0 B19R0.149 CCCCCC/C=C/C=C/COCCCCCC(=O)N 34a_200028454808_100009817443 [0,0,0,0,0,0|2,0,2]=4 1 B19R0.149 CCCCCC/C=C/C=C/COCCCCCC(=O)N 7a_200028454808_100009817443 [0,0,0,0,0,0|2,0,2]=4 2 B19R0.149 CCCCCCC/C=C/C=C/COCCCCC(=O)C 34a_200025756345_100009817362 [0,0,0,0,0,0|2,0,2]=4 3 B19R0.149 CCCCCCC/C=C/C=C/COCCCCC(=O)C 7a_200025756345_100000735457 [0,0,0,0,0,0|2,0,2]=4 4 B19R0.149 CCCCCCCC/C=C/COCCCCOC(=O)C 34a_200020667288_100000033659 [0,0,0,0,0,0|3,0,0]=3 5 B19R0.149 CCCCCCCC/C=C/COCCCCOC(=O)C 7a_200020667288_100000033659 [0,0,0,0,0,0|3,0,0]=3 6 B19R0.149 CCCCCCCC/C=C/COCCCCSC(=O)C 34a_200020667288_200010402107 [0,0,0,0,0,0|3,0,0]=3 7 B19R0.149 CCCCCCCC/C=C/COCCCCSC(=O)C 7a_200020667288_200010402107 [0,0,0,0,0,0|3,0,0]=3 8 B19R0.149 CCCCCCCC/C=C/COCOCCOC(=O)C 34a_200020667288_100000076355 [0,0,0,0,0,0|4,0,0]=4 9 B18R0.176 CCCCCCCC/C=C/COCCCCB(O)O 34a_200020667288_200009817182 [1,0,0,0,0,0|2,0,1]=4 10 B18R0.176 CCCCCCCC/C=C/COCCCCB(O)O 7a_200020667288_200009817182 [1,0,0,0,0,0|2,0,1]=4 11 B18R0.176 CCCCCCCC/C=C/COCCCCC(=O)C 34a_200020667288_100009817362 [1,0,0,0,0,0|2,0,0]=3 12 B18R0.176 CCCCCCCC/C=C/COCCCCC(=O)C 7a_200020667288_100000735457 [1,0,0,0,0,0|2,0,0]=3 13 B18R0.176 CCCCCCCC/C=C/COCCCOC(=O)C 34a_200020667288_100000042594 [1,0,0,0,0,0|3,0,0]=4 14 B18R0.176 CCCCCCCC/C=C/COCCCOC(=O)C 7a_200020667288_100000042594 [1,0,0,0,0,0|3,0,0]=4 15 B18R0.176 CCCCCCCC/C=C/COCCCSC(=O)C 34a_200020667288_100000038929 [1,0,0,0,0,0|3,0,0]=4 16 B18R0.176 CCCCCCCC/C=C/COCCCSC(=O)C 7a_200020667288_100000038929 [1,0,0,0,0,0|3,0,0]=4 17 B18R0.176 CCCCCCCC/C=C/COCCOCC(=O)N 34a_200020667288_100000076697 [1,0,0,0,0,0|3,0,0]=4 18 B18R0.176 CCCCCCCC/C=C/COCCOCC(=O)N 7a_200020667288_100000076697 [1,0,0,0,0,0|3,0,0]=4 19 B18R0.176 CCCCCCCCCCCCCCCNC(=O)C 11a_200000297553_100015343762 [1,0,0,0,0,0|2,0,1]=4 20 B18R0.176 CCCCCCCCCCCCCCCNC(=O)C 1626a_200000297553_100015343762 [1,0,0,0,0,0|2,0,1]=4 21 B18R0.176 CCCCCCCCCCCCCCCNC(=O)C 240690a_200000297553_100015343762 [1,0,0,0,0,0|2,0,1]=4 22 B18R0.176 CCCCCCCCCCCCCCCNC(=O)C 527a_200000297553_100103153847 [1,0,0,0,0,0|2,0,1]=4 23 B18R0.176 CCCCCCCCNCCCCCCNC(=O)C 2230a_200011996284_100000210759 [1,0,0,0,0,0|3,0,0]=4 24 B18R0.176 CCCCCCCCNCCCCCCNC(=O)C 34a_200011996284_100000210759 [1,0,0,0,0,0|3,0,0]=4 25 B18R0.221 C#CCCCCCOC/C=C/CCCCCCCC 34a_200020667288_100012094781 [1,0,0,0,0,0|2,0,1]=4 26 B18R0.221 C#CCCCCCOC/C=C/CCCCCCCC 7a_200020667288_100012094781 [1,0,0,0,0,0|2,0,1]=4 27 B18R0.221 CCCCCC/C=C/C=C/COCCCCCC=O 7a_200028454808_100000139337 [1,0,0,0,0,0|1,0,2]=4 28 B18R0.221 CCCCCCC/C=C/C=C/COCCCCC=O 7a_200025756345_100000139335 [1,0,0,0,0,0|1,0,2]=4 29 B18R0.221 CCCCCCCC/C=C/COCCCCCC#N 7a_200020667288_100009813376 [1,0,0,0,0,0|2,0,1]=4 30 B20R0.68 CCCCCCCCC(=O)NCCCCCCNC(=O)C 11a_200011996284_100000210188 [0,1,0,0,0,0|3,0,0]=4 31 B20R0.68 