0 B14R0.392 C#CCCCCCCCCOCCOC 34a_100000065265_100011201679 [0,0,0,0,0,0|3,0,1]=4 1 B14R0.392 C#CCCCCCCCCOCCOC 7a_100000065265_100000233755 [0,0,0,0,0,0|3,0,1]=4 2 B14R0.392 C#CCCCCCNCCOCCOC 2230a_100000745349_100012094781 [0,0,0,0,0,0|3,0,1]=4 3 B14R0.392 C#CCCCCCNCCOCCOC 34a_100000745349_100012094781 [0,0,0,0,0,0|3,0,1]=4 4 B14R0.392 C#CCCCCCOCCOCCCC 34a_100000210238_100012094781 [0,0,0,0,0,0|3,0,1]=4 5 B14R0.392 C#CCCCCCOCCOCCCC 34a_100000766912_100000743108 [0,0,0,0,0,0|3,0,1]=4 6 B14R0.392 C#CCCCCCOCCOCCCC 7a_100000210238_100012094781 [0,0,0,0,0,0|3,0,1]=4 7 B14R0.392 C#CCCCCCOCCOCCCC 7a_100000766912_100000743108 [0,0,0,0,0,0|3,0,1]=4 8 B14R0.392 C#CCCCCCOCCOCCNC 34a_100000228057_100012094781 [0,0,0,0,0,0|3,0,1]=4 9 B14R0.392 C#CCCCCCOCCOCCOC 34a_100000766912_100000695917 [0,0,0,0,0,0|2,0,1]=3 10 B14R0.392 C#CCCCCCOCCOCCOC 34a_100011215163_100012094781 [0,0,0,0,0,0|2,0,1]=3 11 B14R0.392 C#CCCCCCOCCOCCOC 7a_100000766912_100000695917 [0,0,0,0,0,0|2,0,1]=3 12 B14R0.392 C#CCCCCCOCCOCCOC 7a_100011215163_100012094781 [0,0,0,0,0,0|2,0,1]=3 13 B14R0.392 C#CCCCCCSCCOCCOC 62a_100000695917_100012094781 [0,0,0,0,0,0|2,1,1]=4 14 B14R0.392 C#CCCCCCSCCOCCOC 62a_100012094781_100000695917 [0,0,0,0,0,0|2,1,1]=4 15 B14R0.392 C#CCCNCCOCCOCCOC 2230a_100012028300_100000688953 [0,0,0,0,0,0|2,0,1]=3 16 B14R0.392 C#CCCNCCOCCOCCOC 34a_100000755551_100013367474 [0,0,0,0,0,0|2,0,1]=3 17 B14R0.392 C#CCCNCCOCCOCCOC 34a_100012028300_100000688953 [0,0,0,0,0,0|2,0,1]=3 18 B14R0.392 C#CCCOCCOCCOCCCC 34a_100011215186_100000688953 [0,0,0,0,0,0|2,0,1]=3 19 B14R0.392 C#CCCOCCOCCOCCCC 7a_100011215186_100000688953 [0,0,0,0,0,0|2,0,1]=3 20 B14R0.392 C#CCCOCCOCCOCCCN 34a_100011996194_100000688953 [0,0,0,0,0,0|3,0,1]=4 21 B14R0.392 C#CCCOCCOCCOCCNC 34a_200014138305_100000688953 [0,0,0,0,0,0|2,0,1]=3 22 B14R0.392 C#CCCOCCOCCOCCOC 34a_100000688194_100000688953 [0,0,0,0,0,0|1,0,1]=2 23 B14R0.392 C#CCCOCCOCCOCCOC 34a_100011215631_100013367474 [0,0,0,0,0,0|1,0,1]=2 24 B14R0.392 C#CCCOCCOCCOCCOC 7a_100000688194_100000688953 [0,0,0,0,0,0|1,0,1]=2 25 B14R0.392 C#CCCSCCOCCOCCOC 62a_100000688953_100013367474 [0,0,0,0,0,0|1,1,1]=3 26 B14R0.392 C#CCCSCCOCCOCCOC 62a_100013367474_100000688953 [0,0,0,0,0,0|1,1,1]=3 27 B14R0.392 C/C=C/CNCCOCCOCCOC 34a_100012028300_100102629194 [0,0,0,0,0,0|2,0,1]=3 28 B14R0.392 C/C=C/COCCOCCOCCCC 34a_100011215186_100102629194 [0,0,0,0,0,0|2,0,1]=3 29 B14R0.392 C/C=C/COCCOCCOCCCC 7a_100011215186_100102629194 [0,0,0,0,0,0|2,0,1]=3 30 B14R0.392 C/C=C/COCCOCCOCCCN 34a_100011996194_100102629194 [0,0,0,0,0,0|3,0,1]=4 31 B14R0.392 C/C=C/COCCOCCOCCNC 34a_200014138305_100102629194 [0,0,0,0,0,0|2,0,1]=3 32 B14R0.392 C/C=C/COCCOCCOCCOC 34a_100000688194_100102629194 [0,0,0,0,0,0|1,0,1]=2 33 B14R0.392 C/C=C/COCCOCCOCCOC 34a_100016270725_100013367474 [0,0,0,0,0,0|1,0,1]=2 34 B14R0.392 C/C=C/COCCOCCOCCOC 7a_100000688194_100102629194 [0,0,0,0,0,0|1,0,1]=2 35 B14R0.392 C/C=C/CSCCOCCOCCOC 62a_100013367474_100102629194 [0,0,0,0,0,0|1,1,1]=3 36 B14R0.392 C/C=C/CSCCOCCOCCOC 62a_100102629194_100013367474 [0,0,0,0,0,0|1,1,1]=3 37 B14R0.392 C=CCCCCCCCCOCCOC 34a_100000210237_100011933949 [0,0,0,0,0,0|3,0,1]=4 38 B14R0.392 C=CCCCCCCCCOCCOC 34a_100011215194_100011201679 [0,0,0,0,0,0|3,0,1]=4 39 B14R0.392 C=CCCCCCCCCOCCOC 7a_100011215194_100000233755 [0,0,0,0,0,0|3,0,1]=4 40 B14R0.392 C=CCCCCCNCCOCCOC 2230a_100000745349_100000700193 [0,0,0,0,0,0|3,0,1]=4 41 B14R0.392 C=CCCCCCNCCOCCOC 34a_100000745349_100000700193 [0,0,0,0,0,0|3,0,1]=4 42 B14R0.392 C=CCCCCCOCCOCCCC 34a_100000210238_100000700193 [0,0,0,0,0,0|3,0,1]=4 43 B14R0.392 C=CCCCCCOCCOCCCC 34a_100011216702_100000743108 [0,0,0,0,0,0|3,0,1]=4 44 B14R0.392 C=CCCCCCOCCOCCCC 7a_100000210238_100000700193 [0,0,0,0,0,0|3,0,1]=4 45 B14R0.392 C=CCCCCCOCCOCCCC 7a_100011216702_100000743108 [0,0,0,0,0,0|3,0,1]=4 46 B14R0.392 C=CCCCCCOCCOCCNC 34a_100000228057_100000700193 [0,0,0,0,0,0|3,0,1]=4 47 B14R0.392 C=CCCCCCOCCOCCOC 34a_100011215163_100000700193 [0,0,0,0,0,0|2,0,1]=3 48 B14R0.392 C=CCCCCCOCCOCCOC 34a_100011216702_100000695917 [0,0,0,0,0,0|2,0,1]=3 49 B14R0.392 C=CCCCCCOCCOCCOC 7a_100011215163_100000700193 [0,0,0,0,0,0|2,0,1]=3 