CCCCCCCCC(=O)OCC 240690a_100020643023_200000016031 [1,1,0,0,0,0|1,0,1]=4 3426 B18R0.161 CCCNC(=O)CCCCCCCCC(=O)OCC 527a_100020643023_200000016031 [1,1,0,0,0,0|1,0,1]=4 3427 B18R0.161 CCCOC(C)CNCCCCCCC(=O)OCC 2230a_100015185124_100009814379 [1,1,0,0,0,0|2,0,0]=4 3428 B18R0.161 CCCOC(C)CNCCCCCCC(=O)OCC 34a_100015185124_100009814379 [1,1,0,0,0,0|2,0,0]=4 3429 B18R0.161 CCOC(=O)CCCCCCCCC(=O)CCCF 1458a_200000016031_100011934791 [1,1,0,0,0,0|1,0,1]=4 3430 B18R0.161 CCOC(=O)CCCCCCCCC(=O)CCCO 1458a_200000016031_100011215043 [1,1,0,0,0,0|1,0,1]=4 3431 B18R0.161 CCOC(=O)CCCCCCCCC(=O)CCOC 1458a_100000749529_100010175975 [1,1,0,0,0,0|1,0,1]=4 3432 B18R0.161 CCOC(=O)CCCCCCCCC(=O)CCOC 1458a_200000016031_100000233755 [1,1,0,0,0,0|1,0,1]=4 3433 B18R0.161 CCOC(=O)CCCCCCCCC(=O)CCSC 1458a_100000174002_100010175975 [1,1,0,0,0,0|1,0,1]=4 3434 B18R0.161 CCOC(=O)CCCCCCCCC(=O)CCSC 1458a_200000016031_100000751147 [1,1,0,0,0,0|1,0,1]=4 3435 B18R0.161 CCOC(=O)CCCCCCCCC(=O)CSCC 1458a_100000230394_100010175975 [1,1,0,0,0,0|1,0,1]=4 3436 B18R0.161 CCOC(=O)CCCCCCCCN(C)CCCO 2230a_100000213112_100010175975 [1,1,0,0,0,0|2,0,0]=4 3437 B18R0.161 CCOC(=O)CCCCCCCCN(C)CCCO 269982a_100000213112_100010175975 [1,1,0,0,0,0|2,0,0]=4 3438 B18R0.161 CCOC(=O)CCCCCCCCN(C)CCOC 2230a_100000743101_100010175975 [1,1,0,0,0,0|2,0,0]=4 3439 B18R0.161 CCOC(=O)CCCCCCCCN(C)CCOC 269982a_100000743101_100010175975 [1,1,0,0,0,0|2,0,0]=4 3440 B18R0.161 CCOC(=O)CCCCCCCCN(C)CCSC 2230a_100000686725_100010175975 [1,1,0,0,0,0|2,0,0]=4 3441 B18R0.161 CCOC(=O)CCCCCCCCN(C)CCSC 269982a_100000686725_100010175975 [1,1,0,0,0,0|2,0,0]=4 3442 B18R0.161 CCOC(=O)CCCCCCCOC(C)CCCCl 34a_200000718107_100009991516 [1,1,0,0,0,0|2,0,0]=4 3443 B18R0.161 CCOC(=O)CCCCCCCOC(C)CCCCl 7a_200000718107_100009991516 [1,1,0,0,0,0|2,0,0]=4 3444 B18R0.161 CCOC(=O)CCCCCCNC[C@H](C)CCCO 2230a_100160569302_100009814379 [1,1,0,0,0,0|2,0,0]=4 3445 B18R0.161 CCOC(=O)CCCCCCNC[C@H](C)CCCO 34a_100160569302_100009814379 [1,1,0,0,0,0|2,0,0]=4 3446 B18R0.161 CCOC(=O)CCCCCCOC[C@@H](N)CCSC 34a_100011827619_100009814379 [1,1,0,0,0,0|2,0,0]=4 3447 B18R0.161 CCOCC(=O)CCCCCCCCC(=O)OCC 1458a_100000211967_100010175975 [1,1,0,0,0,0|1,0,1]=4 3448 B18R0.161 CCOCC(C)OCCCCCCCC(=O)OCC 34a_100000718985_100009991516 [1,1,0,0,0,0|2,0,0]=4 3449 B18R0.161 CCOCC(C)OCCCCCCCC(=O)OCC 7a_100000718985_100009991516 [1,1,0,0,0,0|2,0,0]=4 3450 B18R0.161 CCOCC(O)CNCCCCCCC(=O)OCC 2230a_102515437182_100009814379 [1,1,0,0,0,0|2,0,0]=4 3451 B18R0.161 CCOCC(O)CNCCCCCCC(=O)OCC 34a_102515437182_100009814379 [1,1,0,0,0,0|2,0,0]=4 3452 B18R0.166 CCCCCC(=O)CCCCCCCC(=O)OCC 1458a_100000212188_100009991516 [1,1,0,0,0,0|0,0,1]=3 3453 B18R0.166 CCCCCC(=O)COCCCCCC(=O)OCC 7a_100011214988_200012276598 [1,1,0,0,0,0|1,0,1]=4 3454 B18R0.166 CCCCCC(=O)CSCCCCCC(=O)OCC 62a_100000755133_200012276598 [1,1,0,0,0,0|1,0,1]=4 3455 B18R0.166 CCCCCC(=O)CSCCCCCC(=O)OCC 62a_200012276598_100000755133 [1,1,0,0,0,0|1,0,1]=4 3456 B18R0.166 CCCCCC(=O)NCCCCCCC(=O)OCC 188690a_100000741137_100000212188 [1,1,0,0,0,0|1,0,1]=4 3457 B18R0.166 CCCCCC(C)NCCCCCCC(=O)OCC 2230a_100000211957_100009814379 [1,1,0,0,0,0|1,0,0]=3 3458 B18R0.166 CCCCCC(C)OCCCCCCC(=O)OCC 34a_100011215632_100009814379 [1,1,0,0,0,0|1,0,0]=3 3459 B18R0.166 CCCCCC(C)OCCCCCCC(=O)OCC 7a_100011215632_100009814379 [1,1,0,0,0,0|1,0,0]=3 3460 B18R0.166 CCCCCN(C)CCCCCCCC(=O)OCC 2230a_100000223495_100009991516 [1,1,0,0,0,0|1,0,0]=3 3461 B18R0.166 CCCCCN(C)CCCCCCCC(=O)OCC 269982a_100000223495_100009991516 [1,1,0,0,0,0|1,0,0]=3 3462 B18R0.166 CCCOCC(=O)CCCCCCCC(=O)OCC 1458a_100000745993_100009991516 [1,1,0,0,0,0|1,0,1]=4 3463 B18R0.166 CCCSCC(=O)CCCCCCCC(=O)OCC 1458a_100000217233_100009991516 [1,1,0,0,0,0|1,0,1]=4 3464 B18R0.166 CCOC(=O)CCCCCCCC(=O)CCCCO 1458a_100000695505_100009991516 [1,1,0,0,0,0|1,0,1]=4 3465 B18R0.166 CCOC(=O)CCCCCCCC(=O)CCCOC 1458a_100000741012_100009991516 [1,1,0,0,0,0|1,0,1]=4 3466 B18R0.166 CCOC(=O)CCCCCCCC(=O)CCCSC 1458a_100000173376_100009991516 [1,1,0,0,0,0|1,0,1]=4 3467 B18R0.166 CCOC(=O)CCCCCCCC(=O)CCSCC 1458a_100000230768_100009991516 [1,1,0,0,0,0|1,0,1]=4 3468 B18R0.166 CCOC(=O)CCCCCCCN(C)CCCCO 2230a_100000717598_100009991516 [1,1,0,0,0,0|2,0,0]=4 3469 B18R0.166 CCOC(=O)CCCCCCCN(C)CCCCO 269982a_100000717598_100009991516 [1,1,0,0,0,0|2,0,0]=4 3470 B18R0.166 CCOC(=O)CCCCCCCN(C)CCCOC 2230a_100000224831_100009991516 [1,1,0,0,0,0|2,0,0]=4 3471 B18R0.166 CCOC(=O)CCCCCCCN(C)CCCOC 269982a_100000224831_100009991516 [1,1,0,0,0,0|2,0,0]=4 3472 B18R0.166 CCOC(=O)CCCCCCOC(C)CCCOC 34a_200011539412_100009814379 [1,1,0,0,0,0|2,0,0]=4 3473 B18R0.166 CCOC(=O)CCCCCCOC(C)CCCOC 7a_200011539412_100009814379 [1,1,0,0,0,0|2,0,0]=4 3474 B18R0.166 CCOC(=O)CCCCCOC[C@@H](N)CCCCN 34a_100016993712_100000755133 [1,1,0,0,0,0|2,0,0]=4 3475 B18R0.166 CCOCCC(=O)CCCCCCCC(=O)OCC 1458a_100000749530_100009991516 [1,1,0,0,0,0|1,0,1]=4 3476 B18R0.177 C=C(CNCCCCCCCCCC)C(=O)OCC 34a_100000684558_100000755967 [1,1,0,0,0,0|1,0,1]=4 3477 B18R0.177 C=C(COCCCCCCCCCC)C(=O)OCC 34a_100000210711_100000755967 [1,1,0,0,0,0|1,0,1]=4 3478 B18R0.177 C=C(COCCCCCCCCCC)C(=O)OCC 7a_100000210711_100000755967 [1,1,0,0,0,0|1,0,1]=4 3479 B18R0.177 C=C(CSCCCCCCCCCC)C(=O)OCC 62a_100000755967_100000210320 [1,1,0,0,0,0|1,0,1]=4 3480 B18R0.177 CCCCCCCCCCCCC(=O)C(=O)NCC 1458a_200011297158_100000759014 [1,1,0,0,0,0|1,0,1]=4 3481 B18R0.177 CCCCCCCCCCCCC(C)C(=O)CCO 1458a_100011216618_200011217028 [1,1,0,0,0,0|2,0,0]=4 3482 B18R0.177 CCCCCCCCCCCCN(C)C(=O)NCC 2708a_100015525214_100000227908 [1,1,0,0,0,0|2,0,0]=4 3483 B18R0.177 CCCCCCCCCCCCN(C)C(=O)NCC 273464a_100015525214_100000227908 [1,1,0,0,0,0|2,0,0]=4 3484 B18R0.177 CCCCCCCCCCCNC(=O)C(=O)OCC 11a_200011215754_100014798877 [1,1,0,0,0,0|1,0,1]=4 3485 B18R0.177 CCCCCCCCCCCNC(=O)C(=O)OCC 1626a_200011215754_100014798877 [1,1,0,0,0,0|1,0,1]=4 3486 B18R0.177 CCCCCCCCCCCNC(=O)C(=O)OCC 240690a_200011215754_100014798877 [1,1,0,0,0,0|1,0,1]=4 3487 B18R0.177 CCCCCCCCCCCNC(C)C(=O)NCC 2230a_100000736553_100011215454 [1,1,0,0,0,0|2,0,0]=4 3488 B18R0.177 CCCCCCCCCCCNC(C)C(=O)NCC 2230a_200011215754_100000230173 [1,1,0,0,0,0|2,0,0]=4 3489 B18R0.177 CCCCCCCCCCCNC(C)C(=O)NCC 34a_100000736553_100011215454 [1,1,0,0,0,0|2,0,0]=4 3490 B18R0.177 CCCCCCCCCCCNC(C)C(=O)NCC 34a_200011215754_100000230173 [1,1,0,0,0,0|2,0,0]=4 3491 B18R0.177 CCCCCCCCCCCNC(C)C(=O)OCC 2230a_200011215754_100011215307 [1,1,0,0,0,0|1,0,0]=3 3492 B18R0.177 CCCCCCCCCCCNC(C)C(=O)OCC 34a_200011215754_100011216346 [1,1,0,0,0,0|1,0,0]=3 3493 B18R0.177 CCCCCCCCCCCNC(F)C(=O)OCC 2230a_200011215754_100000760018 [1,1,0,0,0,0|1,0,0]=3 3494 B18R0.177 CCCCCCCCCCCNC(F)C(=O)OCC 34a_200011215754_100000760018 [1,1,0,0,0,0|1,0,0]=3 3495 B18R0.177 CCCCCCCCCCCN[C@@H](C)C(=O)SCC 2230a_100103168634_100011215454 [1,1,0,0,0,0|1,1,0]=4 3496 B18R0.177 CCCCCCCCCCCOC(C)C(=O)NCC 34a_100000210809_100000230173 [1,1,0,0,0,0|2,0,0]=4 3497 B18R0.177 CCCCCCCCCCCOC(C)C(=O)NCC 7a_100000210809_100000230173 [1,1,0,0,0,0|2,0,0]=4 3498 B18R0.177 CCCCCCCCCCCOC(C)C(=O)OCC 34a_100000210809_100011216346 [1,1,0,0,0,0|1,0,0]=3 3499 B18R0.177 CCCCCCCCCCCOC(C)C(=O)OCC 7a_100000210809_100011216346 [1,1,0,0,0,0|1,0,0]=3 3500 B18R0.177 CCCCCCCCCCCOC(F)C(=O)OCC 34a_100000210809_100000760018 [1,1,0,0,0,0|1,0,0]=3 3501 B18R0.177 CCCCCCCCCCCOC(F)C(=O)OCC 7a_100000210809_100000040065 [1,1,0,0,0,0|1,0,0]=3 3502 B18R0.177 CCCCCCCCCCCO[C@@H](C)C(=O)OCC 7a_100000751109_100011215454 [1,1,0,0,0,0|1,0,0]=3 3503 B18R0.177 CCCCCCCCCCCSC(C)C(=O)NCC 62a_100000230173_100011215454 [1,1,0,0,0,0|2,0,0]=4 3504 B18R0.177 CCCCCCCCCCSCC(=O)C(=O)OCC 62a_100000211299_100000210320 [1,1,0,0,0,0|1,0,1]=4 3505 B18R0.177 CCCCCCNCCCCCC(=O)C(=O)OCC 2230a_100000210581_100000068741 [1,1,0,0,0,0|1,0,1]=4 3506 B18R0.177 CCCCCCSCCCCCC(=O)C(=O)OCC 62a_100000210314_100000068741 [1,1,0,0,0,0|1,0,1]=4 3507 B18R0.177 CCOC(=O)C(C)NCCCCCCCCCCO 2230a_100000066964_100011215307 [1,1,0,0,0,0|2,0,0]=4 3508 B18R0.177 CCOC(=O)C(C)NCCCCCCCCCCO 34a_100000066964_100011216346 [1,1,0,0,0,0|2,0,0]=4 3509 B18R0.177 CCOC(=O)C(C)OCCCCCCCCCCBr 34a_100009813290_100011216346 [1,1,0,0,0,0|2,0,0]=4 3510 B18R0.177 CCOC(=O)C(C)OCCCCCCCCCCBr 7a_100009813290_100011216346 [1,1,0,0,0,0|2,0,0]=4 3511 B18R0.177 CCOC(=O)C(C)OCCCCCCCCCCCl 34a_200000033068_100011216346 [1,1,0,0,0,0|2,0,0]=4 3512 B18R0.177 CCOC(=O)C(C)OCCCCCCCCCCCl 7a_200000033068_100011216346 [1,1,0,0,0,0|2,0,0]=4 3513 B18R0.177 CCOC(=O)C(C)OCCCCCCCCCCN 34a_100000066964_100011216346 [1,1,0,0,0,0|2,0,0]=4 3514 B18R0.177 CCOC(=O)C(C)SCCCCCCCCCCO 62a_100009813290_100011216346 [1,1,0,0,0,0|2,0,0]=4 3515 B18R0.177 CCOC(=O)C(C)SCCCCCCCCCCO 62a_100011216346_200000033068 [1,1,0,0,0,0|2,0,0]=4 3516 B18R0.177 CCOC(=O)C(F)NCCCCCCCCCCO 2230a_100000066964_100000760018 [1,1,0,0,0,0|2,0,0]=4 3517 B18R0.177 CCOC(=O)C(F)NCCCCCCCCCCO 34a_100000066964_100000760018 [1,1,0,0,0,0|2,0,0]=4 3518 B18R0.177 CCOC(=O)C(F)OCCCCCCCCCCBr 34a_100009813290_100000760018 [1,1,0,0,0,0|2,0,0]=4 3519 B18R0.177 CCOC(=O)C(F)OCCCCCCCCCCBr 7a_100009813290_100000040065 [1,1,0,0,0,0|2,0,0]=4 3520 B18R0.177 CCOC(=O)C(F)OCCCCCCCCCCCl 34a_200000033068_100000760018 [1,1,0,0,0,0|2,0,0]=4 3521 B18R0.177 CCOC(=O)C(F)OCCCCCCCCCCCl 7a_200000033068_100000040065 [1,1,0,0,0,0|2,0,0]=4 3522 B18R0.177 CCOC(=O)C(F)OCCCCCCCCCCN 34a_100000066964_100000760018 [1,1,0,0,0,0|2,0,0]=4 3523 B18R0.177 CCOC(=O)C(F)SCCCCCCCCCCO 62a_100000760018_200000033068 [1,1,0,0,0,0|2,0,0]=4 3524 B18R0.177 CCOC(=O)C(F)SCCCCCCCCCCO 62a_100009813290_100000760018 [1,1,0,0,0,0|2,0,0]=4 3525 B18R0.177 CCOC(=O)[C@H](C)OCCCCCCCCCCO 7a_100000751109_100009813290 [1,1,0,0,0,0|2,0,0]=4 3526 B18R0.189 CCC(C)C(=O)CCCCCCCCCCCCO 1458a_100011192722_100009813331 [1,1,0,0,0,0|2,0,0]=4 3527 B18R0.189 CCC(O)C(=O)CCCCCCCCCCCCO 1458a_100011196387_100009813331 [1,1,0,0,0,0|2,0,0]=4 3528 B18R0.189 CCCCCCCCCCCCCC(=O)C(=O)NC 1458a_100011218921_100000210684 [1,1,0,0,0,0|2,0,0]=4 3529 B18R0.189 CCCCCCCCCCCCCC(=O)C(O)CO 1458a_100011215603_100000210684 [1,1,0,0,0,0|2,0,0]=4 3530 B18R0.189 CCCCCCCCCCCCNC(=O)C(O)CC 240690a_100000210451_100011196387 [1,1,0,0,0,0|2,0,0]=4 3531 B18R0.189 CCCCCCCCCCCCNC(=O)N(C)CC 2708a_100000210451_100000225621 [1,1,0,0,0,0|2,0,0]=4 3532 B18R0.189 CCCCCCCCCCCCNC(=O)N(C)CC 273464a_100000210451_100000225621 [1,1,0,0,0,0|2,0,0]=4 3533 B18R0.189 CCCCCCCCCCCNCC(=O)N(C)CC 2230a_200011215754_100000738999 [1,1,0,0,0,0|2,0,0]=4 3534 B18R0.189 CCCCCCCCCCCNCC(=O)N(C)CC 34a_200011215754_100000738999 [1,1,0,0,0,0|2,0,0]=4 3535 B18R0.189 CCCCCCCCCCCOCC(=O)N(C)CC 34a_100000210809_100000738999 [1,1,0,0,0,0|2,0,0]=4 3536 B18R0.189 CCCCCCCCCCCOCC(=O)N(C)CC 7a_100000210809_100000738999 [1,1,0,0,0,0|2,0,0]=4 3537 B18R0.189 CCCCCCCCCCCSCC(=O)N(C)CC 62a_100000738999_100011215454 [1,1,0,0,0,0|2,0,0]=4 3538 B18R0.189 CCN(C)C(=O)CCCCCCCCCCCCO 240690a_100000225621_100102582631 [1,1,0,0,0,0|2,0,0]=4 3539 B18R0.1436 CCOC(=O)CCCCCCCCCCC(=O)CC 1458a_100000210414_100009827693 [1,1,0,0,0,0|0,0,1]=3 3540 B18R0.1436 CCOC(=O)CCCCCCCCCCC(=O)CC 1458a_200020656980_100000210202 [1,1,0,0,0,0|0,0,1]=3 3541 B18R0.1436 CCOC(=O)CCCCCCCCCCC(=O)CF 1458a_200020656980_100015361967 [1,1,0,0,0,0|1,0,1]=4 3542 B18R0.1436 CCOC(=O)CCCCCCCCCCC(=O)CO 1458a_100000210174_100009827693 [1,1,0,0,0,0|1,0,1]=4 3543 B18R0.1436 CCOC(=O)CCCCCCCCCCC(=O)NC 11a_106832991635_200020656980 [1,1,0,0,0,0|1,0,1]=4 3544 B18R0.1436 CCOC(=O)CCCCCCCCCCC(=O)NC 1626a_100102657272_200020656980 [1,1,0,0,0,0|1,0,1]=4 3545 B18R0.1436 CCOC(=O)CCCCCCCCCCC(=O)NC 240690a_100102657272_200020656980 [1,1,0,0,0,0|1,0,1]=4 3546 B18R0.1436 CCOC(=O)CCCCCCCCCCN(C)CC 2230a_100000225621_100009827693 [1,1,0,0,0,0|1,0,0]=3 3547 B18R0.1436 CCOC(=O)CCCCCCCCCCN(C)CC 269982a_100000225621_100009827693 [1,1,0,0,0,0|1,0,0]=3 3548 B18R0.1436 CCOC(=O)CCCCCCCCCNC(C)CC 2230a_100000209981_100009828014 [1,1,0,0,0,0|1,0,0]=3 3549 B18R0.1436 CCOC(=O)CCCCCCCCCN[C@H](C)CO 2230a_100000737577_100009828014 [1,1,0,0,0,0|2,0,0]=4 3550 B18R0.1436 CCOC(=O)CCCCCCCCCOC(C)CC 7a_100000210228_100009828014 [1,1,0,0,0,0|1,0,0]=3 3551 B18R0.1436 CCOC(=O)CCCCCCCCCOC(C)CF 34a_100016041109_100009828014 [1,1,0,0,0,0|2,0,0]=4 3552 B18R0.1436 CCOC(=O)CCCCCCCCCOC(C)CF 7a_100016041109_100009828014 [1,1,0,0,0,0|2,0,0]=4 3553 B18R0.1436 CCOC(=O)CCCCCCCCCOC(C)CN 34a_100000210904_100009828014 [1,1,0,0,0,0|2,0,0]=4 3554 B18R0.1436 CCOC(=O)CCCCCCCCCSC(C)CO 62a_100012180447_100009828014 [1,1,0,0,0,0|2,0,0]=4 3555 B18R0.1436 CCOC(=O)CCCCCCCCCSC(C)OC 62a_100009879195_100009828014 [1,1,0,0,0,0|2,0,0]=4 3556 B18R0.1436 CCOC(=O)CCCCCCCCCS[C@H](C)CO 62a_100016084084_100009828014 [1,1,0,0,0,0|2,0,0]=4 3557 B18R0.1436 CCOC(=O)CCCCCCCCNCC(C)CC 2230a_100020588543_100010175975 [1,1,0,0,0,0|1,0,0]=3 3558 B18R0.1436 CCOC(=O)CCCCCCCCNCC(C)CO 34a_100000744482_100010175975 [1,1,0,0,0,0|2,0,0]=4 3559 B18R0.1436 CCOC(=O)CCCCCCCCNCC(O)CC 2230a_100011218483_100010175975 [1,1,0,0,0,0|1,0,0]=3 3560 B18R0.1436 CCOC(=O)CCCCCCCCNC[C@@H](C)OC 2230a_100020591295_100010175975 [1,1,0,0,0,0|2,0,0]=4 3561 B18R0.1436 CCOC(=O)CCCCCCCCNC[C@@H](F)CO 34a_100015665980_100010175975 [1,1,0,0,0,0|2,0,0]=4 3562 B18R0.1436 CCOC(=O)CCCCCCCCNC[C@H](O)CO 2230a_100020644852_100010175975 [1,1,0,0,0,0|2,0,0]=4 3563 B18R0.1436 CCOC(=O)CCCCCCCCOCC(=O)CC 34a_100000725409_100010175975 [1,1,0,0,0,0|1,0,1]=4 3564 B18R0.1436 CCOC(=O)CCCCCCCCOCC(C)CN 34a_100000744482_100010175975 [1,1,0,0,0,0|2,0,0]=4 3565 B18R0.1436 CCOC(=O)CCCCCCCCOCC(C)OC 34a_100000690652_100010175975 [1,1,0,0,0,0|2,0,0]=4 3566 B18R0.1436 CCOC(=O)CCCCCCCCOCC(Cl)CCl 34a_100000033668_100010175975 [1,1,0,0,0,0|2,0,0]=4 3567 B18R0.1436 CCOC(=O)CCCCCCCCOC[C@@H](C)CC 7a_100009816381_100010175975 [1,1,0,0,0,0|1,0,0]=3 3568 B18R0.1436 CCOC(=O)CCCCCCCCOC[C@H](F)CN 34a_100015665980_100010175975 [1,1,0,0,0,0|2,0,0]=4 3569 B18R0.1436 CCOC(=O)CCCCCCCCSCC(=O)CC 62a_100000747405_100010175975 [1,1,0,0,0,0|1,0,1]=4 3570 B18R0.1436 CCOC(=O)CCCCCCCCSCC(O)CC 62a_100011218378_100010175975 [1,1,0,0,0,0|1,0,0]=3 3571 B18R0.1436 CCOC(=O)CCCCCCCCSCC(O)CO 62a_100011219619_100010175975 [1,1,0,0,0,0|2,0,0]=4 3572 B18R0.1436 CCOC(=O)CCCCCCCCSC[C@@H](C)CO 62a_100000059175_100010175975 [1,1,0,0,0,0|2,0,0]=4 3573 B18R0.1436 CCOC(=O)CCCCCCCCSC[C@@H](O)CF 62a_100015614560_100010175975 [1,1,0,0,0,0|2,0,0]=4 3574 B18R0.1436 CCOC(=O)CCCCCCCCSC[C@@H](O)CO 62a_100009815848_100010175975 [1,1,0,0,0,0|2,0,0]=4 3575 B18R0.1436 CCOC(=O)CCCCCCCNCCC(C)CC 2230a_100020591266_100009991516 [1,1,0,0,0,0|1,0,0]=3 3576 B18R0.1436 CCOC(=O)CCCCCCCNCCC(C)CO 2230a_106354213184_100009991516 [1,1,0,0,0,0|2,0,0]=4 3577 B18R0.1436 CCOC(=O)CCCCCCCNCCC(C)CO 34a_106354213184_100009991516 [1,1,0,0,0,0|2,0,0]=4 3578 B18R0.1436 CCOC(=O)CCCCCCCOCCC(C)CC 7a_100011215188_100009991516 [1,1,0,0,0,0|1,0,0]=3 3579 B18R0.1436 CCOC(=O)CCCCCCCOCCC(C)OC 7a_100000764861_100009991516 [1,1,0,0,0,0|2,0,0]=4 3580 B18R0.1436 CCOC(=O)CCCCCCOCCCC(C)CC 7a_100011216074_100009814379 [1,1,0,0,0,0|1,0,0]=3 3581 B18R0.1436 CCOC(=O)CCCCCCOCCC[C@@H](C)CN 34a_100160569302_100009814379 [1,1,0,0,0,0|2,0,0]=4 3582 B18R0.1436 CCOC(=O)CCCCOCCCCCC(C)CC 7a_200000035636_100000750268 [1,1,0,0,0,0|1,0,0]=3 3583 B18R0.1436 CCOC(=O)COCCOCCCCCC(C)CC 7a_200000035636_100000088970 [1,1,0,0,0,0|2,0,0]=4 3584 B18R0.3155 C#CCNC(=O)CCCCCCCCCCCCC 11a_100000212058_100000756256 [1,1,0,0,0,0|1,0,1]=4 3585 B18R0.3155 C#CCNC(=O)CCCCCCCCCCCCC 1626a_100000212058_100000756256 [1,1,0,0,0,0|1,0,1]=4 3586 B18R0.3155 C#CCNC(=O)CCCCCCCCCCCCC 240690a_100000212058_100000756256 [1,1,0,0,0,0|1,0,1]=4 3587 B18R0.3155 C=CCNC(=O)CCCCCCCCCCCCC 1626a_100020586998_100000756256 [1,1,0,0,0,0|1,0,1]=4 3588 B18R0.3155 C=CCNC(=O)CCCCCCCCCCCCC 240690a_100020586998_100000756256 [1,1,0,0,0,0|1,0,1]=4 3589 B18R0.3155 C=CCOC(=O)CNCCCCCCCCCCC 2230a_200011215754_100000033060 [1,1,0,0,0,0|1,0,1]=4 3590 B18R0.3155 C=CCOC(=O)CNCCCCCCCCCCC 34a_200011215754_100000033060 [1,1,0,0,0,0|1,0,1]=4 3591 B18R0.3155 C=CCOC(=O)COCCCCCCCCCCC 34a_100000210809_100000033060 [1,1,0,0,0,0|1,0,1]=4 3592 B18R0.3155 C=CCOC(=O)COCCCCCCCCCCC 7a_100000210809_100000033060 [1,1,0,0,0,0|1,0,1]=4 3593 B18R0.3155 C=CCOC(=O)CSCCCCCCCCCCC 62a_100000033060_100011215454 [1,1,0,0,0,0|1,0,1]=4 3594 B18R0.3155 CCC#CC(=O)CCCCCCCCCCCCO 1458a_100011827653_100009813331 [1,1,0,0,0,0|2,0,0]=4 3595 B18R0.3155 CCC=CC(=O)CCCCCCCCCCCCO 1458a_100000212282_100009813331 [1,1,0,0,0,0|2,0,0]=4 3596 B18R0.3155 CCC=CC(=O)NCCCCCCCCCCCC 11a_100000210451_100000212282 [1,1,0,0,0,0|2,0,0]=4 3597 B18R0.3155 CCC=CC(=O)NCCCCCCCCCCCC 1626a_100000210451_100000212282 [1,1,0,0,0,0|2,0,0]=4 3598 B18R0.3155 CCC=CC(=O)NCCCCCCCCCCCC 240690a_100000210451_100000212282 [1,1,0,0,0,0|2,0,0]=4 3599 B18R0.3155 CCCCCCCCCCCCCC(=O)C#CCO 1458a_100000049017_100000210684 [1,1,0,0,0,0|1,0,1]=4 3600 B18R0.3155 CCCCCCCCCCCCCC(=O)NCC#N 1626a_100000734998_100000756256 [1,1,0,0,0,0|1,0,1]=4 3601 B18R0.3155 CCCCCCCCCCCCCC(=O)NCCF 11a_100000724931_100000756256 [1,1,0,0,0,0|1,0,0]=3 3602 B18R0.3155 CCCCCCCCCCCCCC(=O)NCCF 1626a_100000724931_100000756256 [1,1,0,0,0,0|1,0,0]=3 3603 B18R0.3155 CCCCCCCCCCCCCC(=O)NCCF 240690a_100000724931_100000756256 [1,1,0,0,0,0|1,0,0]=3 3604 B18R0.3155 CCCCCCCCCCCCCC(=O)NCCO 240690a_100000210304_100000756256 [1,1,0,0,0,0|1,0,0]=3 3605 B18R0.3155 CCCCCCCCCCCCCC(=O)NNCC 22a_100000756455_100000756256 [1,1,0,0,0,0|1,0,0]=3 3606 B18R0.3155 CCCCCCCCCCCCNC(=O)CCOC 11a_100000210451_100000749529 [1,1,0,0,0,0|2,0,0]=4 3607 B18R0.3155 CCCCCCCCCCCCNC(=O)CCOC 1626a_100000210451_100000749529 [1,1,0,0,0,0|2,0,0]=4 3608 B18R0.3155 CCCCCCCCCCCCNC(=O)CCOC 240690a_100000210451_100000749529 [1,1,0,0,0,0|2,0,0]=4 3609 B18R0.3155 CCCCCCCCCCCCNC(=O)CCOC 527a_100000210451_100000749529 [1,1,0,0,0,0|2,0,0]=4 3610 B18R0.3155 CCCCCCCCCCCCNC(=O)CCSC 11a_100000210451_100000174002 [1,1,0,0,0,0|2,0,0]=4 3611 B18R0.3155 CCCCCCCCCCCCNC(=O)CCSC 1626a_100000210451_100000174002 [1,1,0,0,0,0|2,0,0]=4 3612 B18R0.3155 CCCCCCCCCCCCNC(=O)CCSC 240690a_100000210451_100000174002 [1,1,0,0,0,0|2,0,0]=4 3613 B18R0.3155 CCCCCCCCCCCCNC(=O)CCSC 527a_100000210451_100000174002 [1,1,0,0,0,0|2,0,0]=4 3614 B18R0.3155 CCCCCCCCCCCCNC(=O)COCC 11a_100000210451_100000211967 [1,1,0,0,0,0|1,0,0]=3 3615 B18R0.3155 CCCCCCCCCCCCNC(=O)COCC 1626a_100000210451_100000211967 [1,1,0,0,0,0|1,0,0]=3 3616 B18R0.3155 CCCCCCCCCCCCNC(=O)COCC 240690a_100000210451_100000211967 [1,1,0,0,0,0|1,0,0]=3 3617 B18R0.3155 CCCCCCCCCCCCNC(=O)COCC 527a_100000210451_100000211967 [1,1,0,0,0,0|1,0,0]=3 3618 B18R0.3155 CCCCCCCCCCCCNC(=O)CSCC 11a_100000210451_100000230394 [1,1,0,0,0,0|1,1,0]=4 3619 B18R0.3155 CCCCCCCCCCCCNC(=O)CSCC 1626a_100000210451_100000230394 [1,1,0,0,0,0|1,1,0]=4 3620 B18R0.3155 CCCCCCCCCCCCNC(=O)CSCC 240690a_100000210451_100000230394 [1,1,0,0,0,0|1,1,0]=4 3621 B18R0.3155 CCCCCCCCCCCCNC(=O)CSCC 527a_100000210451_100000230394 [1,1,0,0,0,0|1,1,0]=4 3622 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCC 2708a_100000210451_100020643023 [1,1,0,0,0,0|2,0,0]=4 3623 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCC 2708a_100020643023_100000210451 [1,1,0,0,0,0|2,0,0]=4 3624 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCC 273464a_100000210451_100020643023 [1,1,0,0,0,0|2,0,0]=4 3625 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCC 273464a_100020643023_100000210451 [1,1,0,0,0,0|2,0,0]=4 3626 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCC 512a_100000210451_100020643023 [1,1,0,0,0,0|2,0,0]=4 3627 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCC 512a_100020643023_100000210451 [1,1,0,0,0,0|2,0,0]=4 3628 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCF 2708a_100000210451_100000724931 [1,1,0,0,0,0|2,0,0]=4 3629 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCF 273464a_100000210451_100000724931 [1,1,0,0,0,0|2,0,0]=4 3630 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCF 273464a_100000724931_100000210451 [1,1,0,0,0,0|2,0,0]=4 3631 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCF 512a_100000210451_100000724931 [1,1,0,0,0,0|2,0,0]=4 3632 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCO 2708a_100000210451_100000210304 [1,1,0,0,0,0|2,0,0]=4 3633 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCO 273464a_100000210304_100000210451 [1,1,0,0,0,0|2,0,0]=4 3634 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCO 273464a_100000210451_100000210304 [1,1,0,0,0,0|2,0,0]=4 3635 B18R0.3155 CCCCCCCCCCCCNC(=O)NCCO 512a_100000210451_100000210304 [1,1,0,0,0,0|2,0,0]=4 3636 B18R0.3155 CCCCCCCCCCCCNC(=O)NNCC 273464a_100000210451_100000756455 [1,1,0,0,0,0|2,0,0]=4 3637 B18R0.3155 CCCCCCCCCCCCNC(=O)NNCC 512a_100000210451_100000756455 [1,1,0,0,0,0|2,0,0]=4 3638 B18R0.3155 CCCCCCCCCCCCNC(=O)NNCC 512a_100000756455_100000210451 [1,1,0,0,0,0|2,0,0]=4 3639 B18R0.3155 CCCCCCCCCCCNCC(=O)NCCC 2230a_100000174927_100011215454 [1,1,0,0,0,0|2,0,0]=4 3640 B18R0.3155 CCCCCCCCCCCNCC(=O)NCCC 2230a_200011215754_100000183358 [1,1,0,0,0,0|2,0,0]=4 3641 B18R0.3155 CCCCCCCCCCCNCC(=O)NCCC 34a_200011215754_100000183358 [1,1,0,0,0,0|2,0,0]=4 3642 B18R0.3155 CCCCCCCCCCCNCC(=O)NCCF 2230a_100000725713_100011215454 [1,1,0,0,0,0|2,0,0]=4 3643 B18R0.3155 CCCCCCCCCCCNCC(=O)OCCC 2230a_200011215754_200011215008 [1,1,0,0,0,0|1,0,0]=3 3644 B18R0.3155 CCCCCCCCCCCNCC(=O)OCCC 34a_200011215754_200011215008 [1,1,0,0,0,0|1,0,0]=3 3645 B18R0.3155 CCCCCCCCCCCOCC(=O)NCCC 34a_100000210809_100000183358 [1,1,0,0,0,0|2,0,0]=4 3646 B18R0.3155 CCCCCCCCCCCOCC(=O)NCCC 7a_100000210809_100000183358 [1,1,0,0,0,0|2,0,0]=4 3647 B18R0.3155 CCCCCCCCCCCOCC(=O)OCCC 34a_100000210809_200011215008 [1,1,0,0,0,0|1,0,0]=3 3648 B18R0.3155 CCCCCCCCCCCOCC(=O)OCCC 7a_100000210809_200011215008 [1,1,0,0,0,0|1,0,0]=3 3649 B18R0.3155 CCCCCCCCCCCSCC(=O)NCCC 62a_100000183358_100011215454 [1,1,0,0,0,0|2,0,0]=4 3650 B18R0.3155 CCCCCCCCCCNCOC(=O)OCCC 34a_100000684558_200000139673 [1,1,0,0,0,0|2,0,0]=4 3651 B18R0.3155 CCCCCCCCCCOCOC(=O)OCCC 34a_100000210711_200000139673 [1,1,0,0,0,0|2,0,0]=4 3652 B18R0.3155 CCCCCCCCCCOCOC(=O)OCCC 7a_100000210711_200000139673 [1,1,0,0,0,0|2,0,0]=4 3653 B18R0.3155 CCCCCCCCCNCCCC(=O)NCCC 2230a_100000212291_100011194427 [1,1,0,0,0,0|2,0,0]=4 3654 B18R0.3155 CCCCCCCCCOCCCC(=O)NCCC 7a_100000210712_100011194427 [1,1,0,0,0,0|2,0,0]=4 3655 B18R0.3155 CCCCCCCCCSCCCC(=O)NCCC 62a_100011194427_100000210670 [1,1,0,0,0,0|2,0,0]=4 3656 B18R0.3155 CCCNC(=O)CCCCCCCCCCCCO 240690a_100020643023_100102582631 [1,1,0,0,0,0|2,0,0]=4 3657 B18R0.3155 CCCOC(=O)CNCCCCCCCCCCO 2230a_100000066964_200011215008 [1,1,0,0,0,0|2,0,0]=4 3658 B18R0.3155 CCCOC(=O)CNCCCCCCCCCCO 34a_100000066964_200011215008 [1,1,0,0,0,0|2,0,0]=4 3659 B18R0.3155 CCCOC(=O)COCCCCCCCCCCBr 34a_100009813290_200011215008 [1,1,0,0,0,0|2,0,0]=4 3660 B18R0.3155 CCCOC(=O)COCCCCCCCCCCBr 7a_100009813290_200011215008 [1,1,0,0,0,0|2,0,0]=4 3661 B18R0.3155 CCCOC(=O)COCCCCCCCCCCCl 34a_200000033068_200011215008 [1,1,0,0,0,0|2,0,0]=4 3662 B18R0.3155 CCCOC(=O)COCCCCCCCCCCCl 7a_200000033068_200011215008 [1,1,0,0,0,0|2,0,0]=4 3663 B18R0.3155 CCCOC(=O)COCCCCCCCCCCN 34a_100000066964_200011215008 [1,1,0,0,0,0|2,0,0]=4 3664 B18R0.3155 CCCOC(=O)CSCCCCCCCCCCO 62a_100009813290_200011215008 [1,1,0,0,0,0|2,0,0]=4 3665 B18R0.3155 CCCOC(=O)CSCCCCCCCCCCO 62a_200011215008_200000033068 [1,1,0,0,0,0|2,0,0]=4 3666 B18R0.3155 CCNNC(=O)CCCCCCCCCCCCO 22a_100000756455_100102582631 [1,1,0,0,0,0|2,0,0]=4 3667 B18R0.3155 O=C(CCCCCCCCCCCCO)NCCF 240690a_100000724931_100102582631 [1,1,0,0,0,0|2,0,0]=4 3668 B18R0.3155 O=C(CCCCCCCCCCCCO)NCCO 240690a_100000210304_100102582631 [1,1,0,0,0,0|2,0,0]=4 3669 B18R0.11638 CCCCCCCCCC(=O)CCCC(=O)NCC 1458a_100000199580_100000210670 [1,1,0,0,0,0|1,0,1]=4 3670 B18R0.11638 CCCCCCCCCC(=O)CCCC(=O)OCC 1458a_100000210558_100011215271 [1,1,0,0,0,0|0,0,1]=3 3671 B18R0.11638 CCCCCCCCCC(=O)CCCC(=O)OCC 1458a_100000210991_100000210670 [1,1,0,0,0,0|0,0,1]=3 3672 B18R0.11638 CCCCCCCCCC(=O)CCNC(=O)OCC 1458a_100000210558_200011445536 [1,1,0,0,0,0|1,0,1]=4 3673 B18R0.11638 CCCCCCCCCC(=O)NCCC(=O)OCC 188690a_100000746078_100000210558 [1,1,0,0,0,0|1,0,1]=4 3674 B18R0.11638 CCCCCCCCCC(C)CNCC(=O)NCC 270004a_100016988866_200011218516 [1,1,0,0,0,0|2,0,0]=4 3675 B18R0.11638 CCCCCCCCCC(C)NCCC(=O)NCC 270004a_100025743525_100011215753 [1,1,0,0,0,0|2,0,0]=4 3676 B18R0.11638 CCCCCCCCCC(C)OCCC(=O)NCC 7a_100011218016_100000737597 [1,1,0,0,0,0|2,0,0]=4 3677 B18R0.11638 CCCCCCCCCC(C)OCCC(=O)OCC 34a_100011218016_100000765890 [1,1,0,0,0,0|1,0,0]=3 3678 B18R0.11638 CCCCCCCCCC(C)OCCC(=O)OCC 7a_100011218016_100011206558 [1,1,0,0,0,0|1,0,0]=3 3679 B18R0.11638 CCCCCCCCCN(C)CCCC(=O)OCC 2230a_100000232482_100009991533 [1,1,0,0,0,0|1,0,0]=3 3680 B18R0.11638 CCCCCCCCCN(C)CCCC(=O)OCC 269982a_100000232482_100009991533 [1,1,0,0,0,0|1,0,0]=3 3681 B18R0.11638 CCCCCCCCCN(C)CCNC(=O)OCC 269982a_100000232482_200011445536 [1,1,0,0,0,0|2,0,0]=4 3682 B18R0.11638 CCCCCCCCNC(=O)CCCC(=O)OCC 11a_100000229939_100000210991 [1,1,0,0,0,0|1,0,1]=4 3683 B18R0.11638 CCCCCCCCNC(=O)CCCC(=O)OCC 1626a_100000229939_100000210991 [1,1,0,0,0,0|1,0,1]=4 3684 B18R0.11638 CCCCCCCCNC(=O)CCCC(=O)OCC 240690a_100000229939_100000210991 [1,1,0,0,0,0|1,0,1]=4 3685 B18R0.11638 CCCCCCCCNC(=O)CCCC(=O)OCC 527a_100000229939_100000210991 [1,1,0,0,0,0|1,0,1]=4 3686 B18R0.11638 CCOC(=O)CCCC(=O)CCCCCCCCO 1458a_100000210991_100000033203 [1,1,0,0,0,0|1,0,1]=4 3687 B18R0.19210 CCCCCCCCCCC(=O)CCC(=O)NCC 1458a_100000199579_100000210319 [1,1,0,0,0,0|1,0,1]=4 3688 B18R0.19210 CCCCCCCCCCC(=O)CCC(=O)OCC 1458a_100000183558_100000210319 [1,1,0,0,0,0|0,0,1]=3 3689 B18R0.19210 CCCCCCCCCCC(=O)CNC(=O)OCC 1458a_100000190774_100000210319 [1,1,0,0,0,0|1,0,1]=4 3690 B18R0.19210 CCCCCCCCCCC(=O)NCC(=O)OCC 188690a_100000741813_100000210375 [1,1,0,0,0,0|1,0,1]=4 3691 B18R0.19210 CCCCCCCCCCC(C)NCC(=O)NCC 270004a_100016988866_200011219864 [1,1,0,0,0,0|2,0,0]=4 3692 B18R0.19210 CCCCCCCCCCC(C)OCC(=O)NCC 34a_100011215000_100000183381 [1,1,0,0,0,0|2,0,0]=4 3693 B18R0.19210 CCCCCCCCCCC(C)OCC(=O)NCC 7a_100011215000_100000183381 [1,1,0,0,0,0|2,0,0]=4 3694 B18R0.19210 CCCCCCCCCCC(C)OCC(=O)OCC 34a_100011215000_100000188475 [1,1,0,0,0,0|1,0,0]=3 3695 B18R0.19210 CCCCCCCCCCC(C)OCC(=O)OCC 7a_100011215000_100000188475 [1,1,0,0,0,0|1,0,0]=3 3696 B18R0.19210 CCCCCCCCCCN(C)CCC(=O)NCC 2230a_100000207566_100000737597 [1,1,0,0,0,0|2,0,0]=4 3697 B18R0.19210 CCCCCCCCCCN(C)CCC(=O)NCC 269982a_100000207566_100000737597 [1,1,0,0,0,0|2,0,0]=4 3698 B18R0.19210 CCCCCCCCCCN(C)CCC(=O)OCC 2230a_100000207566_100011206558 [1,1,0,0,0,0|1,0,0]=3 3699 B18R0.19210 CCCCCCCCCCN(C)CCC(=O)OCC 2230a_100000745921_100000210320 [1,1,0,0,0,0|1,0,0]=3 3700 B18R0.19210 CCCCCCCCCCN(C)CCC(=O)OCC 269982a_100000207566_100011206558 [1,1,0,0,0,0|1,0,0]=3 3701 B18R0.19210 CCCCCCCCCCN(C)CCC(=O)OCC 269982a_100000745921_100000210320 [1,1,0,0,0,0|1,0,0]=3 3702 B18R0.19210 CCCCCCCCCNC(=O)CCC(=O)OCC 11a_100000212291_100000183558 [1,1,0,0,0,0|1,0,1]=4 3703 B18R0.19210 CCCCCCCCCNC(=O)CCC(=O)OCC 1626a_100000212291_100000183558 [1,1,0,0,0,0|1,0,1]=4 3704 B18R0.19210 CCCCCCCCCNC(=O)CCC(=O)OCC 240690a_100000212291_100000183558 [1,1,0,0,0,0|1,0,1]=4 3705 B18R0.19210 CCCCCCCCCNC(C)CCC(=O)OCC 2230a_100000212291_100000748298 [1,1,0,0,0,0|1,0,0]=3 3706 B18R0.19210 CCCCCCCCCNC(C)CCC(=O)OCC 34a_100000212291_100000748298 [1,1,0,0,0,0|1,0,0]=3 3707 B18R0.19210 CCCCCCCCCOC(C)CCC(=O)OCC 34a_100000210712_100000748298 [1,1,0,0,0,0|1,0,0]=3 3708 B18R0.19210 CCCCCCCCCOC(C)CCC(=O)OCC 7a_100000210712_100000748298 [1,1,0,0,0,0|1,0,0]=3 3709 B18R0.19210 CCCCCCOCCOC(C)CCC(=O)OCC 34a_100000691444_100000748298 [1,1,0,0,0,0|2,0,0]=4 3710 B18R0.19210 CCCCCCOCCOC(C)CCC(=O)OCC 7a_100000691444_100000748298 [1,1,0,0,0,0|2,0,0]=4 3711 B18R0.19210 CCCCNCCCCOC(C)CCC(=O)OCC 34a_200011216965_100000748298 [1,1,0,0,0,0|2,0,0]=4 3712 B18R0.19210 CCCCOCCCCOC(C)CCC(=O)OCC 34a_200000760531_100000748298 [1,1,0,0,0,0|2,0,0]=4 3713 B18R0.19210 CCCCOCCCCOC(C)CCC(=O)OCC 7a_200000760531_100000748298 [1,1,0,0,0,0|2,0,0]=4 3714 B18R0.19210 CCOC(=O)CCC(=O)CCCCCCCCCO 1458a_100000183558_100009813782 [1,1,0,0,0,0|1,0,1]=4 3715 B18R0.19210 CCOC(=O)CCC(C)NCCCCCCCCO 2230a_102515433106_100000748298 [1,1,0,0,0,0|2,0,0]=4 3716 B18R0.19210 CCOC(=O)CCC(C)NCCCCCCCCO 34a_102515433106_100000748298 [1,1,0,0,0,0|2,0,0]=4 3717 B18R0.19210 CCOC(=O)CCC(C)OCCCCCCCCBr 34a_100009813846_100000748298 [1,1,0,0,0,0|2,0,0]=4 3718 B18R0.19210 CCOC(=O)CCC(C)OCCCCCCCCBr 7a_100009813846_100000748298 [1,1,0,0,0,0|2,0,0]=4 3719 B18R0.19210 CCOC(=O)CCC(C)OCCCCCCCCCl 34a_100000033203_100000748298 [1,1,0,0,0,0|2,0,0]=4 3720 B18R0.19210 CCOC(=O)CCC(C)OCCCCCCCCCl 7a_100000033203_100000748298 [1,1,0,0,0,0|2,0,0]=4 3721 B18R0.19210 CCOC(=O)CCC(C)OCCCCCCCCN 34a_102515433106_100000748298 [1,1,0,0,0,0|2,0,0]=4 3722 B18R0.19210 CCOC(=O)CCC(C)SCCCCCCCCO 62a_100000033203_100000748298 [1,1,0,0,0,0|2,0,0]=4 3723 B18R0.19210 CCOC(=O)CCC(C)SCCCCCCCCO 62a_100000748298_100000033203 [1,1,0,0,0,0|2,0,0]=4 3724 B18R0.19210 CCOC(=O)CCN(C)CCCCCCCCCO 2230a_100000745921_100009813782 [1,1,0,0,0,0|2,0,0]=4 3725 B18R0.19210 CCOC(=O)CCN(C)CCCCCCCCCO 269982a_100000745921_100009813782 [1,1,0,0,0,0|2,0,0]=4 3726 B18R0.131 CCCCCCC(C)CCOCCCC(=O)N(C)C 7a_200011024964_100000737642 [0,1,0,0,1,0|2,0,0]=4 3727 B18R0.186 CCCCCCCCCCCC(=O)CC(=O)N(C)C 1458a_100000210736_100000185267 [0,1,0,0,1,0|1,0,1]=4 3728 B18R0.186 CCCCCCCCCCCC(O)CC(=O)N(C)C 1626a_100102631434_100000082106 [0,1,0,0,1,0|1,0,0]=3 3729 B18R0.186 CCCCCCCCCCCC(O)CC(=O)N(C)C 240690a_100102631434_100000082106 [0,1,0,0,1,0|1,0,0]=3 3730 B18R0.186 CCCCCCCCCCCN(C)CC(=O)N(C)C 2230a_100000185065_100011215454 [0,1,0,0,1,0|2,0,0]=4 3731 B18R0.186 CCCCCCCCCCOC(=O)CC(=O)C(C)C 1458a_100000210198_100000210668 [0,1,0,0,1,0|1,0,1]=4 3732 B18R0.942 CC(C)CCCCCCCOCCCC(=O)N(C)C 7a_200000210741_100000737642 [0,1,0,0,1,0|2,0,0]=4 3733 B18R0.942 CC(C)CCCCCCNCCCCC(=O)N(C)C 34a_100000211014_100000752486 [0,1,0,0,1,0|2,0,0]=4 3734 B18R0.1438 CCOC(=O)CCCCCCCCCC(=O)C(C)C 1458a_100000210198_100009828014 [0,1,0,0,1,0|1,0,1]=4 3735 B18R0.3048 C=CCCCCCCCCCCCC(=O)C(C)(C)O 1458a_100000242741_102130925996 [0,1,0,0,1,0|0,0,2]=4 3736 B18R0.3048 CC(C)(C)C(=O)CCCCCCCCCCCCO 1458a_106744555173_100009813331 [0,1,0,0,1,0|1,0,0]=3 3737 B18R0.3048 CC(C)(C)C(=O)CCCCCCOCCCCCO 1458a_106744555173_200132310570 [0,1,0,0,1,0|2,0,0]=4 3738 B18R0.3048 CC(C)(C)C(=O)CNCCCCCCCCCCO 34a_100000066964_100000229897 [0,1,0,0,1,0|2,0,0]=4 3739 B18R0.3048 CC(C)(C)C(=O)COCCCCCCCCCCCl 34a_200000033068_100000229897 [0,1,0,0,1,0|2,0,0]=4 3740 B18R0.3048 CC(C)(C)C(=O)COCCCCCCCCCCCl 7a_200000033068_100000210923 [0,1,0,0,1,0|2,0,0]=4 3741 B18R0.3048 CC(C)(C)C(=O)COCCCCCCCCCCN 34a_100000066964_100000229897 [0,1,0,0,1,0|2,0,0]=4 3742 B18R0.3048 CC(C)(C)C(=O)COCCCCCCCCCCO 34a_200011592769_100009813290 [0,1,0,0,1,0|2,0,0]=4 3743 B18R0.3048 CC(C)(C)C(=O)COCCCCCCCCCCO 7a_200011592769_100009813290 [0,1,0,0,1,0|2,0,0]=4 3744 B18R0.3048 CC(C)(C)C(=O)CSCCCCCCCCCCO 62a_100000210923_200000033068 [0,1,0,0,1,0|2,0,0]=4 3745 B18R0.3048 CC(C)(C)C(=O)CSCCCCCCCCCCO 62a_100009813290_100000210923 [0,1,0,0,1,0|2,0,0]=4 3746 B18R0.3048 CC(C)(F)C(=O)CCCCCCCCCCCCO 1458a_100000765255_100009813331 [0,1,0,0,1,0|1,0,0]=3 3747 B18R0.3048 CC(C)(F)C(=O)CCCCCCOCCCCCO 1458a_100000765255_200132310570 [0,1,0,0,1,0|2,0,0]=4 3748 B18R0.3048 CC(C)(O)C(=O)CCCCCCCCCCCCO 1458a_100000242741_100009813331 [0,1,0,0,1,0|1,0,0]=3 3749 B18R0.3048 CC(C)(O)C(=O)CCCCCCOCCCCCO 1458a_100000242741_200132310570 [0,1,0,0,1,0|2,0,0]=4 3750 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)F 11a_100000210451_100000765255 [0,1,0,0,1,0|1,0,0]=3 3751 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)F 1626a_100000210451_100000765255 [0,1,0,0,1,0|1,0,0]=3 3752 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)F 240690a_100000210451_100000765255 [0,1,0,0,1,0|1,0,0]=3 3753 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)F 527a_100000210451_100000765255 [0,1,0,0,1,0|1,0,0]=3 3754 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(C)O 240690a_100000210451_100000242741 [0,1,0,0,1,0|1,0,0]=3 3755 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(F)F 