CCCCCCCCC(=O)NCCCCCCNC(=O)C 1626a_200011996284_100000210188 [0,1,0,0,0,0|3,0,0]=4 32 B20R0.68 CCCCCCCCC(=O)NCCCCCCNC(=O)C 240690a_200011996284_100000210188 [0,1,0,0,0,0|3,0,0]=4 33 B20R0.68 CCCCCCCCC(=O)NCCCCCCNC(=O)C 527a_200011996284_100000210188 [0,1,0,0,0,0|3,0,0]=4 34 B20R0.68 CCCCCCCCC(=O)NCCCCCCSC(=O)C 11a_100000704104_100000210188 [0,1,0,0,0,0|3,0,0]=4 35 B20R0.68 CCCCCCCCC(=O)NCCCCCCSC(=O)C 1626a_100000704104_100000210188 [0,1,0,0,0,0|3,0,0]=4 36 B20R0.68 CCCCCCCCC(=O)NCCCCCCSC(=O)C 240690a_100000704104_100000210188 [0,1,0,0,0,0|3,0,0]=4 37 B20R0.68 CCCCCCCCC(=O)NCCCCCCSC(=O)C 527a_100000704104_100000210188 [0,1,0,0,0,0|3,0,0]=4 38 B20R0.3034 CCCCC/C=C\C/C=C\CCCCCCCC(=O)NC 11a_106832991635_100016990378 [0,1,0,0,0,0|1,0,2]=4 39 B20R0.3034 CCCCC/C=C\C/C=C\CCCCCCCC(=O)NC 1626a_100102657272_100016990378 [0,1,0,0,0,0|1,0,2]=4 40 B20R0.3034 CCCCC/C=C\C/C=C\CCCCCCCC(=O)NC 240690a_100102657272_100016990378 [0,1,0,0,0,0|1,0,2]=4 41 B20R0.3034 CCCCC/C=C\C/C=C\CCCCCCCC(=O)NC 527a_100102657272_100016990378 [0,1,0,0,0,0|1,0,2]=4 42 B20R0.3034 CCCCCC/C=C/C=C/COCCCCCC(=O)OC 34a_200028454808_100009816466 [0,1,0,0,0,0|1,0,2]=4 43 B20R0.3034 CCCCCC/C=C/C=C/COCCCCCC(=O)OC 7a_200028454808_100009816466 [0,1,0,0,0,0|1,0,2]=4 44 B20R0.3034 CCCCCCC/C=C/C=C/COCCCCC(=O)OC 34a_200025756345_100000204269 [0,1,0,0,0,0|1,0,2]=4 45 B20R0.3034 CCCCCCC/C=C/C=C/COCCCCC(=O)OC 7a_200025756345_100000204269 [0,1,0,0,0,0|1,0,2]=4 46 B20R0.3034 CCCCCCCCC#CCCCCCCCC(=O)NC 11a_106832991635_200000124685 [0,1,0,0,0,0|1,0,2]=4 47 B20R0.3034 CCCCCCCCC#CCCCCCCCC(=O)NC 1626a_100102657272_200000124685 [0,1,0,0,0,0|1,0,2]=4 48 B20R0.3034 CCCCCCCCC#CCCCCCCCC(=O)NC 240690a_100102657272_200000124685 [0,1,0,0,0,0|1,0,2]=4 49 B20R0.3034 CCCCCCCCC#CCCCCCCCC(=O)NC 527a_100102657272_200000124685 [0,1,0,0,0,0|1,0,2]=4 50 B20R0.31968 CCCCCCCCC=CC(=O)CCCCCOC(=O)C 1458a_100015345288_100000033007 [0,1,0,0,0,0|2,0,1]=4 51 B20R1.3309 CCCCCCCC/C=C/COCCC1COS(=O)O1 7a_200020667288_100009840081 [0,0,0,1,0,0|3,0,0]=4 52 B20R1.4538 CCCCCCCCCN1CCCCC1CCC(=O)O 269956a_100000694054_100000210670 [0,0,0,1,0,0|1,0,1]=3 53 B20R1.4538 O=C(O)CCC1CCCCN1CCCCCCCCO 269956a_100000694054_100000033203 [0,0,0,1,0,0|2,0,1]=4 54 B20R1.18064 CCCCCCCCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000210759 [0,0,0,1,0,0|1,0,1]=3 55 B20R1.18064 COCCCCCCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100011998445 [0,0,0,1,0,0|2,0,1]=4 56 B20R1.18064 O=C(O)[C@H]1CCCCCC[C@H]1NCCCCCCCO 269956a_200049070474_100000760002 [0,0,0,1,0,0|2,0,1]=4 57 B20R1.58003 CCCCCCCCCCCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100011215454 [0,0,0,1,0,0|1,0,2]=4 58 B20R1.58003 CCCCCCCCCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100000210320 [0,0,0,1,0,0|1,0,2]=4 59 B20R1.65974 CCCCCCCCCCCCN1CCC[C@H]1C(=O)O 269956a_100000743916_100000759014 [0,0,0,1,0,0|1,0,2]=4 60 B20R1.66770 CCCCCCCCCCN1CCCCCC1C(=O)O 269956a_100000758484_100000210320 [0,0,0,1,0,0|1,0,2]=4 61 B20R1.201654 CCCCCCCCCCCCCN1CCC1C(=O)O 269956a_100000021838_100000210684 [0,0,0,1,0,0|1,0,2]=4 62 B17R0.43 CC(=O)CCCCCCCCCCCCCCO 1458a_100000070787_100009828009 [2,0,0,0,0,0|2,0,0]=4 63 B17R0.43 CCCCCC/C=C/COCCCCCC(=O)N 34a_200016276170_100009817443 [2,0,0,0,0,0|2,0,0]=4 64 B17R0.43 CCCCCC/C=C/COCCCCCC(=O)N 7a_200016276170_100009817443 [2,0,0,0,0,0|2,0,0]=4 65 B17R0.43 CCCCCC/C=C\CCCCCCCC(=O)C 1458a_100020587579_200000210301 [2,0,0,0,0,0|1,0,0]=3 66 B17R0.43 CCCCCC/C=C\CCCCCCCC(=O)[13CH3] 1458a_100020587579_200025704644 [2,0,0,0,0,0|1,0,0]=3 67 B17R0.43 CCCCCCCC/C=C/COCCCC(=O)C 34a_200020667288_100000685027 [2,0,0,0,0,0|2,0,0]=4 68 B17R0.43 CCCCCCCC/C=C/COCCCC(=O)C 7a_200020667288_100011215641 [2,0,0,0,0,0|2,0,0]=4 69 B17R0.43 CCCCCCCC/C=C/COCCCC(=O)N 34a_200020667288_100102525003 [2,0,0,0,0,0|2,0,0]=4 70 B17R0.43 CCCCCCCC/C=C/COCCCC(=O)N 7a_200020667288_100102525003 [2,0,0,0,0,0|2,0,0]=4 71 B17R0.43 CCCCCCCCCCCCCCNC(=O)C 11a_100011217771_100015343762 [2,0,0,0,0,0|2,0,0]=4 72 B17R0.43 CCCCCCCCCCCCCCNC(=O)C 1626a_100011217771_100015343762 [2,0,0,0,0,0|2,0,0]=4 73 B17R0.43 CCCCCCCCCCCCCCNC(=O)C 240690a_100011217771_100015343762 [2,0,0,0,0,0|2,0,0]=4 74 B17R0.43 CCCCCCCCCCCCCCNC(=O)C 527a_100011217771_100103153847 [2,0,0,0,0,0|2,0,0]=4 75 B17R0.43 CCCCCCCCCCCCCNCC(=O)N 2230a_100000711301_100000210684 [2,0,0,0,0,0|2,0,0]=4 76 B17R0.43 CCCCCCCCCCCCCNCC(=O)N 2230a_100011215765_100000747473 [2,0,0,0,0,0|2,0,0]=4 77 B17R0.43 CCCCCCCCCCCCCNCC(=O)N 34a_100011215765_100000187820 [2,0,0,0,0,0|2,0,0]=4 78 B17R0.43 CCCCCCCCCCCCCNCC(=O)O 269956a_100016091260_100000210684 [2,0,0,0,0,0|1,0,0]=3 79 B17R0.43 CCCCCCCCCCCCCNCC(=O)[O-] 34a_100011215765_100020667443 [2,0,0,0,0,0|1,0,1]=4 80 B17R0.43 CCCCCCCCCCCCCOCC(=O)C 34a_100000211253_100000210684 [2,0,0,0,0,0|2,0,0]=4 81 B17R0.43 CCCCCCCCCCCCCOCC(=O)N 34a_100000185773_100000187820 [2,0,0,0,0,0|2,0,0]=4 82 B17R0.43 CCCCCCCCCCCCCOCC(=O)N 7a_100000185773_100000187820 [2,0,0,0,0,0|2,0,0]=4 83 B17R0.43 CCCCCCCCCCCCCOCC(=O)[O-] 34a_100000185773_100020667443 [2,0,0,0,0,0|1,0,1]=4 84 B17R0.43 CCCCCCCCCCCCCSCC(=O)N 62a_100000747473_100011934334 [2,0,0,0,0,0|2,0,0]=4 85 B17R0.43 CCCCCCCCCCCCCSCC(=O)[O-] 62a_100020667443_100011934334 [2,0,0,0,0,0|1,0,1]=4 86 B17R0.43 CCCCCCCCCCCCNCCC(=O)N 2230a_100000210451_100000744528 [2,0,0,0,0,0|2,0,0]=4 87 B17R0.43 CCCCCCCCCCCCNCCC(=O)N 34a_100000210451_100000731001 [2,0,0,0,0,0|2,0,0]=4 88 B17R0.43 CCCCCCCCCCCCNOCC(=O)O 269956a_100000106656_100000759014 [2,0,0,0,0,0|2,0,0]=4 89 B17R0.43 CCCCCCCCCCCCOCCC(=O)C 34a_100000759926_100000759014 [2,0,0,0,0,0|2,0,0]=4 90 B17R0.43 CCCCCCCCCCCCOCCC(=O)C 7a_100000210810_100000053229 [2,0,0,0,0,0|2,0,0]=4 91 B17R0.43 CCCCCCCCCCCCOCCC(=O)C 