0 B16R0.303 C#CCCCCCCOC/C=C/CCCCC 34a_100016258190_100012276617 [0,0,0,0,0,0|2,0,2]=4 1 B16R0.303 C#CCCCCCCOC/C=C/CCCCC 7a_100016258190_100012276617 [0,0,0,0,0,0|2,0,2]=4 2 B16R0.303 C#CCCCCCOCC/C=C\CCCCC 34a_100016277358_100012094781 [0,0,0,0,0,0|2,0,2]=4 3 B16R0.303 C#CCCCCCOCC/C=C\CCCCC 7a_100016277358_100012094781 [0,0,0,0,0,0|2,0,2]=4 4 B16R0.303 C=CCCCCCCOC/C=C/CCCCC 34a_100016258190_100011215473 [0,0,0,0,0,0|2,0,1]=3 5 B16R0.303 C=CCCCCCCOC/C=C/CCCCC 7a_100016258190_100011215473 [0,0,0,0,0,0|2,0,1]=3 6 B16R0.303 C=CCCCCCOCC/C=C\CCCCC 34a_100016277358_100000700193 [0,0,0,0,0,0|2,0,1]=3 7 B16R0.303 C=CCCCCCOCC/C=C\CCCCC 7a_100016277358_100000700193 [0,0,0,0,0,0|2,0,1]=3 8 B16R0.303 C=CCCCCOC/C=C/C=C/CCCCC 34a_200014065772_100011215482 [0,0,0,0,0,0|2,0,2]=4 9 B16R0.303 C=CCCCCOC/C=C/C=C/CCCCC 7a_200014065772_100011215482 [0,0,0,0,0,0|2,0,2]=4 10 B16R0.303 C=CCCCCOCCC/C=C\CCCCC 34a_100020655193_100011215482 [0,0,0,0,0,0|2,0,2]=4 11 B16R0.303 C=CCCCCOCCC/C=C\CCCCC 7a_100020655193_100011215482 [0,0,0,0,0,0|2,0,2]=4 12 B16R0.303 C=CCCCOC/C=C/C=C/CCCCCC 34a_200028454808_100000757094 [0,0,0,0,0,0|2,0,2]=4 13 B16R0.303 C=CCCCOC/C=C/C=C/CCCCCC 7a_200028454808_100000757094 [0,0,0,0,0,0|2,0,2]=4 14 B16R0.303 C=CCCCOC/C=C/CCCCCCCC 34a_200020667288_100000757094 [0,0,0,0,0,0|2,0,2]=4 15 B16R0.303 C=CCCCOC/C=C/CCCCCCCC 7a_200020667288_100000757094 [0,0,0,0,0,0|2,0,2]=4 16 B16R0.303 CC/C=C/C/C=C/CCOCCCCCC=O 7a_200016273837_100000139337 [0,0,0,0,0,0|1,0,3]=4 17 B16R0.303 CCCCC/C=C/C=C/COCCCCC=O 7a_200014065772_100000139335 [0,0,0,0,0,0|1,0,2]=3 18 B16R0.303 CCCCC/C=C/COCCCCCCC#N 7a_100016258190_100009813337 [0,0,0,0,0,0|2,0,2]=4 19 B16R0.303 CCCCC/C=C/COCCCCCCCC 34a_100016258190_100000210759 [0,0,0,0,0,0|2,0,2]=4 20 B16R0.303 CCCCC/C=C/COCCCCCCCC 7a_100016258190_100000210759 [0,0,0,0,0,0|2,0,2]=4 21 B16R0.303 CCCCC/C=C/COCCCCCCCO 34a_100016258190_100000760002 [0,0,0,0,0,0|1,0,3]=4 22 B16R0.303 CCCCC/C=C/COCCCCCCCO 7a_100016258190_100000760002 [0,0,0,0,0,0|1,0,3]=4 23 B16R0.303 CCCCC/C=C/COCCCCCCOC 34a_100016258190_100011998445 [0,0,0,0,0,0|3,0,1]=4 24 B16R0.303 CCCCC/C=C/COCCCCCCOC 7a_100016258190_100011998445 [0,0,0,0,0,0|3,0,1]=4 25 B16R0.303 CCCCC/C=C\CCCOCCCCC=O 7a_100020655193_100000139335 [0,0,0,0,0,0|1,0,2]=3 26 B16R0.303 CCCCC/C=C\CCOCCCCCC#N 7a_100016277358_100009813376 [0,0,0,0,0,0|2,0,2]=4 27 B16R0.303 CCCCC/C=C\CCOCCCCCC=O 7a_100016277358_100000139337 [0,0,0,0,0,0|1,0,1]=2 28 B16R0.303 CCCCC/C=C\CCOCCCCCCC 34a_100016277358_100000210614 [0,0,0,0,0,0|2,0,2]=4 29 B16R0.303 CCCCC/C=C\CCOCCCCCCC 7a_100016277358_100000210614 [0,0,0,0,0,0|2,0,2]=4 30 B16R0.303 CCCCC/C=C\CCOCCCCCCF 34a_100016277358_100015922095 [0,0,0,0,0,0|2,0,2]=4 31 B16R0.303 CCCCC/C=C\CCOCCCCCCF 7a_100016277358_100015922095 [0,0,0,0,0,0|2,0,2]=4 32 B16R0.303 CCCCC/C=C\CCOCCCCCCO 34a_100016277358_100000766143 [0,0,0,0,0,0|1,0,3]=4 33 B16R0.303 CCCCC/C=C\CCOCCCCCCO 7a_100016277358_100000766143 [0,0,0,0,0,0|1,0,3]=4 34 B16R0.303 CCCCCC#CCCOCCCCCC=O 7a_200000042877_100000139337 [0,0,0,0,0,0|1,0,3]=4 35 B16R0.303 CCCCCC/C=C/C=C/COCCCC=O 7a_200028454808_200011292268 [0,0,0,0,0,0|1,0,2]=3 36 B16R0.303 CCCCCC/C=C/COCCCCCC=O 7a_200016276170_100000139337 [0,0,0,0,0,0|1,0,3]=4 37 B16R0.303 CCCCCCCC/C=C/COCCCC=O 7a_200020667288_200011292268 [0,0,0,0,0,0|1,0,2]=3 38 B16R0.303 CCCCCCCCCNCCCCCC=O 2230a_100000212291_100000139337 [0,0,0,0,0,0|1,0,3]=4 39 B16R0.303 CCCCCCCCCOCCCCCC=O 7a_100000210712_100000139337 [0,0,0,0,0,0|1,0,3]=4 40 B16R0.303 CCCCCCCCCSCCCCCC=O 62a_100000139337_100000210670 [0,0,0,0,0,0|1,0,3]=4 41 B16R0.303 CCCCCCOCCOCCCCCC=O 7a_100000691444_100000139337 [0,0,0,0,0,0|2,0,2]=4 42 B15R0.70 C#CCCCCCOC/C=C/CCCCC 34a_100016258190_100012094781 [1,0,0,0,0,0|2,0,1]=4 43 B15R0.70 C#CCCCCCOC/C=C/CCCCC 7a_100016258190_100012094781 [1,0,0,0,0,0|2,0,1]=4 44 B15R0.70 C#CCCCOC/C=C/C=C/CCCCC 34a_200014065772_100000695029 [1,0,0,0,0,0|2,0,1]=4 45 B15R0.70 C#CCCCOC/C=C/C=C/CCCCC 7a_200014065772_100011215417 [1,0,0,0,0,0|2,0,1]=4 46 B15R0.70 C=CCCC/C=C/COCCCCCC=O 7a_200016268473_100000139337 [1,0,0,0,0,0|1,0,2]=4 47 B15R0.70 C=CCCCCCCOC/C=C/CCCC 34a_200016272032_100011215473 [1,0,0,0,0,0|2,0,1]=4 