11a_100000210451_100000042251 [0,1,0,0,1,0|2,0,0]=4 3756 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(F)F 1626a_100000210451_100000042251 [0,1,0,0,1,0|2,0,0]=4 3757 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(F)F 240690a_100000210451_100000042251 [0,1,0,0,1,0|2,0,0]=4 3758 B18R0.3048 CCCCCCCCCCCCNC(=O)C(C)(F)F 527a_100000210451_100000042251 [0,1,0,0,1,0|2,0,0]=4 3759 B18R0.3048 CCCCCCCCCCCNCC(=O)C(C)(C)C 34a_200011215754_100000229897 [0,1,0,0,1,0|1,0,0]=3 3760 B18R0.3048 CCCCCCCCCOCCOC(=O)C(C)(C)Br 34a_100009817195_100011214924 [0,1,0,0,1,0|2,0,0]=4 3761 B18R0.3048 CCCCCCCCCOCCOC(=O)C(C)(C)Br 7a_100009817195_100000210328 [0,1,0,0,1,0|2,0,0]=4 3762 B18R0.3072 CCCCCCCCC(=O)CCCCC(=O)N(C)C 1458a_100000210188_100000752486 [0,1,0,0,1,0|1,0,1]=4 3763 B18R0.3072 CCCCCCCCC(C)CNCCC(=O)N(C)C 270004a_100000738053_100011995885 [0,1,0,0,1,0|2,0,0]=4 3764 B18R0.3072 CCCCCCCCC(C)COCCC(=O)N(C)C 7a_200012125181_100000737620 [0,1,0,0,1,0|2,0,0]=4 3765 B18R0.3072 CCCCCCCCC(C)NCCCC(=O)N(C)C 270004a_200000744827_100011216694 [0,1,0,0,1,0|2,0,0]=4 3766 B18R0.3072 CCCCCCCCC(C)NCCNC(=O)C(C)C 270004a_100000752568_100011216694 [0,1,0,0,1,0|2,0,0]=4 3767 B18R0.3072 CCCCCCCCC(C)OCCCC(=O)N(C)C 7a_100000210740_100000737642 [0,1,0,0,1,0|2,0,0]=4 3768 B18R0.3072 CCCCCCCCN(C)CCCCC(=O)N(C)C 269982a_100000207567_100000752486 [0,1,0,0,1,0|2,0,0]=4 3769 B18R0.11632 CCCCCCCCCC(=O)CCCC(=O)N(C)C 1458a_100000210558_100000737642 [0,1,0,0,1,0|1,0,1]=4 3770 B18R0.11632 CCCCCCCCCC(C)CNCC(=O)N(C)C 270004a_100015183351_200011218516 [0,1,0,0,1,0|2,0,0]=4 3771 B18R0.11632 CCCCCCCCCC(C)NCCC(=O)N(C)C 270004a_100000738053_100011215753 [0,1,0,0,1,0|2,0,0]=4 3772 B18R0.11632 CCCCCCCCCC(C)OCCC(=O)N(C)C 7a_100011218016_100000737620 [0,1,0,0,1,0|2,0,0]=4 3773 B18R0.11632 CCCCCCCCCN(C)CCCC(=O)N(C)C 2230a_100000232482_100000737642 [0,1,0,0,1,0|2,0,0]=4 3774 B18R0.11632 CCCCCCCCCN(C)CCCC(=O)N(C)C 269982a_100000232482_100000737642 [0,1,0,0,1,0|2,0,0]=4 3775 B18R0.15767 CCC(C)CCCCCOCCCCC(=O)N(C)C 7a_200000035636_100000752486 [0,1,0,0,1,0|2,0,0]=4 3776 B18R0.15767 COC(=O)CCCCCCCCCCC(=O)C(C)C 1458a_100000210198_100009812566 [0,1,0,0,1,0|1,0,1]=4 3777 B18R0.15767 COC(=O)CCCCCCCCCCC(=O)C(C)C 1458a_100016987261_100000210206 [0,1,0,0,1,0|1,0,1]=4 3778 B18R0.19339 CCCCCCCC(C)OCCCCC(=O)N(C)C 34a_200011215852_100000752486 [0,1,0,0,1,0|2,0,0]=4 3779 B18R0.19339 CCCCCCCC(C)OCCCCC(=O)N(C)C 7a_200011215852_100000752486 [0,1,0,0,1,0|2,0,0]=4 3780 B18R0.19339 CCCCCCCC(C)SCCCCC(=O)N(C)C 62a_100000752486_200011218727 [0,1,0,0,1,0|2,0,0]=4 3781 B18R0.19339 CCCCCCCC(C)SCCCCC(=O)N(C)C 62a_200011218727_100000752486 [0,1,0,0,1,0|2,0,0]=4 3782 B18R0.19789 CCCCCCCCCCC(=O)CCC(=O)N(C)C 1458a_100011200748_100000210319 [0,1,0,0,1,0|1,0,1]=4 3783 B18R0.19789 CCCCCCCCCCC(=O)CNC(=O)C(C)C 1458a_100000194582_100000210319 [0,1,0,0,1,0|1,0,1]=4 3784 B18R0.19789 CCCCCCCCCCC(=O)COC(=O)C(C)C 1458a_100000210375_100000139345 [0,1,0,0,1,0|1,0,1]=4 3785 B18R0.19789 CCCCCCCCCCC(C)NCC(=O)N(C)C 270004a_100015183351_200011219864 [0,1,0,0,1,0|2,0,0]=4 3786 B18R0.19789 CCCCCCCCCCC(C)OCC(=O)N(C)C 34a_100011215000_100000692301 [0,1,0,0,1,0|2,0,0]=4 3787 B18R0.19789 CCCCCCCCCCC(C)OCC(=O)N(C)C 7a_100011215000_100000692301 [0,1,0,0,1,0|2,0,0]=4 3788 B18R0.19789 CCCCCCCCCCN(C)CCC(=O)N(C)C 2230a_100000207566_100000737620 [0,1,0,0,1,0|2,0,0]=4 3789 B18R0.19789 CCCCCCCCCCN(C)CCC(=O)N(C)C 269982a_100000207566_100000737620 [0,1,0,0,1,0|2,0,0]=4 3790 B18R0.19862 CCCCC(C)CCCCOCCCC(=O)N(C)C 7a_200011021034_100000737642 [0,1,0,0,1,0|2,0,0]=4 3791 B18R0.19914 CCCCCCCCCCCCNS(=O)(=O)C(C)C 270084a_100000210451_100000742656 [0,1,0,0,1,0|2,0,0]=4 3792 B18R0.19914 CCCCCCCCCCCCNS(=O)(=O)C(C)C 274078a_100000210451_100000742656 [0,1,0,0,1,0|2,0,0]=4 3793 B18R0.19914 CCCCCCCCCCNCCS(=O)(=O)C(C)C 2230a_100000732177_100000210320 [0,1,0,0,1,0|2,0,0]=4 3794 B18R0.19914 CCCCCCCCCCNCCS(=O)(=O)C(C)C 34a_100000732177_100000210320 [0,1,0,0,1,0|2,0,0]=4 3795 B18R1.372 CCCCCCC1CCCC1NCCOC(C)C 269862a_100000701111_100000189428 [1,0,0,1,0,0|1,0,1]=4 3796 B18R1.372 CCCCCCC1CCCC1NCCOC(C)C 270004a_100000701111_100000189428 [1,0,0,1,0,0|1,0,1]=4 3797 B18R1.1108 CCCCCCCCCCCN1CCOC(C1)C 2230a_100000729577_100011215454 [1,0,0,1,0,0|1,0,1]=4 3798 B18R1.1108 CCCCCCCCCCCN1CCOC(C1)C 269982a_100000729577_100011215454 [1,0,0,1,0,0|1,0,1]=4 3799 B18R1.1108 CCCCCCCCCCCN1CCOC(C1)C 34a_100000729577_100011215454 [1,0,0,1,0,0|1,0,1]=4 3800 B18R1.1108 CCCCCCCCCCNC1CCOC(C1)C 270004a_100000684558_100000755752 [1,0,0,1,0,0|1,0,1]=4 3801 B18R1.1108 CCCCCCCCCCOC1CCOC(C1)C 34a_100011986385_100000210320 [1,0,0,1,0,0|1,0,1]=4 3802 B18R1.1108 CCCCCCCCCCOC1CCOC(C1)C 7a_100011986385_100000210320 [1,0,0,1,0,0|1,0,1]=4 3803 B18R1.1326 CCCCCC1CCCC1NCCCOC(C)C 269862a_100000737246_200000198059 [1,0,0,1,0,0|1,0,1]=4 3804 B18R1.1326 CCCCCC1CCCC1NCCCOC(C)C 270004a_100000737246_200000198059 [1,0,0,1,0,0|1,0,1]=4 3805 B18R1.13035 CCCCCCCCCCCOCCOC1CC1 34a_100010166600_100000211595 [1,0,0,1,0,0|1,0,1]=4 3806 B18R1.21165 CC(C)OCNC1CCCCCCCCCCC1 2230a_100011194316_100000709892 [1,0,0,1,0,0|1,0,1]=4 3807 B18R1.21165 CC(C)OCNC1CCCCCCCCCCC1 34a_100011194316_100000709892 [1,0,0,1,0,0|1,0,1]=4 3808 B18R1.252901 CCCCCCCCCCCOCC1OC1(C)C 34a_200010283642_100011215454 [1,0,0,1,0,0|1,0,1]=4 3809 B18R1.252901 CCCCCCCCCCCOCC1OC1(C)C 7a_200010283642_100011215454 [1,0,0,1,0,0|1,0,1]=4 3810 B18R1.377 CCCC1CCCCC1OCCC(=O)NC(C)C 7a_100011217265_100000737564 [1,0,0,1,0,0|2,0,0]=4 3811 B18R1.377 CCCC1CCCCC1OCCC(=O)OC(C)C 7a_100011217265_100000760027 [1,0,0,1,0,0|1,0,0]=3 3812 B18R1.384 CCCN1CCCC1COCCC(=O)OC(C)C 7a_200000694710_100000760027 [1,0,0,1,0,0|2,0,0]=4 3813 B18R1.1138 CC(C)OC(=O)CCN1CCCCC1CCCO 2230a_100011934581_100000760027 [1,0,0,1,0,0|2,0,0]=4 3814 B18R1.1138 CC(C)OC(=O)CCN1CCCCC1CCCO 269982a_100011934581_100000760027 [1,0,0,1,0,0|2,0,0]=4 3815 B18R1.1138 COCCC1CCCCN1CCC(=O)OC(C)C 2230a_100015186528_100000760027 [1,0,0,1,0,0|2,0,0]=4 3816 B18R1.1138 COCCC1CCCCN1CCC(=O)OC(C)C 269982a_100015186528_100000760027 [1,0,0,1,0,0|2,0,0]=4 3817 B18R1.1256 CCC1CCCCN1CCNCC(=O)OC(C)C 2230a_100000755458_100011215430 [1,0,0,1,0,0|2,0,0]=4 3818 B18R1.1256 CCC1CCCCN1CCNCC(=O)OC(C)C 34a_100000755458_100011215430 [1,0,0,1,0,0|2,0,0]=4 3819 B18R1.1256 CCN1CCCCC1CNCCC(=O)OC(C)C 2230a_100000754393_100000760027 [1,0,0,1,0,0|2,0,0]=4 3820 B18R1.1256 CCN1CCCCC1COCCC(=O)OC(C)C 7a_100000225091_100000760027 [1,0,0,1,0,0|2,0,0]=4 3821 B18R1.1325 CCCCCC1CCCC1NCC(=O)NC(C)C 269862a_100000168517_200000198059 [1,0,0,1,0,0|2,0,0]=4 3822 B18R1.1325 CCCCCC1CCCC1NCC(=O)NC(C)C 270004a_100000168517_200000198059 [1,0,0,1,0,0|2,0,0]=4 3823 B18R1.7062 COCCCC1CCCCN1CC(=O)OC(C)C 2230a_100011804088_100011215430 [1,0,0,1,0,0|2,0,0]=4 3824 B18R1.7062 COCCCC1CCCCN1CC(=O)OC(C)C 269982a_100011804088_100011215430 [1,0,0,1,0,0|2,0,0]=4 3825 B18R1.7062 COCCCC1CCCCN1CC(=O)OC(C)C 34a_100011804088_100011215430 [1,0,0,1,0,0|2,0,0]=4 3826 B18R1.9323 CC(C)OC(=O)CCCCCNCC1CCCC1 2230a_100000737975_200010986244 [1,0,0,1,0,0|1,0,0]=3 3827 B18R1.9323 CC(C)OC(=O)CCCCCNCC1CCCC1 34a_100000737975_200010986244 [1,0,0,1,0,0|1,0,0]=3 3828 B18R1.9323 CC(C)OC(=O)CCCCCNCC1CCOC1 2230a_100000737293_200010986244 [1,0,0,1,0,0|2,0,0]=4 3829 B18R1.9323 CC(C)OC(=O)CCCCCNCC1CCOC1 34a_100000737293_200010986244 [1,0,0,1,0,0|2,0,0]=4 3830 B18R1.9323 CC(C)OC(=O)CCCCCNC[C@@H]1CCCO1 2230a_100020590478_200010986244 [1,0,0,1,0,0|2,0,0]=4 3831 B18R1.9323 CC(C)OC(=O)CCCCCNC[C@@H]1CCCO1 34a_100020590478_200010986244 [1,0,0,1,0,0|2,0,0]=4 3832 B18R1.9323 CC(C)OC(=O)CCCCCOCC1CCCC1 34a_100000742336_200010986244 [1,0,0,1,0,0|1,0,0]=3 3833 B18R1.9323 CC(C)OC(=O)CCCCCOCC1CCCC1 7a_100000742336_200010986244 [1,0,0,1,0,0|1,0,0]=3 3834 B18R1.9323 CC(C)OC(=O)CCCCCOCC1CCCO1 34a_100000210270_200010986244 [1,0,0,1,0,0|2,0,0]=4 3835 B18R1.9323 CC(C)OC(=O)CCCCCOCC1CCCO1 7a_100000210270_200010986244 [1,0,0,1,0,0|2,0,0]=4 3836 B18R1.9323 CC(C)OC(=O)CCCCCOCC1CCNC1 34a_100000748654_200010986244 [1,0,0,1,0,0|2,0,0]=4 3837 B18R1.9323 CC(C)OC(=O)CCCCCOCC1CCOC1 34a_100000740260_200010986244 [1,0,0,1,0,0|2,0,0]=4 3838 B18R1.9323 CC(C)OC(=O)CCCCCOC[C@H]1CCCN1 34a_100000745186_200010986244 [1,0,0,1,0,0|2,0,0]=4 3839 B18R1.9323 CC(C)OC(=O)CCCCCSCC1CCCC1 62a_100000740388_200010986244 [1,0,0,1,0,0|1,0,0]=3 3840 B18R1.9323 CC(C)OC(=O)CCCCCSCC1CCCC1 62a_200010986244_100000740388 [1,0,0,1,0,0|1,0,0]=3 3841 B18R1.9323 CC(C)OC(=O)CCCCCSCC1CCCO1 62a_100000203698_200010986244 [1,0,0,1,0,0|2,0,0]=4 3842 B18R1.9323 CC(C)OC(=O)CCCCCSCC1CCCO1 62a_200010986244_100000203698 [1,0,0,1,0,0|2,0,0]=4 3843 B18R1.9323 CC(C)OC(=O)CCCCCSCC1CCOC1 62a_100000702531_200010986244 [1,0,0,1,0,0|2,0,0]=4 3844 B18R1.9323 CC(C)OC(=O)CCCCCSCC1CCOC1 62a_200010986244_100000702531 [1,0,0,1,0,0|2,0,0]=4 3845 B18R1.9340 CC(C)NC(=O)CCNCCCC1CCCCC1 2230a_100011211642_100000737564 [1,0,0,1,0,0|2,0,0]=4 3846 B18R1.9340 CC(C)NC(=O)CCOCCCC1CCCCC1 7a_100000198086_100000737564 [1,0,0,1,0,0|2,0,0]=4 3847 B18R1.9340 CC(C)NC(=O)CCSCCCC1CCCCC1 62a_100000737564_100011713725 [1,0,0,1,0,0|2,0,0]=4 3848 B18R1.9340 CC(C)NC(=O)CCSCCCC1CCCCC1 62a_100011713725_100000737564 [1,0,0,1,0,0|2,0,0]=4 3849 B18R1.9340 CC(C)NC(=O)COCCCCC1CCCCC1 34a_100011215267_100000183996 [1,0,0,1,0,0|2,0,0]=4 3850 B18R1.9340 CC(C)NC(=O)COCCCCC1CCCCC1 7a_100011215267_100000183996 [1,0,0,1,0,0|2,0,0]=4 3851 B18R1.9340 CC(C)OC(=O)CCCCCNC1CCCCC1 2230a_100000182618_200010986244 [1,0,0,1,0,0|1,0,0]=3 3852 B18R1.9340 CC(C)OC(=O)CCCCCNC1CCCCC1 34a_100000182618_200010986244 [1,0,0,1,0,0|1,0,0]=3 3853 B18R1.9340 CC(C)OC(=O)CCCCCNC1CCCOC1 2230a_100000719290_200010986244 [1,0,0,1,0,0|2,0,0]=4 3854 B18R1.9340 CC(C)OC(=O)CCCCCNC1CCCOC1 34a_100000719290_200010986244 [1,0,0,1,0,0|2,0,0]=4 3855 B18R1.9340 CC(C)OC(=O)CCCCCNC1CCOCC1 2230a_100000741149_200010986244 [1,0,0,1,0,0|2,0,0]=4 3856 B18R1.9340 CC(C)OC(=O)CCCCCNC1CCOCC1 34a_100000741149_200010986244 [1,0,0,1,0,0|2,0,0]=4 3857 B18R1.9340 CC(C)OC(=O)CCCCCNC1CCSCC1 2230a_100000748639_200010986244 [1,0,0,1,0,0|2,0,0]=4 3858 B18R1.9340 CC(C)OC(=O)CCCCCNC1CCSCC1 34a_100000748639_200010986244 [1,0,0,1,0,0|2,0,0]=4 3859 B18R1.9340 CC(C)OC(=O)CCCCCOC1CCCCC1 34a_100000210231_200010986244 [1,0,0,1,0,0|1,0,0]=3 3860 B18R1.9340 CC(C)OC(=O)CCCCCOC1CCCCC1 7a_100000210231_200010986244 [1,0,0,1,0,0|1,0,0]=3 3861 B18R1.9340 CC(C)OC(=O)CCCCCOC1CCCCO1 34a_100000033831_200010986244 [1,0,0,1,0,0|2,0,0]=4 3862 B18R1.9340 CC(C)OC(=O)CCCCCOC1CCCOC1 34a_100000754041_200010986244 [1,0,0,1,0,0|2,0,0]=4 3863 B18R1.9340 CC(C)OC(=O)CCCCCOC1CCCSC1 7a_100015962668_200010986244 [1,0,0,1,0,0|2,0,0]=4 3864 B18R1.9340 CC(C)OC(=O)CCCCCOC1CCOCC1 34a_100000744328_200010986244 [1,0,0,1,0,0|2,0,0]=4 3865 B18R1.9340 CC(C)OC(=O)CCCCCOC1CCSCC1 34a_100000731022_200010986244 [1,0,0,1,0,0|2,0,0]=4 3866 B18R1.9340 CC(C)OC(=O)CCCCCOC1CCSCC1 7a_100000731022_200010986244 [1,0,0,1,0,0|2,0,0]=4 3867 B18R1.9340 CC(C)OC(=O)CCCCCSC1CCCCC1 62a_100000210327_200010986244 [1,0,0,1,0,0|1,0,0]=3 3868 B18R1.9340 CC(C)OC(=O)CCCCCSC1CCCCC1 62a_200010986244_100000210327 [1,0,0,1,0,0|1,0,0]=3 3869 B18R1.9340 CC(C)OC(=O)CCCCCSC1CCCOC1 62a_200010986244_100000693364 [1,0,0,1,0,0|2,0,0]=4 3870 B18R1.9340 CC(C)OC(=O)CCCCCSC1CCOCC1 62a_200010986244_100011324220 [1,0,0,1,0,0|2,0,0]=4 3871 B18R1.9340 CC(C)OC(=O)CCCCCSC1CCSCC1 62a_200010986244_100000069128 [1,0,0,1,0,0|2,0,0]=4 3872 B18R1.9340 CC(C)OC(=O)CCNCCCC1CCCCC1 2230a_100011211642_100000760027 [1,0,0,1,0,0|1,0,0]=3 3873 B18R1.9340 CC(C)OC(=O)CCOCCCC1CCCCC1 7a_100000198086_100000760027 [1,0,0,1,0,0|1,0,0]=3 3874 B18R1.9340 CC(C)OC(=O)CCOCCOC1CCCCC1 7a_100011249652_100000760027 [1,0,0,1,0,0|2,0,0]=4 3875 B18R1.9340 CC(C)OC(=O)CCSCCCC1CCCCC1 62a_100000760027_100011713725 [1,0,0,1,0,0|1,0,0]=3 3876 B18R1.9340 CC(C)OC(=O)CCSCCCC1CCCCC1 62a_100011713725_100000760027 [1,0,0,1,0,0|1,0,0]=3 3877 B18R1.9340 CC(C)OC(=O)CCSCCCN1CCCCC1 62a_100000760027_100000007876 [1,0,0,1,0,0|2,0,0]=4 3878 B18R1.9340 CC(C)OC(=O)CCSCCCN1CCCCC1 62a_100132302099_100000760027 [1,0,0,1,0,0|2,0,0]=4 3879 B18R1.9340 CC(C)OC(=O)CCSCCOC1CCCCC1 62a_100000760027_100011211530 [1,0,0,1,0,0|2,0,0]=4 3880 B18R1.9340 CC(C)OC(=O)CCSCCOC1CCCCC1 62a_100011211530_100000760027 [1,0,0,1,0,0|2,0,0]=4 3881 B18R1.9340 CC(C)OC(=O)CNCCCOC1CCCCC1 34a_100000205933_100011215430 [1,0,0,1,0,0|2,0,0]=4 3882 B18R1.9340 CC(C)OC(=O)COCCCCC1CCCCC1 34a_100011215267_100011215430 [1,0,0,1,0,0|1,0,0]=3 3883 B18R1.9340 CC(C)OC(=O)COCCCCC1CCCCC1 7a_100011215267_100011215430 [1,0,0,1,0,0|1,0,0]=3 3884 B18R1.9340 CC(C)OC(=O)COCCCCC1CCNCC1 34a_100016989291_100011215430 [1,0,0,1,0,0|2,0,0]=4 3885 B18R1.9340 CC(C)OC(=O)OCSCCCC1CCCCC1 62a_100000003507_100011713725 [1,0,0,1,0,0|2,0,0]=4 3886 B18R1.9340 CC(C)OC(=O)OCSCCCC1CCCCC1 62a_100011713725_100000003507 [1,0,0,1,0,0|2,0,0]=4 3887 B18R1.10470 CC(C)OC(=O)CCCCCOC1CCCC1C 34a_100011216460_200010986244 [1,0,0,1,0,0|1,0,0]=3 3888 B18R1.10470 CC(C)OC(=O)CCCCCOC1CCCC1C 7a_100011216460_200010986244 [1,0,0,1,0,0|1,0,0]=3 3889 B18R1.10470 CC(C)OC(=O)CCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_200010986244 [1,0,0,1,0,0|2,0,0]=4 3890 B18R1.10470 CC(C)OC(=O)CCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_200010986244 [1,0,0,1,0,0|2,0,0]=4 3891 B18R1.10470 CC(C)OC(=O)CCCCCO[C@H]1CNC[C@H]1C 34a_200015306588_200010986244 [1,0,0,1,0,0|2,0,0]=4 3892 B18R1.10470 CC(C)OC(=O)CCCCCS[C@@H]1CCC[C@H]1O 62a_200010986244_200016002552 [1,0,0,1,0,0|2,0,0]=4 3893 B18R1.10470 CC(C)OC(=O)CCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_200010986244 [1,0,0,1,0,0|2,0,0]=4 3894 B18R1.13741 CCCCCCCCCCCCC(=O)CC1CO1 1458a_100011215791_100011216344 [1,0,0,1,0,0|2,0,0]=4 3895 B18R1.13741 CCCCCCCCCCCCC(=O)C[C@@H]1CO1 1458a_100011215791_100000745022 [1,0,0,1,0,0|2,0,0]=4 3896 B18R1.13741 CCCCCCCCCCCCC(=O)NC1CC1 1626a_100000212008_100011215791 [1,0,0,1,0,0|1,0,0]=3 3897 B18R1.13741 CCCCCCCCCCCCC(=O)NC1CC1 240690a_100000212008_100011215791 [1,0,0,1,0,0|1,0,0]=3 3898 B18R1.13741 CCCCCCCCCCCNC(=O)CC1CC1 11a_200011215754_100000738066 [1,0,0,1,0,0|2,0,0]=4 3899 B18R1.13741 CCCCCCCCCCCNC(=O)CC1CC1 1626a_200011215754_100000738066 [1,0,0,1,0,0|2,0,0]=4 3900 B18R1.13741 CCCCCCCCCCCNC(=O)CC1CC1 240690a_200011215754_100000738066 [1,0,0,1,0,0|2,0,0]=4 3901 B18R1.13741 CCCCCCCCCCCNC(=O)CC1CC1 527a_200011215754_100000738066 [1,0,0,1,0,0|2,0,0]=4 3902 B18R1.13741 CCCCCCCCCCCNC(=O)NC1CC1 2708a_100000212008_200011215754 [1,0,0,1,0,0|2,0,0]=4 3903 B18R1.13741 CCCCCCCCCCCNC(=O)NC1CC1 2708a_200011215754_100000212008 [1,0,0,1,0,0|2,0,0]=4 3904 B18R1.13741 CCCCCCCCCCCNC(=O)NC1CC1 273464a_100000212008_200011215754 [1,0,0,1,0,0|2,0,0]=4 3905 B18R1.13741 CCCCCCCCCCCNC(=O)NC1CC1 273464a_200011215754_100000212008 [1,0,0,1,0,0|2,0,0]=4 3906 B18R1.13741 CCCCCCCCCCCNC(=O)NC1CC1 512a_100000212008_200011215754 [1,0,0,1,0,0|2,0,0]=4 3907 B18R1.13741 CCCCCCCCCCNCC(=O)NC1CC1 2230a_100000684558_100000182950 [1,0,0,1,0,0|2,0,0]=4 3908 B18R1.13741 CCCCCCCCCCNCC(=O)NC1CC1 2230a_100000702991_100000210320 [1,0,0,1,0,0|2,0,0]=4 3909 B18R1.13741 CCCCCCCCCCNCC(=O)NC1CC1 34a_100000684558_100000182950 [1,0,0,1,0,0|2,0,0]=4 3910 B18R1.13741 CCCCCCCCCCOCC(=O)NC1CC1 34a_100000210711_100000182950 [1,0,0,1,0,0|2,0,0]=4 3911 B18R1.13741 CCCCCCCCCCOCC(=O)NC1CC1 7a_100000210711_100000182950 [1,0,0,1,0,0|2,0,0]=4 3912 B18R1.13741 CCCCCCCCCCSCC(=O)NC1CC1 62a_100000182950_100000210320 [1,0,0,1,0,0|2,0,0]=4 3913 B18R1.13741 CCCCCCCCCNCCC(=O)NC1CC1 2230a_100000212291_100000737409 [1,0,0,1,0,0|2,0,0]=4 3914 B18R1.13741 CCCCCCCCCNCCC(=O)NC1CC1 34a_100000212291_100000737409 [1,0,0,1,0,0|2,0,0]=4 3915 B18R1.13741 CCCCCCCCCOCCC(=O)NC1CC1 34a_100000210712_100000737409 [1,0,0,1,0,0|2,0,0]=4 3916 B18R1.13741 CCCCCCCCCSCCC(=O)NC1CC1 62a_100000737409_100000210670 [1,0,0,1,0,0|2,0,0]=4 3917 B18R1.13741 O=C(CCCCCCCCCCCO)CC1CC1 1458a_100000738066_100009812471 [1,0,0,1,0,0|2,0,0]=4 3918 B18R1.13741 O=C(CCCCCCCCCCCO)NC1CC1 240690a_100000212008_100000037981 [1,0,0,1,0,0|2,0,0]=4 3919 B18R1.13992 