7a_100000759926_100000759014 [2,0,0,0,0,0|2,0,0]=4 92 B17R0.43 CCCCCCCCCCCCOCCC(=O)N 34a_100000210810_100000731001 [2,0,0,0,0,0|2,0,0]=4 93 B17R0.43 CCCCCCCCCCCCOCCC(=O)N 34a_100000757172_100000759014 [2,0,0,0,0,0|2,0,0]=4 94 B17R0.43 CCCCCCCCCCCCOCCC(=O)N 7a_100000210810_100000744528 [2,0,0,0,0,0|2,0,0]=4 95 B17R0.43 CCCCCCCCCCCCOCCC(=O)N 7a_100000757172_100000759014 [2,0,0,0,0,0|2,0,0]=4 96 B17R0.43 CCCCCCCCCCCCSCCC(=O)C 1458a_100008107568_200000210301 [2,0,0,0,0,0|2,0,0]=4 97 B17R0.43 CCCCCCCCCCCCSCCC(=O)C 62a_100000053229_100000759014 [2,0,0,0,0,0|2,0,0]=4 98 B17R0.43 CCCCCCCCCCCCSCCC(=O)N 62a_100000744528_100000759014 [2,0,0,0,0,0|2,0,0]=4 99 B17R0.43 CCCCCCCCCCCCSCCC(=O)[13CH3] 1458a_100008107568_200025704644 [2,0,0,0,0,0|2,0,0]=4 100 B17R0.43 CCCCCCCCCCCNCCCC(=O)C 34a_200011215754_100000685027 [2,0,0,0,0,0|2,0,0]=4 101 B17R0.43 CCCCCCCCCCCNCCCC(=O)N 34a_100000739312_100011215454 [2,0,0,0,0,0|2,0,0]=4 102 B17R0.43 CCCCCCCCCCCNCCCC(=O)N 34a_200011215754_100102525003 [2,0,0,0,0,0|2,0,0]=4 103 B17R0.43 CCCCCCCCCCCOCCCC(=O)C 34a_100000210809_100000685027 [2,0,0,0,0,0|2,0,0]=4 104 B17R0.43 CCCCCCCCCCCOCCCC(=O)C 34a_100000759063_100011215454 [2,0,0,0,0,0|2,0,0]=4 105 B17R0.43 CCCCCCCCCCCOCCCC(=O)C 7a_100000210809_100011215641 [2,0,0,0,0,0|2,0,0]=4 106 B17R0.43 CCCCCCCCCCCOCCCC(=O)C 7a_100000759063_100011215454 [2,0,0,0,0,0|2,0,0]=4 107 B17R0.43 CCCCCCCCCCCOCCCC(=O)N 34a_100000210809_100102525003 [2,0,0,0,0,0|2,0,0]=4 108 B17R0.43 CCCCCCCCCCCOCCCC(=O)N 7a_100000210809_100102525003 [2,0,0,0,0,0|2,0,0]=4 109 B17R0.43 CCCCCCCCCCCSCCCC(=O)C 62a_100011215641_100011215454 [2,0,0,0,0,0|2,0,0]=4 110 B17R0.43 CCCCCCCCCCCSCCCC(=O)N 62a_100102525003_100011215454 [2,0,0,0,0,0|2,0,0]=4 111 B17R0.43 CCCCCCCCCCNCCCCC(=O)C 34a_100000684558_100009817362 [2,0,0,0,0,0|2,0,0]=4 112 B17R0.43 CCCCCCCCCCNCCCCC(=O)N 34a_100000696515_100000210320 [2,0,0,0,0,0|2,0,0]=4 113 B17R0.43 CCCCCCCCCCNCCOCC(=O)O 269956a_100000700818_100000210320 [2,0,0,0,0,0|2,0,0]=4 114 B17R0.43 CCCCCCCCCCOCCCCC(=O)C 34a_100000210711_100009817362 [2,0,0,0,0,0|2,0,0]=4 115 B17R0.43 CCCCCCCCCCOCCCCC(=O)C 7a_100000210711_100000735457 [2,0,0,0,0,0|2,0,0]=4 116 B17R0.43 CCCCCCCCCCOCCCCC(=O)N 34a_100012022536_100000210320 [2,0,0,0,0,0|2,0,0]=4 117 B17R0.43 CCCCCCCCCCOCCCCC(=O)N 7a_100012022536_100000210320 [2,0,0,0,0,0|2,0,0]=4 118 B17R0.43 CCCCCCCCCCSCCCCC(=O)C 62a_100000735457_100000210320 [2,0,0,0,0,0|2,0,0]=4 119 B17R0.43 CCCCCCCCCNCCCCCC(=O)N 2230a_100000212291_100009817443 [2,0,0,0,0,0|2,0,0]=4 120 B17R0.43 CCCCCCCCCNCCCCCC(=O)N 34a_100000212291_100009817443 [2,0,0,0,0,0|2,0,0]=4 121 B17R0.43 CCCCCCCCCOCCCCCC(=O)N 34a_100000123541_100011214924 [2,0,0,0,0,0|2,0,0]=4 122 B17R0.43 CCCCCCCCCOCCCCCC(=O)N 34a_100000210712_100009817443 [2,0,0,0,0,0|2,0,0]=4 123 B17R0.43 CCCCCCCCCOCCCCCC(=O)N 7a_100000123541_100000210328 [2,0,0,0,0,0|2,0,0]=4 124 B17R0.43 CCCCCCCCCOCCCCCC(=O)N 7a_100000210712_100009817443 [2,0,0,0,0,0|2,0,0]=4 125 B17R0.43 CCCCCCCCCOCCCCCC(=O)[O-] 7a_100102619762_100000210328 [2,0,0,0,0,0|1,0,1]=4 126 B17R0.43 CCCCCCCCCSCCCCCC(=O)N 62a_100009817443_100000210670 [2,0,0,0,0,0|2,0,0]=4 127 B17R0.43 CCCCNCCCCCCCCCCC(=O)N 2230a_100000102301_200010167045 [2,0,0,0,0,0|2,0,0]=4 128 B17R0.43 CCCCNCCCCCCCCCCC(=O)N 7a_106832991798_200010167045 [2,0,0,0,0,0|2,0,0]=4 129 B17R0.43 CCCCOCCCCCCCCCCC(=O)N 34a_100000210227_200010167045 [2,0,0,0,0,0|2,0,0]=4 130 B17R0.43 CCCCOCCCCCCCCCCC(=O)N 7a_100000210227_200010167045 [2,0,0,0,0,0|2,0,0]=4 131 B17R0.43 CCCCSCCCCCCCCCCC(=O)N 62a_100000210211_200010167045 [2,0,0,0,0,0|2,0,0]=4 132 B17R0.43 CCCCSCCCCCCCCCCC(=O)N 62a_200010167045_100000210210 [2,0,0,0,0,0|2,0,0]=4 133 B17R0.43 O=C(O)CNCCCCCCCCCCCCO 269956a_100016091260_100009813331 [2,0,0,0,0,0|2,0,0]=4 134 B17R0.117 C=CCCCCOC/C=C/CCCCCCCC 34a_200020667288_100011215482 [2,0,0,0,0,0|1,0,1]=4 135 B17R0.117 C=CCCCCOC/C=C/CCCCCCCC 7a_200020667288_100011215482 [2,0,0,0,0,0|1,0,1]=4 136 B17R0.117 CCCCCCCC/C=C/COCCCCC=O 7a_200020667288_100000139335 [2,0,0,0,0,0|1,0,0]=3 137 B17R0.117 CCCCCCCC/C=C/COCCCCCC 34a_200020667288_100000210314 [2,0,0,0,0,0|1,0,1]=4 138 B17R0.117 CCCCCCCC/C=C/COCCCCCC 7a_200020667288_100000210314 [2,0,0,0,0,0|1,0,1]=4 139 B17R0.117 CCCCCCCC/C=C/COCCCCCF 34a_200020667288_100000729378 [2,0,0,0,0,0|2,0,0]=4 140 B17R0.117 CCCCCCCC/C=C/COCCCCCF 7a_200020667288_100000729378 [2,0,0,0,0,0|2,0,0]=4 141 B17R0.117 CCCCCCCC/C=C/COCCCCCO 34a_200020667288_100000746330 [2,0,0,0,0,0|1,0,0]=3 142 B17R0.117 CCCCCCCC/C=C/COCCCCCO 7a_200020667288_100000746330 [2,0,0,0,0,0|1,0,0]=3 143 B17R0.117 CCCCCCCC/C=C/COCCOCCO 34a_200020667288_100000692535 [2,0,0,0,0,0|2,0,0]=4 144 B17R0.117 CCCCCCCC/C=C/COCCOCCO 7a_200020667288_100011215305 [2,0,0,0,0,0|2,0,0]=4 145 B19R0.148 CCCCCCCC/C=C/COCCCCC(=O)OC 34a_200020667288_100000204269 [1,1,0,0,0,0|1,0,0]=3 146 B19R0.148 CCCCCCCC/C=C/COCCCCC(=O)OC 7a_200020667288_100000204269 [1,1,0,0,0,0|1,0,0]=3 147 B19R0.148 CCCCCCCC/C=C/COCCOCC(=O)OC 34a_200020667288_100000090808 [1,1,0,0,0,0|2,0,0]=4 148 B19R0.148 CCCCCCCC/C=C/COCCOCC(=O)OC 7a_200020667288_100000090808 [1,1,0,0,0,0|2,0,0]=4 149 B19R0.23236 CCCCCCCCC=CC(=O)CCCCCC(=O)N 1458a_100015345288_100009817443 [1,1,0,0,0,0|1,0,1]=4 150 B21R0.2929 CCCCCCCC=CC(=O)NCCCCCCC(=O)OC 188690a_100000739044_200015332781 [0,2,0,0,0,0|1,0,1]=4 151 B21R0.18597 CCCCCCCCC=CC(=O)NCCCCCC(=O)OC 188690a_100000184999_100015345288 [0,2,0,0,0,0|1,0,1]=4 152 B19R1.274 CCCCCCCC/C=C/COCC1CNC(=O)O1 34a_200020667288_100000181169 [1,0,0,1,0,0|2,0,0]=4 153 B19R1.274 CCCCCCCC/C=C/COCC1CNC(=O)O1 7a_200020667288_100000181169 [1,0,0,1,0,0|2,0,0]=4 154 B19R1.274 CCCCCCCC/C=C/COCC1COC(=O)O1 34a_200020667288_100000073702 [1,0,0,1,0,0|2,0,0]=4 155 