48 B15R0.70 C=CCCCCCCOC/C=C/CCCC 7a_200016272032_100011215473 [1,0,0,0,0,0|2,0,1]=4 49 B15R0.70 C=CCCCCCOC/C=C/CCCCC 34a_100016258190_100000700193 [1,0,0,0,0,0|2,0,0]=3 50 B15R0.70 C=CCCCCCOC/C=C/CCCCC 7a_100016258190_100000700193 [1,0,0,0,0,0|2,0,0]=3 51 B15R0.70 C=CCCCCCOCC/C=C\CCCC 34a_200016286491_100000700193 [1,0,0,0,0,0|2,0,1]=4 52 B15R0.70 C=CCCCCCOCC/C=C\CCCC 7a_200016286491_100000700193 [1,0,0,0,0,0|2,0,1]=4 53 B15R0.70 C=CCCCCOCC/C=C\CCCCC 34a_100016277358_100011215482 [1,0,0,0,0,0|1,0,2]=4 54 B15R0.70 C=CCCCCOCC/C=C\CCCCC 7a_100016277358_100011215482 [1,0,0,0,0,0|1,0,2]=4 55 B15R0.70 C=CCCCOC/C=C/C=C/CCCCC 34a_200014065772_100000757094 [1,0,0,0,0,0|2,0,0]=3 56 B15R0.70 C=CCCCOC/C=C/C=C/CCCCC 7a_200014065772_100000757094 [1,0,0,0,0,0|2,0,0]=3 57 B15R0.70 C=CCCCOCCC/C=C\CCCCC 34a_100020655193_100000757094 [1,0,0,0,0,0|2,0,1]=4 58 B15R0.70 C=CCCCOCCC/C=C\CCCCC 7a_100020655193_100000757094 [1,0,0,0,0,0|2,0,1]=4 59 B15R0.70 C=COCCOC/C=C/C=C/CCCCC 34a_200014065772_100000039644 [1,0,0,0,0,0|3,0,0]=4 60 B15R0.70 C=COCCOC/C=C/C=C/CCCCC 7a_200014065772_100000039644 [1,0,0,0,0,0|3,0,0]=4 61 B15R0.70 CCCC/C=C/CCCCOCCCC=O 7a_200020645093_200011292268 [1,0,0,0,0,0|1,0,2]=4 62 B15R0.70 CCCC/C=C\CCOCCCCCC=O 7a_200016286491_100000139337 [1,0,0,0,0,0|1,0,1]=3 63 B15R0.70 CCCCC/C=C/C=C/COCCCC#N 7a_200014065772_100000687738 [1,0,0,0,0,0|2,0,1]=4 64 B15R0.70 CCCCC/C=C/C=C/COCCCC=O 7a_200014065772_200011292268 [1,0,0,0,0,0|1,0,0]=2 65 B15R0.70 CCCCC/C=C/C=C/COCCCCC 34a_200014065772_100000718602 [1,0,0,0,0,0|2,0,1]=4 66 B15R0.70 CCCCC/C=C/C=C/COCCCCC 7a_200014065772_100000210326 [1,0,0,0,0,0|2,0,1]=4 67 B15R0.70 CCCCC/C=C/C=C/COCCCCF 34a_200014065772_100000729493 [1,0,0,0,0,0|2,0,1]=4 68 B15R0.70 CCCCC/C=C/C=C/COCCCCF 7a_200014065772_100000729493 [1,0,0,0,0,0|2,0,1]=4 69 B15R0.70 CCCCC/C=C/C=C/COCCCCO 34a_200014065772_100011216708 [1,0,0,0,0,0|1,0,2]=4 70 B15R0.70 CCCCC/C=C/C=C/COCCCCO 7a_200014065772_100000210776 [1,0,0,0,0,0|1,0,2]=4 71 B15R0.70 CCCCC/C=C/C=C/COCCCOC 34a_200014065772_100000740836 [1,0,0,0,0,0|3,0,0]=4 72 B15R0.70 CCCCC/C=C/C=C/COCCCOC 7a_200014065772_100000740836 [1,0,0,0,0,0|3,0,0]=4 73 B15R0.70 CCCCC/C=C/COCCCCCC#N 7a_100016258190_100009813376 [1,0,0,0,0,0|2,0,1]=4 74 B15R0.70 CCCCC/C=C/COCCCCCC=O 7a_100016258190_100000139337 [1,0,0,0,0,0|1,0,0]=2 75 B15R0.70 CCCCC/C=C/COCCCCCCC 34a_100016258190_100000210614 [1,0,0,0,0,0|1,0,2]=4 76 B15R0.70 CCCCC/C=C/COCCCCCCC 7a_100016258190_100000210614 [1,0,0,0,0,0|1,0,2]=4 77 B15R0.70 CCCCC/C=C/COCCCCCCF 34a_100016258190_100015922095 [1,0,0,0,0,0|2,0,1]=4 78 B15R0.70 CCCCC/C=C/COCCCCCCF 7a_100016258190_100015922095 [1,0,0,0,0,0|2,0,1]=4 79 B15R0.70 CCCCC/C=C/COCCCCCCO 34a_100016258190_100000766143 [1,0,0,0,0,0|1,0,2]=4 80 B15R0.70 CCCCC/C=C/COCCCCCCO 7a_100016258190_100000766143 [1,0,0,0,0,0|1,0,2]=4 81 B15R0.70 CCCCC/C=C\CCCOCCCC=O 7a_100020655193_200011292268 [1,0,0,0,0,0|1,0,1]=3 82 B15R0.70 CCCCC/C=C\CCOCCCCC=O 7a_100016277358_100000139335 [1,0,0,0,0,0|1,0,1]=3 83 B15R0.70 CCCCC/C=C\CCOCCCCCC 34a_100016277358_100000210314 [1,0,0,0,0,0|1,0,2]=4 84 B15R0.70 CCCCC/C=C\CCOCCCCCC 7a_100016277358_100000210314 [1,0,0,0,0,0|1,0,2]=4 85 B15R0.70 CCCCC/C=C\CCOCCCCCF 34a_100016277358_100000729378 [1,0,0,0,0,0|2,0,1]=4 86 B15R0.70 CCCCC/C=C\CCOCCCCCF 7a_100016277358_100000729378 [1,0,0,0,0,0|2,0,1]=4 87 B15R0.70 CCCCC/C=C\CCOCCCCCO 34a_100016277358_100000746330 [1,0,0,0,0,0|1,0,2]=4 88 B15R0.70 CCCCC/C=C\CCOCCCCCO 7a_100016277358_100000746330 [1,0,0,0,0,0|1,0,2]=4 89 B15R0.70 CCCCCC#CCOCCCCCC=O 7a_200000033628_100000139337 [1,0,0,0,0,0|1,0,2]=4 90 B15R0.70 CCCCCC#CCSCCCCCC=O 62a_100000139337_100009816472 [1,0,0,0,0,0|1,0,2]=4 91 B15R0.70 CCCCCC#CCSCCCCCC=O 62a_100009816472_100000139337 [1,0,0,0,0,0|1,0,2]=4 92 B15R0.70 CCCCCC/C=C/COCCCCC=O 7a_200016276170_100000139335 [1,0,0,0,0,0|1,0,2]=4 93 B15R0.70 CCCCCC/C=C/COCCCCCC 34a_200016276170_100000210314 [1,0,0,0,0,0|1,0,2]=4 94 B15R0.70 CCCCCC/C=C/COCCCCCC 7a_200016276170_100000210314 [1,0,0,0,0,0|1,0,2]=4 95 B15R0.70 CCCCCCC/C=C/C=C/COCCC 34a_200025756345_100000210303 [1,0,0,0,0,0|2,0,1]=4 96 B15R0.70 CCCCCCC/C=C/C=C/COCCC 7a_200025756345_100000210303 [1,0,0,0,0,0|2,0,1]=4 97 B15R0.70 CCCCCCCCNCCCCCC=O 2230a_100000229939_100000139337 [1,0,0,0,0,0|1,0,2]=4 98 B15R0.70 CCCCCCCCOCCCCCC=O 7a_100000210232_100000139337 [1,0,0,0,0,0|1,0,2]=4 99 B15R0.70 CCCCCCCCSCCCCCC=O 62a_100000139337_100000210317 [1,0,0,0,0,0|1,0,2]=4 100 B15R0.70 CCCCCCCCSCCCCCC=O 62a_100000210759_100000139337 [1,0,0,0,0,0|1,0,2]=4 101 B15R0.70 CCCCCOCCOCCCCCC=O 7a_100011215259_100000139337 [1,0,0,0,0,0|2,0,1]=4 102 B17R0.43 CCCCC/C=C/C=C/COCCCCC(=O)C 34a_200014065772_100009817362 [0,1,0,0,0,0|1,0,2]=4 103 B17R0.43 CCCCC/C=C/C=C/COCCCCC(=O)C 7a_200014065772_100000735457 [0,1,0,0,0,0|1,0,2]=4 104 B17R0.43 CCCCC/C=C/COCCCCCOC(=O)C 34a_100016258190_100000033007 [0,1,0,0,0,0|2,0,1]=4 105 B17R0.43 CCCCC/C=C/COCCCCCOC(=O)C 7a_100016258190_100000033007 [0,1,0,0,0,0|2,0,1]=4 106 B17R0.43 CCCCC/C=C\CCCOCCCCC(=O)C 34a_100020655193_100009817362 [0,1,0,0,0,0|1,0,2]=4 107 B17R0.43 CCCCC/C=C\CCCOCCCCC(=O)C 7a_100020655193_100000735457 [0,1,0,0,0,0|1,0,2]=4 108 B17R0.43 CCCCC/C=C\CCOCCCCCC(=O)N 34a_100016277358_100009817443 [0,1,0,0,0,0|1,0,1]=3 109 B17R0.43 CCCCC/C=C\CCOCCCCCC(=O)N 7a_100016277358_100009817443 [0,1,0,0,0,0|1,0,1]=3 110 B17R0.43 CCCCC/C=C\CCOCCCCOC(=O)C 34a_100016277358_100000033659 [0,1,0,0,0,0|2,0,1]=4 111 B17R0.43 CCCCC/C=C\CCOCCCCOC(=O)C 7a_100016277358_100000033659 [0,1,0,0,0,0|2,0,1]=4 112 B17R0.43 CCCCC/C=C\CCOCCCCSC(=O)C 34a_100016277358_200010402107 [0,1,0,0,0,0|2,0,1]=4 113 B17R0.43 CCCCC/C=C\CCOCCCCSC(=O)C 7a_100016277358_200010402107 [0,1,0,0,0,0|2,0,1]=4 114 B17R0.43 CCCCCC/C=C/C=C/COCCCC(=O)C 34a_200028454808_100000685027 [0,1,0,0,0,0|1,0,2]=4 115 B17R0.43 CCCCCC/C=C/C=C/COCCCC(=O)C 7a_200028454808_100011215641 [0,1,0,0,0,0|1,0,2]=4 116 B17R0.43 CCCCCC/C=C/C=C/COCCCC(=O)N 34a_200028454808_100102525003 [0,1,0,0,0,0|1,0,2]=4 117 B17R0.43 CCCCCC/C=C/C=C/COCCCC(=O)N 7a_200028454808_100102525003 [0,1,0,0,0,0|1,0,2]=4 118 B17R0.43 CCCCCCCC/C=C/COCCCC(=O)C 34a_200020667288_100000685027 [0,1,0,0,0,0|1,0,2]=4 119 B17R0.43 CCCCCCCC/C=C/COCCCC(=O)C 7a_200020667288_100011215641 [0,1,0,0,0,0|1,0,2]=4 120 B17R0.43 CCCCCCCC/C=C/COCCCC(=O)N 34a_200020667288_100102525003 [0,1,0,0,0,0|1,0,2]=4 121 B17R0.43 CCCCCCCC/C=C/COCCCC(=O)N 7a_200020667288_100102525003 [0,1,0,0,0,0|1,0,2]=4 122 B17R0.104 C#CCCCCCCC(=O)C/C=C/CCCCC 1458a_100020675968_100012276617 [0,1,0,0,0,0|1,0,2]=4 123 B17R0.104 C=CCCCCCCC(=O)C/C=C/CCCCC 1458a_100020675968_100011215473 [0,1,0,0,0,0|1,0,1]=3 124 B17R0.104 CCCCC/C=C/CC(=O)CCCCCCC#N 1458a_100020675968_100009813337 [0,1,0,0,0,0|1,0,2]=4 125 B17R0.104 CCCCC/C=C/CC(=O)CCCCCCCC 1458a_100020675968_100000210759 [0,1,0,0,0,0|1,0,2]=4 126 B17R0.104 CCCCC/C=C/CC(=O)CCCCCCCO 1458a_100020675968_100000760002 [0,1,0,0,0,0|0,0,3]=4 127 B17R0.104 CCCCC/C=C/CC(=O)CCCCCCOC 1458a_100020675968_100011998445 [0,1,0,0,0,0|2,0,1]=4 128 B17R0.104 CCCCC/C=C/CC(=O)NCCCCCC#N 11a_100000061152_100020675968 [0,1,0,0,0,0|2,0,1]=4 129 B17R0.104 CCCCC/C=C/CC(=O)NCCCCCC#N 1626a_100000061152_100020675968 [0,1,0,0,0,0|2,0,1]=4 130 B17R0.104 CCCCC/C=C/CC(=O)NCCCCCC#N 240690a_100000061152_100020675968 [0,1,0,0,0,0|2,0,1]=4 131 B17R0.104 CCCCC/C=C/CC(=O)NCCCCCCC 11a_100000229938_100020675968 [0,1,0,0,0,0|2,0,1]=4 132 B17R0.104 CCCCC/C=C/CC(=O)NCCCCCCC 1626a_100000229938_100020675968 [0,1,0,0,0,0|2,0,1]=4 133 B17R0.104 CCCCC/C=C/CC(=O)NCCCCCCC 240690a_100000229938_100020675968 [0,1,0,0,0,0|2,0,1]=4 134 B17R0.104 CCCCC/C=C/CC(=O)NCCCCCCO 240690a_100000686447_100020675968 [0,1,0,0,0,0|1,0,2]=4 135 B17R0.104 CCCCC/C=C/CC(=O)NCCCCCOC 11a_100000747528_100020675968 [0,1,0,0,0,0|3,0,0]=4 136 B17R0.104 CCCCC/C=C/CC(=O)NCCCCCOC 1626a_100000747528_100020675968 [0,1,0,0,0,0|3,0,0]=4 137 B17R0.104 CCCCC/C=C/CC(=O)NCCCCCOC 240690a_100000747528_100020675968 [0,1,0,0,0,0|3,0,0]=4 138 B17R0.117 C=CCCCCCCCOC/C=C/CCCCC 34a_100016258190_100012355270 [0,1,0,0,0,0|1,0,2]=4 139 B17R0.117 C=CCCCCCCCOC/C=C/CCCCC 7a_100016258190_100012355270 [0,1,0,0,0,0|1,0,2]=4 140 B17R0.117 C=CCCCCCCOC/C=C/CCCCCC 34a_200016276170_100011215473 [0,1,0,0,0,0|2,0,1]=4 141 B17R0.117 C=CCCCCCCOC/C=C/CCCCCC 7a_200016276170_100011215473 [0,1,0,0,0,0|2,0,1]=4 142 B17R0.117 