CC(C)OC(=O)CCCCCN1CCCCC1C 2230a_100000211376_200010986244 [1,0,0,1,0,0|1,0,0]=3 3920 B18R1.13992 CC(C)OC(=O)CCCCCN1CCCCC1C 269982a_100000211376_200010986244 [1,0,0,1,0,0|1,0,0]=3 3921 B18R1.13992 CC(C)OC(=O)CCCCCN1CCCCC1C 34a_100000211376_200010986244 [1,0,0,1,0,0|1,0,0]=3 3922 B18R1.13992 CC(C)OC(=O)CCCCCN1CCOC[C@@H]1C 2230a_100009815349_200010986244 [1,0,0,1,0,0|2,0,0]=4 3923 B18R1.13992 CC(C)OC(=O)CCCCCN1CCOC[C@@H]1C 269982a_100009815349_200010986244 [1,0,0,1,0,0|2,0,0]=4 3924 B18R1.13992 CC(C)OC(=O)CCCCCN1CCOC[C@@H]1C 34a_100009815349_200010986244 [1,0,0,1,0,0|2,0,0]=4 3925 B18R1.13992 CC(C)OC(=O)CCNCCN1CCCCC1C 2230a_100000739827_100000760027 [1,0,0,1,0,0|2,0,0]=4 3926 B18R1.13992 CC(C)OC(=O)CCSCCC1CCCCN1C 62a_100000211948_100000760027 [1,0,0,1,0,0|2,0,0]=4 3927 B18R1.13992 CC(C)OC(=O)CCSCCC1CCCCN1C 62a_100000760027_100000211948 [1,0,0,1,0,0|2,0,0]=4 3928 B18R1.13992 CC(C)OC(=O)CNCCCN1CCCCC1C 34a_100000212276_100011215430 [1,0,0,1,0,0|2,0,0]=4 3929 B18R1.13992 CC(C)OC(=O)COCCCN1CCCCC1C 34a_100000213889_100011215430 [1,0,0,1,0,0|2,0,0]=4 3930 B18R1.13992 CC(C)OC(=O)COCCCN1CCCCC1C 7a_100000213889_100011215430 [1,0,0,1,0,0|2,0,0]=4 3931 B18R1.23297 COCC1CCN1CCCCCC(=O)OC(C)C 2230a_100015195929_200010986244 [1,0,0,1,0,0|2,0,0]=4 3932 B18R1.23297 COCC1CCN1CCCCCC(=O)OC(C)C 269982a_100015195929_200010986244 [1,0,0,1,0,0|2,0,0]=4 3933 B18R1.23297 COCC1CCN1CCCCCC(=O)OC(C)C 34a_100015195929_200010986244 [1,0,0,1,0,0|2,0,0]=4 3934 B18R1.34998 CC1CC(C(=O)O1)NCCCCCCCCCO 2230a_100000078944_200000216747 [1,0,0,1,0,0|2,0,0]=4 3935 B18R1.34998 CC1CC(C(=O)O1)NCCCCCCCCCO 34a_100000078944_200000216747 [1,0,0,1,0,0|2,0,0]=4 3936 B18R1.34998 CC1CC(C(=O)O1)OCCCCCCCCCBr 34a_100009813782_200000216747 [1,0,0,1,0,0|2,0,0]=4 3937 B18R1.34998 CC1CC(C(=O)O1)OCCCCCCCCCBr 7a_100009813782_200000216747 [1,0,0,1,0,0|2,0,0]=4 3938 B18R1.34998 CC1CC(C(=O)O1)OCCCCCCCCCCl 34a_100009868337_200000216747 [1,0,0,1,0,0|2,0,0]=4 3939 B18R1.34998 CC1CC(C(=O)O1)OCCCCCCCCCCl 7a_100009868337_200000216747 [1,0,0,1,0,0|2,0,0]=4 3940 B18R1.34998 CC1CC(C(=O)O1)OCCCCCCCCCN 34a_100000078944_200000216747 [1,0,0,1,0,0|2,0,0]=4 3941 B18R1.34998 CC1CC(C(=O)O1)SCCCCCCCCCO 62a_100009813782_200000216747 [1,0,0,1,0,0|2,0,0]=4 3942 B18R1.34998 CC1CC(C(=O)O1)SCCCCCCCCCO 62a_200000216747_100009813782 [1,0,0,1,0,0|2,0,0]=4 3943 B18R1.34998 CCCCCCCCCCNC1CC(OC1=O)C 2230a_100000684558_200000216747 [1,0,0,1,0,0|1,0,0]=3 3944 B18R1.34998 CCCCCCCCCCNC1CC(OC1=O)C 34a_100000684558_200000216747 [1,0,0,1,0,0|1,0,0]=3 3945 B18R1.34998 CCCCCCCCCCOC1CC(OC1=O)C 34a_100000210711_200000216747 [1,0,0,1,0,0|1,0,0]=3 3946 B18R1.34998 CCCCCCCCCCOC1CC(OC1=O)C 7a_100000210711_200000216747 [1,0,0,1,0,0|1,0,0]=3 3947 B18R1.34998 CCCCCCCCCCSC1CC(OC1=O)C 62a_200000216747_100000210320 [1,0,0,1,0,0|1,0,0]=3 3948 B18R1.38080 CC(C)OC(=O)CCCCCN1CCC[C@@H]1CO 2230a_100000745186_200010986244 [1,0,0,1,0,0|2,0,0]=4 3949 B18R1.38080 CC(C)OC(=O)CCCCCN1CCC[C@@H]1CO 269982a_100000745186_200010986244 [1,0,0,1,0,0|2,0,0]=4 3950 B18R1.38080 CC(C)OC(=O)CCCCCN1CCC[C@@H]1CO 34a_100000745186_200010986244 [1,0,0,1,0,0|2,0,0]=4 3951 B18R1.38080 CCC1CCCN1CCCCCC(=O)OC(C)C 2230a_100000754278_200010986244 [1,0,0,1,0,0|1,0,0]=3 3952 B18R1.38080 CCC1CCCN1CCCCCC(=O)OC(C)C 269982a_100000754278_200010986244 [1,0,0,1,0,0|1,0,0]=3 3953 B18R1.38080 CCC1CCCN1CCCCCC(=O)OC(C)C 34a_100000754278_200010986244 [1,0,0,1,0,0|1,0,0]=3 3954 B18R1.40319 CCCCCCCN1CCC[C@@H]1C(=O)NC(C)C 2230a_100153395200_100000210681 [1,0,0,1,0,0|2,0,0]=4 3955 B18R1.40319 CCCCCCCN1CCC[C@@H]1C(=O)NC(C)C 269982a_100153395200_100000210681 [1,0,0,1,0,0|2,0,0]=4 3956 B18R1.40319 CCCCCCCN1CCC[C@@H]1C(=O)NC(C)C 34a_100153395200_100000210614 [1,0,0,1,0,0|2,0,0]=4 3957 B18R1.97287 CC(C)OC(=O)CCCCCOCCNC1CC1 34a_100000738766_200010986244 [1,0,0,1,0,0|2,0,0]=4 3958 B18R1.97287 CC(C)OC(=O)CCCCCSCCCC1CO1 62a_100000733510_200010986244 [1,0,0,1,0,0|2,0,0]=4 3959 B18R1.97287 CC(C)OC(=O)CCCCCSCCCC1CO1 62a_200010986244_100000733510 [1,0,0,1,0,0|2,0,0]=4 3960 B18R1.97325 CC(C)NC(=O)CCNCCC1CCCCCC1 2230a_100011532351_100000737564 [1,0,0,1,0,0|2,0,0]=4 3961 B18R1.97325 CC(C)OC(=O)CCCCCN1CCCCCC1 2230a_100000185865_200010986244 [1,0,0,1,0,0|1,0,0]=3 3962 B18R1.97325 CC(C)OC(=O)CCCCCN1CCCCCC1 269982a_100000185865_200010986244 [1,0,0,1,0,0|1,0,0]=3 3963 B18R1.97325 CC(C)OC(=O)CCCCCN1CCCCCC1 34a_100000185865_200010986244 [1,0,0,1,0,0|1,0,0]=3 3964 B18R1.97325 CC(C)OC(=O)CCCCCN1CCCOCC1 2230a_100000685342_200010986244 [1,0,0,1,0,0|2,0,0]=4 3965 B18R1.97325 CC(C)OC(=O)CCCCCN1CCCOCC1 269982a_100000685342_200010986244 [1,0,0,1,0,0|2,0,0]=4 3966 B18R1.97325 CC(C)OC(=O)CCCCCN1CCCOCC1 34a_100000685342_200010986244 [1,0,0,1,0,0|2,0,0]=4 3967 B18R1.97325 CC(C)OC(=O)CCNCCC1CCCCCC1 2230a_100011532351_100000760027 [1,0,0,1,0,0|1,0,0]=3 3968 B18R1.97325 CC(C)OC(=O)CCSCCN1CCCCCC1 62a_100000722644_100000760027 [1,0,0,1,0,0|2,0,0]=4 3969 B18R1.97325 CC(C)OC(=O)CCSCCN1CCCCCC1 62a_100000760027_100000722644 [1,0,0,1,0,0|2,0,0]=4 3970 B18R1.97325 CC(C)OC(=O)COCCCN1CCCCCC1 34a_100102886287_100011215430 [1,0,0,1,0,0|2,0,0]=4 3971 B18R1.97325 CC(C)OC(=O)COCCCN1CCCCCC1 7a_100102886287_100011215430 [1,0,0,1,0,0|2,0,0]=4 3972 B18R1.122414 CC1CC1C(=O)CCCCCCCCCCCO 1458a_100000211227_100009812471 [1,0,0,1,0,0|2,0,0]=4 3973 B18R1.122414 CCCCCCCCCCCNC(=O)C1CC1C 11a_200011215754_100000211227 [1,0,0,1,0,0|2,0,0]=4 3974 B18R1.122414 CCCCCCCCCCCNC(=O)C1CC1C 1626a_200011215754_100000211227 [1,0,0,1,0,0|2,0,0]=4 3975 B18R1.122414 CCCCCCCCCCCNC(=O)C1CC1C 527a_200011215754_100000211227 [1,0,0,1,0,0|2,0,0]=4 3976 B18R1.176969 CC(C)OC(=O)CCCCCOCCC1COC1 34a_100009855314_200010986244 [1,0,0,1,0,0|2,0,0]=4 3977 B18R1.264841 CC(C)NC(=O)CCOCC1CCCCCCC1 7a_100011216312_100000737564 [1,0,0,1,0,0|2,0,0]=4 3978 B18R1.264841 CC(C)NC(=O)CNCCC1CCCCCCC1 2230a_100011532352_100000183996 [1,0,0,1,0,0|2,0,0]=4 3979 B18R1.264841 CC(C)NC(=O)CNCCC1CCCCCCC1 34a_100011532352_100000183996 [1,0,0,1,0,0|2,0,0]=4 3980 B18R1.264841 CC(C)OC(=O)CCOCC1CCCCCCC1 7a_100011216312_100000760027 [1,0,0,1,0,0|1,0,0]=3 3981 B18R1.264841 CC(C)OC(=O)CNCCC1CCCCCCC1 2230a_100011532352_100011215430 [1,0,0,1,0,0|1,0,0]=3 3982 B18R1.264841 CC(C)OC(=O)CNCCC1CCCCCCC1 34a_100011532352_100011215430 [1,0,0,1,0,0|1,0,0]=3 3983 B18R1.371 CCCCCCC1CCCC1NCC(=O)NCC 270004a_100016988866_100000189428 [1,0,0,1,0,0|2,0,0]=4 3984 B18R1.848 CCNC(=O)CCOCCCCC1CCCCC1 7a_100011215267_100000737597 [1,0,0,1,0,0|2,0,0]=4 3985 B18R1.848 CCOC(=O)CCCCCCCN1CCCOC1 2230a_100000131196_100009991516 [1,0,0,1,0,0|2,0,0]=4 3986 B18R1.848 CCOC(=O)CCCCCCCN1CCCOC1 269982a_100000131196_100009991516 [1,0,0,1,0,0|2,0,0]=4 3987 B18R1.848 CCOC(=O)CCCCCCCN1CCCOC1 34a_100000131196_100009991516 [1,0,0,1,0,0|2,0,0]=4 3988 B18R1.848 CCOC(=O)CCCCCCCN1CCOCC1 2230a_100015191051_100009991516 [1,0,0,1,0,0|2,0,0]=4 3989 B18R1.848 CCOC(=O)CCCCCCCN1CCOCC1 269982a_100015191051_100009991516 [1,0,0,1,0,0|2,0,0]=4 3990 B18R1.848 CCOC(=O)CCCCCCCN1CCOCC1 34a_100015191051_100009991516 [1,0,0,1,0,0|2,0,0]=4 3991 B18R1.848 CCOC(=O)CCCCCCCN1CCSCC1 2230a_100000737611_100009991516 [1,0,0,1,0,0|2,0,0]=4 3992 B18R1.848 CCOC(=O)CCCCCCCN1CCSCC1 269982a_100000737611_100009991516 [1,0,0,1,0,0|2,0,0]=4 3993 B18R1.848 CCOC(=O)CCCCCCNC1CCCCC1 2230a_100000182618_100009814379 [1,0,0,1,0,0|1,0,0]=3 3994 B18R1.848 CCOC(=O)CCCCCCNC1CCCCC1 34a_100000182618_100009814379 [1,0,0,1,0,0|1,0,0]=3 3995 B18R1.848 CCOC(=O)CCCCCCNC1CCCOC1 2230a_100000719290_100009814379 [1,0,0,1,0,0|2,0,0]=4 3996 B18R1.848 CCOC(=O)CCCCCCNC1CCCOC1 34a_100000719290_100009814379 [1,0,0,1,0,0|2,0,0]=4 3997 B18R1.848 CCOC(=O)CCCCCCNC1CCOCC1 2230a_100000741149_100009814379 [1,0,0,1,0,0|2,0,0]=4 3998 B18R1.848 CCOC(=O)CCCCCCNC1CCOCC1 34a_100000741149_100009814379 [1,0,0,1,0,0|2,0,0]=4 3999 B18R1.848 CCOC(=O)CCCCCCNC1CCSCC1 2230a_100000748639_100009814379 [1,0,0,1,0,0|2,0,0]=4 4000 B18R1.848 CCOC(=O)CCCCCCNC1CCSCC1 34a_100000748639_100009814379 [1,0,0,1,0,0|2,0,0]=4 4001 B18R1.848 CCOC(=O)CCCCCCOC1CCCCC1 34a_100000210231_100009814379 [1,0,0,1,0,0|1,0,0]=3 4002 B18R1.848 CCOC(=O)CCCCCCOC1CCCCC1 7a_100000210231_100009814379 [1,0,0,1,0,0|1,0,0]=3 4003 B18R1.848 CCOC(=O)CCCCCCOC1CCCCO1 34a_100000033831_100009814379 [1,0,0,1,0,0|2,0,0]=4 4004 B18R1.848 CCOC(=O)CCCCCCOC1CCCOC1 34a_100000754041_100009814379 [1,0,0,1,0,0|2,0,0]=4 4005 B18R1.848 CCOC(=O)CCCCCCOC1CCCSC1 7a_100015962668_100009814379 [1,0,0,1,0,0|2,0,0]=4 4006 B18R1.848 CCOC(=O)CCCCCCOC1CCOCC1 34a_100000744328_100009814379 [1,0,0,1,0,0|2,0,0]=4 4007 B18R1.848 CCOC(=O)CCCCCCOC1CCSCC1 34a_100000731022_100009814379 [1,0,0,1,0,0|2,0,0]=4 4008 B18R1.848 CCOC(=O)CCCCCCOC1CCSCC1 7a_100000731022_100009814379 [1,0,0,1,0,0|2,0,0]=4 4009 B18R1.848 CCOC(=O)CCCCCCSC1CCCCC1 62a_100000210327_100009814379 [1,0,0,1,0,0|1,0,0]=3 4010 B18R1.848 CCOC(=O)CCCCCNCC1CCCCC1 2230a_100000210473_100000755133 [1,0,0,1,0,0|1,0,0]=3 4011 B18R1.848 CCOC(=O)CCCCCNCC1CCCCC1 34a_100000210473_100000755133 [1,0,0,1,0,0|1,0,0]=3 4012 B18R1.848 CCOC(=O)CCCCCNCC1CCCCO1 2230a_100000174945_100000755133 [1,0,0,1,0,0|2,0,0]=4 4013 B18R1.848 CCOC(=O)CCCCCNCC1CCCCO1 34a_100000174945_100000755133 [1,0,0,1,0,0|2,0,0]=4 4014 B18R1.848 CCOC(=O)CCCCCNCC1CCCOC1 2230a_100000720124_100000755133 [1,0,0,1,0,0|2,0,0]=4 4015 B18R1.848 CCOC(=O)CCCCCNCC1CCCOC1 34a_100000720124_100000755133 [1,0,0,1,0,0|2,0,0]=4 4016 B18R1.848 CCOC(=O)CCCCCNCC1CCOCC1 2230a_100000746373_100000755133 [1,0,0,1,0,0|2,0,0]=4 4017 B18R1.848 CCOC(=O)CCCCCNCC1CCOCC1 34a_100000746373_100000755133 [1,0,0,1,0,0|2,0,0]=4 4018 B18R1.848 CCOC(=O)CCCCCNCC1CCSCC1 2230a_100015188806_100000755133 [1,0,0,1,0,0|2,0,0]=4 4019 B18R1.848 CCOC(=O)CCCCCNCC1CCSCC1 34a_100015188806_100000755133 [1,0,0,1,0,0|2,0,0]=4 4020 B18R1.848 CCOC(=O)CCCCCOCC1CCCCC1 34a_100000212181_100000755133 [1,0,0,1,0,0|1,0,0]=3 4021 B18R1.848 CCOC(=O)CCCCCOCC1CCCCC1 7a_100000212181_100000755133 [1,0,0,1,0,0|1,0,0]=3 4022 B18R1.848 CCOC(=O)CCCCCOCC1CCCCC1 7a_100011214988_100000211423 [1,0,0,1,0,0|1,0,0]=3 4023 B18R1.848 CCOC(=O)CCCCCOCC1CCCCN1 34a_100000210821_100000755133 [1,0,0,1,0,0|2,0,0]=4 4024 B18R1.848 CCOC(=O)CCCCCOCC1CCCCO1 34a_100000211370_100000755133 [1,0,0,1,0,0|2,0,0]=4 4025 B18R1.848 CCOC(=O)CCCCCOCC1CCCCO1 7a_100000211370_100000755133 [1,0,0,1,0,0|2,0,0]=4 4026 B18R1.848 CCOC(=O)CCCCCOCC1CCCCO1 7a_100011214988_100000211543 [1,0,0,1,0,0|2,0,0]=4 4027 B18R1.848 CCOC(=O)CCCCCOCC1CCCNC1 34a_100000211344_100000755133 [1,0,0,1,0,0|2,0,0]=4 4028 B18R1.848 CCOC(=O)CCCCCOCC1CCCOC1 34a_100000741520_100000755133 [1,0,0,1,0,0|2,0,0]=4 4029 B18R1.848 CCOC(=O)CCCCCOCC1CCCOC1 7a_100011214988_100000741521 [1,0,0,1,0,0|2,0,0]=4 4030 B18R1.848 CCOC(=O)CCCCCOCC1CCNCC1 34a_100000738675_100000755133 [1,0,0,1,0,0|2,0,0]=4 4031 B18R1.848 CCOC(=O)CCCCCOCC1CCOCC1 34a_100000749013_100000755133 [1,0,0,1,0,0|2,0,0]=4 4032 B18R1.848 CCOC(=O)CCCCCOCC1CCOCC1 7a_100011214988_100000754603 [1,0,0,1,0,0|2,0,0]=4 4033 B18R1.848 CCOC(=O)CCCCCOCC1CCSCC1 34a_100000070558_100000755133 [1,0,0,1,0,0|2,0,0]=4 4034 B18R1.848 CCOC(=O)CCCCCOCC1CCSCC1 7a_100000070558_100000755133 [1,0,0,1,0,0|2,0,0]=4 4035 B18R1.848 CCOC(=O)CCCCCSCC1CCCCC1 62a_100000211423_100000755133 [1,0,0,1,0,0|1,0,0]=3 4036 B18R1.848 CCOC(=O)CCCCCSCC1CCCCC1 62a_100000755133_100000211423 [1,0,0,1,0,0|1,0,0]=3 4037 B18R1.848 CCOC(=O)CCCCCSCC1CCCCO1 62a_100000211543_100000755133 [1,0,0,1,0,0|2,0,0]=4 4038 B18R1.848 CCOC(=O)CCCCCSCC1CCCCO1 62a_100000755133_100000211543 [1,0,0,1,0,0|2,0,0]=4 4039 B18R1.848 CCOC(=O)CCCCCSCC1CCCOC1 62a_100000741521_100000755133 [1,0,0,1,0,0|2,0,0]=4 4040 B18R1.848 CCOC(=O)CCCCCSCC1CCCOC1 62a_100000755133_100000741521 [1,0,0,1,0,0|2,0,0]=4 4041 B18R1.848 CCOC(=O)CCCCCSCC1CCOCC1 62a_100000754603_100000755133 [1,0,0,1,0,0|2,0,0]=4 4042 B18R1.848 CCOC(=O)CCCCCSCC1CCOCC1 62a_100000755133_100000749018 [1,0,0,1,0,0|2,0,0]=4 4043 B18R1.848 CCOC(=O)CCCCNCCC1CCCCC1 2230a_100000738074_100000750268 [1,0,0,1,0,0|1,0,0]=3 4044 B18R1.848 CCOC(=O)CCCCNCCC1CCCCC1 34a_100000738074_100000750268 [1,0,0,1,0,0|1,0,0]=3 4045 B18R1.848 CCOC(=O)CCCCNCCC1CCCCO1 2230a_100015183643_100000750268 [1,0,0,1,0,0|2,0,0]=4 4046 B18R1.848 CCOC(=O)CCCCNCCC1CCCCO1 34a_100015183643_100000750268 [1,0,0,1,0,0|2,0,0]=4 4047 B18R1.848 CCOC(=O)CCCCNCCC1CCOCC1 2230a_100000755988_100000750268 [1,0,0,1,0,0|2,0,0]=4 4048 B18R1.848 CCOC(=O)CCCCNCCC1CCOCC1 34a_100000755988_100000750268 [1,0,0,1,0,0|2,0,0]=4 4049 B18R1.848 CCOC(=O)CCCCOCCC1CCCCC1 34a_100011217863_100000750268 [1,0,0,1,0,0|1,0,0]=3 4050 B18R1.848 CCOC(=O)CCCCOCCC1CCCCC1 7a_100011217863_100000750268 [1,0,0,1,0,0|1,0,0]=3 4051 B18R1.848 CCOC(=O)CCCCOCCC1CCCCN1 34a_100000211664_100000750268 [1,0,0,1,0,0|2,0,0]=4 4052 B18R1.848 CCOC(=O)CCCCOCCC1CCCNC1 34a_100000752241_100000750268 [1,0,0,1,0,0|2,0,0]=4 4053 B18R1.848 CCOC(=O)CCCCOCCC1CCNCC1 34a_100015190746_100000750268 [1,0,0,1,0,0|2,0,0]=4 4054 B18R1.848 CCOC(=O)CCCCOCCC1CCOCC1 34a_100011933979_100000750268 [1,0,0,1,0,0|2,0,0]=4 4055 B18R1.848 CCOC(=O)CCCCOCCC1CCOCC1 7a_100011933979_100000750268 [1,0,0,1,0,0|2,0,0]=4 4056 B18R1.848 CCOC(=O)CCCCSCCC1CCCCC1 62a_100000750268_100012355289 [1,0,0,1,0,0|1,0,0]=3 4057 B18R1.848 CCOC(=O)CCCCSCCC1CCCCC1 62a_100012355289_100000750268 [1,0,0,1,0,0|1,0,0]=3 4058 B18R1.848 CCOC(=O)CCCCSCCC1CCOCC1 62a_100000750268_100011934994 [1,0,0,1,0,0|2,0,0]=4 4059 B18R1.848 CCOC(=O)CCCCSCCC1CCOCC1 62a_100011934994_100000750268 [1,0,0,1,0,0|2,0,0]=4 4060 B18R1.848 CCOC(=O)CCCCSCCN1CCCCC1 62a_100000739454_100000750268 [1,0,0,1,0,0|2,0,0]=4 4061 B18R1.848 CCOC(=O)CCCCSCCN1CCCCC1 62a_100000750268_100000739454 [1,0,0,1,0,0|2,0,0]=4 4062 B18R1.848 CCOC(=O)CCCCSCOC1CCCCC1 62a_100000750268_100011935260 [1,0,0,1,0,0|2,0,0]=4 4063 B18R1.848 CCOC(=O)CCCCSCOC1CCCCC1 62a_100011935260_100000750268 [1,0,0,1,0,0|2,0,0]=4 4064 B18R1.848 CCOC(=O)CCCNCCCC1CCCCC1 2230a_100011211642_100009991533 [1,0,0,1,0,0|1,0,0]=3 4065 B18R1.848 CCOC(=O)CCCNCCCC1CCCCC1 34a_100011211642_100009991533 [1,0,0,1,0,0|1,0,0]=3 4066 B18R1.848 CCOC(=O)CCCNCCOC1CCCCC1 34a_100015206981_100009991533 [1,0,0,1,0,0|2,0,0]=4 4067 B18R1.848 CCOC(=O)CCCOCCCC1CCCCC1 34a_100000198086_100009991533 [1,0,0,1,0,0|1,0,0]=3 4068 B18R1.848 CCOC(=O)CCCOCCCC1CCCCC1 7a_100000198086_100011215271 [1,0,0,1,0,0|1,0,0]=3 4069 B18R1.848 CCOC(=O)CCCOCCCC1CCCCC1 7a_100012001163_100011713725 [1,0,0,1,0,0|1,0,0]=3 4070 B18R1.848 CCOC(=O)CCCOCCCC1CCCCN1 34a_100011934581_100009991533 [1,0,0,1,0,0|2,0,0]=4 4071 B18R1.848 CCOC(=O)CCCOCCCC1CCCNC1 34a_100150707839_100009991533 [1,0,0,1,0,0|2,0,0]=4 4072 B18R1.848 CCOC(=O)CCCOCCCC1CCNCC1 34a_100016988962_100009991533 [1,0,0,1,0,0|2,0,0]=4 4073 B18R1.848 CCOC(=O)CCCOCCCN1CCCCC1 34a_100000212458_100009991533 [1,0,0,1,0,0|2,0,0]=4 4074 B18R1.848 CCOC(=O)CCCOCCCN1CCCCC1 7a_100012001163_100000007876 [1,0,0,1,0,0|2,0,0]=4 4075 B18R1.848 CCOC(=O)CCCOCCNC1CCCCC1 34a_100000200466_100009991533 [1,0,0,1,0,0|2,0,0]=4 4076 B18R1.848 CCOC(=O)CCCOCCOC1CCCCC1 34a_100011249652_100009991533 [1,0,0,1,0,0|2,0,0]=4 4077 B18R1.848 CCOC(=O)CCCOCCOC1CCCCC1 7a_100011249652_100011215271 [1,0,0,1,0,0|2,0,0]=4 4078 B18R1.848 CCOC(=O)CCCOCCOC1CCCCC1 7a_100012001163_100011211530 [1,0,0,1,0,0|2,0,0]=4 4079 B18R1.848 CCOC(=O)CCCSCCCC1CCCCC1 62a_100009991533_100011713725 [1,0,0,1,0,0|1,0,0]=3 4080 B18R1.848 CCOC(=O)CCCSCCCC1CCCCC1 62a_100011713725_100009991533 [1,0,0,1,0,0|1,0,0]=3 4081 B18R1.848 CCOC(=O)CCCSCCCN1CCCCC1 62a_100009991533_100000007876 [1,0,0,1,0,0|2,0,0]=4 4082 B18R1.848 CCOC(=O)CCCSCCCN1CCCCC1 62a_100132302099_100009991533 [1,0,0,1,0,0|2,0,0]=4 4083 B18R1.848 CCOC(=O)CCCSCCOC1CCCCC1 62a_100009991533_100011211530 [1,0,0,1,0,0|2,0,0]=4 4084 B18R1.848 CCOC(=O)CCCSCCOC1CCCCC1 62a_100011211530_100009991533 [1,0,0,1,0,0|2,0,0]=4 4085 B18R1.848 CCOC(=O)CCNCCCOC1CCCCC1 34a_100000205933_100000765890 [1,0,0,1,0,0|2,0,0]=4 4086 B18R1.848 CCOC(=O)CCOCCCCC1CCCCC1 34a_100011215267_100000765890 [1,0,0,1,0,0|1,0,0]=3 4087 B18R1.848 CCOC(=O)CCOCCCCC1CCCCC1 7a_100011215267_100011206558 [1,0,0,1,0,0|1,0,0]=3 4088 