50 B14R0.392 C=CCCCCCOCCOCCOC 7a_100011216702_100000695917 [0,0,0,0,0,0|2,0,1]=3 51 B14R0.392 C=CCCCCCSCCOCCOC 62a_100000695917_100000700193 [0,0,0,0,0,0|2,1,1]=4 52 B14R0.392 C=CCCCCCSCCOCCOC 62a_100000700193_100000695917 [0,0,0,0,0,0|2,1,1]=4 53 B14R0.392 C=CCCNCCOCCOCCOC 2230a_100012028300_100000754431 [0,0,0,0,0,0|2,0,1]=3 54 B14R0.392 C=CCCNCCOCCOCCOC 2230a_100015191253_100013367474 [0,0,0,0,0,0|2,0,1]=3 55 B14R0.392 C=CCCNCCOCCOCCOC 34a_100012028300_100000754431 [0,0,0,0,0,0|2,0,1]=3 56 B14R0.392 C=CCCOCCOCCOCCCC 34a_100011215186_100000754431 [0,0,0,0,0,0|2,0,1]=3 57 B14R0.392 C=CCCOCCOCCOCCCC 7a_100011215186_100000754431 [0,0,0,0,0,0|2,0,1]=3 58 B14R0.392 C=CCCOCCOCCOCCCN 34a_100011996194_100000754431 [0,0,0,0,0,0|3,0,1]=4 59 B14R0.392 C=CCCOCCOCCOCCNC 34a_200014138305_100000754431 [0,0,0,0,0,0|2,0,1]=3 60 B14R0.392 C=CCCOCCOCCOCCOC 34a_100000688194_100000754431 [0,0,0,0,0,0|1,0,1]=2 61 B14R0.392 C=CCCOCCOCCOCCOC 34a_100011205117_100013367474 [0,0,0,0,0,0|1,0,1]=2 62 B14R0.392 C=CCCOCCOCCOCCOC 7a_100000688194_100000754431 [0,0,0,0,0,0|1,0,1]=2 63 B14R0.392 C=CCCSCCOCCOCCOC 62a_100000754431_100013367474 [0,0,0,0,0,0|1,1,1]=3 64 B14R0.392 C=CCCSCCOCCOCCOC 62a_100013367474_100000754431 [0,0,0,0,0,0|1,1,1]=3 65 B14R0.392 C=COCCCCOCCOCCOC 34a_100000031558_100000695917 [0,0,0,0,0,0|3,0,1]=4 66 B14R0.392 C=COCCCCOCCOCCOC 7a_100000031558_100000695917 [0,0,0,0,0,0|3,0,1]=4 67 B14R0.392 CC#CCNCCOCCOCCOC 2230a_100000685387_100013367474 [0,0,0,0,0,0|2,0,1]=3 68 B14R0.392 CC#CCNCCOCCOCCOC 2230a_100012028300_100000748600 [0,0,0,0,0,0|2,0,1]=3 69 B14R0.392 CC#CCNCCOCCOCCOC 34a_100000685387_100013367474 [0,0,0,0,0,0|2,0,1]=3 70 B14R0.392 CC#CCNCCOCCOCCOC 34a_100012028300_100000748600 [0,0,0,0,0,0|2,0,1]=3 71 B14R0.392 CC#CCOCCOCCOCCCC 34a_100011215186_100000748600 [0,0,0,0,0,0|2,0,1]=3 72 B14R0.392 CC#CCOCCOCCOCCCC 7a_100011215186_100000748600 [0,0,0,0,0,0|2,0,1]=3 73 B14R0.392 CC#CCOCCOCCOCCCN 34a_100011996194_100000748600 [0,0,0,0,0,0|3,0,1]=4 74 B14R0.392 CC#CCOCCOCCOCCNC 34a_200014138305_100000748600 [0,0,0,0,0,0|2,0,1]=3 75 B14R0.392 CC#CCOCCOCCOCCOC 34a_100000688194_100000748600 [0,0,0,0,0,0|1,0,1]=2 76 B14R0.392 CC#CCOCCOCCOCCOC 34a_100000761923_100013367474 [0,0,0,0,0,0|1,0,1]=2 77 B14R0.392 CC#CCOCCOCCOCCOC 7a_100000688194_100000748600 [0,0,0,0,0,0|1,0,1]=2 78 B14R0.392 CC#CCSCCOCCOCCOC 62a_100000748600_100013367474 [0,0,0,0,0,0|1,1,1]=3 79 B14R0.392 CC#CCSCCOCCOCCOC 62a_100013367474_100000748600 [0,0,0,0,0,0|1,1,1]=3 80 B14R0.392 CC/C=C/CCCOCCOCCOC 34a_100016287902_100000695917 [0,0,0,0,0,0|2,0,2]=4 81 B14R0.392 CC/C=C/CCCOCCOCCOC 7a_100016287902_100000695917 [0,0,0,0,0,0|2,0,2]=4 82 B14R0.392 CC=CCNCCOCCOCCOC 2230a_100012028300_100000070051 [0,0,0,0,0,0|2,0,1]=3 83 B14R0.392 CC=CCNCCOCCOCCOC 34a_100012028300_100000070051 [0,0,0,0,0,0|2,0,1]=3 84 B14R0.392 CC=CCOCCOCCOCCCC 34a_100011215186_100000070051 [0,0,0,0,0,0|2,0,1]=3 85 B14R0.392 CC=CCOCCOCCOCCCC 7a_100011215186_100000070051 [0,0,0,0,0,0|2,0,1]=3 86 B14R0.392 CC=CCOCCOCCOCCCN 34a_100011996194_100000070051 [0,0,0,0,0,0|3,0,1]=4 87 B14R0.392 CC=CCOCCOCCOCCNC 34a_200014138305_100000070051 [0,0,0,0,0,0|2,0,1]=3 88 B14R0.392 CC=CCOCCOCCOCCOC 34a_100000688194_100000070051 [0,0,0,0,0,0|1,0,1]=2 89 B14R0.392 CC=CCOCCOCCOCCOC 7a_100000688194_100000070051 [0,0,0,0,0,0|1,0,1]=2 90 B14R0.392 CC=CCSCCOCCOCCOC 62a_100000070051_100013367474 [0,0,0,0,0,0|1,1,1]=3 91 B14R0.392 CC=CCSCCOCCOCCOC 62a_100013367474_100000070051 [0,0,0,0,0,0|1,1,1]=3 92 B14R0.392 CCCC#CCCOCCOCCCC 34a_100000042726_100000743108 [0,0,0,0,0,0|3,0,1]=4 93 B14R0.392 CCCC#CCCOCCOCCCC 7a_100000042726_100000743108 [0,0,0,0,0,0|3,0,1]=4 94 B14R0.392 CCCC#CCCOCCOCCOC 34a_100000042726_100000695917 [0,0,0,0,0,0|2,0,1]=3 95 B14R0.392 CCCC#CCCOCCOCCOC 7a_100000042726_100000695917 [0,0,0,0,0,0|2,0,1]=3 96 B14R0.392 CCCC/C=C/CCCCOCCOC 34a_200020645093_100011201679 [0,0,0,0,0,0|3,0,1]=4 97 B14R0.392 CCCC/C=C/CCCCOCCOC 7a_200020645093_100000233755 [0,0,0,0,0,0|3,0,1]=4 98 B14R0.392 CCCC/C=C/COCCOCCCC 34a_200016272032_100000743108 [0,0,0,0,0,0|3,0,1]=4 99 B14R0.392 CCCC/C=C/COCCOCCCC 7a_200016272032_100000743108 [0,0,0,0,0,0|3,0,1]=4 100 B14R0.392 CCCC/C=C/COCCOCCOC 34a_200016272032_100000695917 [0,0,0,0,0,0|2,0,1]=3 101 B14R0.392 CCCC/C=C/COCCOCCOC 7a_200016272032_100000695917 [0,0,0,0,0,0|2,0,1]=3 102 B14R0.392 CCCCC#CCCCCOCCOC 34a_200000066234_100011201679 [0,0,0,0,0,0|3,0,1]=4 103 B14R0.392 CCCCC#CCCCCOCCOC 7a_200000066234_100000233755 [0,0,0,0,0,0|3,0,1]=4 104 B14R0.392 CCCCC#CCOCCOCCCC 34a_200000034558_100000743108 [0,0,0,0,0,0|3,0,1]=4 105 B14R0.392 CCCCC#CCOCCOCCCC 7a_200000034558_100000743108 [0,0,0,0,0,0|3,0,1]=4 106 B14R0.392 CCCCC#CCOCCOCCOC 34a_200000034558_100000695917 [0,0,0,0,0,0|2,0,1]=3 107 B14R0.392 CCCCC#CCOCCOCCOC 7a_200000034558_100000695917 [0,0,0,0,0,0|2,0,1]=3 108 B14R0.392 CCCCCCC#CCCOCCOC 34a_200000033163_100011201679 [0,0,0,0,0,0|3,0,1]=4 109 B14R0.392 CCCCCCC#CCCOCCOC 7a_200000033163_100000233755 [0,0,0,0,0,0|3,0,1]=4 110 B14R0.392 CCCCCCCC#CCOCCOC 34a_200000061759_100011201679 [0,0,0,0,0,0|3,0,1]=4 111 B14R0.392 CCCCCCCC#CCOCCOC 7a_200000061759_100000233755 [0,0,0,0,0,0|3,0,1]=4 112 B14R0.392 CCCCCCCCCCCCCOC 34a_100000185773_200000210301 [0,0,0,0,0,0|4,0,0]=4 113 B14R0.392 CCCCCCCCCCCCCOC 34a_100138415774_100000210684 [0,0,0,0,0,0|4,0,0]=4 114 B14R0.392 CCCCCCCCCCCCCOC 7a_100000185773_200000210301 [0,0,0,0,0,0|4,0,0]=4 115 B14R0.392 CCCCCCCCCCCCCO[13CH3] 34a_100000185773_200025704644 [0,0,0,0,0,0|4,0,0]=4 116 B14R0.392 CCCCCCCCCCCCCO[13CH3] 7a_100000185773_200025704644 [0,0,0,0,0,0|4,0,0]=4 117 B14R0.392 CCCCCCCCCCNCCOC 2230a_100000209980_100000210320 [0,0,0,0,0,0|4,0,0]=4 118 B14R0.392 CCCCCCCCCCNCCOC 2230a_100000684558_100011201679 [0,0,0,0,0,0|4,0,0]=4 119 B14R0.392 CCCCCCCCCCNCCOC 34a_100000684558_100011201679 [0,0,0,0,0,0|4,0,0]=4 120 B14R0.392 CCCCCCCCCCOCCCC 34a_100000210227_100000210320 [0,0,0,0,0,0|4,0,0]=4 121 B14R0.392 CCCCCCCCCCOCCCC 34a_100000210711_100000210210 [0,0,0,0,0,0|4,0,0]=4 122 B14R0.392 CCCCCCCCCCOCCCC 7a_100000210227_100000210320 [0,0,0,0,0,0|4,0,0]=4 123 B14R0.392 CCCCCCCCCCOCCCC 7a_100000210711_100000210211 [0,0,0,0,0,0|4,0,0]=4 124 B14R0.392 CCCCCCCCCCOCCOC 34a_100000210237_100000210320 [0,0,0,0,0,0|3,0,0]=3 125 B14R0.392 CCCCCCCCCCOCCOC 34a_100000210711_100011201679 [0,0,0,0,0,0|3,0,0]=3 126 B14R0.392 CCCCCCCCCCOCCOC 7a_100000210711_100000233755 [0,0,0,0,0,0|3,0,0]=3 127 B14R0.392 CCCCCCCCCCOCCON 34a_100000700252_100000210320 [0,0,0,0,0,0|4,0,0]=4 128 B14R0.392 CCCCCCCCCCOCCSC 34a_100000210711_100000212216 [0,0,0,0,0,0|3,1,0]=4 129 B14R0.392 CCCCCCCCCCOCCSC 34a_100000230434_100000210320 [0,0,0,0,0,0|3,1,0]=4 130 B14R0.392 CCCCCCCCCCOCCSC 7a_100000210711_100000212216 [0,0,0,0,0,0|3,1,0]=4 131 B14R0.392 CCCCCCCCCCOCCSC 7a_100000230434_100000210320 [0,0,0,0,0,0|3,1,0]=4 132 B14R0.392 CCCCCCCCCCSCCOC 34a_100011628728_200000210301 [0,0,0,0,0,0|3,1,0]=4 133 B14R0.392 CCCCCCCCCCSCCOC 62a_100000233755_100000210320 [0,0,0,0,0,0|3,1,0]=4 134 B14R0.392 CCCCCCCCCCSCCOC 7a_100011628728_200000210301 [0,0,0,0,0,0|3,1,0]=4 135 B14R0.392 CCCCCCCCCCSCCO[13CH3] 34a_100011628728_200025704644 [0,0,0,0,0,0|3,1,0]=4 136 B14R0.392 CCCCCCCCCCSCCO[13CH3] 7a_100011628728_200025704644 [0,0,0,0,0,0|3,1,0]=4 137 B14R0.392 CCCCCCCCNCOCCOC 2230a_100000229939_100000231047 [0,0,0,0,0,0|4,0,0]=4 138 B14R0.392 CCCCCCCCSCOCCOC 62a_100000210759_100000231047 [0,0,0,0,0,0|4,0,0]=4 139 B14R0.392 CCCCCCCCSCOCCOC 62a_100000231047_100000210317 [0,0,0,0,0,0|4,0,0]=4 140 B14R0.392 CCCCCCCNCCCCCOC 2230a_100000747528_100000210681 [0,0,0,0,0,0|4,0,0]=4 141 B14R0.392 CCCCCCCNCCCCCOC 34a_100000747528_100000210614 [0,0,0,0,0,0|4,0,0]=4 142 B14R0.392 CCCCCCCNCCOCCCC 2230a_100000229938_100000743108 [0,0,0,0,0,0|4,0,0]=4 143 B14R0.392 CCCCCCCNCCOCCOC 2230a_100000229938_100000695917 [0,0,0,0,0,0|3,0,0]=3 144 B14R0.392 CCCCCCCNCCOCCOC 2230a_100000745349_100000210681 [0,0,0,0,0,0|3,0,0]=3 145 B14R0.392 CCCCCCCNCCOCCOC 34a_100000745349_100000210614 [0,0,0,0,0,0|3,0,0]=3 146 B14R0.392 CCCCCCCOCCCCCCC 34a_100000210272_100000210614 [0,0,0,0,0,0|4,0,0]=4 147 B14R0.392 CCCCCCCOCCCCCCC 7a_100000210272_100000210614 [0,0,0,0,0,0|4,0,0]=4 148 B14R0.392 CCCCCCCOCCCCCNC 34a_100000722520_100000210614 [0,0,0,0,0,0|4,0,0]=4 149 B14R0.392 CCCCCCCOCCOCCCC 