C=CCCCCCCOCC/C=C\CCCCC 34a_100016277358_100011215473 [0,1,0,0,0,0|1,0,2]=4 143 B17R0.117 C=CCCCCCCOCC/C=C\CCCCC 7a_100016277358_100011215473 [0,1,0,0,0,0|1,0,2]=4 144 B17R0.117 C=CCCCCCOC/C=C/C=C/CCCCC 34a_200014065772_100000700193 [0,1,0,0,0,0|1,0,2]=4 145 B17R0.117 C=CCCCCCOC/C=C/C=C/CCCCC 7a_200014065772_100000700193 [0,1,0,0,0,0|1,0,2]=4 146 B17R0.117 C=CCCCCCOCCC/C=C\CCCCC 34a_100020655193_100000700193 [0,1,0,0,0,0|1,0,2]=4 147 B17R0.117 C=CCCCCCOCCC/C=C\CCCCC 7a_100020655193_100000700193 [0,1,0,0,0,0|1,0,2]=4 148 B17R0.117 C=CCCCCOC/C=C/C=C/CCCCCC 34a_200028454808_100011215482 [0,1,0,0,0,0|1,0,2]=4 149 B17R0.117 C=CCCCCOC/C=C/C=C/CCCCCC 7a_200028454808_100011215482 [0,1,0,0,0,0|1,0,2]=4 150 B17R0.117 C=CCCCCOC/C=C/CCCCCCCC 34a_200020667288_100011215482 [0,1,0,0,0,0|1,0,2]=4 151 B17R0.117 C=CCCCCOC/C=C/CCCCCCCC 7a_200020667288_100011215482 [0,1,0,0,0,0|1,0,2]=4 152 B17R0.117 CCCCC/C=C/C=C/COCCCCCC=O 7a_200014065772_100000139337 [0,1,0,0,0,0|0,0,2]=3 153 B17R0.117 CCCCC/C=C\CCCOCCCCCC=O 7a_100020655193_100000139337 [0,1,0,0,0,0|0,0,2]=3 154 B17R0.117 CCCCCC/C=C/C=C/COCCCCC=O 7a_200028454808_100000139335 [0,1,0,0,0,0|0,0,2]=3 155 B17R0.117 CCCCCCC/C=C/C=C/COCCCC=O 7a_200025756345_200011292268 [0,1,0,0,0,0|1,0,2]=4 156 B17R0.117 CCCCCCCC/C=C/COCCCCC=O 7a_200020667288_100000139335 [0,1,0,0,0,0|0,0,2]=3 157 B17R0.117 CCCCCCCCC/C=C/COCCCC=O 7a_100015232335_200011292268 [0,1,0,0,0,0|1,0,2]=4 158 B17R0.8809 C#CCCCCCC(=O)CC/C=C/CCCCC 1458a_200015255902_100012094781 [0,1,0,0,0,0|1,0,2]=4 159 B17R0.8809 C=CCCCCCC(=O)CC/C=C/CCCCC 1458a_200015255902_100000700193 [0,1,0,0,0,0|1,0,1]=3 160 B17R0.8809 C=CCCCCNC(=O)CC/C=C/CCCCC 11a_100000703577_200015255902 [0,1,0,0,0,0|2,0,1]=4 161 B17R0.8809 C=CCCCCNC(=O)CC/C=C/CCCCC 1626a_100000703577_200015255902 [0,1,0,0,0,0|2,0,1]=4 162 B17R0.8809 C=CCCCCNC(=O)CC/C=C/CCCCC 240690a_100000703577_200015255902 [0,1,0,0,0,0|2,0,1]=4 163 B17R0.8809 C=CCCCCNC(=O)CC/C=C/CCCCC 527a_100000703577_200015255902 [0,1,0,0,0,0|2,0,1]=4 164 B17R0.8809 CCCCC/C=C/CCC(=O)CCCCCC#N 1458a_200015255902_100009813376 [0,1,0,0,0,0|1,0,2]=4 165 B17R0.8809 CCCCC/C=C/CCC(=O)CCCCCCC 1458a_200015255902_100000210614 [0,1,0,0,0,0|1,0,2]=4 166 B17R0.8809 CCCCC/C=C/CCC(=O)CCCCCCF 1458a_200015255902_100015922095 [0,1,0,0,0,0|1,0,2]=4 167 B17R0.8809 CCCCC/C=C/CCC(=O)CCCCCCO 1458a_200015255902_100000766143 [0,1,0,0,0,0|0,0,3]=4 168 B17R1.1261 CCCCC/C=C/COC1CCCCCC1=O 7a_100016258190_100000243696 [0,0,0,1,0,0|1,0,1]=3 169 B17R1.1261 CCCCC/C=C/COC1CCCCNC1=O 7a_100016258190_100000735217 [0,0,0,1,0,0|2,0,1]=4 170 B17R1.1450 CCCCC/C=C\CCOC1CCCCC1=O 34a_100016277358_100000754470 [0,0,0,1,0,0|1,0,1]=3 171 B17R1.1450 CCCCC/C=C\CCOC1CCCCC1=O 7a_100016277358_100000204591 [0,0,0,1,0,0|1,0,1]=3 172 B17R1.1450 CCCCC/C=C\CCOC1CCCNC1=O 34a_100016277358_100000687798 [0,0,0,1,0,0|2,0,1]=4 173 B17R1.1450 CCCCC/C=C\CCOC1CCCNC1=O 7a_100016277358_100000687798 [0,0,0,1,0,0|2,0,1]=4 174 B17R1.1450 CCCCC/C=C\CCOC1COCCC1=O 34a_100016277358_100012180262 [0,0,0,1,0,0|2,0,1]=4 175 B17R1.1450 CCCCC/C=C\CCOC1COCCC1=O 7a_100016277358_100012180262 [0,0,0,1,0,0|2,0,1]=4 176 B17R1.4155 CCCCc1ccccc1NCCCCC=O 2230a_200011217597_100000139335 [0,0,0,1,0,0|1,0,2]=4 177 B17R1.4155 CCCCc1ccccc1NCCCCC=O 7a_200011217597_100000139335 [0,0,0,1,0,0|1,0,2]=4 178 B17R1.5241 CCCCC/C=C/C=C/COC1CCCC1=O 34a_200014065772_100000709159 [0,0,0,1,0,0|1,0,2]=4 179 B17R1.5241 CCCCC/C=C/C=C/COC1CCCC1=O 7a_200014065772_100000211823 [0,0,0,1,0,0|1,0,2]=4 180 B17R1.5241 CCCCC/C=C/COCCN1CCCC1=O 34a_100016258190_100000739059 [0,0,0,1,0,0|2,0,1]=4 181 B17R1.5241 CCCCC/C=C/COCCN1CCCC1=O 7a_100016258190_100000739059 [0,0,0,1,0,0|2,0,1]=4 182 B17R1.5241 CCCCC/C=C\CCCOC1CCCC1=O 34a_100020655193_100000709159 [0,0,0,1,0,0|1,0,2]=4 183 B17R1.5241 CCCCC/C=C\CCCOC1CCCC1=O 7a_100020655193_100000211823 [0,0,0,1,0,0|1,0,2]=4 184 B17R1.5249 CCCCC/C=C\CCOCCC1CCC1=O 7a_100016277358_200016118888 [0,0,0,1,0,0|1,0,1]=3 185 B17R1.5249 CCCCCC/C=C/C=C/COC1CCC1=O 34a_200028454808_100009892977 [0,0,0,1,0,0|1,0,2]=4 186 B17R1.5249 CCCCCC/C=C/C=C/COC1CCC1=O 7a_200028454808_100009892977 [0,0,0,1,0,0|1,0,2]=4 187 B17R1.5249 CCCCCCCC/C=C/COC1CCC1=O 