B18R1.848 CCOC(=O)CCOCCCCC1CCNCC1 34a_100016989291_100000765890 [1,0,0,1,0,0|2,0,0]=4 4089 B18R1.848 CCOC(=O)COCCCCCN1CCCCC1 34a_100011216611_100000188475 [1,0,0,1,0,0|2,0,0]=4 4090 B18R1.848 CCOC(=O)COCCCCCN1CCCCC1 7a_100011216611_100000188475 [1,0,0,1,0,0|2,0,0]=4 4091 B18R1.848 CCOC(=O)COCCCNCC1CCCCC1 2230a_100000210473_100009893628 [1,0,0,1,0,0|2,0,0]=4 4092 B18R1.848 CCOC(=O)COCCCNCC1CCCCC1 34a_100000210473_100009893628 [1,0,0,1,0,0|2,0,0]=4 4093 B18R1.848 CCOC(=O)COCCCOCC1CCCCC1 34a_100000212181_100009893628 [1,0,0,1,0,0|2,0,0]=4 4094 B18R1.848 CCOC(=O)COCCCOCC1CCCCC1 7a_100000212181_100009893628 [1,0,0,1,0,0|2,0,0]=4 4095 B18R1.848 CCOC(=O)COCCCSCC1CCCCC1 62a_100000211423_100009893628 [1,0,0,1,0,0|2,0,0]=4 4096 B18R1.848 CCOC(=O)COCCCSCC1CCCCC1 62a_100009893628_100000211423 [1,0,0,1,0,0|2,0,0]=4 4097 B18R1.848 CCOC(=O)COCCNCCC1CCCCC1 2230a_100000738074_100000088970 [1,0,0,1,0,0|2,0,0]=4 4098 B18R1.848 CCOC(=O)COCCNCCC1CCCCC1 34a_100000738074_100000088970 [1,0,0,1,0,0|2,0,0]=4 4099 B18R1.848 CCOC(=O)COCCOCCC1CCCCC1 34a_100011217863_100000088970 [1,0,0,1,0,0|2,0,0]=4 4100 B18R1.848 CCOC(=O)COCCOCCC1CCCCC1 7a_100011217863_100000088970 [1,0,0,1,0,0|2,0,0]=4 4101 B18R1.848 CCOC(=O)COCCSCCC1CCCCC1 62a_100000088970_100012355289 [1,0,0,1,0,0|2,0,0]=4 4102 B18R1.848 CCOC(=O)COCCSCCC1CCCCC1 62a_100012355289_100000088970 [1,0,0,1,0,0|2,0,0]=4 4103 B18R1.848 CCOC(=O)CSCCOCCC1CCCCC1 7a_200000230590_100011273959 [1,0,0,1,0,0|2,0,0]=4 4104 B18R1.848 CCOC(=O)NCCOCCCC1CCCCC1 34a_100000158857_100011713725 [1,0,0,1,0,0|2,0,0]=4 4105 B18R1.848 CCOC(=O)NCCOCCCC1CCCCC1 7a_100000198086_200011445536 [1,0,0,1,0,0|2,0,0]=4 4106 B18R1.848 CCOC(=O)NCCSCCCC1CCCCC1 62a_100011713725_200011445536 [1,0,0,1,0,0|2,0,0]=4 4107 B18R1.938 CCOC(=O)CCCN1CCCCC1CCCO 2230a_100011934581_100009991533 [1,0,0,1,0,0|2,0,0]=4 4108 B18R1.938 CCOC(=O)CCCN1CCCCC1CCCO 269982a_100011934581_100009991533 [1,0,0,1,0,0|2,0,0]=4 4109 B18R1.938 CCOC(=O)CCCN1CCCCC1CCCO 34a_100011934581_100009991533 [1,0,0,1,0,0|2,0,0]=4 4110 B18R1.938 CCOC(=O)CCCN1CCCCC1CCOC 2230a_100015186528_100009991533 [1,0,0,1,0,0|2,0,0]=4 4111 B18R1.938 CCOC(=O)CCCN1CCCCC1CCOC 269982a_100015186528_100009991533 [1,0,0,1,0,0|2,0,0]=4 4112 B18R1.938 CCOC(=O)CCCN1CCCCC1CCOC 34a_100015186528_100009991533 [1,0,0,1,0,0|2,0,0]=4 4113 B18R1.1312 CCOC(=O)CCN1CCCCC1CCCOC 2230a_100011804088_100011206558 [1,0,0,1,0,0|2,0,0]=4 4114 B18R1.1312 CCOC(=O)CCN1CCCCC1CCCOC 269982a_100011804088_100011206558 [1,0,0,1,0,0|2,0,0]=4 4115 B18R1.1312 CCOC(=O)CCN1CCCCC1CCCOC 34a_100011804088_100000765890 [1,0,0,1,0,0|2,0,0]=4 4116 B18R1.1445 CCOC(=O)CCCCCCCCN1CCCC1 2230a_100000188435_100010175975 [1,0,0,1,0,0|1,0,0]=3 4117 B18R1.1445 CCOC(=O)CCCCCCCCN1CCCC1 269982a_100000188435_100010175975 [1,0,0,1,0,0|1,0,0]=3 4118 B18R1.1445 CCOC(=O)CCCCCCCCN1CCSC1 2230a_100011215254_100010175975 [1,0,0,1,0,0|2,0,0]=4 4119 B18R1.1445 CCOC(=O)CCCCCCCCN1CCSC1 269982a_100011215254_100010175975 [1,0,0,1,0,0|2,0,0]=4 4120 B18R1.1445 CCOC(=O)CCCCCCCNC1CCCC1 2230a_100000211070_100009991516 [1,0,0,1,0,0|1,0,0]=3 4121 B18R1.1445 CCOC(=O)CCCCCCCNC1CCCC1 34a_100000211070_100009991516 [1,0,0,1,0,0|1,0,0]=3 4122 B18R1.1445 CCOC(=O)CCCCCCCN[C@@H]1CCOC1 2230a_200015188469_100009991516 [1,0,0,1,0,0|2,0,0]=4 4123 B18R1.1445 CCOC(=O)CCCCCCCN[C@H]1CCOC1 2230a_100015188467_100009991516 [1,0,0,1,0,0|2,0,0]=4 4124 B18R1.1445 CCOC(=O)CCCCCCCN[C@H]1CCOC1 34a_100015188467_100009991516 [1,0,0,1,0,0|2,0,0]=4 4125 B18R1.1445 CCOC(=O)CCCCCCCOC1CCCC1 34a_100000210269_100009991516 [1,0,0,1,0,0|1,0,0]=3 4126 B18R1.1445 CCOC(=O)CCCCCCCOC1CCCC1 7a_100000210269_100009991516 [1,0,0,1,0,0|1,0,0]=3 4127 B18R1.1445 CCOC(=O)CCCCCCCOC1CCCO1 34a_100000085407_100009991516 [1,0,0,1,0,0|2,0,0]=4 4128 B18R1.1445 CCOC(=O)CCCCCCCOC1CCSC1 7a_100011232664_100009991516 [1,0,0,1,0,0|2,0,0]=4 4129 B18R1.1445 CCOC(=O)CCCCCCCO[C@H]1CCOC1 34a_100000717292_100009991516 [1,0,0,1,0,0|2,0,0]=4 4130 B18R1.1445 CCOC(=O)CCCCCCCSC1CCCC1 62a_100011217020_100009991516 [1,0,0,1,0,0|1,0,0]=3 4131 B18R1.1445 CCOC(=O)CCCCCCNCC1CCCC1 2230a_100000737975_100009814379 [1,0,0,1,0,0|1,0,0]=3 4132 B18R1.1445 CCOC(=O)CCCCCCNCC1CCCC1 34a_100000737975_100009814379 [1,0,0,1,0,0|1,0,0]=3 4133 B18R1.1445 CCOC(=O)CCCCCCNCC1CCOC1 2230a_100000737293_100009814379 [1,0,0,1,0,0|2,0,0]=4 4134 B18R1.1445 CCOC(=O)CCCCCCNCC1CCOC1 34a_100000737293_100009814379 [1,0,0,1,0,0|2,0,0]=4 4135 B18R1.1445 CCOC(=O)CCCCCCNC[C@@H]1CCCO1 2230a_100020590478_100009814379 [1,0,0,1,0,0|2,0,0]=4 4136 B18R1.1445 CCOC(=O)CCCCCCNC[C@@H]1CCCO1 34a_100020590478_100009814379 [1,0,0,1,0,0|2,0,0]=4 4137 B18R1.1445 CCOC(=O)CCCCCCOCC1CCCC1 34a_100000742336_100009814379 [1,0,0,1,0,0|1,0,0]=3 4138 B18R1.1445 CCOC(=O)CCCCCCOCC1CCCC1 7a_100000742336_100009814379 [1,0,0,1,0,0|1,0,0]=3 4139 B18R1.1445 CCOC(=O)CCCCCCOCC1CCCO1 34a_100000210270_100009814379 [1,0,0,1,0,0|2,0,0]=4 4140 B18R1.1445 CCOC(=O)CCCCCCOCC1CCCO1 7a_100000210270_100009814379 [1,0,0,1,0,0|2,0,0]=4 4141 B18R1.1445 CCOC(=O)CCCCCCOCC1CCNC1 34a_100000748654_100009814379 [1,0,0,1,0,0|2,0,0]=4 4142 B18R1.1445 CCOC(=O)CCCCCCOCC1CCOC1 34a_100000740260_100009814379 [1,0,0,1,0,0|2,0,0]=4 4143 B18R1.1445 CCOC(=O)CCCCCCOC[C@H]1CCCN1 34a_100000745186_100009814379 [1,0,0,1,0,0|2,0,0]=4 4144 B18R1.1445 CCOC(=O)CCCCCCSCC1CCCC1 62a_100000740388_100009814379 [1,0,0,1,0,0|1,0,0]=3 4145 B18R1.1445 CCOC(=O)CCCCCCSCC1CCCO1 62a_100000203698_100009814379 [1,0,0,1,0,0|2,0,0]=4 4146 B18R1.1445 CCOC(=O)CCCCCCSCC1CCOC1 62a_100000702531_100009814379 [1,0,0,1,0,0|2,0,0]=4 4147 B18R1.1445 CCOC(=O)CCCCCNCCC1CCCC1 2230a_100000739158_100000755133 [1,0,0,1,0,0|1,0,0]=3 4148 B18R1.1445 CCOC(=O)CCCCCNCCC1CCCC1 34a_100000739158_100000755133 [1,0,0,1,0,0|1,0,0]=3 4149 B18R1.1445 CCOC(=O)CCCCCOCCC1CCCC1 34a_100000749090_100000755133 [1,0,0,1,0,0|1,0,0]=3 4150 B18R1.1445 CCOC(=O)CCCCCOCCC1CCCC1 7a_100000749090_100000755133 [1,0,0,1,0,0|1,0,0]=3 4151 B18R1.1445 CCOC(=O)CCCCCOCCC1CCCC1 7a_100011214988_100000760354 [1,0,0,1,0,0|1,0,0]=3 4152 B18R1.1445 CCOC(=O)CCCCCOCCC1CCNC1 34a_100016987287_100000755133 [1,0,0,1,0,0|2,0,0]=4 4153 B18R1.1445 CCOC(=O)CCCCCOCCC1CCOC1 34a_100011879284_100000755133 [1,0,0,1,0,0|2,0,0]=4 4154 B18R1.1445 CCOC(=O)CCCCCOCCN1CCCC1 7a_100011214988_100000004467 [1,0,0,1,0,0|2,0,0]=4 4155 B18R1.1445 CCOC(=O)CCCCCSCCC1CCCC1 62a_100000755133_100000760354 [1,0,0,1,0,0|1,0,0]=3 4156 B18R1.1445 CCOC(=O)CCCCCSCCC1CCCC1 62a_100000760354_100000755133 [1,0,0,1,0,0|1,0,0]=3 4157 B18R1.1445 CCOC(=O)CCCCCSCCN1CCCC1 62a_100000700749_100000755133 [1,0,0,1,0,0|2,0,0]=4 4158 B18R1.1445 CCOC(=O)CCCCCSCCN1CCCC1 62a_100000755133_100000004467 [1,0,0,1,0,0|2,0,0]=4 4159 B18R1.1445 CCOC(=O)CCCCNCCCC1CCCC1 2230a_100000736752_100000750268 [1,0,0,1,0,0|1,0,0]=3 4160 B18R1.1445 CCOC(=O)CCCCNCCCC1CCCC1 34a_100000736752_100000750268 [1,0,0,1,0,0|1,0,0]=3 4161 B18R1.1445 CCOC(=O)CCCCNCCOC1CCCC1 34a_100000741755_100000750268 [1,0,0,1,0,0|2,0,0]=4 4162 B18R1.1445 CCOC(=O)CCCCOCCCC1CCCC1 34a_100011215328_100000750268 [1,0,0,1,0,0|1,0,0]=3 4163 B18R1.1445 CCOC(=O)CCCCOCCCC1CCCC1 7a_100011215328_100000750268 [1,0,0,1,0,0|1,0,0]=3 4164 B18R1.1445 CCOC(=O)CCCCOCCNC1CCCC1 34a_200000200444_100000750268 [1,0,0,1,0,0|2,0,0]=4 4165 B18R1.1445 CCOC(=O)CCCCOCCOC1CCCC1 34a_100000738311_100000750268 [1,0,0,1,0,0|2,0,0]=4 4166 B18R1.1445 CCOC(=O)CCCCOCCOC1CCCC1 7a_100000738311_100000750268 [1,0,0,1,0,0|2,0,0]=4 4167 B18R1.1445 CCOC(=O)CCCCSCCCC1CCCC1 62a_100000750268_100011713738 [1,0,0,1,0,0|1,0,0]=3 4168 B18R1.1445 CCOC(=O)CCCCSCCCC1CCCC1 62a_100011713738_100000750268 [1,0,0,1,0,0|1,0,0]=3 4169 B18R1.1445 CCOC(=O)CCCCSCCCN1CCCC1 62a_100000750268_100011445909 [1,0,0,1,0,0|2,0,0]=4 4170 B18R1.1445 CCOC(=O)CCCCSCCCN1CCCC1 62a_100016991639_100000750268 [1,0,0,1,0,0|2,0,0]=4 4171 B18R1.1445 CCOC(=O)CCCNCCCOC1CCCC1 34a_100000747560_100009991533 [1,0,0,1,0,0|2,0,0]=4 4172 B18R1.1445 CCOC(=O)COCCCNCCC1CCCC1 2230a_100000739158_100009893628 [1,0,0,1,0,0|2,0,0]=4 4173 B18R1.1445 CCOC(=O)COCCCNCCC1CCCC1 34a_100000739158_100009893628 [1,0,0,1,0,0|2,0,0]=4 4174 B18R1.1445 CCOC(=O)COCCCOCCC1CCCC1 34a_100000749090_100009893628 [1,0,0,1,0,0|2,0,0]=4 4175 B18R1.1445 CCOC(=O)COCCCOCCC1CCCC1 7a_100000749090_100009893628 [1,0,0,1,0,0|2,0,0]=4 4176 B18R1.1445 CCOC(=O)COCCCSCCC1CCCC1 62a_100000760354_100009893628 [1,0,0,1,0,0|2,0,0]=4 4177 B18R1.1445 CCOC(=O)COCCCSCCC1CCCC1 62a_100009893628_100000760354 [1,0,0,1,0,0|2,0,0]=4 4178 B18R1.1445 CCOC(=O)COCCNCCCC1CCCC1 2230a_100000736752_100000088970 [1,0,0,1,0,0|2,0,0]=4 4179 B18R1.1445 CCOC(=O)COCCNCCCC1CCCC1 34a_100000736752_100000088970 [1,0,0,1,0,0|2,0,0]=4 4180 B18R1.1445 CCOC(=O)COCCOCCCC1CCCC1 34a_100011215328_100000088970 [1,0,0,1,0,0|2,0,0]=4 4181 B18R1.1445 CCOC(=O)COCCOCCCC1CCCC1 7a_100011215328_100000088970 [1,0,0,1,0,0|2,0,0]=4 4182 B18R1.1445 CCOC(=O)COCCSCCCC1CCCC1 62a_100000088970_100011713738 [1,0,0,1,0,0|2,0,0]=4 4183 B18R1.1445 CCOC(=O)COCCSCCCC1CCCC1 62a_100011713738_100000088970 [1,0,0,1,0,0|2,0,0]=4 4184 B18R1.1445 CCOC(=O)CSCCOCCCC1CCCC1 7a_200000230590_100011713738 [1,0,0,1,0,0|2,0,0]=4 4185 B18R1.1481 CCOC(=O)CCCCCCN1CCCCC1C 2230a_100000211376_100009814379 [1,0,0,1,0,0|1,0,0]=3 4186 B18R1.1481 CCOC(=O)CCCCCCN1CCCCC1C 269982a_100000211376_100009814379 [1,0,0,1,0,0|1,0,0]=3 4187 B18R1.1481 CCOC(=O)CCCCCCN1CCCCC1C 34a_100000211376_100009814379 [1,0,0,1,0,0|1,0,0]=3 4188 B18R1.1481 CCOC(=O)CCCCCCN1CCOC[C@@H]1C 2230a_100009815349_100009814379 [1,0,0,1,0,0|2,0,0]=4 4189 B18R1.1481 CCOC(=O)CCCCCCN1CCOC[C@@H]1C 269982a_100009815349_100009814379 [1,0,0,1,0,0|2,0,0]=4 4190 B18R1.1481 CCOC(=O)CCCCCCN1CCOC[C@@H]1C 34a_100009815349_100009814379 [1,0,0,1,0,0|2,0,0]=4 4191 B18R1.1481 CCOC(=O)CCCCCNC1CCCCC1C 2230a_100000211402_100000755133 [1,0,0,1,0,0|1,0,0]=3 4192 B18R1.1481 CCOC(=O)CCCCCNC1CCCCC1C 34a_100000211402_100000755133 [1,0,0,1,0,0|1,0,0]=3 4193 B18R1.1481 CCOC(=O)CCCCCN[C@@H]1CCCC[C@H]1F 2230a_100015195156_100000755133 [1,0,0,1,0,0|2,0,0]=4 4194 B18R1.1481 CCOC(=O)CCCCCN[C@@H]1CCCC[C@H]1F 34a_100015195156_100000755133 [1,0,0,1,0,0|2,0,0]=4 4195 B18R1.1481 CCOC(=O)CCCCCOC1CCCCC1C 34a_100000211207_100000755133 [1,0,0,1,0,0|1,0,0]=3 4196 B18R1.1481 CCOC(=O)CCCCCOC1CCCCC1C 7a_100000211207_100000755133 [1,0,0,1,0,0|1,0,0]=3 4197 B18R1.1481 CCOC(=O)CCCCCOC1CCCCC1Cl 34a_100000038908_100000755133 [1,0,0,1,0,0|2,0,0]=4 4198 B18R1.1481 CCOC(=O)CCCCCOC1CCCCC1Cl 7a_100000038908_100000755133 [1,0,0,1,0,0|2,0,0]=4 4199 B18R1.1481 CCOC(=O)CCCCCOC1CCNCC1C 34a_100011998114_100000755133 [1,0,0,1,0,0|2,0,0]=4 4200 B18R1.1481 CCOC(=O)CCCCCOC1CNCCC1C 34a_100000696640_100000755133 [1,0,0,1,0,0|2,0,0]=4 4201 B18R1.1481 CCOC(=O)CCCCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000755133 [1,0,0,1,0,0|2,0,0]=4 4202 B18R1.1481 CCOC(=O)CCCCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000755133 [1,0,0,1,0,0|2,0,0]=4 4203 B18R1.1481 CCOC(=O)CCCCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000755133 [1,0,0,1,0,0|2,0,0]=4 4204 B18R1.1481 CCOC(=O)CCCCCSC1CCCCC1F 62a_100000755133_100015423560 [1,0,0,1,0,0|2,0,0]=4 4205 B18R1.1481 CCOC(=O)CCCCCSC1CCCCC1F 62a_100015423560_100000755133 [1,0,0,1,0,0|2,0,0]=4 4206 B18R1.1481 CCOC(=O)CCCCCSC1CCCCC1O 62a_100000038908_100000755133 [1,0,0,1,0,0|2,0,0]=4 4207 B18R1.1481 CCOC(=O)CCCCCSC1CCCCC1O 62a_100000755133_100000038908 [1,0,0,1,0,0|2,0,0]=4 4208 B18R1.1481 CCOC(=O)CCCCNCC1CCCCC1O 34a_100011216029_100000750268 [1,0,0,1,0,0|2,0,0]=4 4209 B18R1.1481 CCOC(=O)CCCCNCC1CCCCN1C 34a_100011228421_100000750268 [1,0,0,1,0,0|2,0,0]=4 4210 B18R1.1481 CCOC(=O)CCCCOCC1CCCCN1C 34a_100000225079_100000750268 [1,0,0,1,0,0|2,0,0]=4 4211 B18R1.1481 CCOC(=O)CCCCSCC1CCCCN1C 62a_100000750268_100015185383 [1,0,0,1,0,0|2,0,0]=4 4212 B18R1.1481 CCOC(=O)CCCCSCC1CCCCN1C 62a_100015185383_100000750268 [1,0,0,1,0,0|2,0,0]=4 4213 B18R1.1481 CCOC(=O)CCCNCCN1CCCCC1C 2230a_100000739827_100009991533 [1,0,0,1,0,0|2,0,0]=4 4214 B18R1.1481 CCOC(=O)CCCNCCN1CCCCC1C 34a_100000739827_100009991533 [1,0,0,1,0,0|2,0,0]=4 4215 B18R1.1481 CCOC(=O)CCCOCCC1CCCCN1C 7a_100012001163_100000211948 [1,0,0,1,0,0|2,0,0]=4 4216 B18R1.1481 CCOC(=O)CCCOCCN1CCCCC1C 34a_100011305533_100009991533 [1,0,0,1,0,0|2,0,0]=4 4217 B18R1.1481 CCOC(=O)CCCSCCC1CCCCN1C 62a_100000211948_100009991533 [1,0,0,1,0,0|2,0,0]=4 4218 B18R1.1481 CCOC(=O)CCCSCCC1CCCCN1C 62a_100009991533_100000211948 [1,0,0,1,0,0|2,0,0]=4 4219 B18R1.1481 CCOC(=O)CCNCCCN1CCCCC1C 34a_100000212276_100000765890 [1,0,0,1,0,0|2,0,0]=4 4220 B18R1.1481 CCOC(=O)CCOCCCN1CCCCC1C 34a_100000213889_100000765890 [1,0,0,1,0,0|2,0,0]=4 4221 B18R1.1481 CCOC(=O)CCOCCCN1CCCCC1C 7a_100000213889_100011206558 [1,0,0,1,0,0|2,0,0]=4 4222 B18R1.1481 CCOC(=O)COCCCNC1CCCCC1C 2230a_100000211402_100009893628 [1,0,0,1,0,0|2,0,0]=4 4223 B18R1.1481 CCOC(=O)COCCCNC1CCCCC1C 34a_100000211402_100009893628 [1,0,0,1,0,0|2,0,0]=4 4224 B18R1.1481 CCOC(=O)COCCCOC1CCCCC1C 34a_100000211207_100009893628 [1,0,0,1,0,0|2,0,0]=4 4225 B18R1.1481 CCOC(=O)COCCCOC1CCCCC1C 7a_100000211207_100009893628 [1,0,0,1,0,0|2,0,0]=4 4226 B18R1.1482 CCOC(=O)CCCCCCN1CCCC1CC 2230a_100000754278_100009814379 [1,0,0,1,0,0|1,0,0]=3 4227 B18R1.1482 CCOC(=O)CCCCCCN1CCCC1CC 269982a_100000754278_100009814379 [1,0,0,1,0,0|1,0,0]=3 4228 B18R1.1482 CCOC(=O)CCCCCCN1CCCC1CC 34a_100000754278_100009814379 [1,0,0,1,0,0|1,0,0]=3 4229 B18R1.1482 CCOC(=O)CCCCCCN1CCC[C@@H]1CO 2230a_100000745186_100009814379 [1,0,0,1,0,0|2,0,0]=4 4230 B18R1.1482 CCOC(=O)CCCCCCN1CCC[C@@H]1CO 269982a_100000745186_100009814379 [1,0,0,1,0,0|2,0,0]=4 4231 B18R1.1482 CCOC(=O)CCCCCCN1CCC[C@@H]1CO 34a_100000745186_100009814379 [1,0,0,1,0,0|2,0,0]=4 4232 B18R1.1482 CCOC(=O)CCCCNCC1CCCN1CC 2230a_100000211693_100000750268 [1,0,0,1,0,0|2,0,0]=4 4233 B18R1.1482 CCOC(=O)CCCCOC[C@H]1CCCN1CC 34a_100011739246_100000750268 [1,0,0,1,0,0|2,0,0]=4 4234 B18R1.1482 CCOC(=O)CCCCOC[C@H]1CCCN1CC 7a_100011739246_100000750268 [1,0,0,1,0,0|2,0,0]=4 4235 B18R1.4901 CCOC(=O)CCCCCN1CCCCC1CC 2230a_100000210034_100000755133 [1,0,0,1,0,0|1,0,0]=3 4236 B18R1.4901 CCOC(=O)CCCCCN1CCCCC1CC 269982a_100000210034_100000755133 [1,0,0,1,0,0|1,0,0]=3 4237 B18R1.4901 CCOC(=O)CCCCCN1CCCCC1CC 34a_100000210034_100000755133 [1,0,0,1,0,0|1,0,0]=3 4238 B18R1.4901 CCOC(=O)CCCCCN1CCCCC1CO 2230a_100000210821_100000755133 [1,0,0,1,0,0|2,0,0]=4 4239 B18R1.4901 CCOC(=O)CCCCCN1CCCCC1CO 269982a_100000210821_100000755133 [1,0,0,1,0,0|2,0,0]=4 4240 B18R1.4901 CCOC(=O)CCCCCN1CCCCC1CO 34a_100000210821_100000755133 [1,0,0,1,0,0|2,0,0]=4 4241 B18R1.4901 CCOC(=O)CCCCCN1CCOC[C@@H]1CC 2230a_100016988097_100000755133 [1,0,0,1,0,0|2,0,0]=4 4242 B18R1.4901 CCOC(=O)CCCCCN1CCOC[C@@H]1CC 269982a_100016988097_100000755133 [1,0,0,1,0,0|2,0,0]=4 4243 B18R1.4901 CCOC(=O)CCCCCN1CCOC[C@@H]1CC 34a_100016988097_100000755133 [1,0,0,1,0,0|2,0,0]=4 4244 B18R1.4901 CCOC(=O)CCCCNC1CCCCC1OC 34a_100011208099_100000750268 [1,0,0,1,0,0|2,0,0]=4 4245 B18R1.4901 CCOC(=O)CCCCOC1CCCCC1CC 34a_100000210738_100000750268 [1,0,0,1,0,0|1,0,0]=3 4246 B18R1.4901 CCOC(=O)CCCCOC1CCCCC1CC 7a_100000210738_100000750268 [1,0,0,1,0,0|1,0,0]=3 4247 B18R1.4901 CCOC(=O)CCCCOC1CCCCC1CN 34a_100011216029_100000750268 [1,0,0,1,0,0|2,0,0]=4 4248 B18R1.4901 CCOC(=O)CCCCO[C@@H]1CCCC[C@H]1NC 34a_100000708425_100000750268 [1,0,0,1,0,0|2,0,0]=4 4249 B18R1.4901 CCOC(=O)CCCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000750268 [1,0,0,1,0,0|2,0,0]=4 4250 B18R1.4901 CCOC(=O)CCCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000750268 [1,0,0,1,0,0|2,0,0]=4 4251 B18R1.4901 CCOC(=O)CCCNCC1CCCCN1CC 2230a_100000754393_100009991533 [1,0,0,1,0,0|2,0,0]=4 4252 B18R1.4901 CCOC(=O)CCCNCC1CCCCN1CC 34a_100000754393_100009991533 [1,0,0,1,0,0|2,0,0]=4 4253 B18R1.4901 CCOC(=O)CCCOCC1CCCCN1CC 34a_100000225091_100009991533 [1,0,0,1,0,0|2,0,0]=4 4254 B18R1.4901 CCOC(=O)CCCOCC1CCCCN1CC 7a_100000225091_100011215271 [1,0,0,1,0,0|2,0,0]=4 4255 B18R1.4901 CCOC(=O)CCNCCN1CCCCC1CC 2230a_100000755458_100011206558 [1,0,0,1,0,0|2,0,0]=4 4256 B18R1.4901 