34a_100000210238_100000210614 [0,0,0,0,0,0|3,0,0]=3 150 B14R0.392 CCCCCCCOCCOCCCC 34a_100000210272_100000743108 [0,0,0,0,0,0|3,0,0]=3 151 B14R0.392 CCCCCCCOCCOCCCC 7a_100000210238_100000210614 [0,0,0,0,0,0|3,0,0]=3 152 B14R0.392 CCCCCCCOCCOCCCC 7a_100000210272_100000743108 [0,0,0,0,0,0|3,0,0]=3 153 B14R0.392 CCCCCCCOCCOCCNC 34a_100000228057_100000210614 [0,0,0,0,0,0|3,0,0]=3 154 B14R0.392 CCCCCCCOCCOCCOC 34a_100000210272_100000695917 [0,0,0,0,0,0|2,0,0]=2 155 B14R0.392 CCCCCCCOCCOCCOC 34a_100011215163_100000210614 [0,0,0,0,0,0|2,0,0]=2 156 B14R0.392 CCCCCCCOCCOCCOC 7a_100000210272_100000695917 [0,0,0,0,0,0|2,0,0]=2 157 B14R0.392 CCCCCCCOCCOCCOC 7a_100011215163_100000210614 [0,0,0,0,0,0|2,0,0]=2 158 B14R0.392 CCCCCCCOCCSCCCC 34a_200000230436_100000210614 [0,0,0,0,0,0|3,1,0]=4 159 B14R0.392 CCCCCCCOCCSCCCC 7a_200000230436_100000210614 [0,0,0,0,0,0|3,1,0]=4 160 B14R0.392 CCCCCCCSCCOCCCC 62a_100000210614_100000743108 [0,0,0,0,0,0|3,1,0]=4 161 B14R0.392 CCCCCCCSCCOCCCC 62a_100000743108_100000210316 [0,0,0,0,0,0|3,1,0]=4 162 B14R0.392 CCCCCCCSCCOCCOC 62a_100000210614_100000695917 [0,0,0,0,0,0|2,1,0]=3 163 B14R0.392 CCCCCCCSCCOCCOC 62a_100000695917_100000210316 [0,0,0,0,0,0|2,1,0]=3 164 B14R0.392 CCCCCCNCCCOCCOC 2230a_100000206027_100000210314 [0,0,0,0,0,0|4,0,0]=4 165 B14R0.392 CCCCCCNCCCOCCOC 2230a_100000210581_100011216529 [0,0,0,0,0,0|4,0,0]=4 166 B14R0.392 CCCCCCNCCCOCCOC 34a_100000206027_100000210314 [0,0,0,0,0,0|4,0,0]=4 167 B14R0.392 CCCCCCOCCCOCCOC 34a_100000210259_100011216529 [0,0,0,0,0,0|4,0,0]=4 168 B14R0.392 CCCCCCOCCCOCCOC 7a_100000210259_100011216529 [0,0,0,0,0,0|4,0,0]=4 169 B14R0.392 CCCCCCSCCCOCCOC 62a_100000210314_100011216529 [0,0,0,0,0,0|4,0,0]=4 170 B14R0.392 CCCCCCSCCCOCCOC 62a_100011216529_100000210757 [0,0,0,0,0,0|4,0,0]=4 171 B14R0.392 CCCCNCCOCCOCCOC 2230a_100000102301_100013367474 [0,0,0,0,0,0|2,0,0]=2 172 B14R0.392 CCCCNCCOCCOCCOC 2230a_100012028300_100000210211 [0,0,0,0,0,0|2,0,0]=2 173 B14R0.392 CCCCNCCOCCOCCOC 34a_100012028300_100000210210 [0,0,0,0,0,0|2,0,0]=2 174 B14R0.392 CCCCNCCOCCOCCOC 7a_106832991798_100013367474 [0,0,0,0,0,0|2,0,0]=2 175 B14R0.392 CCCCOCCCCOCCCOC 34a_200000760531_100000740836 [0,0,0,0,0,0|4,0,0]=4 176 B14R0.392 CCCCOCCCCOCCCOC 7a_200000760531_100000740836 [0,0,0,0,0,0|4,0,0]=4 177 B14R0.392 CCCCOCCCNCCCCOC 2230a_200000211371_100000730899 [0,0,0,0,0,0|4,0,0]=4 178 B14R0.392 CCCCOCCCNCCCCOC 34a_200000211371_100000755781 [0,0,0,0,0,0|4,0,0]=4 179 B14R0.392 CCCCOCCCNCOCCCC 2230a_200000211371_100011995733 [0,0,0,0,0,0|4,0,0]=4 180 B14R0.392 CCCCOCCCNCOCCCC 34a_200000211371_100011995733 [0,0,0,0,0,0|4,0,0]=4 181 B14R0.392 CCCCOCCCNCOCCOC 2230a_200000211371_100000231047 [0,0,0,0,0,0|3,0,0]=3 182 B14R0.392 CCCCOCCCOCCCCOC 34a_200011215613_100000755781 [0,0,0,0,0,0|4,0,0]=4 183 B14R0.392 CCCCOCCCOCCCCOC 7a_200011215613_100000730899 [0,0,0,0,0,0|4,0,0]=4 184 B14R0.392 CCCCOCCCOCOCCCC 34a_200011215613_100011995733 [0,0,0,0,0,0|4,0,0]=4 185 B14R0.392 CCCCOCCNCCCCCOC 2230a_100000747528_100000743108 [0,0,0,0,0,0|3,0,0]=3 186 B14R0.392 CCCCOCCNCCCCCOC 34a_100000747528_100000743108 [0,0,0,0,0,0|3,0,0]=3 187 B14R0.392 CCCCOCCNCCOCCOC 2230a_100000745349_100000743108 [0,0,0,0,0,0|2,0,0]=2 188 B14R0.392 CCCCOCCNCCOCCOC 34a_100000745349_100000743108 [0,0,0,0,0,0|2,0,0]=2 189 B14R0.392 CCCCOCCNCCSCCCC 2230a_100025743550_100000743108 [0,0,0,0,0,0|3,1,0]=4 190 B14R0.392 CCCCOCCOCCCCCC#N 7a_100000210238_100009813376 [0,0,0,0,0,0|4,0,0]=4 191 B14R0.392 CCCCOCCOCCCCCC=O 7a_100000210238_100000139337 [0,0,0,0,0,0|4,0,0]=4 192 B14R0.392 CCCCOCCOCCCCCCBr 34a_100011215345_100000743108 [0,0,0,0,0,0|4,0,0]=4 193 B14R0.392 CCCCOCCOCCCCCCBr 7a_100011215345_100000743108 [0,0,0,0,0,0|4,0,0]=4 194 B14R0.392 CCCCOCCOCCCCCCCl 34a_100000766143_100000743108 [0,0,0,0,0,0|4,0,0]=4 195 B14R0.392 CCCCOCCOCCCCCCCl 7a_100000766143_100000743108 [0,0,0,0,0,0|4,0,0]=4 196 B14R0.392 CCCCOCCOCCCCCCF 34a_100000210238_100015922095 [0,0,0,0,0,0|4,0,0]=4 197 B14R0.392 CCCCOCCOCCCCCCF 34a_100000732779_100000743108 [0,0,0,0,0,0|4,0,0]=4 198 B14R0.392 CCCCOCCOCCCCCCF 7a_100000210238_100015922095 [0,0,0,0,0,0|4,0,0]=4 199 B14R0.392 