34a_200020667288_100009892977 [0,0,0,1,0,0|1,0,2]=4 188 B17R1.5249 CCCCCCCC/C=C/COC1CCC1=O 7a_200020667288_100009892977 [0,0,0,1,0,0|1,0,2]=4 189 B17R1.7906 C=CCCCCCCN1CC=CC1CCCC 2230a_100015184376_100011215473 [0,0,0,1,0,0|2,0,1]=4 190 B17R1.7906 C=CCCCCCCN1CC=CC1CCCC 269982a_100015184376_100011215473 [0,0,0,1,0,0|2,0,1]=4 191 B17R1.7906 C=CCCCCCCN1CC=CC1CCCC 34a_100015184376_100011215473 [0,0,0,1,0,0|2,0,1]=4 192 B17R1.7906 CCCCc1ccsc1SCCCCCC=O 62a_100000139337_100010071534 [0,0,0,1,0,0|2,0,1]=4 193 B17R1.7906 CCCCc1ccsc1SCCCCCC=O 62a_100010071534_100000139337 [0,0,0,1,0,0|2,0,1]=4 194 B17R1.25275 C=CCCCCCCOC1C=CCCCCC1 34a_100000688657_100011215473 [0,0,0,1,0,0|2,0,1]=4 195 B14R0.392 C=CCCCCCOC/C=C/CCCC 34a_200016272032_100000700193 [2,0,0,0,0,0|2,0,0]=4 196 B14R0.392 C=CCCCCCOC/C=C/CCCC 7a_200016272032_100000700193 [2,0,0,0,0,0|2,0,0]=4 197 B14R0.392 C=CCCCCOC/C=C/CCCCC 34a_100016258190_100011215482 [2,0,0,0,0,0|1,0,1]=4 198 B14R0.392 C=CCCCCOC/C=C/CCCCC 7a_100016258190_100011215482 [2,0,0,0,0,0|1,0,1]=4 199 B14R0.392 C=CCCCOC/C=C/CCCCCC 34a_200016276170_100000757094 [2,0,0,0,0,0|2,0,0]=4 200 B14R0.392 C=CCCCOC/C=C/CCCCCC 7a_200016276170_100000757094 [2,0,0,0,0,0|2,0,0]=4 201 B14R0.392 C=CCCCOCC/C=C\CCCCC 34a_100016277358_100000757094 [2,0,0,0,0,0|2,0,0]=4 202 B14R0.392 C=CCCCOCC/C=C\CCCCC 7a_100016277358_100000757094 [2,0,0,0,0,0|2,0,0]=4 203 B14R0.392 C=CCCOC/C=C/C=C/CCCCC 34a_200014065772_100000754431 [2,0,0,0,0,0|1,0,1]=4 204 B14R0.392 C=CCCOC/C=C/C=C/CCCCC 7a_200014065772_100000754431 [2,0,0,0,0,0|1,0,1]=4 205 B14R0.392 C=CCCOCCC/C=C\CCCCC 34a_100020655193_100000754431 [2,0,0,0,0,0|2,0,0]=4 206 B14R0.392 C=CCCOCCC/C=C\CCCCC 7a_100020655193_100000754431 [2,0,0,0,0,0|2,0,0]=4 207 B14R0.392 CCCC/C=C/COCCCCCC=O 7a_200016272032_100000139337 [2,0,0,0,0,0|1,0,0]=3 208 B14R0.392 CCCC/C=C\CCOCCCCC=O 7a_200016286491_100000139335 [2,0,0,0,0,0|1,0,1]=4 209 B14R0.392 CCCCC/C=C/C=C/COCCCC 34a_200014065772_100000210210 [2,0,0,0,0,0|1,0,1]=4 210 B14R0.392 CCCCC/C=C/C=C/COCCCC 7a_200014065772_100000210211 [2,0,0,0,0,0|1,0,1]=4 211 B14R0.392 CCCCC/C=C/C=C/COCCCF 34a_200014065772_100011934791 [2,0,0,0,0,0|2,0,0]=4 212 B14R0.392 CCCCC/C=C/C=C/COCCCF 7a_200014065772_100011934791 [2,0,0,0,0,0|2,0,0]=4 213 B14R0.392 CCCCC/C=C/C=C/COCCCO 34a_200014065772_100000230001 [2,0,0,0,0,0|1,0,1]=4 214 B14R0.392 CCCCC/C=C/C=C/COCCCO 7a_200014065772_100011215043 [2,0,0,0,0,0|1,0,1]=4 215 B14R0.392 CCCCC/C=C/COCCCCC=O 7a_100016258190_100000139335 [2,0,0,0,0,0|1,0,0]=3 216 B14R0.392 CCCCC/C=C/COCCCCCC 34a_100016258190_100000210314 [2,0,0,0,0,0|1,0,1]=4 217 B14R0.392 CCCCC/C=C/COCCCCCC 7a_100016258190_100000210314 [2,0,0,0,0,0|1,0,1]=4 218 B14R0.392 CCCCC/C=C/COCCCCCF 34a_100016258190_100000729378 [2,0,0,0,0,0|2,0,0]=4 219 B14R0.392 CCCCC/C=C/COCCCCCF 7a_100016258190_100000729378 [2,0,0,0,0,0|2,0,0]=4 220 B14R0.392 CCCCC/C=C/COCCCCCO 34a_100016258190_100000746330 [2,0,0,0,0,0|1,0,1]=4 221 B14R0.392 CCCCC/C=C/COCCCCCO 7a_100016258190_100000746330 [2,0,0,0,0,0|1,0,1]=4 222 B14R0.392 CCCCC/C=C\CCOCCCC=O 7a_100016277358_200011292268 [2,0,0,0,0,0|1,0,0]=3 223 B14R0.392 CCCCC/C=C\CCOCCCCC 34a_100016277358_100000718602 [2,0,0,0,0,0|1,0,1]=4 224 B14R0.392 CCCCC/C=C\CCOCCCCC 7a_100016277358_100000210326 [2,0,0,0,0,0|1,0,1]=4 225 B14R0.392 CCCCCC/C=C/C=C/COCCC 34a_200028454808_100000210303 [2,0,0,0,0,0|1,0,1]=4 226 B14R0.392 CCCCCC/C=C/C=C/COCCC 7a_200028454808_100000210303 [2,0,0,0,0,0|1,0,1]=4 227 B14R0.392 CCCCCC/C=C/COCCCC=O 7a_200016276170_200011292268 [2,0,0,0,0,0|1,0,0]=3 228 B14R0.392 CCCCCC/C=C/COCCCCC 34a_200016276170_100000718602 [2,0,0,0,0,0|1,0,1]=4 229 B14R0.392 CCCCCC/C=C/COCCCCC 7a_200016276170_100000210326 [2,0,0,0,0,0|1,0,1]=4 230 B14R0.392 CCCCCCCNCCCCCC=O 2230a_100000229938_100000139337 [2,0,0,0,0,0|1,0,1]=4 231 B14R0.392 CCCCCCCOCCCCCC=O 7a_100000210272_100000139337 [2,0,0,0,0,0|1,0,1]=4 232 B14R0.392 CCCCCCCSCCCCCC=O 62a_100000139337_100000210316 [2,0,0,0,0,0|1,0,1]=4 233 B14R0.392 CCCCCCCSCCCCCC=O 62a_100000210614_100000139337 [2,0,0,0,0,0|1,0,1]=4 234 B16R0.136 C#CCCCCCC(=O)C/C=C/CCCCC 1458a_100020675968_100012094781 [1,1,0,0,0,0|1,0,1]=4 235 B16R0.136 