CCOC(=O)CCNCCN1CCCCC1CC 34a_100000755458_100000765890 [1,0,0,1,0,0|2,0,0]=4 4257 B18R1.4901 CCOC(=O)CNCCCN1CCCCC1CC 34a_100011191702_100000188475 [1,0,0,1,0,0|2,0,0]=4 4258 B18R1.4901 CCOC(=O)COCCCN1CCCCC1CC 2230a_100000210034_100009893628 [1,0,0,1,0,0|2,0,0]=4 4259 B18R1.4901 CCOC(=O)COCCCN1CCCCC1CC 269982a_100000210034_100009893628 [1,0,0,1,0,0|2,0,0]=4 4260 B18R1.4901 CCOC(=O)COCCCN1CCCCC1CC 34a_100000210034_100009893628 [1,0,0,1,0,0|2,0,0]=4 4261 B18R1.4901 CCOC(=O)COCCOC1CCCCC1CC 34a_100000210738_100000088970 [1,0,0,1,0,0|2,0,0]=4 4262 B18R1.4901 CCOC(=O)COCCOC1CCCCC1CC 7a_100000210738_100000088970 [1,0,0,1,0,0|2,0,0]=4 4263 B18R1.4933 CCCC1CCCCC1OCCCC(=O)OCC 34a_100011217265_100009991533 [1,0,0,1,0,0|1,0,0]=3 4264 B18R1.4933 CCCC1CCCCC1OCCCC(=O)OCC 7a_100011217265_100011215271 [1,0,0,1,0,0|1,0,0]=3 4265 B18R1.4933 CCCC1CCCCC1OCCNC(=O)OCC 7a_100011217265_200011445536 [1,0,0,1,0,0|2,0,0]=4 4266 B18R1.4933 CCCC1CCCCN1CCCCC(=O)OCC 2230a_100000701414_100000750268 [1,0,0,1,0,0|1,0,0]=3 4267 B18R1.4933 CCCC1CCCCN1CCCCC(=O)OCC 269982a_100000701414_100000750268 [1,0,0,1,0,0|1,0,0]=3 4268 B18R1.4933 CCCC1CCCCN1CCCCC(=O)OCC 34a_100000701414_100000750268 [1,0,0,1,0,0|1,0,0]=3 4269 B18R1.4933 CCCC1CCCCN1CCOCC(=O)OCC 2230a_100000701414_100000088970 [1,0,0,1,0,0|2,0,0]=4 4270 B18R1.4933 CCCC1CCCCN1CCOCC(=O)OCC 269982a_100000701414_100000088970 [1,0,0,1,0,0|2,0,0]=4 4271 B18R1.4933 CCCC1CCCCN1CCOCC(=O)OCC 34a_100000701414_100000088970 [1,0,0,1,0,0|2,0,0]=4 4272 B18R1.4933 CCCC1COCCN1CCCCC(=O)OCC 2230a_102495339903_100000750268 [1,0,0,1,0,0|2,0,0]=4 4273 B18R1.4933 CCCC1COCCN1CCCCC(=O)OCC 269982a_102495339903_100000750268 [1,0,0,1,0,0|2,0,0]=4 4274 B18R1.4933 CCCC1COCCN1CCCCC(=O)OCC 34a_102495339903_100000750268 [1,0,0,1,0,0|2,0,0]=4 4275 B18R1.4933 CCOC(=O)CCCCN1CCCCC1CCO 2230a_100000211664_100000750268 [1,0,0,1,0,0|2,0,0]=4 4276 B18R1.4933 CCOC(=O)CCCCN1CCCCC1CCO 269982a_100000211664_100000750268 [1,0,0,1,0,0|2,0,0]=4 4277 B18R1.4933 CCOC(=O)CCCCN1CCCCC1CCO 34a_100000211664_100000750268 [1,0,0,1,0,0|2,0,0]=4 4278 B18R1.4933 CCOC(=O)CCCCN1CCCCC1COC 2230a_100015184032_100000750268 [1,0,0,1,0,0|2,0,0]=4 4279 B18R1.4933 CCOC(=O)CCCCN1CCCCC1COC 269982a_100015184032_100000750268 [1,0,0,1,0,0|2,0,0]=4 4280 B18R1.4933 CCOC(=O)CCCCN1CCCCC1COC 34a_100015184032_100000750268 [1,0,0,1,0,0|2,0,0]=4 4281 B18R1.13046 CCCCCCCCN1CCC[C@H]1C(=O)NCC 2230a_100020641767_100000210759 [1,0,0,1,0,0|2,0,0]=4 4282 B18R1.13046 CCCCCCCCN1CCC[C@H]1C(=O)NCC 269982a_100020641767_100000210759 [1,0,0,1,0,0|2,0,0]=4 4283 B18R1.13046 CCCCCCCCN1CCC[C@H]1C(=O)NCC 34a_100020641767_100000210759 [1,0,0,1,0,0|2,0,0]=4 4284 B18R1.13046 CCCCCCCCN1CCC[C@H]1C(=O)OCC 2230a_100000703725_100000210759 [1,0,0,1,0,0|1,0,0]=3 4285 B18R1.13046 CCCCCCCCN1CCC[C@H]1C(=O)OCC 269982a_100000703725_100000210759 [1,0,0,1,0,0|1,0,0]=3 4286 B18R1.13046 CCCCCCCCN1CSC[C@H]1C(=O)OCC 269982a_100016989239_100000210759 [1,0,0,1,0,0|2,0,0]=4 4287 B18R1.13046 CCCCCCCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100000210614 [1,0,0,1,0,0|1,0,0]=3 4288 B18R1.13046 CCCCOCCO[C@H]1CCC[C@H]1C(=O)OCC 7a_200015395474_100000743108 [1,0,0,1,0,0|2,0,0]=4 4289 B18R1.13046 CCOC(=O)[C@@H]1CCCN1CCCCCCCO 2230a_100000703725_100000760002 [1,0,0,1,0,0|2,0,0]=4 4290 B18R1.13046 CCOC(=O)[C@@H]1CCCN1CCCCCCCO 269982a_100000703725_100000760002 [1,0,0,1,0,0|2,0,0]=4 4291 B18R1.13046 CCOC(=O)[C@@H]1CCCN1CCCCCCOC 2230a_100000703725_100011998445 [1,0,0,1,0,0|2,0,0]=4 4292 B18R1.13046 CCOC(=O)[C@@H]1CCCN1CCCCCCOC 269982a_100000703725_100011998445 [1,0,0,1,0,0|2,0,0]=4 4293 B18R1.13046 CCOC(=O)[C@@H]1CCC[C@@H]1OCCCCCCF 7a_200015395474_100015922095 [1,0,0,1,0,0|2,0,0]=4 4294 B18R1.13046 CCOC(=O)[C@@H]1CCC[C@@H]1OCCCCCCO 7a_200015395474_100000766143 [1,0,0,1,0,0|2,0,0]=4 4295 B18R1.14112 CCCN1CCCC1COCCCC(=O)OCC 34a_200000694710_100009991533 [1,0,0,1,0,0|2,0,0]=4 4296 B18R1.14112 CCCN1CCCC1COCCCC(=O)OCC 7a_200000694710_100011215271 [1,0,0,1,0,0|2,0,0]=4 4297 B18R1.14112 CCOC(=O)CCCCCN1CCC[C@H]1COC 2230a_100020646714_100000755133 [1,0,0,1,0,0|2,0,0]=4 4298 B18R1.14112 CCOC(=O)CCCCCN1CCC[C@H]1COC 269982a_100020646714_100000755133 [1,0,0,1,0,0|2,0,0]=4 4299 B18R1.14112 CCOC(=O)CCCCCN1CCC[C@H]1COC 34a_100020646714_100000755133 [1,0,0,1,0,0|2,0,0]=4 4300 B18R1.14469 CCOC(=O)CCCCCCN1CCC1COC 2230a_100015195929_100009814379 [1,0,0,1,0,0|2,0,0]=4 4301 B18R1.14469 CCOC(=O)CCCCCCN1CCC1COC 269982a_100015195929_100009814379 [1,0,0,1,0,0|2,0,0]=4 4302 B18R1.14469 CCOC(=O)CCCCCCN1CCC1COC 34a_100015195929_100009814379 [1,0,0,1,0,0|2,0,0]=4 4303 B18R1.21916 CCCCCCCCCCCNC1CCCC1=O 2230a_200011215754_100000211823 [1,0,0,1,0,0|2,0,0]=4 4304 B18R1.21916 CCCCCCCCCCCNC1CCCC1=O 34a_200011215754_100000709159 [1,0,0,1,0,0|2,0,0]=4 4305 B18R1.21916 CCCCCCCCCCCNC1CCNC1=O 2230a_100016995588_100011215454 [1,0,0,1,0,0|2,0,0]=4 4306 B18R1.21916 CCCCCCCCCCCNC1CCNC1=O 34a_100016995588_100011215454 [1,0,0,1,0,0|2,0,0]=4 4307 B18R1.21916 CCCCCCCCCCCNC1CCOC1=O 2230a_200011215754_100000211211 [1,0,0,1,0,0|1,0,0]=3 4308 B18R1.21916 CCCCCCCCCCCNC1CCOC1=O 34a_200011215754_100000211211 [1,0,0,1,0,0|1,0,0]=3 4309 B18R1.21916 CCCCCCCCCCCOC1CCCC1=O 34a_100000210809_100000709159 [1,0,0,1,0,0|2,0,0]=4 4310 B18R1.21916 CCCCCCCCCCCOC1CCCC1=O 34a_200000719330_100011215454 [1,0,0,1,0,0|2,0,0]=4 4311 B18R1.21916 CCCCCCCCCCCOC1CCCC1=O 7a_100000210809_100000211823 [1,0,0,1,0,0|2,0,0]=4 4312 B18R1.21916 CCCCCCCCCCCOC1CCOC1=O 34a_100000210809_100000211211 [1,0,0,1,0,0|1,0,0]=3 4313 B18R1.21916 CCCCCCCCCCCOC1CCOC1=O 7a_100000210809_100000211211 [1,0,0,1,0,0|1,0,0]=3 4314 B18R1.21916 CCCCCCCCCCCO[C@H]1CCNC1=O 34a_100000688343_100011215454 [1,0,0,1,0,0|2,0,0]=4 4315 B18R1.21916 CCCCCCCCCCCSC1CCOC1=O 62a_100000211211_100011215454 [1,0,0,1,0,0|1,0,0]=3 4316 B18R1.21916 CCCCCCCCCCOCC1CCNC1=O 34a_100000133458_100000210320 [1,0,0,1,0,0|2,0,0]=4 4317 B18R1.21916 NCCCCCCCCCCOC1CCOC1=O 34a_100000066964_100000211211 [1,0,0,1,0,0|2,0,0]=4 4318 B18R1.21916 O=C1OCCC1NCCCCCCCCCCO 2230a_100000066964_100000211211 [1,0,0,1,0,0|2,0,0]=4 4319 B18R1.21916 O=C1OCCC1NCCCCCCCCCCO 34a_100000066964_100000211211 [1,0,0,1,0,0|2,0,0]=4 4320 B18R1.21916 O=C1OCCC1OCCCCCCCCCCBr 34a_100009813290_100000211211 [1,0,0,1,0,0|2,0,0]=4 4321 B18R1.21916 O=C1OCCC1OCCCCCCCCCCBr 7a_100009813290_100000211211 [1,0,0,1,0,0|2,0,0]=4 4322 B18R1.21916 O=C1OCCC1OCCCCCCCCCCCl 34a_200000033068_100000211211 [1,0,0,1,0,0|2,0,0]=4 4323 B18R1.21916 O=C1OCCC1OCCCCCCCCCCCl 7a_200000033068_100000211211 [1,0,0,1,0,0|2,0,0]=4 4324 B18R1.21916 O=C1OCCC1SCCCCCCCCCCO 62a_100000211211_200000033068 [1,0,0,1,0,0|2,0,0]=4 4325 B18R1.21916 O=C1OCCC1SCCCCCCCCCCO 62a_100009813290_100000211211 [1,0,0,1,0,0|2,0,0]=4 4326 B18R1.21934 CCCCCC1CCCC1NCCC(=O)NCC 269862a_100025743525_200000198059 [1,0,0,1,0,0|2,0,0]=4 4327 B18R1.21934 CCCCCC1CCCC1NCCC(=O)NCC 270004a_100025743525_200000198059 [1,0,0,1,0,0|2,0,0]=4 4328 B18R1.23387 CCCCCCN1CCCCC1CC(=O)OCC 2230a_100116209990_100000210314 [1,0,0,1,0,0|1,0,0]=3 4329 B18R1.23387 CCCCCCN1CCCCC1CC(=O)OCC 269982a_100116209990_100000210757 [1,0,0,1,0,0|1,0,0]=3 4330 B18R1.23387 CCCCOCN1CCCCC1CC(=O)OCC 2230a_100116209990_100011995733 [1,0,0,1,0,0|2,0,0]=4 4331 B18R1.23387 CCCCOCN1CCCCC1CC(=O)OCC 269982a_100116209990_100011995733 [1,0,0,1,0,0|2,0,0]=4 4332 B18R1.23387 CCCOCCN1CCCCC1CC(=O)OCC 2230a_100116209990_100011215938 [1,0,0,1,0,0|2,0,0]=4 4333 B18R1.23387 CCCOCCN1CCCCC1CC(=O)OCC 269982a_100116209990_100011215938 [1,0,0,1,0,0|2,0,0]=4 4334 B18R1.23387 CCOC(=O)CC1CCCCN1CCCCCF 2230a_100116209990_100000729378 [1,0,0,1,0,0|2,0,0]=4 4335 B18R1.23387 CCOC(=O)CC1CCCCN1CCCCCF 269982a_100116209990_100000729378 [1,0,0,1,0,0|2,0,0]=4 4336 B18R1.23387 CCOC(=O)CC1CCCCN1CCCCCO 2230a_100116209990_100000746330 [1,0,0,1,0,0|2,0,0]=4 4337 B18R1.23387 CCOC(=O)CC1CCCCN1CCCCCO 269982a_100116209990_100000746330 [1,0,0,1,0,0|2,0,0]=4 4338 B18R1.23387 CCOC(=O)CC1CCCCN1CCCCOC 2230a_100116209990_100000730899 [1,0,0,1,0,0|2,0,0]=4 4339 B18R1.23387 CCOC(=O)CC1CCCCN1CCCCOC 269982a_100116209990_100000730899 [1,0,0,1,0,0|2,0,0]=4 4340 B18R1.23387 CCOCCCN1CCCCC1CC(=O)OCC 2230a_100116209990_100012232248 [1,0,0,1,0,0|2,0,0]=4 4341 B18R1.23387 CCOCCCN1CCCCC1CC(=O)OCC 269982a_100116209990_100012232248 [1,0,0,1,0,0|2,0,0]=4 4342 B18R1.29002 CCOC(=O)CCCCN1CCCCCCCC1 2230a_100000039187_100000750268 [1,0,0,1,0,0|1,0,0]=3 4343 B18R1.29002 CCOC(=O)CCCCN1CCCCCCCC1 269982a_100000039187_100000750268 [1,0,0,1,0,0|1,0,0]=3 4344 B18R1.29002 CCOC(=O)CCCCN1CCCCCCCC1 34a_100000039187_100000750268 [1,0,0,1,0,0|1,0,0]=3 4345 B18R1.29002 CCOC(=O)COCCN1CCCCCCCC1 2230a_100000039187_100000088970 [1,0,0,1,0,0|2,0,0]=4 4346 B18R1.29002 CCOC(=O)COCCN1CCCCCCCC1 269982a_100000039187_100000088970 [1,0,0,1,0,0|2,0,0]=4 4347 B18R1.29002 CCOC(=O)COCCN1CCCCCCCC1 34a_100000039187_100000088970 [1,0,0,1,0,0|2,0,0]=4 4348 B18R1.29249 CCOC(=O)CCCCCCCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100010175975 [1,0,0,1,0,0|2,0,0]=4 4349 B18R1.29249 CCOC(=O)CCCCCCCCN[C@@H]1C[C@H]1F 2230a_100025746932_100010175975 [1,0,0,1,0,0|2,0,0]=4 4350 B18R1.29249 CCOC(=O)CCCCCCCCN[C@@H]1C[C@H]1F 34a_100025746932_100010175975 [1,0,0,1,0,0|2,0,0]=4 4351 B18R1.29249 CCOC(=O)CCCCCCCOCC1CC1C 34a_100000744939_100009991516 [1,0,0,1,0,0|1,0,0]=3 4352 B18R1.29249 CCOC(=O)CCCCCCCOCC1CC1C 7a_100000744939_100009991516 [1,0,0,1,0,0|1,0,0]=3 4353 B18R1.29250 CCOC(=O)CCCCCCCCCN1CCC1 269982a_100000754969_100009828014 [1,0,0,1,0,0|1,0,0]=3 4354 B18R1.29250 CCOC(=O)CCCCCCCCNC1CCC1 2230a_100000749019_100010175975 [1,0,0,1,0,0|1,0,0]=3 4355 B18R1.29250 CCOC(=O)CCCCCCCCNC1CCC1 34a_100000749019_100010175975 [1,0,0,1,0,0|1,0,0]=3 4356 B18R1.29250 CCOC(=O)CCCCCCCCNC1COC1 2230a_100016991112_100010175975 [1,0,0,1,0,0|2,0,0]=4 4357 B18R1.29250 CCOC(=O)CCCCCCCCOC1CCC1 34a_100000748187_100010175975 [1,0,0,1,0,0|1,0,0]=3 4358 B18R1.29250 CCOC(=O)CCCCCCCCOC1CSC1 7a_100000072292_100010175975 [1,0,0,1,0,0|2,0,0]=4 4359 B18R1.29250 CCOC(=O)CCCCCCCNCC1CCC1 2230a_100000738700_100009991516 [1,0,0,1,0,0|1,0,0]=3 4360 B18R1.29250 CCOC(=O)CCCCCCCNCC1CCC1 34a_100000738700_100009991516 [1,0,0,1,0,0|1,0,0]=3 4361 B18R1.29250 CCOC(=O)CCCCCCCNCC1COC1 2230a_100015281925_100009991516 [1,0,0,1,0,0|2,0,0]=4 4362 B18R1.29250 CCOC(=O)CCCCCCCNCC1COC1 34a_100015281925_100009991516 [1,0,0,1,0,0|2,0,0]=4 4363 B18R1.29250 CCOC(=O)CCCCCCCNC[C@@H]1CCO1 2230a_100020831831_100009991516 [1,0,0,1,0,0|2,0,0]=4 4364 B18R1.29250 CCOC(=O)CCCCCCCNC[C@@H]1CCO1 34a_100020831831_100009991516 [1,0,0,1,0,0|2,0,0]=4 4365 B18R1.29250 CCOC(=O)CCCCCCCOCC1CCC1 34a_100000760304_100009991516 [1,0,0,1,0,0|1,0,0]=3 4366 B18R1.29250 CCOC(=O)CCCCCCCOCC1CCO1 34a_100000039022_100009991516 [1,0,0,1,0,0|2,0,0]=4 4367 B18R1.29250 CCOC(=O)CCCCCCCOCC1CNC1 34a_100016987283_100009991516 [1,0,0,1,0,0|2,0,0]=4 4368 B18R1.29250 CCOC(=O)CCCCCCCOCC1COC1 34a_100000060846_100009991516 [1,0,0,1,0,0|2,0,0]=4 4369 B18R1.29250 CCOC(=O)CCCCCCCSCC1CCC1 62a_100000763275_100009991516 [1,0,0,1,0,0|1,0,0]=3 4370 B18R1.29250 CCOC(=O)CCCCCCCSCC1CCO1 62a_100000103362_100009991516 [1,0,0,1,0,0|2,0,0]=4 4371 B18R1.29250 CCOC(=O)CCCCCCCSCC1COC1 62a_100010264016_100009991516 [1,0,0,1,0,0|2,0,0]=4 4372 B18R1.29250 CCOC(=O)CCCCCCOCCC1COC1 34a_100009855314_100009814379 [1,0,0,1,0,0|2,0,0]=4 4373 B18R1.29395 CCNC(=O)CCNCCC1CCCCCCC1 2230a_100011532352_100000737597 [1,0,0,1,0,0|2,0,0]=4 4374 B18R1.29395 CCOC(=O)CCCCCN1CCCCCCC1 2230a_100000211400_100000755133 [1,0,0,1,0,0|1,0,0]=3 4375 B18R1.29395 CCOC(=O)CCCCCN1CCCCCCC1 269982a_100000211400_100000755133 [1,0,0,1,0,0|1,0,0]=3 4376 B18R1.29395 CCOC(=O)CCCCCN1CCCCCCC1 34a_100000211400_100000755133 [1,0,0,1,0,0|1,0,0]=3 4377 B18R1.29395 CCOC(=O)CCCCNC1CCCCCCC1 2230a_100000211152_100000750268 [1,0,0,1,0,0|1,0,0]=3 4378 B18R1.29395 CCOC(=O)CCCCNC1CCCCCCC1 34a_100000211152_100000750268 [1,0,0,1,0,0|1,0,0]=3 4379 B18R1.29395 CCOC(=O)CCCCOC1CCCCCCC1 34a_100000210054_100000750268 [1,0,0,1,0,0|1,0,0]=3 4380 B18R1.29395 CCOC(=O)CCCCOC1CCCCCCC1 7a_100000210054_100000750268 [1,0,0,1,0,0|1,0,0]=3 4381 B18R1.29395 CCOC(=O)CCCOCC1CCCCCCC1 34a_100011216312_100009991533 [1,0,0,1,0,0|1,0,0]=3 4382 B18R1.29395 CCOC(=O)CCCOCC1CCCCCCC1 7a_100011216312_100011215271 [1,0,0,1,0,0|1,0,0]=3 4383 B18R1.29395 CCOC(=O)CCNCCC1CCCCCCC1 2230a_100011532352_100011206558 [1,0,0,1,0,0|1,0,0]=3 4384 B18R1.29395 CCOC(=O)CCNCCC1CCCCCCC1 34a_100011532352_100000765890 [1,0,0,1,0,0|1,0,0]=3 4385 B18R1.29395 CCOC(=O)COCCCN1CCCCCCC1 2230a_100000211400_100009893628 [1,0,0,1,0,0|2,0,0]=4 4386 B18R1.29395 CCOC(=O)COCCCN1CCCCCCC1 269982a_100000211400_100009893628 [1,0,0,1,0,0|2,0,0]=4 4387 B18R1.29395 CCOC(=O)COCCCN1CCCCCCC1 34a_100000211400_100009893628 [1,0,0,1,0,0|2,0,0]=4 4388 B18R1.29395 CCOC(=O)COCCNC1CCCCCCC1 2230a_100000211152_100000088970 [1,0,0,1,0,0|2,0,0]=4 4389 B18R1.29395 CCOC(=O)COCCNC1CCCCCCC1 34a_100000211152_100000088970 [1,0,0,1,0,0|2,0,0]=4 4390 B18R1.29395 CCOC(=O)COCCOC1CCCCCCC1 34a_100000210054_100000088970 [1,0,0,1,0,0|2,0,0]=4 4391 B18R1.29395 CCOC(=O)COCCOC1CCCCCCC1 7a_100000210054_100000088970 [1,0,0,1,0,0|2,0,0]=4 4392 B18R1.29395 CCOC(=O)NCCOCC1CCCCCCC1 7a_100011216312_200011445536 [1,0,0,1,0,0|2,0,0]=4 4393 B18R1.29583 CCOC(=O)CCCCCCCN1CCC[C@@H]1C 2230a_100020605311_100009991516 [1,0,0,1,0,0|1,0,0]=3 4394 B18R1.29583 CCOC(=O)CCCCCCCN1CCC[C@@H]1C 269982a_100020605311_100009991516 [1,0,0,1,0,0|1,0,0]=3 4395 B18R1.29583 CCOC(=O)CCCCCCCN1CCC[C@H]1C 2230a_100015189458_100009991516 [1,0,0,1,0,0|1,0,0]=3 4396 B18R1.29583 CCOC(=O)CCCCCCCN1CCC[C@H]1C 269982a_100015189458_100009991516 [1,0,0,1,0,0|1,0,0]=3 4397 B18R1.29583 CCOC(=O)CCCCCCCN1CCC[C@H]1C 34a_100015189458_100009991516 [1,0,0,1,0,0|1,0,0]=3 4398 B18R1.29583 CCOC(=O)CCCCCCCN1CCSC1C 2230a_200011216479_100009991516 [1,0,0,1,0,0|2,0,0]=4 4399 B18R1.29583 CCOC(=O)CCCCCCCN1CCSC1C 269982a_200011216479_100009991516 [1,0,0,1,0,0|2,0,0]=4 4400 B18R1.29583 CCOC(=O)CCCCCCCN1CCSC1C 34a_200011216479_100009991516 [1,0,0,1,0,0|2,0,0]=4 4401 B18R1.29583 CCOC(=O)CCCCCCOC1CCCC1C 34a_100011216460_100009814379 [1,0,0,1,0,0|1,0,0]=3 4402 B18R1.29583 CCOC(=O)CCCCCCOC1CCCC1C 7a_100011216460_100009814379 [1,0,0,1,0,0|1,0,0]=3 4403 B18R1.29583 CCOC(=O)CCCCCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100009814379 [1,0,0,1,0,0|2,0,0]=4 4404 B18R1.29583 CCOC(=O)CCCCCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100009814379 [1,0,0,1,0,0|2,0,0]=4 4405 B18R1.29583 CCOC(=O)CCCCCCO[C@H]1CNC[C@H]1C 34a_200015306588_100009814379 [1,0,0,1,0,0|2,0,0]=4 4406 B18R1.29583 CCOC(=O)CCCCCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100009814379 [1,0,0,1,0,0|2,0,0]=4 4407 B18R1.29583 CCOC(=O)CCCCCOCC1CCCN1C 34a_100000743107_100000755133 [1,0,0,1,0,0|2,0,0]=4 4408 B18R1.29583 CCOC(=O)CCCCOCCC1CCCN1C 34a_100011215177_100000750268 [1,0,0,1,0,0|2,0,0]=4 4409 B18R1.29583 CCOC(=O)CCCCOCCC1CCCN1C 7a_100011215177_100000750268 [1,0,0,1,0,0|2,0,0]=4 4410 B18R1.29583 CCOC(=O)CCCCSCCC1CCCN1C 62a_100000005710_100000750268 [1,0,0,1,0,0|2,0,0]=4 4411 B18R1.29583 CCOC(=O)CCCCSCCC1CCCN1C 62a_100000750268_100000005710 [1,0,0,1,0,0|2,0,0]=4 4412 B18R1.29593 CCOC(=O)CCCCCCCCN1CCC1C 269982a_100000755817_100010175975 [1,0,0,1,0,0|1,0,0]=3 4413 B18R1.29593 CCOC(=O)CCCCCCCCN1CCC1C 34a_100000755817_100010175975 [1,0,0,1,0,0|1,0,0]=3 4414 B18R1.40331 CCCCCCCN1CCCCC1C(=O)OCC 2230a_100016990872_100000210681 [1,0,0,1,0,0|1,0,0]=3 4415 B18R1.40331 CCCCCCCN1CCCCC1C(=O)OCC 269982a_100016990872_100000210681 [1,0,0,1,0,0|1,0,0]=3 4416 B18R1.40331 CCCCCCCN1CCOC[C@H]1C(=O)OCC 2230a_100015229691_100000210681 [1,0,0,1,0,0|2,0,0]=4 4417 B18R1.40331 CCCCCCCN1CCOC[C@H]1C(=O)OCC 269982a_100015229691_100000210681 [1,0,0,1,0,0|2,0,0]=4 4418 B18R1.40331 CCCCCCCN1CCSCC1C(=O)OCC 2230a_100000735462_100000210681 [1,0,0,1,0,0|2,0,0]=4 4419 B18R1.40331 CCCCCCCN1CCSCC1C(=O)OCC 269982a_100000735462_100000210681 [1,0,0,1,0,0|2,0,0]=4 4420 B18R1.40331 CCCCCCOC1CCCCC1C(=O)OCC 7a_100000038711_100000210314 [1,0,0,1,0,0|1,0,0]=3 4421 B18R1.40331 