CCCCOCCOCCCCCCF 7a_100000732779_100000743108 [0,0,0,0,0,0|4,0,0]=4 200 B14R0.392 CCCCOCCOCCCCCCN 34a_100000686447_100000743108 [0,0,0,0,0,0|4,0,0]=4 201 B14R0.392 CCCCOCCOCCCCCCO 34a_100000210238_100000766143 [0,0,0,0,0,0|4,0,0]=4 202 B14R0.392 CCCCOCCOCCCCCCO 7a_100000210238_100000766143 [0,0,0,0,0,0|4,0,0]=4 203 B14R0.392 CCCCOCCOCCCCCNC 34a_100000722520_100000743108 [0,0,0,0,0,0|3,0,0]=3 204 B14R0.392 CCCCOCCOCCOCCC#N 7a_100011215186_100000184422 [0,0,0,0,0,0|3,0,0]=3 205 B14R0.392 CCCCOCCOCCOCCCC 34a_100000210238_100000743108 [0,0,0,0,0,0|2,0,0]=2 206 B14R0.392 CCCCOCCOCCOCCCC 34a_100011215186_100000210210 [0,0,0,0,0,0|2,0,0]=2 207 B14R0.392 CCCCOCCOCCOCCCC 7a_100000210238_100000743108 [0,0,0,0,0,0|2,0,0]=2 208 B14R0.392 CCCCOCCOCCOCCCC 7a_100011215186_100000210211 [0,0,0,0,0,0|2,0,0]=2 209 B14R0.392 CCCCOCCOCCOCCCF 34a_100011215186_100011934791 [0,0,0,0,0,0|3,0,0]=3 210 B14R0.392 CCCCOCCOCCOCCCF 7a_100011215186_100011934791 [0,0,0,0,0,0|3,0,0]=3 211 B14R0.392 CCCCOCCOCCOCCCN 34a_100011996194_100000210210 [0,0,0,0,0,0|3,0,0]=3 212 B14R0.392 CCCCOCCOCCOCCCO 34a_100011215186_100000230001 [0,0,0,0,0,0|3,0,0]=3 213 B14R0.392 CCCCOCCOCCOCCCO 7a_100011215186_100011215043 [0,0,0,0,0,0|3,0,0]=3 214 B14R0.392 CCCCOCCOCCOCCNC 34a_100000228057_100000743108 [0,0,0,0,0,0|2,0,0]=2 215 B14R0.392 CCCCOCCOCCOCCNC 34a_200014138305_100000210210 [0,0,0,0,0,0|2,0,0]=2 216 B14R0.392 CCCCOCCOCCOCCOC 34a_100000210227_100013367474 [0,0,0,0,0,0|1,0,0]=1 217 B14R0.392 CCCCOCCOCCOCCOC 34a_100000210238_100000695917 [0,0,0,0,0,0|1,0,0]=1 218 B14R0.392 CCCCOCCOCCOCCOC 34a_100000688194_100000210210 [0,0,0,0,0,0|1,0,0]=1 219 B14R0.392 CCCCOCCOCCOCCOC 34a_100000700218_200000210301 [0,0,0,0,0,0|1,0,0]=1 220 B14R0.392 CCCCOCCOCCOCCOC 34a_100011215163_100000743108 [0,0,0,0,0,0|1,0,0]=1 221 B14R0.392 CCCCOCCOCCOCCOC 34a_100011215186_100011201679 [0,0,0,0,0,0|1,0,0]=1 222 B14R0.392 CCCCOCCOCCOCCOC 7a_100000210227_100013367474 [0,0,0,0,0,0|1,0,0]=1 223 B14R0.392 CCCCOCCOCCOCCOC 7a_100000210238_100000695917 [0,0,0,0,0,0|1,0,0]=1 224 B14R0.392 CCCCOCCOCCOCCOC 7a_100000688194_100000210211 [0,0,0,0,0,0|1,0,0]=1 225 B14R0.392 CCCCOCCOCCOCCOC 7a_100000700218_200000210301 [0,0,0,0,0,0|1,0,0]=1 226 B14R0.392 CCCCOCCOCCOCCOC 7a_100011215163_100000743108 [0,0,0,0,0,0|1,0,0]=1 227 B14R0.392 CCCCOCCOCCOCCOC 7a_100011215186_100000233755 [0,0,0,0,0,0|1,0,0]=1 228 B14R0.392 CCCCOCCOCCOCCO[13CH3] 34a_100000700218_200025704644 [0,0,0,0,0,0|1,0,0]=1 229 B14R0.392 CCCCOCCOCCOCCO[13CH3] 7a_100000700218_200025704644 [0,0,0,0,0,0|1,0,0]=1 230 B14R0.392 CCCCOCCOCCOCCSC 34a_100011215186_100000212216 [0,0,0,0,0,0|1,1,0]=2 231 B14R0.392 CCCCOCCOCCOCCSC 7a_100011215186_100000212216 [0,0,0,0,0,0|1,1,0]=2 232 B14R0.392 CCCCOCCOCCSCCCC 34a_200000230436_100000743108 [0,0,0,0,0,0|2,1,0]=3 233 B14R0.392 CCCCOCCOCCSCCCC 7a_200000230436_100000743108 [0,0,0,0,0,0|2,1,0]=3 234 B14R0.392 CCCCOCCSCCOCCCC 62a_100000743108_100000743108 [0,0,0,0,0,0|2,1,0]=3 235 B14R0.392 CCCCOCCSCCOCCOC 62a_100000695917_100000743108 [0,0,0,0,0,0|1,1,0]=2 236 B14R0.392 CCCCOCCSCCOCCOC 62a_100000743108_100000695917 [0,0,0,0,0,0|1,1,0]=2 237 B14R0.392 CCCCOCNCCCOCCOC 2230a_100000206027_100011995733 [0,0,0,0,0,0|3,0,0]=3 238 B14R0.392 CCCCOCNCCCOCCOC 34a_100000206027_100011995733 [0,0,0,0,0,0|3,0,0]=3 239 B14R0.392 CCCCOCOCCCCCCOC 34a_200012092642_100011995733 [0,0,0,0,0,0|4,0,0]=4 240 B14R0.392 CCCCOCSCCCCCCOC 62a_100011995733_100011998445 [0,0,0,0,0,0|4,0,0]=4 241 B14R0.392 CCCCOCSCCCCCCOC 62a_100011998445_100011995733 [0,0,0,0,0,0|4,0,0]=4 242 B14R0.392 CCCCOCSCCCOCCOC 62a_100011216529_100011995733 [0,0,0,0,0,0|3,0,0]=3 243 B14R0.392 CCCCOCSCCCOCCOC 62a_100011995733_100011216529 [0,0,0,0,0,0|3,0,0]=3 244 B14R0.392 CCCCSCCNCCOCCOC 2230a_100025743550_100000695917 [0,0,0,0,0,0|2,1,0]=3 245 B14R0.392 CCCCSCCOCCOCCOC 34a_200000230436_100000695917 [0,0,0,0,0,0|1,1,0]=2 246 B14R0.392 CCCCSCCOCCOCCOC 62a_100000210211_100013367474 [0,0,0,0,0,0|1,1,0]=2 247 B14R0.392 CCCCSCCOCCOCCOC 62a_100013367474_100000210210 [0,0,0,0,0,0|1,1,0]=2 248 B14R0.392 CCCCSCCOCCOCCOC 7a_200000230436_100000695917 [0,0,0,0,0,0|1,1,0]=2 249 B14R0.392 