C=CCCCCCC(=O)C/C=C/CCCCC 1458a_100020675968_100000700193 [1,1,0,0,0,0|1,0,0]=3 236 B16R0.136 C=CCCCCCC(=O)C=CCCCCCC 1458a_200015324643_100000700193 [1,1,0,0,0,0|1,0,1]=4 237 B16R0.136 C=CCCCCCCC(=O)C/C=C/CCCC 1458a_200016282684_100011215473 [1,1,0,0,0,0|1,0,1]=4 238 B16R0.136 C=CCCCCCCC(=O)C=CCCCCC 1458a_100016263427_100011215473 [1,1,0,0,0,0|1,0,1]=4 239 B16R0.136 C=CCCCCNC(=O)C/C=C/CCCCC 11a_100000703577_100020675968 [1,1,0,0,0,0|1,0,1]=4 240 B16R0.136 C=CCCCCNC(=O)C/C=C/CCCCC 1626a_100000703577_100020675968 [1,1,0,0,0,0|1,0,1]=4 241 B16R0.136 C=CCCCCNC(=O)C/C=C/CCCCC 240690a_100000703577_100020675968 [1,1,0,0,0,0|1,0,1]=4 242 B16R0.136 CCCCC/C=C/CC(=O)CCCCCC#N 1458a_100020675968_100009813376 [1,1,0,0,0,0|1,0,1]=4 243 B16R0.136 CCCCC/C=C/CC(=O)CCCCCCC 1458a_100020675968_100000210614 [1,1,0,0,0,0|0,0,2]=4 244 B16R0.136 CCCCC/C=C/CC(=O)CCCCCCF 1458a_100020675968_100015922095 [1,1,0,0,0,0|1,0,1]=4 245 B16R0.136 CCCCC/C=C/CC(=O)CCCCCCO 1458a_100020675968_100000766143 [1,1,0,0,0,0|0,0,2]=4 246 B16R0.136 CCCCC/C=C/CC(=O)NCCCCCC 11a_100000210581_100020675968 [1,1,0,0,0,0|1,0,1]=4 247 B16R0.136 CCCCC/C=C/CC(=O)NCCCCCC 1626a_100000210581_100020675968 [1,1,0,0,0,0|1,0,1]=4 248 B16R0.136 CCCCC/C=C/CC(=O)NCCCCCC 240690a_100000210581_100020675968 [1,1,0,0,0,0|1,0,1]=4 249 B16R0.136 CCCCC/C=C/CC(=O)NCCCCCO 240690a_100000762737_100020675968 [1,1,0,0,0,0|1,0,1]=4 250 B16R0.274 CCCC/C=C\CCOCCCCCC(=O)N 34a_200016286491_100009817443 [1,1,0,0,0,0|1,0,1]=4 251 B16R0.274 CCCC/C=C\CCOCCCCCC(=O)N 7a_200016286491_100009817443 [1,1,0,0,0,0|1,0,1]=4 252 B16R0.274 CCCCC/C=C/C=C/COCCCC(=O)C 34a_200014065772_100000685027 [1,1,0,0,0,0|1,0,0]=3 253 B16R0.274 CCCCC/C=C/C=C/COCCCC(=O)C 7a_200014065772_100011215641 [1,1,0,0,0,0|1,0,0]=3 254 B16R0.274 CCCCC/C=C/C=C/COCCCC(=O)N 34a_200014065772_100102525003 [1,1,0,0,0,0|1,0,0]=3 255 B16R0.274 CCCCC/C=C/C=C/COCCCC(=O)N 7a_200014065772_100102525003 [1,1,0,0,0,0|1,0,0]=3 256 B16R0.274 CCCCC/C=C/C=C/COCCNC(=O)C 7a_200014065772_100000189650 [1,1,0,0,0,0|2,0,0]=4 257 B16R0.274 CCCCC/C=C/C=C/COCCNC(=O)N 7a_200014065772_200000034859 [1,1,0,0,0,0|2,0,0]=4 258 B16R0.274 CCCCC/C=C/C=C/COCCOC(=O)C 34a_200014065772_100009814007 [1,1,0,0,0,0|2,0,0]=4 259 B16R0.274 CCCCC/C=C/C=C/COCCOC(=O)C 7a_200014065772_100009814007 [1,1,0,0,0,0|2,0,0]=4 260 B16R0.274 CCCCC/C=C/C=C/COCCOC(=O)N 34a_200014065772_200011214921 [1,1,0,0,0,0|2,0,0]=4 261 B16R0.274 CCCCC/C=C/C=C/COCCOC(=O)N 7a_200014065772_200011214921 [1,1,0,0,0,0|2,0,0]=4 262 B16R0.274 CCCCC/C=C/COCCCCCC(=O)N 34a_100016258190_100009817443 [1,1,0,0,0,0|1,0,0]=3 263 B16R0.274 CCCCC/C=C/COCCCCCC(=O)N 7a_100016258190_100009817443 [1,1,0,0,0,0|1,0,0]=3 264 B16R0.274 CCCCC/C=C/COCCCCOC(=O)C 34a_100016258190_100000033659 [1,1,0,0,0,0|2,0,0]=4 265 B16R0.274 CCCCC/C=C/COCCCCOC(=O)C 7a_100016258190_100000033659 [1,1,0,0,0,0|2,0,0]=4 266 B16R0.274 CCCCC/C=C/COCCCCSC(=O)C 34a_100016258190_200010402107 [1,1,0,0,0,0|2,0,0]=4 267 B16R0.274 CCCCC/C=C/COCCCCSC(=O)C 7a_100016258190_200010402107 [1,1,0,0,0,0|2,0,0]=4 268 B16R0.274 CCCCC/C=C\CCCOCCCC(=O)C 34a_100020655193_100000685027 [1,1,0,0,0,0|1,0,1]=4 269 B16R0.274 CCCCC/C=C\CCCOCCCC(=O)C 7a_100020655193_100011215641 [1,1,0,0,0,0|1,0,1]=4 270 B16R0.274 CCCCC/C=C\CCCOCCCC(=O)N 34a_100020655193_100102525003 [1,1,0,0,0,0|1,0,1]=4 271 B16R0.274 CCCCC/C=C\CCCOCCCC(=O)N 7a_100020655193_100102525003 [1,1,0,0,0,0|1,0,1]=4 272 B16R0.274 CCCCC/C=C\CCOCCCCC(=O)C 34a_100016277358_100009817362 [1,1,0,0,0,0|1,0,1]=4 273 B16R0.274 CCCCC/C=C\CCOCCCCC(=O)C 7a_100016277358_100000735457 [1,1,0,0,0,0|1,0,1]=4 274 B16R0.6603 C=CCCCCC(=O)CC/C=C/CCCCC 1458a_200015255902_100011215482 [1,1,0,0,0,0|0,0,2]=4 275 B16R0.6603 CCCCC/C=C/CCC(=O)CCCCCC 1458a_200015255902_100000210757 [1,1,0,0,0,0|0,0,2]=4 276 B16R0.6603 CCCCC/C=C/CCC(=O)CCCCCF 1458a_200015255902_100000729378 [1,1,0,0,0,0|1,0,1]=4 277 B16R0.6603 CCCCC/C=C/CCC(=O)CCCCCO 1458a_200015255902_100000746330 [1,1,0,0,0,0|0,0,2]=4 278 B16R0.6603 CCCCCC/C=C/CC(=O)CCCCCC 1458a_100020681715_100000210757 [1,1,0,0,0,0|0,0,2]=4 279 B16R0.6603 CCCCCC/C=C/CC(=O)NCCCCC 11a_100000209983_100020681715 [1,1,0,0,0,0|1,0,1]=4 280 B16R0.6603 CCCCCC/C=C/CC(=O)NCCCCC 