CCCCOCCN1CCCCC1C(=O)OCC 2230a_100016990872_100000743108 [1,0,0,1,0,0|2,0,0]=4 4422 B18R1.40331 CCCCOCCN1CCCCC1C(=O)OCC 269982a_100016990872_100000743108 [1,0,0,1,0,0|2,0,0]=4 4423 B18R1.40331 CCCOCCOC1CCCCC1C(=O)OCC 7a_100000038711_100011215938 [1,0,0,1,0,0|2,0,0]=4 4424 B18R1.40331 CCOC(=O)C1CCCCC1OCCCCCF 7a_100000038711_100000729378 [1,0,0,1,0,0|2,0,0]=4 4425 B18R1.40331 CCOC(=O)C1CCCCC1OCCCCCO 7a_100000038711_100000746330 [1,0,0,1,0,0|2,0,0]=4 4426 B18R1.40331 CCOC(=O)C1CCCCC1OCCCCOC 7a_100000038711_100000730899 [1,0,0,1,0,0|2,0,0]=4 4427 B18R1.40331 CCOC(=O)C1CCCCN1CCCCCCF 2230a_100016990872_100015922095 [1,0,0,1,0,0|2,0,0]=4 4428 B18R1.40331 CCOC(=O)C1CCCCN1CCCCCCF 269982a_100016990872_100015922095 [1,0,0,1,0,0|2,0,0]=4 4429 B18R1.40331 CCOC(=O)C1CCCCN1CCCCCCO 2230a_100016990872_100000766143 [1,0,0,1,0,0|2,0,0]=4 4430 B18R1.40331 CCOC(=O)C1CCCCN1CCCCCCO 269982a_100016990872_100000766143 [1,0,0,1,0,0|2,0,0]=4 4431 B18R1.40331 CCOCCCOC1CCCCC1C(=O)OCC 7a_100000038711_100012232248 [1,0,0,1,0,0|2,0,0]=4 4432 B18R1.40569 CCCCCCCCCCN1CCNC(=O)CC1 2230a_100000698595_100000210320 [1,0,0,1,0,0|2,0,0]=4 4433 B18R1.40569 CCCCCCCCCCN1CCNC(=O)CC1 269982a_100000698595_100000210320 [1,0,0,1,0,0|2,0,0]=4 4434 B18R1.42824 CCOC(=O)CCCCCCCCCNC1CC1 34a_100000212008_100009828014 [1,0,0,1,0,0|1,0,0]=3 4435 B18R1.42824 CCOC(=O)CCCCCCCCNCC1CC1 2230a_100000735609_100010175975 [1,0,0,1,0,0|1,0,0]=3 4436 B18R1.42824 CCOC(=O)CCCCCCCCNCC1CC1 34a_100000735609_100010175975 [1,0,0,1,0,0|1,0,0]=3 4437 B18R1.42824 CCOC(=O)CCCCCCCCOCC1CC1 34a_100000211283_100010175975 [1,0,0,1,0,0|1,0,0]=3 4438 B18R1.42824 CCOC(=O)CCCCCCCCOC[C@@H]1CO1 34a_100000757423_100010175975 [1,0,0,1,0,0|2,0,0]=4 4439 B18R1.42824 CCOC(=O)CCCCCCCCSCC1CC1 62a_100000756562_100010175975 [1,0,0,1,0,0|1,0,0]=3 4440 B18R1.42824 CCOC(=O)CCCCCCCCSCC1CO1 62a_102125554688_100010175975 [1,0,0,1,0,0|2,0,0]=4 4441 B18R1.42824 CCOC(=O)CCCCCCCCSCC1CS1 62a_100000031435_100010175975 [1,0,0,1,0,0|2,0,0]=4 4442 B18R1.42824 CCOC(=O)CCCCCCCCSC[C@@H]1CO1 62a_100000745022_100010175975 [1,0,0,1,0,0|2,0,0]=4 4443 B18R1.42824 CCOC(=O)CCCCCCCNCCC1CC1 34a_100000764129_100009991516 [1,0,0,1,0,0|1,0,0]=3 4444 B18R1.42824 CCOC(=O)CCCCCCCOCCC1CC1 34a_100000754188_100009991516 [1,0,0,1,0,0|1,0,0]=3 4445 B18R1.42824 CCOC(=O)CCCCCCCOCCC1CC1 7a_100000754188_100009991516 [1,0,0,1,0,0|1,0,0]=3 4446 B18R1.42824 CCOC(=O)CCCCCCCOCC[C@@H]1CO1 34a_100009820653_100009991516 [1,0,0,1,0,0|2,0,0]=4 4447 B18R1.42824 CCOC(=O)CCCCCCCSCCC1CC1 62a_100000764125_100009991516 [1,0,0,1,0,0|1,0,0]=3 4448 B18R1.42824 CCOC(=O)CCCCCCCSCCC1CO1 62a_100000732470_100009991516 [1,0,0,1,0,0|2,0,0]=4 4449 B18R1.42824 CCOC(=O)CCCCCCOCCNC1CC1 34a_100000738766_100009814379 [1,0,0,1,0,0|2,0,0]=4 4450 B18R1.42824 CCOC(=O)CCCCCCSCCCC1CO1 62a_100000733510_100009814379 [1,0,0,1,0,0|2,0,0]=4 4451 B18R1.43007 CCOC(=O)CCCCCCN1CCCCCC1 2230a_100000185865_100009814379 [1,0,0,1,0,0|1,0,0]=3 4452 B18R1.43007 CCOC(=O)CCCCCCN1CCCCCC1 269982a_100000185865_100009814379 [1,0,0,1,0,0|1,0,0]=3 4453 B18R1.43007 CCOC(=O)CCCCCCN1CCCCCC1 34a_100000185865_100009814379 [1,0,0,1,0,0|1,0,0]=3 4454 B18R1.43007 CCOC(=O)CCCCCCN1CCCOCC1 2230a_100000685342_100009814379 [1,0,0,1,0,0|2,0,0]=4 4455 B18R1.43007 CCOC(=O)CCCCCCN1CCCOCC1 269982a_100000685342_100009814379 [1,0,0,1,0,0|2,0,0]=4 4456 B18R1.43007 CCOC(=O)CCCCCCN1CCCOCC1 34a_100000685342_100009814379 [1,0,0,1,0,0|2,0,0]=4 4457 B18R1.43007 CCOC(=O)CCCCCNC1CCCCCC1 2230a_100000210984_100000755133 [1,0,0,1,0,0|1,0,0]=3 4458 B18R1.43007 CCOC(=O)CCCCCNC1CCCCCC1 34a_100000210984_100000755133 [1,0,0,1,0,0|1,0,0]=3 4459 B18R1.43007 CCOC(=O)CCCCCOC1CCCCCC1 34a_100000210887_100000755133 [1,0,0,1,0,0|1,0,0]=3 4460 B18R1.43007 CCOC(=O)CCCCCOC1CCCCCC1 7a_100000210887_100000755133 [1,0,0,1,0,0|1,0,0]=3 4461 B18R1.43007 CCOC(=O)CCCCCSC1CCCCCC1 62a_100000755133_100011217769 [1,0,0,1,0,0|1,0,0]=3 4462 B18R1.43007 CCOC(=O)CCCCCSC1CCCCCC1 62a_100011217769_100000755133 [1,0,0,1,0,0|1,0,0]=3 4463 B18R1.43007 CCOC(=O)CCCCNCC1CCCCCC1 2230a_100015204231_100000750268 [1,0,0,1,0,0|1,0,0]=3 4464 B18R1.43007 CCOC(=O)CCCCNCC1CCCCCC1 34a_100015204231_100000750268 [1,0,0,1,0,0|1,0,0]=3 4465 B18R1.43007 CCOC(=O)CCCCOCC1CCCCCC1 34a_100000699130_100000750268 [1,0,0,1,0,0|1,0,0]=3 4466 B18R1.43007 CCOC(=O)CCCCOCC1CCCCCC1 7a_100000699130_100000750268 [1,0,0,1,0,0|1,0,0]=3 4467 B18R1.43007 CCOC(=O)CCCCSCC1CCCCCC1 62a_100000750268_200000696569 [1,0,0,1,0,0|1,0,0]=3 4468 B18R1.43007 CCOC(=O)CCCCSCC1CCCCCC1 62a_200000696569_100000750268 [1,0,0,1,0,0|1,0,0]=3 4469 B18R1.43007 CCOC(=O)CCCNCCC1CCCCCC1 2230a_100011532351_100009991533 [1,0,0,1,0,0|1,0,0]=3 4470 B18R1.43007 CCOC(=O)CCCNCCC1CCCCCC1 34a_100011532351_100009991533 [1,0,0,1,0,0|1,0,0]=3 4471 B18R1.43007 CCOC(=O)CCCOCCN1CCCCCC1 34a_100000238007_100009991533 [1,0,0,1,0,0|2,0,0]=4 4472 B18R1.43007 CCOC(=O)CCCOCCN1CCCCCC1 7a_100012001163_100000722644 [1,0,0,1,0,0|2,0,0]=4 4473 B18R1.43007 CCOC(=O)CCCSCCN1CCCCCC1 62a_100000722644_100009991533 [1,0,0,1,0,0|2,0,0]=4 4474 B18R1.43007 CCOC(=O)CCCSCCN1CCCCCC1 62a_100009991533_100000722644 [1,0,0,1,0,0|2,0,0]=4 4475 B18R1.43007 CCOC(=O)CCOCCCN1CCCCCC1 34a_100102886287_100000765890 [1,0,0,1,0,0|2,0,0]=4 4476 B18R1.43007 CCOC(=O)CCOCCCN1CCCCCC1 7a_100102886287_100011206558 [1,0,0,1,0,0|2,0,0]=4 4477 B18R1.43007 CCOC(=O)COCCCCN1CCCCCC1 34a_100011305542_100000188475 [1,0,0,1,0,0|2,0,0]=4 4478 B18R1.43007 CCOC(=O)COCCCNC1CCCCCC1 2230a_100000210984_100009893628 [1,0,0,1,0,0|2,0,0]=4 4479 B18R1.43007 CCOC(=O)COCCCNC1CCCCCC1 34a_100000210984_100009893628 [1,0,0,1,0,0|2,0,0]=4 4480 B18R1.43007 CCOC(=O)COCCCOC1CCCCCC1 34a_100000210887_100009893628 [1,0,0,1,0,0|2,0,0]=4 4481 B18R1.43007 CCOC(=O)COCCCOC1CCCCCC1 7a_100000210887_100009893628 [1,0,0,1,0,0|2,0,0]=4 4482 B18R1.43007 CCOC(=O)COCCCSC1CCCCCC1 62a_100009893628_100011217769 [1,0,0,1,0,0|2,0,0]=4 4483 B18R1.43007 CCOC(=O)COCCCSC1CCCCCC1 62a_100011217769_100009893628 [1,0,0,1,0,0|2,0,0]=4 4484 B18R1.43007 CCOC(=O)COCCNCC1CCCCCC1 2230a_100015204231_100000088970 [1,0,0,1,0,0|2,0,0]=4 4485 B18R1.43007 CCOC(=O)COCCNCC1CCCCCC1 34a_100015204231_100000088970 [1,0,0,1,0,0|2,0,0]=4 4486 B18R1.43007 CCOC(=O)COCCOCC1CCCCCC1 34a_100000699130_100000088970 [1,0,0,1,0,0|2,0,0]=4 4487 B18R1.43007 CCOC(=O)COCCOCC1CCCCCC1 7a_100000699130_100000088970 [1,0,0,1,0,0|2,0,0]=4 4488 B18R1.43007 CCOC(=O)COCCSCC1CCCCCC1 62a_100000088970_200000696569 [1,0,0,1,0,0|2,0,0]=4 4489 B18R1.43007 CCOC(=O)COCCSCC1CCCCCC1 62a_200000696569_100000088970 [1,0,0,1,0,0|2,0,0]=4 4490 B18R1.43007 CCOC(=O)CSCCOCC1CCCCCC1 7a_200000230590_200000696569 [1,0,0,1,0,0|2,0,0]=4 4491 B18R1.43424 CCCC(=O)NC1CCCCCCCCCCC1 11a_100011194316_100000211992 [1,0,0,1,0,0|2,0,0]=4 4492 B18R1.43424 CCCC(=O)NC1CCCCCCCCCCC1 1626a_100011194316_100000211992 [1,0,0,1,0,0|2,0,0]=4 4493 B18R1.43424 CCCC(=O)NC1CCCCCCCCCCC1 240690a_100011194316_100000211992 [1,0,0,1,0,0|2,0,0]=4 4494 B18R1.43424 CCCC(=O)NC1CCCCCCCCCCC1 527a_100011194316_100000211992 [1,0,0,1,0,0|2,0,0]=4 4495 B18R1.43424 CCNC(=O)NC1CCCCCCCCCCC1 2708a_100011194316_100015525214 [1,0,0,1,0,0|2,0,0]=4 4496 B18R1.43424 CCNC(=O)NC1CCCCCCCCCCC1 2708a_100015525214_100011194316 [1,0,0,1,0,0|2,0,0]=4 4497 B18R1.43424 CCNC(=O)NC1CCCCCCCCCCC1 273464a_100011194316_100015525214 [1,0,0,1,0,0|2,0,0]=4 4498 B18R1.43424 CCNC(=O)NC1CCCCCCCCCCC1 273464a_100015525214_100011194316 [1,0,0,1,0,0|2,0,0]=4 4499 B18R1.49730 CCCCCCCCCCCCCC(=O)C1CO1 1458a_100000701028_100000210684 [1,0,0,1,0,0|2,0,0]=4 4500 B18R1.49730 CCCCCCCCCCCCNC(=O)C1CC1 11a_100000210451_100000210395 [1,0,0,1,0,0|2,0,0]=4 4501 B18R1.49730 CCCCCCCCCCCCNC(=O)C1CC1 1626a_100000210451_100000210395 [1,0,0,1,0,0|2,0,0]=4 4502 B18R1.49730 CCCCCCCCCCCCNC(=O)C1CC1 240690a_100000210451_100000210395 [1,0,0,1,0,0|2,0,0]=4 4503 B18R1.49730 CCCCCCCCCCCCNC(=O)C1CC1 527a_100000210451_100000210395 [1,0,0,1,0,0|2,0,0]=4 4504 B18R1.49730 CCCCCCCCCCCNCC(=O)C1CC1 2230a_200011215754_100000746382 [1,0,0,1,0,0|2,0,0]=4 4505 B18R1.49730 CCCCCCCCCCCNCC(=O)C1CC1 34a_200011215754_100000746382 [1,0,0,1,0,0|2,0,0]=4 4506 B18R1.49730 CCCCCCCCCCCOCC(=O)C1CC1 34a_100000210809_100000746382 [1,0,0,1,0,0|2,0,0]=4 4507 B18R1.49730 CCCCCCCCCCCOCC(=O)C1CC1 34a_100000686663_100011215454 [1,0,0,1,0,0|2,0,0]=4 4508 B18R1.49730 CCCCCCCCCCCOCC(=O)C1CC1 7a_100000210809_100000746382 [1,0,0,1,0,0|2,0,0]=4 4509 B18R1.49730 O=C(CCCCCCCCCCCCO)C1CC1 1458a_100000210395_100009813331 [1,0,0,1,0,0|2,0,0]=4 4510 B18R1.375 CCCCCCC1CCCC1NCC(=O)N(C)C 270004a_100015183351_100000189428 [0,0,0,1,1,0|2,0,0]=4 4511 B18R1.955 CCCCC1CCCC1NCCCC(=O)N(C)C 269862a_200000744827_100000750825 [0,0,0,1,1,0|2,0,0]=4 4512 B18R1.955 CCCCC1CCCC1NCCCC(=O)N(C)C 270004a_200000744827_100000750825 [0,0,0,1,1,0|2,0,0]=4 4513 B18R1.955 CCCCC1CCCC1NCCNC(=O)C(C)C 269862a_100000752568_100000750825 [0,0,0,1,1,0|2,0,0]=4 4514 B18R1.955 CCCCC1CCCC1NCCNC(=O)C(C)C 270004a_100000752568_100000750825 [0,0,0,1,1,0|2,0,0]=4 4515 B18R1.4457 CN(C)C(=O)CCCCNCCCC1CCCC1 34a_100000736752_100000752486 [0,0,0,1,1,0|2,0,0]=4 4516 B18R1.4457 CN(C)C(=O)CCCCOCCCC1CCCC1 34a_100011215328_100000752486 [0,0,0,1,1,0|2,0,0]=4 4517 B18R1.4457 CN(C)C(=O)CCCCOCCCC1CCCC1 7a_100011215328_100000752486 [0,0,0,1,1,0|2,0,0]=4 4518 B18R1.4457 CN(C)C(=O)CCCCSCCCC1CCCC1 62a_100000752486_100011713738 [0,0,0,1,1,0|2,0,0]=4 4519 B18R1.4457 CN(C)C(=O)CCCCSCCCC1CCCC1 62a_100011713738_100000752486 [0,0,0,1,1,0|2,0,0]=4 4520 B18R1.4475 CC(C)C(=O)CCCCCCOC1CCCCO1 1458a_100000210198_100000033462 [0,0,0,1,1,0|2,0,0]=4 4521 B18R1.4475 CC(C)C(=O)COCCCCCN1CCCCC1 34a_100011216611_100000753385 [0,0,0,1,1,0|2,0,0]=4 4522 B18R1.4475 CC(C)C(=O)COCCCCCN1CCCCC1 7a_100011216611_100000753385 [0,0,0,1,1,0|2,0,0]=4 4523 B18R1.4475 CC(C)C(=O)NCCNCCCC1CCCCC1 2230a_100000752568_100011713725 [0,0,0,1,1,0|2,0,0]=4 4524 B18R1.4475 CC(C)C(=O)NCCNCCCC1CCCCC1 34a_100000752568_100011713725 [0,0,0,1,1,0|2,0,0]=4 4525 B18R1.4475 CN(C)C(=O)CCCCNCCC1CCCCC1 34a_100000738074_100000752486 [0,0,0,1,1,0|2,0,0]=4 4526 B18R1.4475 CN(C)C(=O)CCCCOCCC1CCCCC1 34a_100011217863_100000752486 [0,0,0,1,1,0|2,0,0]=4 4527 B18R1.4475 CN(C)C(=O)CCCCOCCC1CCCCC1 7a_100011217863_100000752486 [0,0,0,1,1,0|2,0,0]=4 4528 B18R1.4475 CN(C)C(=O)CCCCSCCC1CCCCC1 62a_100000752486_100012355289 [0,0,0,1,1,0|2,0,0]=4 4529 B18R1.4475 CN(C)C(=O)CCCCSCCC1CCCCC1 62a_100012355289_100000752486 [0,0,0,1,1,0|2,0,0]=4 4530 B18R1.4475 CN(C)C(=O)CCCNCCCC1CCCCC1 2230a_100011211642_100000737642 [0,0,0,1,1,0|2,0,0]=4 4531 B18R1.4475 CN(C)C(=O)CCCNCCCC1CCCCC1 2230a_200000744827_100011713725 [0,0,0,1,1,0|2,0,0]=4 4532 B18R1.4475 CN(C)C(=O)CCCOCCCC1CCCCC1 7a_100000198086_100000737642 [0,0,0,1,1,0|2,0,0]=4 4533 B18R1.4475 CN(C)C(=O)CCCSCCCC1CCCCC1 62a_100000737642_100011713725 [0,0,0,1,1,0|2,0,0]=4 4534 B18R1.4475 CN(C)C(=O)CCCSCCCC1CCCCC1 62a_100011713725_100000737642 [0,0,0,1,1,0|2,0,0]=4 4535 B18R1.4475 CN(C)C(=O)CCOCCCCC1CCCCC1 7a_100011215267_100000737620 [0,0,0,1,1,0|2,0,0]=4 4536 B18R1.4936 CCCC1CCCCC1NCCCC(=O)N(C)C 269862a_200000744827_100011218038 [0,0,0,1,1,0|2,0,0]=4 4537 B18R1.4936 CCCC1CCCCC1NCCCC(=O)N(C)C 270004a_200000744827_100011218038 [0,0,0,1,1,0|2,0,0]=4 4538 B18R1.4936 CCCC1CCCCC1NCCNC(=O)C(C)C 269862a_100000752568_100011218038 [0,0,0,1,1,0|2,0,0]=4 4539 B18R1.4936 CCCC1CCCCC1NCCNC(=O)C(C)C 270004a_100000752568_100011218038 [0,0,0,1,1,0|2,0,0]=4 4540 B18R1.4936 CCCC1CCCCC1OCCCC(=O)N(C)C 7a_100011217265_100000737642 [0,0,0,1,1,0|2,0,0]=4 4541 B18R1.4936 CCCC1CCCCN1CCCCC(=O)N(C)C 269982a_100000701414_100000752486 [0,0,0,1,1,0|2,0,0]=4 4542 B18R1.4936 CCCC1CCCCN1CCCCC(=O)N(C)C 34a_100000701414_100000752486 [0,0,0,1,1,0|2,0,0]=4 4543 B18R1.8768 CCCCCCCCN1CCC[C@H]1C(=O)N(C)C 2230a_100020603401_100000210759 [0,0,0,1,1,0|2,0,0]=4 4544 B18R1.8768 CCCCCCCCN1CCC[C@H]1C(=O)N(C)C 34a_100020603401_100000210759 [0,0,0,1,1,0|2,0,0]=4 4545 B18R1.13446 CCCCCCCCCN1CCNC(=O)C1(C)C 2230a_100000751695_100011214924 [0,0,0,1,1,0|2,0,0]=4 4546 B18R1.13446 CCCCCCCCCN1CCNC(=O)C1(C)C 269982a_100000751695_100000210670 [0,0,0,1,1,0|2,0,0]=4 4547 B18R1.13446 CCCCCCCCCN1CCNC(=O)C1(C)C 34a_100000751695_100011214924 [0,0,0,1,1,0|2,0,0]=4 4548 B18R1.17254 CC(C)C(=O)C1CCCCCCCCCCC1=O 1458a_100000210198_200009990614 [0,0,0,1,1,0|1,0,1]=4 4549 B18R1.21928 CCCCCCCCCNC1CCC(=O)N(C1)C 2230a_100011935005_100011214924 [0,0,0,1,1,0|2,0,0]=4 4550 B18R1.21928 CCCCCCCCCNC1CCC(=O)N(C1)C 34a_100011935005_100011214924 [0,0,0,1,1,0|2,0,0]=4 4551 B18R1.21937 CCCCCC1CCCC1NCCC(=O)N(C)C 269862a_100000738053_200000198059 [0,0,0,1,1,0|2,0,0]=4 4552 B18R1.21937 CCCCCC1CCCC1NCCC(=O)N(C)C 270004a_100000738053_200000198059 [0,0,0,1,1,0|2,0,0]=4 4553 B18R1.34999 CCCCCCCCCCNC1CC(=O)N(C1)C 2230a_100000748898_100000210320 [0,0,0,1,1,0|2,0,0]=4 4554 B18R1.34999 CCCCCCCCCCNC1CC(=O)N(C1)C 34a_100000748898_100000210320 [0,0,0,1,1,0|2,0,0]=4 4555 B18R1.34999 CCCCCCCCCOCC1CC(=O)N(C1)C 34a_100015185614_100011214924 [0,0,0,1,1,0|2,0,0]=4 4556 B18R1.37992 CCC1CCCCC1OCCCCC(=O)N(C)C 34a_100000210738_100000752486 [0,0,0,1,1,0|2,0,0]=4 4557 B18R1.37992 CCC1CCCCC1OCCCCC(=O)N(C)C 7a_100000210738_100000752486 [0,0,0,1,1,0|2,0,0]=4 4558 B18R1.37992 CCC1CCCCN1CCCNCC(=O)C(C)C 34a_100011191702_100000753385 [0,0,0,1,1,0|2,0,0]=4 4559 B18R1.52682 CC(C)C(=O)COCCCCN1CCCCCC1 34a_100011305542_100000753385 [0,0,0,1,1,0|2,0,0]=4 4560 B18R1.52682 CN(C)C(=O)CCCCNCC1CCCCCC1 34a_100015204231_100000752486 [0,0,0,1,1,0|2,0,0]=4 4561 B18R1.52682 CN(C)C(=O)CCCCOCC1CCCCCC1 34a_100000699130_100000752486 [0,0,0,1,1,0|2,0,0]=4 4562 B18R1.52682 CN(C)C(=O)CCCCOCC1CCCCCC1 7a_100000699130_100000752486 [0,0,0,1,1,0|2,0,0]=4 4563 B18R1.52682 CN(C)C(=O)CCCCSCC1CCCCCC1 62a_100000752486_200000696569 [0,0,0,1,1,0|2,0,0]=4 4564 B18R1.52682 CN(C)C(=O)CCCCSCC1CCCCCC1 62a_200000696569_100000752486 [0,0,0,1,1,0|2,0,0]=4 4565 B18R1.52682 CN(C)C(=O)CCCNCCC1CCCCCC1 2230a_100011532351_100000737642 [0,0,0,1,1,0|2,0,0]=4 4566 B18R1.52728 CC(C)C(=O)NC1CCCCCCCCCCC1 11a_100011194316_100000210198 [0,0,0,1,1,0|1,0,0]=3 4567 B18R1.52728 CC(C)C(=O)NC1CCCCCCCCCCC1 1626a_100011194316_100000210198 [0,0,0,1,1,0|1,0,0]=3 4568 B18R1.52728 CC(C)C(=O)NC1CCCCCCCCCCC1 240690a_100011194316_100000210198 [0,0,0,1,1,0|1,0,0]=3 4569 B18R1.52728 CC(C)C(=O)NC1CCCCCCCCCCC1 527a_100011194316_100000210198 [0,0,0,1,1,0|1,0,0]=3 4570 B18R1.52728 CC(F)C(=O)NC1CCCCCCCCCCC1 11a_100011194316_100000062450 [0,0,0,1,1,0|2,0,0]=4 4571 B18R1.52728 CC(F)C(=O)NC1CCCCCCCCCCC1 1626a_100011194316_100000062450 [0,0,0,1,1,0|2,0,0]=4 4572 B18R1.52728 CC(F)C(=O)NC1CCCCCCCCCCC1 240690a_100011194316_100000062450 [0,0,0,1,1,0|2,0,0]=4 4573 B18R1.52728 CC(F)C(=O)NC1CCCCCCCCCCC1 527a_100011194316_100000062450 [0,0,0,1,1,0|2,0,0]=4 4574 B18R1.52728 CN(C)C(=O)NC1CCCCCCCCCCC1 2708a_100011194316_100102631434 [0,0,0,1,1,0|2,0,0]=4 4575 B18R1.52728 C[C@@H](O)C(=O)NC1CCCCCCCCCCC1 240690a_100011194316_100000717761 [0,0,0,1,1,0|2,0,0]=4 4576 B18R1.52728 C[C@H](O)C(=O)NC1CCCCCCCCCCC1 1626a_100011194316_217856618621 [0,0,0,1,1,0|2,0,0]=4 4577 B18R1.52728 C[C@H](O)C(=O)NC1CCCCCCCCCCC1 240690a_100011194316_217856618621 [0,0,0,1,1,0|2,0,0]=4 4578 B18R1.52838 CN(C)C(=O)CCCCNC1CCCCCCC1 34a_100000211152_100000752486 [0,0,0,1,1,0|2,0,0]=4 4579 B18R1.52838 CN(C)C(=O)CCCCOC1CCCCCCC1 34a_100000210054_100000752486 [0,0,0,1,1,0|2,0,0]=4 4580 B18R1.52838 CN(C)C(=O)CCCCOC1CCCCCCC1 7a_100000210054_100000752486 [0,0,0,1,1,0|2,0,0]=4 4581 B18R1.52838 CN(C)C(=O)CCCOCC1CCCCCCC1 7a_100011216312_100000737642 [0,0,0,1,1,0|2,0,0]=4 4582 B18R1.52838 CN(C)C(=O)CCNCCC1CCCCCCC1 2230a_100011532352_100000737620 [0,0,0,1,1,0|2,0,0]=4 4583 B18R1.177008 CC(C)C(=O)NCCNC1CCCCCCCC1 270004a_100000752568_100000038600 [0,0,0,1,1,0|2,0,0]=4 4584 B18R1.177008 CN(C)C(=O)CCCCN1CCCCCCCC1 269982a_100000039187_100000752486 [0,0,0,1,1,0|2,0,0]=4 4585 B18R1.177008 CN(C)C(=O)CCCCN1CCCCCCCC1 34a_100000039187_100000752486 [0,0,0,1,1,0|2,0,0]=4 4586 B18R1.177008 CN(C)C(=O)CCCNC1CCCCCCCC1 270004a_200000744827_100000038600 [0,0,0,1,1,0|2,0,0]=4 