CCCOCCCNCCOCCOC 2230a_100011217757_100000695917 [0,0,0,0,0,0|4,0,0]=4 250 B14R0.392 CCCOCCCNCCOCCOC 34a_100011217757_100000695917 [0,0,0,0,0,0|4,0,0]=4 251 B14R0.392 CCOCSCCOCCOCCOC 62a_100000739092_100013367474 [0,0,0,0,0,0|2,1,0]=3 252 B14R0.392 CCOCSCCOCCOCCOC 62a_100013367474_100000739092 [0,0,0,0,0,0|2,1,0]=3 253 B14R0.392 CNCCCCCOCCOCCOC 34a_100000722520_100000695917 [0,0,0,0,0,0|2,0,0]=2 254 B14R0.392 CNCCOCCOCCCCCCF 34a_100000228057_100015922095 [0,0,0,0,0,0|4,0,0]=4 255 B14R0.392 CNCCOCCOCCCCCCO 34a_100000228057_100000766143 [0,0,0,0,0,0|4,0,0]=4 256 B14R0.392 CNCCOCCOCCOCCCF 34a_200014138305_100011934791 [0,0,0,0,0,0|3,0,0]=3 257 B14R0.392 CNCCOCCOCCOCCCO 34a_200014138305_100000230001 [0,0,0,0,0,0|3,0,0]=3 258 B14R0.392 CNCCOCCOCCOCCOC 2230a_100012359593_200000210301 [0,0,0,0,0,0|1,0,0]=1 259 B14R0.392 CNCCOCCOCCOCCOC 2230a_106832991635_100012349117 [0,0,0,0,0,0|1,0,0]=1 260 B14R0.392 CNCCOCCOCCOCCOC 34a_100000228057_100000695917 [0,0,0,0,0,0|1,0,0]=1 261 B14R0.392 CNCCOCCOCCOCCOC 34a_100012359593_200000210301 [0,0,0,0,0,0|1,0,0]=1 262 B14R0.392 CNCCOCCOCCOCCOC 34a_100036875364_200000210301 [0,0,0,0,0,0|1,0,0]=1 263 B14R0.392 CNCCOCCOCCOCCOC 34a_100102657272_100012349117 [0,0,0,0,0,0|1,0,0]=1 264 B14R0.392 CNCCOCCOCCOCCOC 34a_200014138305_100011201679 [0,0,0,0,0,0|1,0,0]=1 265 B14R0.392 CNCCOCCOCCOCCOC 7a_106832991635_100012349117 [0,0,0,0,0,0|1,0,0]=1 266 B14R0.392 CNCCOCCOCCOCCO[13CH3] 34a_100036875364_200025704644 [0,0,0,0,0,0|1,0,0]=1 267 B14R0.392 CNCCOCCOCCOCCSC 34a_200014138305_100000212216 [0,0,0,0,0,0|1,1,0]=2 268 B14R0.392 COCCCCCCOCCCCOC 34a_100000740925_100011998445 [0,0,0,0,0,0|4,0,0]=4 269 B14R0.392 COCCCCCCOCCCCOC 34a_200012092642_100000755781 [0,0,0,0,0,0|4,0,0]=4 270 B14R0.392 COCCCCCCOCCCCOC 7a_200012092642_100000730899 [0,0,0,0,0,0|4,0,0]=4 271 B14R0.392 COCCCCCCSCCCCOC 62a_100000730899_100011998445 [0,0,0,0,0,0|4,0,0]=4 272 B14R0.392 COCCCCCCSCCCCOC 62a_100011998445_100000730899 [0,0,0,0,0,0|4,0,0]=4 273 B14R0.392 COCCCCCCSCOCCOC 62a_100000231047_100011998445 [0,0,0,0,0,0|3,0,0]=3 274 B14R0.392 COCCCCCCSCOCCOC 62a_100011998445_100000231047 [0,0,0,0,0,0|3,0,0]=3 275 B14R0.392 COCCCCCNCCOCCOC 2230a_100000747528_100000695917 [0,0,0,0,0,0|2,0,0]=2 276 B14R0.392 COCCCCCNCCOCCOC 34a_100000747528_100000695917 [0,0,0,0,0,0|2,0,0]=2 277 B14R0.392 COCCCCCOCCCCCCCl 34a_200132310570_200000210301 [0,0,0,0,0,0|4,0,0]=4 278 B14R0.392 COCCCCCOCCCCCCCl 7a_200132310570_200000210301 [0,0,0,0,0,0|4,0,0]=4 279 B14R0.392 COCCCCNCCCOCCOC 2230a_100000206027_100000730899 [0,0,0,0,0,0|3,0,0]=3 280 B14R0.392 COCCCCNCCCOCCOC 34a_100000206027_100000755781 [0,0,0,0,0,0|3,0,0]=3 281 B14R0.392 COCCCCOCCCOCCOC 34a_100000740925_100011216529 [0,0,0,0,0,0|3,0,0]=3 282 B14R0.392 COCCCCSCCCOCCOC 62a_100000730899_100011216529 [0,0,0,0,0,0|3,0,0]=3 283 B14R0.392 COCCCCSCCCOCCOC 62a_100011216529_100000730899 [0,0,0,0,0,0|3,0,0]=3 284 B14R0.392 COCCNCCOCCOCCOC 2230a_100000209980_100013367474 [0,0,0,0,0,0|1,0,0]=1 285 B14R0.392 COCCNCCOCCOCCOC 2230a_100012028300_100011201679 [0,0,0,0,0,0|1,0,0]=1 286 B14R0.392 COCCNCCOCCOCCOC 34a_100012028300_100011201679 [0,0,0,0,0,0|1,0,0]=1 287 B14R0.392 COCCOCCCCCCCCCBr 34a_100009813782_100011201679 [0,0,0,0,0,0|4,0,0]=4 288 B14R0.392 COCCOCCCCCCCCCBr 7a_100009813782_100000233755 [0,0,0,0,0,0|4,0,0]=4 289 B14R0.392 COCCOCCCCCCCCCCl 34a_100009868337_100011201679 [0,0,0,0,0,0|4,0,0]=4 290 B14R0.392 COCCOCCCCCCCCCCl 7a_100009868337_100000233755 [0,0,0,0,0,0|4,0,0]=4 291 B14R0.392 COCCOCCCCCCCCCN 34a_100000078944_100011201679 [0,0,0,0,0,0|4,0,0]=4 292 B14R0.392 COCCOCCCCCCCCCO 34a_100000210237_100009813782 [0,0,0,0,0,0|4,0,0]=4 293 B14R0.392 COCCOCCCNCOCCOC 2230a_100000206027_100000231047 [0,0,0,0,0,0|2,0,0]=2 294 B14R0.392 COCCOCCCOCCCCSC 34a_100011217163_100011216529 [0,0,0,0,0,0|3,1,0]=4 295 B14R0.392 COCCOCCCOCCCCSC 7a_100011217163_100011216529 [0,0,0,0,0,0|3,1,0]=4 296 B14R0.392 COCCOCCCSCOCCOC 62a_100000231047_100011216529 [0,0,0,0,0,0|2,0,0]=2 297 B14R0.392 COCCOCCCSCOCCOC 62a_100011216529_100000231047 [0,0,0,0,0,0|2,0,0]=2 298 B14R0.392 COCCOCCNCCCCCC#N 2230a_100000745349_100009813376 [0,0,0,0,0,0|4,0,0]=4 299 B14R0.392 COCCOCCNCCCCCC=O 2230a_100000745349_100000139337 [0,0,0,0,0,0|4,0,0]=4 300 B14R0.392 COCCOCCNCCCCCCF 2230a_100000745349_100015922095 [0,0,0,0,0,0|4,0,0]=4 301 B14R0.392 COCCOCCNCCCCCCF 34a_100000745349_100015922095 [0,0,0,0,0,0|4,0,0]=4 302 B14R0.392 COCCOCCNCCCCCCO 2230a_100000686447_100000695917 [0,0,0,0,0,0|4,0,0]=4 303 B14R0.392 COCCOCCNCCCCCCO 2230a_100000745349_100000766143 [0,0,0,0,0,0|4,0,0]=4 304 B14R0.392 COCCOCCNCCCCCCO 34a_100000686447_100000695917 [0,0,0,0,0,0|4,0,0]=4 305 B14R0.392 COCCOCCNCCCCCCO 34a_100000745349_100000766143 [0,0,0,0,0,0|4,0,0]=4 306 B14R0.392 COCCOCCNCCOCCOC 2230a_100000745349_100000695917 [0,0,0,0,0,0|1,0,0]=1 307 B14R0.392 COCCOCCNCCOCCOC 34a_100000745349_100000695917 [0,0,0,0,0,0|1,0,0]=1 308 B14R0.392 COCCOCCOCCCCCC#N 7a_100011215163_100009813376 [0,0,0,0,0,0|3,0,0]=3 309 B14R0.392 COCCOCCOCCCCCC=O 7a_100011215163_100000139337 [0,0,0,0,0,0|3,0,0]=3 310 B14R0.392 COCCOCCOCCCCCCBr 34a_100011215345_100000695917 [0,0,0,0,0,0|3,0,0]=3 311 B14R0.392 COCCOCCOCCCCCCBr 7a_100011215345_100000695917 [0,0,0,0,0,0|3,0,0]=3 312 B14R0.392 COCCOCCOCCCCCCCl 34a_100000766143_100000695917 [0,0,0,0,0,0|3,0,0]=3 313 B14R0.392 COCCOCCOCCCCCCCl 7a_100000766143_100000695917 [0,0,0,0,0,0|3,0,0]=3 314 B14R0.392 COCCOCCOCCCCCCF 34a_100000732779_100000695917 [0,0,0,0,0,0|3,0,0]=3 315 B14R0.392 COCCOCCOCCCCCCF 34a_100011215163_100015922095 [0,0,0,0,0,0|3,0,0]=3 316 B14R0.392 COCCOCCOCCCCCCF 7a_100000732779_100000695917 [0,0,0,0,0,0|3,0,0]=3 317 B14R0.392 COCCOCCOCCCCCCF 7a_100011215163_100015922095 [0,0,0,0,0,0|3,0,0]=3 318 B14R0.392 COCCOCCOCCCCCCN 34a_100000686447_100000695917 [0,0,0,0,0,0|3,0,0]=3 319 B14R0.392 COCCOCCOCCCCCCO 34a_100011215163_100000766143 [0,0,0,0,0,0|3,0,0]=3 320 B14R0.392 COCCOCCOCCCCCCO 7a_100011215163_100000766143 [0,0,0,0,0,0|3,0,0]=3 321 B14R0.392 COCCOCCOCCNCCC#N 2230a_100012028300_100011215226 [0,0,0,0,0,0|3,0,0]=3 322 B14R0.392 COCCOCCOCCNCCCF 2230a_100012028300_100011934791 [0,0,0,0,0,0|3,0,0]=3 323 B14R0.392 COCCOCCOCCNCCCF 2230a_100015189416_100013367474 [0,0,0,0,0,0|3,0,0]=3 324 B14R0.392 COCCOCCOCCNCCCF 34a_100012028300_100011934791 [0,0,0,0,0,0|3,0,0]=3 325 B14R0.392 COCCOCCOCCNCCCF 34a_100015189416_100013367474 [0,0,0,0,0,0|3,0,0]=3 326 B14R0.392 COCCOCCOCCNCCCO 2230a_100012028300_100000230001 [0,0,0,0,0,0|3,0,0]=3 327 B14R0.392 COCCOCCOCCNCCCO 34a_100012028300_100000230001 [0,0,0,0,0,0|3,0,0]=3 328 B14R0.392 COCCOCCOCCNCCSC 2230a_100012028300_100000751147 [0,0,0,0,0,0|1,1,0]=2 329 B14R0.392 COCCOCCOCCNCCSC 2230a_100020590264_100013367474 [0,0,0,0,0,0|1,1,0]=2 330 B14R0.392 COCCOCCOCCNCCSC 34a_100012028300_100000212216 [0,0,0,0,0,0|1,1,0]=2 331 B14R0.392 COCCOCCOCCOCCC#N 7a_100000688194_100000184422 [0,0,0,0,0,0|2,0,0]=2 332 B14R0.392 COCCOCCOCCOCCCBr 34a_100011217188_100013367474 [0,0,0,0,0,0|2,0,0]=2 333 B14R0.392 COCCOCCOCCOCCCCl 34a_100000230001_100013367474 [0,0,0,0,0,0|2,0,0]=2 334 B14R0.392 COCCOCCOCCOCCCF 34a_100000688194_100011934791 [0,0,0,0,0,0|2,0,0]=2 335 B14R0.392 COCCOCCOCCOCCCF 34a_100000759539_100013367474 [0,0,0,0,0,0|2,0,0]=2 336 B14R0.392 COCCOCCOCCOCCCF 7a_100000688194_100011934791 [0,0,0,0,0,0|2,0,0]=2 337 B14R0.392 COCCOCCOCCOCCCN 34a_100000182051_100013367474 [0,0,0,0,0,0|2,0,0]=2 338 B14R0.392 COCCOCCOCCOCCCN 34a_100011996194_100011201679 [0,0,0,0,0,0|2,0,0]=2 339 B14R0.392 COCCOCCOCCOCCCO 34a_100000688194_100000230001 [0,0,0,0,0,0|2,0,0]=2 340 B14R0.392 COCCOCCOCCOCCCO 7a_100000688194_100011215043 [0,0,0,0,0,0|2,0,0]=2 341 B14R0.392 COCCOCCOCCOCCN[13CH3] 2230a_100012359593_200025704644 [0,0,0,0,0,0|1,0,0]=1 342 B14R0.392 COCCOCCOCCOCCN[13CH3] 34a_100012359593_200025704644 [0,0,0,0,0,0|1,0,0]=1 343 B14R0.392 COCCOCCOCCOCCOC 34a_100000210237_100013367474 [0,0,0,0,0,0|0,0,0]=0 344 B14R0.392 COCCOCCOCCOCCOC 34a_100000688194_100011201679 [0,0,0,0,0,0|0,0,0]=0 345 B14R0.392 COCCOCCOCCOCCOC 34a_100011215163_100000695917 [0,0,0,0,0,0|0,0,0]=0 346 B14R0.392 COCCOCCOCCOCCOC 34a_100011218579_200000210301 [0,0,0,0,0,0|0,0,0]=0 347 B14R0.392 COCCOCCOCCOCCOC 34a_100138415774_100012349117 [0,0,0,0,0,0|0,0,0]=0 348 B14R0.392 COCCOCCOCCOCCOC 