1626a_100000209983_100020681715 [1,1,0,0,0,0|1,0,1]=4 281 B16R0.6603 CCCCCC/C=C/CC(=O)NCCCCC 240690a_100000209983_100020681715 [1,1,0,0,0,0|1,0,1]=4 282 B16R0.6603 CCCCCNC(=O)CSCCCCCC=O 62a_100000139337_100000230301 [1,1,0,0,0,0|2,0,0]=4 283 B16R0.6603 CCCCCNC(=O)CSCCCCCC=O 62a_100000230301_100000139337 [1,1,0,0,0,0|2,0,0]=4 284 B18R0.94 CCCCC/C=C/CC(=O)CCCCCOC(=O)C 1458a_100020675968_100000033007 [0,2,0,0,0,0|1,0,1]=4 285 B18R0.94 CCCCC/C=C/CC(=O)NCCCCNC(=O)C 11a_200011368371_100020675968 [0,2,0,0,0,0|2,0,0]=4 286 B18R0.94 CCCCC/C=C/CC(=O)NCCCCNC(=O)C 1626a_200011368371_100020675968 [0,2,0,0,0,0|2,0,0]=4 287 B18R0.94 CCCCC/C=C/CC(=O)NCCCCNC(=O)C 240690a_200011368371_100020675968 [0,2,0,0,0,0|2,0,0]=4 288 B18R0.171 CCCCC/C=C/COCCCCCCC(=O)OC 34a_100016258190_100009815986 [0,2,0,0,0,0|1,0,1]=4 289 B18R0.171 CCCCC/C=C/COCCCCCCC(=O)OC 7a_100016258190_100009815986 [0,2,0,0,0,0|1,0,1]=4 290 B18R0.171 CCCCC/C=C\CCOCCCCCC(=O)OC 34a_100016277358_100009816466 [0,2,0,0,0,0|1,0,1]=4 291 B18R0.171 CCCCC/C=C\CCOCCCCCC(=O)OC 7a_100016277358_100009816466 [0,2,0,0,0,0|1,0,1]=4 292 B18R0.176 CCCCC/C=C/C=C/COCCCCCC(=O)N 34a_200014065772_100009817443 [0,2,0,0,0,0|0,0,2]=4 293 B18R0.176 CCCCC/C=C/C=C/COCCCCCC(=O)N 7a_200014065772_100009817443 [0,2,0,0,0,0|0,0,2]=4 294 B18R0.176 CCCCC/C=C\CCCOCCCCCC(=O)N 34a_100020655193_100009817443 [0,2,0,0,0,0|0,0,2]=4 295 B18R0.176 CCCCC/C=C\CCCOCCCCCC(=O)N 7a_100020655193_100009817443 [0,2,0,0,0,0|0,0,2]=4 296 B18R0.176 CCCCC/C=C\CCOCCCCCOC(=O)C 34a_100016277358_100000033007 [0,2,0,0,0,0|1,0,1]=4 297 B18R0.176 CCCCC/C=C\CCOCCCCCOC(=O)C 7a_100016277358_100000033007 [0,2,0,0,0,0|1,0,1]=4 298 B18R0.176 CCCCCC/C=C/C=C/COCCCCC(=O)C 34a_200028454808_100009817362 [0,2,0,0,0,0|0,0,2]=4 299 B18R0.176 CCCCCC/C=C/C=C/COCCCCC(=O)C 7a_200028454808_100000735457 [0,2,0,0,0,0|0,0,2]=4 300 B18R0.176 CCCCCCCC/C=C/COCCCCC(=O)C 34a_200020667288_100009817362 [0,2,0,0,0,0|0,0,2]=4 301 B18R0.176 CCCCCCCC/C=C/COCCCCC(=O)C 7a_200020667288_100000735457 [0,2,0,0,0,0|0,0,2]=4 302 B18R0.11628 CCCCC/C=C/CCC(=O)CCCCCC(=O)N 1458a_200015255902_100009817443 [0,2,0,0,0,0|0,0,1]=3 303 B18R0.11628 CCCCC/C=C/CCC(=O)CCCCOC(=O)C 1458a_200015255902_100000033659 [0,2,0,0,0,0|1,0,1]=4 304 B18R0.11628 CCCCC/C=C/CCC(=O)CCCCSC(=O)C 1458a_200015255902_200010402107 [0,2,0,0,0,0|1,0,1]=4 305 B18R0.11628 CCCCC/C=C/CCC(=O)NCCCCC(=O)N 11a_100000696515_200015255902 [0,2,0,0,0,0|1,0,1]=4 306 B18R0.11628 CCCCC/C=C/CCC(=O)NCCCCC(=O)N 1626a_100000696515_200015255902 [0,2,0,0,0,0|1,0,1]=4 307 B18R0.11628 CCCCC/C=C/CCC(=O)NCCCCC(=O)N 240690a_100000696515_200015255902 [0,2,0,0,0,0|1,0,1]=4 308 B18R0.11628 CCCCC/C=C/CCC(=O)NCCCCC(=O)N 527a_100000696515_200015255902 [0,2,0,0,0,0|1,0,1]=4 309 B18R0.221 CCCCCC/C=C/C=C/COCCCCCC=O 7a_200028454808_100000139337 [0,2,0,0,0,0|0,0,2]=4 310 B18R0.221 CCCCCCC/C=C/C=C/COCCCCC=O 7a_200025756345_100000139335 [0,2,0,0,0,0|0,0,2]=4 311 B16R1.643 O=CCCCCCNCCC1=CCCCC1 2230a_100000212019_100000139337 [1,0,0,1,0,0|1,0,1]=4 312 B16R1.662 CCCC/C=C/COC1CCCCCC1=O 7a_200016272032_100000243696 [1,0,0,1,0,0|1,0,1]=4 313 B16R1.1218 CCCC/C=C\CCOC1CCCCC1=O 34a_200016286491_100000754470 [1,0,0,1,0,0|1,0,1]=4 314 B16R1.1218 CCCC/C=C\CCOC1CCCCC1=O 7a_200016286491_100000204591 [1,0,0,1,0,0|1,0,1]=4 315 B16R1.1218 CCCCC/C=C/COC1CCCCC1=O 34a_100016258190_100000754470 [1,0,0,1,0,0|1,0,0]=3 316 B16R1.1218 CCCCC/C=C/COC1CCCCC1=O 7a_100016258190_100000204591 [1,0,0,1,0,0|1,0,0]=3 317 B16R1.1218 CCCCC/C=C/COC1CCCNC1=O 34a_100016258190_100000687798 [1,0,0,1,0,0|2,0,0]=4 318 B16R1.1218 CCCCC/C=C/COC1CCCNC1=O 7a_100016258190_100000687798 [1,0,0,1,0,0|2,0,0]=4 319 B16R1.1218 CCCCC/C=C/COC1COCCC1=O 34a_100016258190_100012180262 [1,0,0,1,0,0|2,0,0]=4 320 B16R1.1218 CCCCC/C=C/COC1COCCC1=O 7a_100016258190_100012180262 [1,0,0,1,0,0|2,0,0]=4 321 B16R1.3905 C=CCCCCCN1CC=CC1CCCC 2230a_100015184376_100000700193 [1,0,0,1,0,0|2,0,0]=4 322 B16R1.3905 C=CCCCCCN1CC=CC1CCCC 269982a_100015184376_100000700193 [1,0,0,1,0,0|2,0,0]=4 323 B16R1.3905 C=CCCCCCN1CC=CC1CCCC 34a_100015184376_100000700193 [1,0,0,1,0,0|2,0,0]=4 324 B16R1.3905 CCCCC1C=CCN1CCCCCC=O 2230a_100015184376_100000139337 [1,0,0,1,0,0|1,0,0]=3 325 B16R1.3905 CCCCC1C=CCN1CCCCCC=O 269982a_100015184376_100000139337 [1,0,0,1,0,0|1,0,0]=3 326 B16R1.6680 CCCCC/C=C\CCOC1CCCC1=O 34a_100016277358_100000709159 [1,0,0,1,0,0|1,0,1]=4 327 B16R1.6680 CCCCC/C=C\CCOC1CCCC1=O 7a_100016277358_100000211823 [1,0,0,1,0,0|1,0,1]=4 328 B16R1.6688 CCCC/C=C\CCOCCC1CCC1=O 7a_200016286491_200016118888 [1,0,0,1,0,0|1,0,1]=4 329 B16R1.6688 CCCCC/C=C/C=C/COC1CCC1=O 34a_200014065772_100009892977 [1,0,0,1,0,0|1,0,0]=3 330 B16R1.6688 CCCCC/C=C/C=C/COC1CCC1=O 7a_200014065772_100009892977 [1,0,0,1,0,0|1,0,0]=3 331 B16R1.6688 CCCCC/C=C/COCCC1CCC1=O 7a_100016258190_200016118888 [1,0,0,1,0,0|1,0,0]=3 332 B16R1.6688 CCCCC/C=C\CCCOC1CCC1=O 34a_100020655193_100009892977 [1,0,0,1,0,0|1,0,1]=4 333 B16R1.6688 CCCCC/C=C\CCCOC1CCC1=O 7a_100020655193_100009892977 [1,0,0,1,0,0|1,0,1]=4 334 B16R1.8379 C=CCCCCCOC1C=CCCCCC1 34a_100000688657_100000700193 [1,0,0,1,0,0|2,0,0]=4 335 B18R1.7813 CCCCC/C=C/CC(=O)CCN1CCCC1=O 1458a_100020675968_100000742232 [0,1,0,1,0,0|1,0,1]=4 336 B18R1.7833 CCCCC/C=C/CC(=O)C1CCCCCC1=O 1458a_100020675968_100000243696 [0,1,0,1,0,0|0,0,1]=3 337 B18R1.7833 CCCCC/C=C/CC(=O)C1CCCCNC1=O 1458a_100020675968_100000735217 [0,1,0,1,0,0|1,0,1]=4 338 B18R1.7841 CCCCC/C=C/CC(=O)NC1CCCNC1=O 11a_100000747585_100020675968 [0,1,0,1,0,0|2,0,0]=4 339 B18R1.7841 CCCCC/C=C/CC(=O)NC1CCCNC1=O 1626a_100000747585_100020675968 [0,1,0,1,0,0|2,0,0]=4 340 B18R1.7841 CCCCC/C=C/CC(=O)NC1CCCNC1=O 240690a_100000747585_100020675968 [0,1,0,1,0,0|2,0,0]=4 341 B18R1.317 CCCCC/C=C/C=C/COC1CCCCC1=O 34a_200014065772_100000754470 [0,1,0,1,0,0|0,0,2]=4 342 B18R1.317 CCCCC/C=C/C=C/COC1CCCCC1=O 7a_200014065772_100000204591 [0,1,0,1,0,0|0,0,2]=4 343 B18R1.317 CCCCC/C=C\CCCOC1CCCCC1=O 34a_100020655193_100000754470 [0,1,0,1,0,0|0,0,2]=4 344 B18R1.317 CCCCC/C=C\CCCOC1CCCCC1=O 7a_100020655193_100000204591 [0,1,0,1,0,0|0,0,2]=4 345 B18R1.1280 CCCCC/C=C\CCOC1CCCCCC1=O 7a_100016277358_100000243696 [0,1,0,1,0,0|0,0,2]=4 346 B18R1.1280 CCCCC/C=C\CCOC1CCCCNC1=O 7a_100016277358_100000735217 [0,1,0,1,0,0|1,0,1]=4 347 B18R1.1280 CCCCCC/C=C/COC1CCCCCC1=O 7a_200016276170_100000243696 [0,1,0,1,0,0|1,0,1]=4 348 B18R1.4120 CCCCCc1ncncc1SCCCCC=O 62a_100000139335_100009816991 [0,1,0,1,0,0|2,0,0]=4 349 B18R1.4120 CCCCCc1ncncc1SCCCCC=O 62a_100009816991_100000139335 [0,1,0,1,0,0|2,0,0]=4 350 B18R1.8759 CCCCc1ccccc1NCCCCCC=O 2230a_200011217597_100000139337 [0,1,0,1,0,0|0,0,2]=4 351 B18R1.8759 CCCCc1ccccc1NCCCCCC=O 7a_200011217597_100000139337 [0,1,0,1,0,0|0,0,2]=4 352 B18R1.21916 CCCCC/C=C\CCOCCN1CCCC1=O 34a_100016277358_100000739059 [0,1,0,1,0,0|1,0,1]=4 353 B18R1.21916 CCCCC/C=C\CCOCCN1CCCC1=O 7a_100016277358_100000739059 [0,1,0,1,0,0|1,0,1]=4 354 B18R1.21916 CCCCCC/C=C/C=C/COC1CCCC1=O 34a_200028454808_100000709159 [0,1,0,1,0,0|0,0,2]=4 355 B18R1.21916 CCCCCC/C=C/C=C/COC1CCCC1=O 7a_200028454808_100000211823 [0,1,0,1,0,0|0,0,2]=4 356 B18R1.21916 CCCCCCCC/C=C/COC1CCCC1=O 34a_200020667288_100000709159 [0,1,0,1,0,0|0,0,2]=4 357 B18R1.21916 CCCCCCCC/C=C/COC1CCCC1=O 7a_200020667288_100000211823 [0,1,0,1,0,0|0,0,2]=4 358 B18R1.21926 CCCCC/C=C/C=C/COCCC1CCC1=O 7a_200014065772_200016118888 [0,1,0,1,0,0|0,0,2]=4 359 B18R1.21926 CCCCC/C=C\CCCOCCC1CCC1=O 7a_100020655193_200016118888 [0,1,0,1,0,0|0,0,2]=4 360 B18R1.10581 C=CCCCCCC(=O)N1CC=CC1CCCC 11a_100015184376_100011934241 [0,1,0,1,0,0|2,0,0]=4 361 B18R1.10581 C=CCCCCCC(=O)N1CC=CC1CCCC 1626a_100015184376_100011934241 [0,1,0,1,0,0|2,0,0]=4 362 B18R1.10581 C=CCCCCCC(=O)N1CC=CC1CCCC 240690a_100015184376_100011934241 [0,1,0,1,0,0|2,0,0]=4 363 B18R1.10581 C=CCCCCCC(=O)N1CC=CC1CCCC 527a_100015184376_100011934241 [0,1,0,1,0,0|2,0,0]=4 364 B18R1.24263 CCCCC/C=C/CCC(=O)C1CCCCC1=O 1458a_200015255902_100000204591 [0,1,0,1,0,0|0,0,1]=3 365 B18R1.24263 CCCCC/C=C/CCC(=O)C1CCCNC1=O 1458a_200015255902_100000687798 [0,1,0,1,0,0|1,0,1]=4 366 B18R1.24263 CCCCC/C=C/CCC(=O)C1COCCC1=O 1458a_200015255902_100012180262 [0,1,0,1,0,0|1,0,1]=4 367 B18R1.24265 CCCCC/C=C/CCC(=O)CCC1CCC1=O 1458a_200015255902_200016118888 [0,1,0,1,0,0|0,0,1]=3 368 B18R2.100525 CCCCC1C=CCN1C2CCCCCC2=O 269982a_100015184376_100000243696 [0,0,0,2,0,0|1,0,1]=4