4587 B20R2.17878 CC(C)NC(=O)CCN1CCCC1C2CCCCC2 2230a_100011206067_100000737564 [0,0,0,2,0,0|2,0,0]=4 4588 B20R2.17878 CC(C)NC(=O)CCN1CCCC1C2CCCCC2 269982a_100011206067_100000737564 [0,0,0,2,0,0|2,0,0]=4 4589 B20R2.17878 CC(C)OC(=O)CCN1CCCC1C2CCCCC2 2230a_100011206067_100000760027 [0,0,0,2,0,0|1,0,0]=3 4590 B20R2.17878 CC(C)OC(=O)CCN1CCCC1C2CCCCC2 269982a_100011206067_100000760027 [0,0,0,2,0,0|1,0,0]=3 4591 B20R2.17878 CC(C)OC(=O)OCN1CCCC1C2CCCCC2 269982a_100011206067_100010125566 [0,0,0,2,0,0|2,0,0]=4 4592 B20R2.173419 CC(C)OC(=O)CCN1CCCC1CN2CCCC2 2230a_100000746075_100000760027 [0,0,0,2,0,0|2,0,0]=4 4593 B20R2.173419 CC(C)OC(=O)CCN1CCCC1CN2CCCC2 269982a_100000746075_100000760027 [0,0,0,2,0,0|2,0,0]=4 4594 B20R2.1411106 CCCCCCC1CCCC1NCC(=O)NC2CC2 270004a_100000702991_100000189428 [0,0,0,2,0,0|2,0,0]=4 4595 B20R2.8870 CC(C)NC(=O)CCN1C(CCC2C1CCCC2)C 2230a_100132302184_100000737564 [0,0,0,2,0,0|2,0,0]=4 4596 B20R2.8870 CC(C)NC(=O)CCN1C(CCC2C1CCCC2)C 269982a_100132302184_100000737564 [0,0,0,2,0,0|2,0,0]=4 4597 B20R2.8870 CC(C)OC(=O)CCN1C(CCC2C1CCCC2)C 2230a_100132302184_100000760027 [0,0,0,2,0,0|1,0,0]=3 4598 B20R2.8870 CC(C)OC(=O)CCN1C(CCC2C1CCCC2)C 269982a_100132302184_100000760027 [0,0,0,2,0,0|1,0,0]=3 4599 B20R2.8870 CC(C)OC(=O)OCN1C(CCC2C1CCCC2)C 269982a_100132302184_100010125566 [0,0,0,2,0,0|2,0,0]=4 4600 B20R2.14143450 CC(C)NC(=O)CCOC1CCCC2C1CCCC2 7a_100000042559_100000737564 [0,0,0,2,0,0|2,0,0]=4 4601 B20R2.14143450 CC(C)OC(=O)CCOC1CCCC2C1CCCC2 7a_100000042559_100000760027 [0,0,0,2,0,0|1,0,0]=3 4602 B20R2.14143450 CC(C)OC(=O)CNC[C@@H]1CCCN2[C@@H]1CCCC2 34a_100015187183_100011215430 [0,0,0,2,0,0|2,0,0]=4 4603 B20R2.14143450 CC(C)OC(=O)COC[C@@H]1CCCN2[C@@H]1CCCC2 34a_200009815849_100011215430 [0,0,0,2,0,0|2,0,0]=4 4604 B20R2.14143450 CC(C)OC(=O)COC[C@@H]1CCCN2[C@@H]1CCCC2 7a_200009815849_100011215430 [0,0,0,2,0,0|2,0,0]=4 4605 B20R2.2666511 CC(C)OC(=O)CCOC[C@@H]1CCCN1CC2CC2 7a_100012446949_100000760027 [0,0,0,2,0,0|2,0,0]=4 4606 B20R2.68297 CC(C)OC(=O)CN[C@@H]1CCCC[C@H]1N2CCCC2 34a_100009820197_100011215430 [0,0,0,2,0,0|2,0,0]=4 4607 B20R2.68381 CC(C)OC(=O)CN1CCCC1CN2CCCCC2 2230a_200000725506_100011215430 [0,0,0,2,0,0|2,0,0]=4 4608 B20R2.68381 CC(C)OC(=O)CN1CCCC1CN2CCCCC2 269982a_200000725506_100011215430 [0,0,0,2,0,0|2,0,0]=4 4609 B20R2.766522 CC(C)OC(=O)CCCCCSC1C2CCC1CC2 62a_100009813300_200010986244 [0,0,0,2,0,0|1,0,0]=3 4610 B20R2.766522 CC(C)OC(=O)CCCCCSC1C2CCC1CC2 62a_200010986244_100009813300 [0,0,0,2,0,0|1,0,0]=3 4611 B20R2.11056862 CC(C)OC(=O)CCCCCNC1CC2CCC1C2 2230a_100000758229_200010986244 [0,0,0,2,0,0|1,0,0]=3 4612 B20R2.11056862 CC(C)OC(=O)CCCCCNC1CC2CCC1C2 34a_100000758229_200010986244 [0,0,0,2,0,0|1,0,0]=3 4613 B20R2.11056862 CC(C)OC(=O)CCCCCOC1CC2CCC1C2 34a_100000211339_200010986244 [0,0,0,2,0,0|1,0,0]=3 4614 B20R2.11056862 CC(C)OC(=O)CCCCCSC1CC2CCC1C2 62a_100000727232_200010986244 [0,0,0,2,0,0|1,0,0]=3 4615 B20R2.11056862 CC(C)OC(=O)CCCCCSC1CC2CCC1C2 62a_200010986244_100000727232 [0,0,0,2,0,0|1,0,0]=3 4616 B20R2.10722 CC(C)CC(=O)NC1CCCCC1C2CCCCC2 11a_200011339469_100000210554 [0,0,0,2,0,0|2,0,0]=4 4617 B20R2.10722 CC(C)CC(=O)NC1CCCCC1C2CCCCC2 1626a_200011339469_100000210554 [0,0,0,2,0,0|2,0,0]=4 4618 B20R2.10722 CC(C)CC(=O)NC1CCCCC1C2CCCCC2 240690a_200011339469_100000210554 [0,0,0,2,0,0|2,0,0]=4 4619 B20R2.10722 CC(C)CC(=O)NC1CCCCC1C2CCCCC2 527a_200011339469_100000210554 [0,0,0,2,0,0|2,0,0]=4 4620 B20R2.10722 CC(C)NC(=O)CN1CCCCC1C2CCCCC2 2230a_100011219272_100000183996 [0,0,0,2,0,0|2,0,0]=4 4621 B20R2.10722 CC(C)NC(=O)CN1CCCCC1C2CCCCC2 269982a_100011219272_100000183996 [0,0,0,2,0,0|2,0,0]=4 4622 B20R2.10722 CC(C)NC(=O)CN1CCCCC1C2CCCCC2 34a_100011219272_100000183996 [0,0,0,2,0,0|2,0,0]=4 4623 B20R2.10722 CC(C)NC(=O)NC1CCCCC1C2CCCCC2 2708a_100138425928_200011339469 [0,0,0,2,0,0|2,0,0]=4 4624 B20R2.10722 CC(C)NC(=O)NC1CCCCC1C2CCCCC2 2708a_200011339469_100138425928 [0,0,0,2,0,0|2,0,0]=4 4625 B20R2.10722 CC(C)NC(=O)NC1CCCCC1C2CCCCC2 273464a_100138425928_200011339469 [0,0,0,2,0,0|2,0,0]=4 4626 B20R2.10722 CC(C)NC(=O)NC1CCCCC1C2CCCCC2 512a_100138425928_200011339469 [0,0,0,2,0,0|2,0,0]=4 4627 B20R2.10722 CC(C)OC(=O)CN1CCCCC1C2CCCCC2 2230a_100011219272_100011215430 [0,0,0,2,0,0|1,0,0]=3 4628 B20R2.10722 CC(C)OC(=O)CN1CCCCC1C2CCCCC2 269982a_100011219272_100011215430 [0,0,0,2,0,0|1,0,0]=3 4629 B20R2.10722 CC(C)OC(=O)CN1CCCCC1C2CCCCC2 34a_100011219272_100011215430 [0,0,0,2,0,0|1,0,0]=3 4630 B20R2.10722 CC(C)OC(=O)CN1CCOC[C@@H]1C2CCCCC2 2230a_100015984746_100011215430 [0,0,0,2,0,0|2,0,0]=4 4631 B20R2.10722 CC(C)OC(=O)CN1CCOC[C@@H]1C2CCCCC2 269982a_100015984746_100011215430 [0,0,0,2,0,0|2,0,0]=4 4632 B20R2.10722 CC(C)OC(=O)CN1CCOC[C@@H]1C2CCCCC2 34a_100015984746_100011215430 [0,0,0,2,0,0|2,0,0]=4 4633 B20R2.68341 CC(C)NC(=O)[C@H]1CCCN1CCC2CCCCC2 2230a_100153395200_100012355289 [0,0,0,2,0,0|2,0,0]=4 4634 B20R2.68341 CC(C)NC(=O)[C@H]1CCCN1CCC2CCCCC2 269982a_100153395200_100011273959 [0,0,0,2,0,0|2,0,0]=4 4635 B20R2.68341 CC(C)NC(=O)[C@H]1CCCN1CCC2CCCCC2 270004a_100153395200_100011713444 [0,0,0,2,0,0|2,0,0]=4 4636 B20R2.68341 CC(C)NC(=O)[C@H]1CCCN1CCC2CCCCC2 34a_100153395200_100011209188 [0,0,0,2,0,0|2,0,0]=4 4637 B20R2.70831 CC1CC(C(=O)O1)OCCCCCN2CCCCC2 34a_100011216611_200000216747 [0,0,0,2,0,0|2,0,0]=4 4638 B20R2.70831 CC1CC(C(=O)O1)OCCCCCN2CCCCC2 7a_100011216611_200000216747 [0,0,0,2,0,0|2,0,0]=4 4639 B20R2.780517 O=C(CCOCCCCC1CCCCC1)NC2CC2 34a_100011215267_100000737409 [0,0,0,2,0,0|2,0,0]=4 4640 B20R2.1488041 CC(C)OC(=O)CCCCCN1CC2CCC1CC2 2230a_100000750499_200010986244 [0,0,0,2,0,0|1,0,0]=3 4641 B20R2.1488041 CC(C)OC(=O)CCCCCN1CC2CCC1CC2 269982a_100000750499_200010986244 [0,0,0,2,0,0|1,0,0]=3 4642 B20R2.1488041 CC(C)OC(=O)CCCCCN1CC2CCC1CC2 34a_100000750499_200010986244 [0,0,0,2,0,0|1,0,0]=3 4643 B20R2.7197670 CC(C)OC(=O)CCCCCOCC1C2C1CNC2 34a_100000045132_200010986244 [0,0,0,2,0,0|2,0,0]=4 4644 B20R2.68336 CC(C)NC(=O)CCOC1CCC2CCCCC2C1 7a_100000211317_100000737564 [0,0,0,2,0,0|2,0,0]=4 4645 B20R2.68336 CC(C)OC(=O)CCOC1CCC2CCCCC2C1 7a_100000211317_100000760027 [0,0,0,2,0,0|1,0,0]=3 4646 B20R2.262850 CC(C)OC(=O)CCCCCN1C[C@H]2CCC[C@H]2C1 2230a_100102946302_200010986244 [0,0,0,2,0,0|1,0,0]=3 4647 B20R2.262850 CC(C)OC(=O)CCCCCN1C[C@H]2CCC[C@H]2C1 269982a_100102946302_200010986244 [0,0,0,2,0,0|1,0,0]=3 4648 B20R2.262850 CC(C)OC(=O)CCCCCN1C[C@H]2CCC[C@H]2C1 34a_100102946302_200010986244 [0,0,0,2,0,0|1,0,0]=3 4649 B20R2.262850 CC(C)OC(=O)CCCCCN1C[C@H]2COC[C@H]2C1 2230a_100000700037_200010986244 [0,0,0,2,0,0|2,0,0]=4 4650 B20R2.262850 CC(C)OC(=O)CCCCCN1C[C@H]2COC[C@H]2C1 269982a_100000700037_200010986244 [0,0,0,2,0,0|2,0,0]=4 4651 B20R2.262850 CC(C)OC(=O)CCCCCN1C[C@H]2COC[C@H]2C1 34a_100000700037_200010986244 [0,0,0,2,0,0|2,0,0]=4 4652 B20R2.496700 CC(C)OC(=O)CCCCCN1C[C@@H]2C[C@H]1CN2C 2230a_100025763010_200010986244 [0,0,0,2,0,0|2,0,0]=4 4653 B20R2.496700 CC(C)OC(=O)CCCCCN1C[C@@H]2C[C@H]1CN2C 269982a_100025763010_200010986244 [0,0,0,2,0,0|2,0,0]=4 4654 B20R2.42887 CCC1CCCCC1N2CCC[C@@H]2C(=O)NC(C)C 270004a_100153395200_100000757040 [0,0,0,2,0,0|2,0,0]=4 4655 B20R2.68373 CC(C)NC(=O)[C@H]1CCCN1CCCC2CCCC2 2230a_100153395200_100011713738 [0,0,0,2,0,0|2,0,0]=4 4656 B20R2.68373 CC(C)NC(=O)[C@H]1CCCN1CCCC2CCCC2 269982a_100153395200_100011713738 [0,0,0,2,0,0|2,0,0]=4 4657 B20R2.68373 CC(C)NC(=O)[C@H]1CCCN1CCCC2CCCC2 34a_100153395200_100011713738 [0,0,0,2,0,0|2,0,0]=4 4658 B20R2.189798 CCCC1CCCC1N2CCC[C@@H]2C(=O)NC(C)C 270004a_100153395200_100000723119 [0,0,0,2,0,0|2,0,0]=4 4659 B20R2.2667211 CC(C)NC(=O)[C@H]1CCCN1CC2CCCCCC2 2230a_100153395200_200000696569 [0,0,0,2,0,0|2,0,0]=4 4660 B20R2.2667211 CC(C)NC(=O)[C@H]1CCCN1CC2CCCCCC2 269982a_100153395200_200000696569 [0,0,0,2,0,0|2,0,0]=4 4661 B20R2.2667211 CC(C)NC(=O)[C@H]1CCCN1CC2CCCCCC2 34a_100153395200_200000696569 [0,0,0,2,0,0|2,0,0]=4 4662 B20R2.2667260 CC(C)NC(=O)[C@H]1CCCN1C2CCCCCCC2 270004a_100153395200_100000210524 [0,0,0,2,0,0|2,0,0]=4 4663 B20R2.2666641 CC(C)OC(=O)CCCCCN1C2CCC1COC2 2230a_100015205251_200010986244 [0,0,0,2,0,0|2,0,0]=4 4664 B20R2.2666641 CC(C)OC(=O)CCCCCN1C2CCC1COC2 269982a_100015205251_200010986244 [0,0,0,2,0,0|2,0,0]=4 4665 B20R2.2666641 CC(C)OC(=O)CCCCCN1C2CCC1COC2 34a_100015205251_200010986244 [0,0,0,2,0,0|2,0,0]=4 4666 B20R2.11056841 CC(C)OC(=O)CCCCCN1CCCC1C2CC2 2230a_200000757794_200010986244 [0,0,0,2,0,0|1,0,0]=3 4667 B20R2.11056841 CC(C)OC(=O)CCCCCN1CCCC1C2CC2 269982a_200000757794_200010986244 [0,0,0,2,0,0|1,0,0]=3 4668 B20R2.11056841 CC(C)OC(=O)CCCCCN1CCCC1C2CC2 34a_200000757794_200010986244 [0,0,0,2,0,0|1,0,0]=3 4669 B20R2.173440 CC(C)OC(=O)CN1CCCCC1CN2CCCC2 2230a_200011224931_100011215430 [0,0,0,2,0,0|2,0,0]=4 4670 B20R2.173440 CC(C)OC(=O)CN1CCCCC1CN2CCCC2 269982a_200011224931_100011215430 [0,0,0,2,0,0|2,0,0]=4 4671 B20R2.42483 CCC1CCCCN1CCCNC2CC(OC2=O)C 34a_100011191702_200000216747 [0,0,0,2,0,0|2,0,0]=4 4672 B20R2.2689270 CC1CC(C(=O)O1)OCCCCN2CCCCCC2 34a_100011305542_200000216747 [0,0,0,2,0,0|2,0,0]=4 4673 B20R2.11065161 O=C(CCNCCC1CCCCCCC1)NC2CC2 2230a_100011532352_100000737409 [0,0,0,2,0,0|2,0,0]=4 4674 B20R2.11065161 O=C(CCNCCC1CCCCCCC1)NC2CC2 34a_100011532352_100000737409 [0,0,0,2,0,0|2,0,0]=4 4675 B20R2.11073220 O=C(CC1CC1)NC2CCCCCCCCCCC2 11a_100011194316_100000738066 [0,0,0,2,0,0|2,0,0]=4 4676 B20R2.11073220 O=C(CC1CC1)NC2CCCCCCCCCCC2 1626a_100011194316_100000738066 [0,0,0,2,0,0|2,0,0]=4 4677 B20R2.11073220 O=C(CC1CC1)NC2CCCCCCCCCCC2 240690a_100011194316_100000738066 [0,0,0,2,0,0|2,0,0]=4 4678 B20R2.11073220 O=C(CC1CC1)NC2CCCCCCCCCCC2 527a_100011194316_100000738066 [0,0,0,2,0,0|2,0,0]=4 4679 B20R2.11073220 O=C(NC1CCCCCCCCCCC1)NC2CC2 2708a_100000212008_100011194316 [0,0,0,2,0,0|2,0,0]=4 4680 B20R2.11073220 O=C(NC1CCCCCCCCCCC1)NC2CC2 2708a_100011194316_100000212008 [0,0,0,2,0,0|2,0,0]=4 4681 B20R2.11073220 O=C(NC1CCCCCCCCCCC1)NC2CC2 273464a_100000212008_100011194316 [0,0,0,2,0,0|2,0,0]=4 4682 B20R2.11073220 O=C(NC1CCCCCCCCCCC1)NC2CC2 273464a_100011194316_100000212008 [0,0,0,2,0,0|2,0,0]=4 4683 B20R2.8013944 CC1CC1C(=O)NC2CCCCCCCCCCC2 11a_100011194316_100000211227 [0,0,0,2,0,0|2,0,0]=4 4684 B20R2.8013944 CC1CC1C(=O)NC2CCCCCCCCCCC2 1626a_100011194316_100000211227 [0,0,0,2,0,0|2,0,0]=4 4685 B20R2.8013944 CC1CC1C(=O)NC2CCCCCCCCCCC2 527a_100011194316_100000211227 [0,0,0,2,0,0|2,0,0]=4 4686 B16R0.224 CC(C)C(=O)CCCCCCCCCCCO 1458a_100000210198_100009812471 [1,0,0,0,1,0|1,0,0]=3 4687 B16R0.224 CC(C)C(=O)CNCCCCCCCCCO 2230a_100000078944_100000753385 [1,0,0,0,1,0|2,0,0]=4 4688 B16R0.224 CC(C)C(=O)CNCCCCCCCCCO 34a_100000078944_100000753385 [1,0,0,0,1,0|2,0,0]=4 4689 B16R0.224 CC(C)C(=O)COCCCCCCCCCBr 34a_100009813782_100000753385 [1,0,0,0,1,0|2,0,0]=4 4690 B16R0.224 CC(C)C(=O)COCCCCCCCCCBr 7a_100009813782_100000753385 [1,0,0,0,1,0|2,0,0]=4 4691 B16R0.224 CC(C)C(=O)COCCCCCCCCCCl 34a_100009868337_100000753385 [1,0,0,0,1,0|2,0,0]=4 4692 B16R0.224 CC(C)C(=O)COCCCCCCCCCCl 7a_100009868337_100000753385 [1,0,0,0,1,0|2,0,0]=4 4693 B16R0.224 CC(C)C(=O)COCCCCCCCCCN 34a_100000078944_100000753385 [1,0,0,0,1,0|2,0,0]=4 4694 B16R0.224 CC(C)C(=O)CSCCCCCCCCCO 62a_100000753385_100009813782 [1,0,0,0,1,0|2,0,0]=4 4695 B16R0.224 CC(C)C(=O)CSCCCCCCCCCO 62a_100009813782_100000753385 [1,0,0,0,1,0|2,0,0]=4 4696 B16R0.224 CC(C)C(=O)NCCCCCCCCCCO 240690a_100000066964_100000210198 [1,0,0,0,1,0|2,0,0]=4 4697 B16R0.224 CC(F)C(=O)CCCCCCCCCCCO 1458a_100000062450_100009812471 [1,0,0,0,1,0|2,0,0]=4 4698 B16R0.224 CCCCC#CCCCCCCC(=O)C(C)C 1458a_100000210198_200000043322 [1,0,0,0,1,0|0,0,2]=4 4699 B16R0.224 CCCCCCCCCCCCC(=O)C(O)O 1458a_100000233687_100000759014 [1,0,0,0,1,0|2,0,0]=4 4700 B16R0.224 CCCCCCCCCCCCC(=O)N(C)C 11a_100102631434_100011215791 [1,0,0,0,1,0|1,0,0]=3 4701 B16R0.224 CCCCCCCCCCCCC(=O)N(C)C 1626a_100102631434_100011215791 [1,0,0,0,1,0|1,0,0]=3 4702 B16R0.224 CCCCCCCCCCCCC(=O)N(C)C 240690a_100102631434_100011215791 [1,0,0,0,1,0|1,0,0]=3 4703 B16R0.224 CCCCCCCCCCCCC(=O)[C@@H](C)O 1458a_100000717761_100000759014 [1,0,0,0,1,0|1,0,0]=3 4704 B16R0.224 CCCCCCCCCCCCC(=O)[C@H](C)O 1458a_217856618621_100000759014 [1,0,0,0,1,0|1,0,0]=3 4705 B16R0.224 CCCCCCCCCCCNC(=O)C(C)C 11a_200011215754_100000210198 [1,0,0,0,1,0|1,0,0]=3 4706 B16R0.224 CCCCCCCCCCCNC(=O)C(C)C 1626a_200011215754_100000210198 [1,0,0,0,1,0|1,0,0]=3 4707 B16R0.224 CCCCCCCCCCCNC(=O)C(C)C 240690a_200011215754_100000210198 [1,0,0,0,1,0|1,0,0]=3 4708 B16R0.224 CCCCCCCCCCCNC(=O)C(C)C 527a_200011215754_100000210198 [1,0,0,0,1,0|1,0,0]=3 4709 B16R0.224 CCCCCCCCCCCNC(=O)C(C)F 11a_200011215754_100000062450 [1,0,0,0,1,0|2,0,0]=4 4710 B16R0.224 CCCCCCCCCCCNC(=O)C(C)F 1626a_200011215754_100000062450 [1,0,0,0,1,0|2,0,0]=4 4711 B16R0.224 CCCCCCCCCCCNC(=O)C(C)F 240690a_200011215754_100000062450 [1,0,0,0,1,0|2,0,0]=4 4712 B16R0.224 CCCCCCCCCCCNC(=O)C(C)F 527a_200011215754_100000062450 [1,0,0,0,1,0|2,0,0]=4 4713 B16R0.224 CCCCCCCCCCCNC(=O)N(C)C 2708a_200011215754_100102631434 [1,0,0,0,1,0|2,0,0]=4 4714 B16R0.224 CCCCCCCCCCCNC(=O)[C@@H](C)O 240690a_200011215754_100000717761 [1,0,0,0,1,0|2,0,0]=4 4715 B16R0.224 CCCCCCCCCCCNC(=O)[C@H](C)O 1626a_200011215754_217856618621 [1,0,0,0,1,0|2,0,0]=4 4716 B16R0.224 CCCCCCCCCCCNC(=O)[C@H](C)O 240690a_200011215754_217856618621 [1,0,0,0,1,0|2,0,0]=4 4717 B16R0.224 CCCCCCCCCCNCC(=O)C(C)C 2230a_100000684558_100000753385 [1,0,0,0,1,0|1,0,0]=3 4718 B16R0.224 CCCCCCCCCCNCC(=O)C(C)C 34a_100000684558_100000753385 [1,0,0,0,1,0|1,0,0]=3 4719 B16R0.224 CCCCCCCCCCNCC(=O)N(C)C 2230a_100000684558_100000185267 [1,0,0,0,1,0|2,0,0]=4 4720 B16R0.224 CCCCCCCCCCNCC(=O)N(C)C 2230a_100015183351_100000210320 [1,0,0,0,1,0|2,0,0]=4 4721 B16R0.224 CCCCCCCCCCNCC(=O)N(C)C 34a_100000684558_100000692301 [1,0,0,0,1,0|2,0,0]=4 4722 B16R0.224 CCCCCCCCCCOCC(=O)C(C)C 34a_100000210711_100000753385 [1,0,0,0,1,0|1,0,0]=3 4723 B16R0.224 CCCCCCCCCCOCC(=O)C(C)C 7a_100000210711_100000753385 [1,0,0,0,1,0|1,0,0]=3 4724 B16R0.224 CCCCCCCCCCOCC(=O)N(C)C 34a_100000210711_100000692301 [1,0,0,0,1,0|2,0,0]=4 4725 B16R0.224 CCCCCCCCCCOCC(=O)N(C)C 7a_100000210711_100000692301 [1,0,0,0,1,0|2,0,0]=4 4726 B16R0.224 CCCCCCCCCCSCC(=O)N(C)C 62a_100000692301_100000210320 [1,0,0,0,1,0|2,0,0]=4 4727 B16R0.224 CCCCCCCCCNCCC(=O)N(C)C 2230a_100000212291_100000737620 [1,0,0,0,1,0|2,0,0]=4 4728 B16R0.224 CCCCCCCCCNCCC(=O)N(C)C 2230a_100000738053_100011214924 [1,0,0,0,1,0|2,0,0]=4 4729 B16R0.224 CCCCCCCCCOCCC(=O)N(C)C 34a_200000747469_100011214924 [1,0,0,0,1,0|2,0,0]=4 4730 B16R0.224 CCCCCCCCCOCCC(=O)N(C)C 7a_100000210712_100000737620 [1,0,0,0,1,0|2,0,0]=4 4731 B16R0.224 CCCCCCCCCSCCC(=O)N(C)C 62a_100000737620_100000210670 [1,0,0,0,1,0|2,0,0]=4 4732 B16R0.224 CCCCCCCCCSCOC(=O)C(C)C 62a_100000139345_100000210670 [1,0,0,0,1,0|2,0,0]=4 4733 B16R0.224 CCCCCCCCNCCCC(=O)N(C)C 2230a_100000229939_100000737642 [1,0,0,0,1,0|2,0,0]=4 4734 B16R0.224 CCCCCCCCNCCCC(=O)N(C)C 2230a_200000744827_100000210759 [1,0,0,0,1,0|2,0,0]=4 4735 B16R0.224 CCCCCCCCNCCNC(=O)C(C)C 2230a_100000752568_100000210759 [1,0,0,0,1,0|2,0,0]=4 4736 B16R0.224 CCCCCCCCNCCNC(=O)C(C)C 34a_100000752568_100000210759 [1,0,0,0,1,0|2,0,0]=4 4737 B16R0.224 CCCCCCCCOCCCC(=O)N(C)C 7a_100000210232_100000737642 [1,0,0,0,1,0|2,0,0]=4 4738 B16R0.224 CCCCCCCCSCCCC(=O)N(C)C 62a_100000210759_100000737642 [1,0,0,0,1,0|2,0,0]=4 4739 B16R0.224 CCCCCCCCSCCCC(=O)N(C)C 62a_100000737642_100000210317 [1,0,0,0,1,0|2,0,0]=4 4740 B16R0.224 CCCCCCCOCCCCC(=O)N(C)C 34a_100000210272_100000752486 [1,0,0,0,1,0|2,0,0]=4 4741 B16R0.224 CCCCCCCOCCCCC(=O)N(C)C 7a_100000210272_100000752486 [1,0,0,0,1,0|2,0,0]=4 4742 B16R0.224 CCCCCCCSCCCCC(=O)N(C)C 62a_100000210614_100000752486 [1,0,0,0,1,0|2,0,0]=4 4743 B16R0.224 CCCCCCCSCCCCC(=O)N(C)C 62a_100000752486_100000210316 [1,0,0,0,1,0|2,0,0]=4 4744 B16R0.224 CN(C)C(=O)CCCCCCCCCCCO 240690a_100102631434_100000037981 [1,0,0,0,1,0|2,0,0]=4 4745 B16R0.224 C[C@@H](O)C(=O)CCCCCCCCCCCO 1458a_100000717761_100009812471 [1,0,0,0,1,0|2,0,0]=4 4746 B16R0.224 C[C@H](O)C(=O)CCCCCCCCCCCO 1458a_217856618621_100009812471 [1,0,0,0,1,0|2,0,0]=4