B19R1.274 CCCCCCCC/C=C/COC[C@@H]1CCC(=O)N1 7a_200020667288_100015189358 [1,0,0,1,0,0|2,0,0]=4 156 B19R1.8985 CCCCCCCCN1CCCCC1CCC(=O)O 269956a_100000694054_100000210759 [1,0,0,1,0,0|1,0,0]=3 157 B19R1.8985 COCCCCCCN1CCCCC1CCC(=O)O 269956a_100000694054_100011998445 [1,0,0,1,0,0|2,0,0]=4 158 B19R1.8985 O=C(O)CCC1CCCCN1CCCCCCCO 269956a_100000694054_100000760002 [1,0,0,1,0,0|2,0,0]=4 159 B19R1.27390 CCCCCCCCCCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100000210320 [1,0,0,1,0,0|1,0,1]=4 160 B19R1.27390 CCCCCCCCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100000210670 [1,0,0,1,0,0|1,0,1]=4 161 B19R1.46531 CCCCCCCCCCCN1CCC[C@H]1C(=O)O 269956a_100000743916_100011215454 [1,0,0,1,0,0|1,0,1]=4 162 B19R1.47245 CCCCCCCCCN1CCCCCC1C(=O)O 269956a_100000758484_100000210670 [1,0,0,1,0,0|1,0,1]=4 163 B19R1.54339 CCCCCCCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000210614 [1,0,0,1,0,0|1,0,1]=4 164 B19R1.68071 CCCCCCCCCCCCN1CCC1C(=O)O 269956a_100000021838_100000759014 [1,0,0,1,0,0|1,0,1]=4 165 B19R1.275 CCCCCCCC/C=C/COCC1CCCCO1 34a_200020667288_100000211543 [1,0,0,1,0,0|1,0,1]=4 166 B19R1.275 CCCCCCCC/C=C/COCC1CCCCO1 7a_200020667288_100000211543 [1,0,0,1,0,0|1,0,1]=4 167 B19R1.27373 CCCCCCCC/C=C/COC1CCCCC1=O 34a_200020667288_100000754470 [1,0,0,1,0,0|1,0,0]=3 168 B19R1.27373 CCCCCCCC/C=C/COC1CCCCC1=O 7a_200020667288_100000204591 [1,0,0,1,0,0|1,0,0]=3 169 B19R1.27373 CCCCCCCC/C=C/COC1CCCCC1O 34a_200020667288_100000038908 [1,0,0,1,0,0|1,0,1]=4 170 B19R1.27373 CCCCCCCC/C=C/COC1CCCNC1=O 34a_200020667288_100000687798 [1,0,0,1,0,0|2,0,0]=4 171 B19R1.27373 CCCCCCCC/C=C/COC1CCCNC1=O 7a_200020667288_100000687798 [1,0,0,1,0,0|2,0,0]=4 172 B19R1.27373 CCCCCCCC/C=C/COC1COCCC1=O 34a_200020667288_100012180262 [1,0,0,1,0,0|2,0,0]=4 173 B19R1.27373 CCCCCCCC/C=C/COC1COCCC1=O 7a_200020667288_100012180262 [1,0,0,1,0,0|2,0,0]=4 174 B19R1.46528 CCCCCCCC/C=C/COCCC1CCC1=O 7a_200020667288_200016118888 [1,0,0,1,0,0|1,0,0]=3 175 B21R1.5907 CCC1CCCCC1OCCCCCCCCC(=O)OC 34a_100000210738_100010282707 [0,1,0,1,0,0|1,0,1]=4 176 B21R1.5907 CCC1CCCCC1OCCCCCCCCC(=O)OC 7a_100000210738_100010282707 [0,1,0,1,0,0|1,0,1]=4 177 B21R1.39984 CCCC1CCCCC1OCCCCCCCC(=O)OC 34a_100011217265_100010004213 [0,1,0,1,0,0|1,0,1]=4 178 B21R1.39984 CCCC1CCCCC1OCCCCCCCC(=O)OC 7a_100011217265_100010004213 [0,1,0,1,0,0|1,0,1]=4 179 B21R1.39984 CCCC1CCCCN1CCCCCCCCC(=O)OC 2230a_100000701414_100010282707 [0,1,0,1,0,0|1,0,1]=4 180 B21R1.39984 CCCC1CCCCN1CCCCCCCCC(=O)OC 269982a_100000701414_100010282707 [0,1,0,1,0,0|1,0,1]=4 181 B21R1.39984 CCCC1CCCCN1CCCCCCCCC(=O)OC 34a_100000701414_100010282707 [0,1,0,1,0,0|1,0,1]=4 182 B21R1.63198 COC(=O)CCCCCCCCNCCC1CCCCC1 2230a_100000738074_100010282707 [0,1,0,1,0,0|1,0,1]=4 183 B21R1.63198 COC(=O)CCCCCCCCNCCC1CCCCC1 34a_100000738074_100010282707 [0,1,0,1,0,0|1,0,1]=4 184 B21R1.63198 COC(=O)CCCCCCCCOCCC1CCCCC1 34a_100000035544_100011209188 [0,1,0,1,0,0|1,0,1]=4 185 B21R1.63198 COC(=O)CCCCCCCCOCCC1CCCCC1 34a_100011217863_100010282707 [0,1,0,1,0,0|1,0,1]=4 186 B21R1.63198 COC(=O)CCCCCCCCOCCC1CCCCC1 7a_100000035544_100011273959 [0,1,0,1,0,0|1,0,1]=4 187 B21R1.63198 COC(=O)CCCCCCCCOCCC1CCCCC1 7a_100011217863_100010282707 [0,1,0,1,0,0|1,0,1]=4 188 B21R1.63198 COC(=O)CCCCCCCCSCCC1CCCCC1 62a_100010282707_100012355289 [0,1,0,1,0,0|1,0,1]=4 189 B21R1.63198 COC(=O)CCCCCCCCSCCC1CCCCC1 62a_100012355289_100010282707 [0,1,0,1,0,0|1,0,1]=4 190 B21R1.63198 COC(=O)CCCCCCCNCCCC1CCCCC1 2230a_100011211642_100010004213 [0,1,0,1,0,0|1,0,1]=4 191 B21R1.63198 COC(=O)CCCCCCCNCCCC1CCCCC1 34a_100011211642_100010004213 [0,1,0,1,0,0|1,0,1]=4 192 B21R1.63198 COC(=O)CCCCCCCOCCCC1CCCCC1 34a_100000198086_100010004213 [0,1,0,1,0,0|1,0,1]=4 193 B21R1.63198 COC(=O)CCCCCCCOCCCC1CCCCC1 34a_100011022521_100011713725 [0,1,0,1,0,0|1,0,1]=4 194 B21R1.63198 COC(=O)CCCCCCCOCCCC1CCCCC1 7a_100000198086_100010004213 [0,1,0,1,0,0|1,0,1]=4 195 B21R1.63198 COC(=O)CCCCCCCOCCCC1CCCCC1 7a_100011022521_100011713725 [0,1,0,1,0,0|1,0,1]=4 196 B21R1.63198 COC(=O)CCCCCCCSCCCC1CCCCC1 62a_100010004213_100011713725 [0,1,0,1,0,0|1,0,1]=4 197 B21R1.63198 COC(=O)CCCCCCCSCCCC1CCCCC1 62a_100011713725_100010004213 [0,1,0,1,0,0|1,0,1]=4 198 B21R1.64503 COC(=O)CCCCCCCCNCCCC1CCCC1 2230a_100000736752_100010282707 [0,1,0,1,0,0|1,0,1]=4 199 B21R1.64503 COC(=O)CCCCCCCCNCCCC1CCCC1 34a_100000736752_100010282707 [0,1,0,1,0,0|1,0,1]=4 200 B21R1.64503 COC(=O)CCCCCCCCOCCCC1CCCC1 34a_100000035544_100011713738 [0,1,0,1,0,0|1,0,1]=4 201 B21R1.64503 COC(=O)CCCCCCCCOCCCC1CCCC1 34a_100011215328_100010282707 [0,1,0,1,0,0|1,0,1]=4 202 B21R1.64503 COC(=O)CCCCCCCCOCCCC1CCCC1 7a_100000035544_100011713738 [0,1,0,1,0,0|1,0,1]=4 203 B21R1.64503 COC(=O)CCCCCCCCOCCCC1CCCC1 7a_100011215328_100010282707 [0,1,0,1,0,0|1,0,1]=4 204 B21R1.64503 COC(=O)CCCCCCCCSCCCC1CCCC1 62a_100010282707_100011713738 [0,1,0,1,0,0|1,0,1]=4 205 B21R1.64503 COC(=O)CCCCCCCCSCCCC1CCCC1 62a_100011713738_100010282707 [0,1,0,1,0,0|1,0,1]=4 206 B21R1.934315 COC(=O)CCCCCCCCNC1CCCCCCC1 2230a_100000211152_100010282707 [0,1,0,1,0,0|1,0,1]=4 207 B21R1.934315 COC(=O)CCCCCCCCNC1CCCCCCC1 34a_100000211152_100010282707 [0,1,0,1,0,0|1,0,1]=4 208 B21R1.934315 COC(=O)CCCCCCCCOC1CCCCCCC1 34a_100000210054_100010282707 [0,1,0,1,0,0|1,0,1]=4 209 B21R1.934315 COC(=O)CCCCCCCCOC1CCCCCCC1 7a_100000210054_100010282707 [0,1,0,1,0,0|1,0,1]=4 210 B21R1.934315 COC(=O)CCCCCCCOCC1CCCCCCC1 34a_100011216312_100010004213 [0,1,0,1,0,0|1,0,1]=4 211 B21R1.934315 COC(=O)CCCCCCCOCC1CCCCCCC1 7a_100011216312_100010004213 [0,1,0,1,0,0|1,0,1]=4 212 B21R1.963239 COC(=O)CCCCCCCCN1CCCCCCCC1 2230a_100000039187_100010282707 [0,1,0,1,0,0|1,0,1]=4 213 B21R1.963239 COC(=O)CCCCCCCCN1CCCCCCCC1 269982a_100000039187_100010282707 [0,1,0,1,0,0|1,0,1]=4 214 B21R1.963239 COC(=O)CCCCCCCCN1CCCCCCCC1 34a_100000039187_100010282707 [0,1,0,1,0,0|1,0,1]=4 215 B21R1.1054595 COC(=O)CCCCCCCCNCC1CCCCCC1 2230a_100015204231_100010282707 [0,1,0,1,0,0|1,0,1]=4 216 B21R1.1054595 COC(=O)CCCCCCCCNCC1CCCCCC1 34a_100015204231_100010282707 [0,1,0,1,0,0|1,0,1]=4 217 B21R1.1054595 COC(=O)CCCCCCCCOCC1CCCCCC1 34a_100000035544_200000696569 [0,1,0,1,0,0|1,0,1]=4 218 B21R1.1054595 COC(=O)CCCCCCCCOCC1CCCCCC1 34a_100000699130_100010282707 [0,1,0,1,0,0|1,0,1]=4 219 B21R1.1054595 COC(=O)CCCCCCCCOCC1CCCCCC1 7a_100000035544_200000696569 [0,1,0,1,0,0|1,0,1]=4 220 B21R1.1054595 COC(=O)CCCCCCCCOCC1CCCCCC1 7a_100000699130_100010282707 [0,1,0,1,0,0|1,0,1]=4 221 B21R1.1054595 COC(=O)CCCCCCCCSCC1CCCCCC1 62a_100010282707_200000696569 [0,1,0,1,0,0|1,0,1]=4 222 B21R1.1054595 COC(=O)CCCCCCCCSCC1CCCCCC1 62a_200000696569_100010282707 [0,1,0,1,0,0|1,0,1]=4 223 B21R1.1054595 COC(=O)CCCCCCCNCCC1CCCCCC1 2230a_100011532351_100010004213 [0,1,0,1,0,0|1,0,1]=4 224 B21R1.1054595 COC(=O)CCCCCCCNCCC1CCCCCC1 34a_100011532351_100010004213 [0,1,0,1,0,0|1,0,1]=4 225 B21R1.17793 CCCCCCCCCCCCCN1CCC[C@H]1C(=O)O 269956a_100000743916_100000210684 [0,1,0,1,0,0|0,0,2]=4 226 B21R1.18614 CCCCCCCCCCCN1CCCCCC1C(=O)O 269956a_100000758484_100011215454 [0,1,0,1,0,0|0,0,2]=4 227 B21R1.37196 CCCCCCCCCCN1CCCCC1CCC(=O)O 269956a_100000694054_100000210320 [0,1,0,1,0,0|0,0,2]=4 228 B21R1.37196 O=C(O)CCC1CCCCN1CCCCCCCCCO 269956a_100000694054_100009813782 [0,1,0,1,0,0|1,0,1]=4 229 B21R1.75651 CCCCCCCCCCCCN1CCCC[C@@H]1C(=O)O 269956a_100000763471_100000759014 [0,1,0,1,0,0|0,0,2]=4 230 B21R1.75651 CCCCCCCCCCCN[C@@H]1CCCC[C@H]1C(=O)O 269956a_100009816435_100011215454 [0,1,0,1,0,0|0,0,2]=4 231 B21R1.155837 CCCCCCCCCCCCCCN1CCC1C(=O)O 269956a_100000021838_100011215471 [0,1,0,1,0,0|0,0,2]=4 232 B21R1.1153454 CCCCCCCCCN[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_100000210670 [0,1,0,1,0,0|0,0,2]=4 233 B21R1.1153454 O=C(O)[C@H]1CCCCCC[C@H]1NCCCCCCCCO 269956a_200049070474_100000033203 [0,1,0,1,0,0|1,0,1]=4 234 B21R1.681110 CCCCCCCC(C)N[C@@H]1CCCCCC[C@@H]1C(=O)O 269956a_200049070474_200011218727 [0,1,0,1,0,0|1,0,1]=4 235 B21R2.131420 CCCCCCCCN1[C@@H](C[C@H]2[C@@H]1CCCC2)C(=O)O 269956a_100000703543_100000210759 [0,0,0,2,0,0|1,0,1]=4 236 B21R2.252780 O=C(O)CCC1CCCCN1CCCC2CCCCC2 269956a_100000694054_100011713725 [0,0,0,2,0,0|1,0,1]=4 237 B21R2.252141 O=C(O)[C@H]1CCCCCC[C@H]1NCCC2CCCCC2 269956a_200049070474_100011273959 [0,0,0,2,0,0|1,0,1]=4 238 B21R2.256105 O=C(O)[C@H]1CCCCCC[C@H]1NCCCC2CCCC2 269956a_200049070474_100011713738 [0,0,0,2,0,0|1,0,1]=4 239 B21R2.387562 CCCCCCCCCN1[C@@H](C[C@H]2[C@@H]1CCC2)C(=O)O 269956a_100015758391_100000210670 [0,0,0,2,0,0|1,0,1]=4 240 B21R2.4821610 O=C(O)[C@H]1CCCCCC[C@H]1NCC2CCCCCC2 269956a_200049070474_200000696569 [0,0,0,2,0,0|1,0,1]=4