7a_100000688194_100000233755 [0,0,0,0,0,0|0,0,0]=0 349 B14R0.392 COCCOCCOCCOCCOC 7a_100011215163_100000695917 [0,0,0,0,0,0|0,0,0]=0 350 B14R0.392 COCCOCCOCCOCCOC 7a_100011218579_200000210301 [0,0,0,0,0,0|0,0,0]=0 351 B14R0.392 COCCOCCOCCOCCON 34a_100000700252_100013367474 [0,0,0,0,0,0|1,0,0]=1 352 B14R0.392 COCCOCCOCCOCCON 34a_200121571635_200000210301 [0,0,0,0,0,0|1,0,0]=1 353 B14R0.392 COCCOCCOCCOCCO[13CH3] 34a_100011218579_200025704644 [0,0,0,0,0,0|0,0,0]=0 354 B14R0.392 COCCOCCOCCOCCO[13CH3] 7a_100011218579_200025704644 [0,0,0,0,0,0|0,0,0]=0 355 B14R0.392 COCCOCCOCCOCCSC 34a_100000230434_100013367474 [0,0,0,0,0,0|0,1,0]=1 356 B14R0.392 COCCOCCOCCOCCSC 34a_100000688194_100000212216 [0,0,0,0,0,0|0,1,0]=1 357 B14R0.392 COCCOCCOCCOCCSC 62a_100012349117_200000210301 [0,0,0,0,0,0|0,1,0]=1 358 B14R0.392 COCCOCCOCCOCCSC 62a_200000210301_100012349117 [0,0,0,0,0,0|0,1,0]=1 359 B14R0.392 COCCOCCOCCOCCSC 7a_100000230434_100013367474 [0,0,0,0,0,0|0,1,0]=1 360 B14R0.392 COCCOCCOCCOCCSC 7a_100000688194_100000212216 [0,0,0,0,0,0|0,1,0]=1 361 B14R0.392 COCCOCCOCCOCCS[13CH3] 62a_100012349117_200025704644 [0,0,0,0,0,0|0,1,0]=1 362 B14R0.392 COCCOCCOCCOCCS[13CH3] 62a_200025704644_100012349117 [0,0,0,0,0,0|0,1,0]=1 363 B14R0.392 COCCOCCOCCSCCC#N 62a_100011215226_100013367474 [0,0,0,0,0,0|2,1,0]=3 364 B14R0.392 COCCOCCOCCSCCC#N 62a_100013367474_100011215226 [0,0,0,0,0,0|2,1,0]=3 365 B14R0.392 COCCOCCOCCSCCCF 62a_100011934791_100013367474 [0,0,0,0,0,0|2,1,0]=3 366 B14R0.392 COCCOCCOCCSCCCF 62a_100013367474_100011934791 [0,0,0,0,0,0|2,1,0]=3 367 B14R0.392 COCCOCCOCCSCCCO 62a_100011215043_100013367474 [0,0,0,0,0,0|2,1,0]=3 368 B14R0.392 COCCOCCOCCSCCCO 62a_100013367474_100011215043 [0,0,0,0,0,0|2,1,0]=3 369 B14R0.392 COCCOCCOCCSCCOC 62a_100000233755_100013367474 [0,0,0,0,0,0|0,1,0]=1 370 B14R0.392 COCCOCCOCCSCCOC 62a_100013367474_100000233755 [0,0,0,0,0,0|0,1,0]=1 371 B14R0.392 COCCOCCOCCSCCSC 62a_100000212216_100013367474 [0,0,0,0,0,0|0,2,0]=2 372 B14R0.392 COCCOCCOCCSCCSC 62a_100013367474_100000751147 [0,0,0,0,0,0|0,2,0]=2 373 B14R0.392 COCCOCCOCCSCSC#N 62a_100000211825_100013367474 [0,0,0,0,0,0|3,1,0]=4 374 B14R0.392 COCCOCCOCCSCSC#N 62a_100013367474_100000211825 [0,0,0,0,0,0|3,1,0]=4 375 B14R0.392 COCCOCCSCCCCCC#N 62a_100000695917_100009813376 [0,0,0,0,0,0|3,1,0]=4 376 B14R0.392 COCCOCCSCCCCCC#N 62a_100009813376_100000695917 [0,0,0,0,0,0|3,1,0]=4 377 B14R0.392 COCCOCCSCCCCCC=O 62a_100000139337_100000695917 [0,0,0,0,0,0|3,1,0]=4 378 B14R0.392 COCCOCCSCCCCCC=O 62a_100000695917_100000139337 [0,0,0,0,0,0|3,1,0]=4 379 B14R0.392 COCCOCCSCCCCCCF 62a_100000695917_100015922095 [0,0,0,0,0,0|3,1,0]=4 380 B14R0.392 COCCOCCSCCCCCCF 62a_100015922095_100000695917 [0,0,0,0,0,0|3,1,0]=4 381 B14R0.392 COCCOCCSCCCCCCO 62a_100000695917_100000766143 [0,0,0,0,0,0|3,1,0]=4 382 B14R0.392 COCCOCCSCCCCCCO 62a_100000766143_100000695917 [0,0,0,0,0,0|3,1,0]=4 383 B14R0.392 COCCOCCSCCOCCOC 62a_100000695917_100000695917 [0,0,0,0,0,0|0,1,0]=1 384 B14R0.392 COCCOCNCCCOCCCO 2230a_100011310245_100000231047 [0,0,0,0,0,0|4,0,0]=4 385 B14R0.392 CSCCOCCOCCOCCCN 34a_100011996194_100000212216 [0,0,0,0,0,0|2,1,0]=3 386 B14R0.392 NCCCOCCOCCOCCCF 34a_100011996194_100011934791 [0,0,0,0,0,0|4,0,0]=4 387 B14R0.392 NCCCOCCOCCOCCCO 34a_100011996194_100000230001 [0,0,0,0,0,0|4,0,0]=4 388 B14R0.392 [13CH3]OCCCCCOCCCCCCCl 34a_200132310570_200025704644 [0,0,0,0,0,0|4,0,0]=4 389 B14R0.392 [13CH3]OCCCCCOCCCCCCCl 7a_200132310570_200025704644 [0,0,0,0,0,0|4,0,0]=4 390 B14R0.392 [13CH3]OCCOCCOCCOCCON 34a_200121571635_200025704644 [0,0,0,0,0,0|1,0,0]=1 391 B13R0.336 C#CCCCCCCCOCCOC 34a_100000054614_100011201679 [1,0,0,0,0,0|2,0,1]=4 392 B13R0.336 C#CCCCCCCCOCCOC 34a_100000210237_100153394163 [1,0,0,0,0,0|2,0,1]=4 393 B13R0.336 C#CCCCCCCCOCCOC 7a_100000054614_100000233755 [1,0,0,0,0,0|2,0,1]=4 394 B13R0.336 C#CCCCCCOCCCCOC 34a_100000740925_100012094781 [1,0,0,0,0,0|2,0,1]=4 395 B13R0.336 C#CCCCCCOCCCCOC 34a_100000766912_100000755781 [1,0,0,0,0,0|2,0,1]=4 396 B13R0.336 C#CCCCCCOCCCCOC 7a_100000766912_100000730899 [1,0,0,0,0,0|2,0,1]=4 397 B13R0.336 C#CCCCCCOCCOCCC 34a_100000752267_100012094781 [1,0,0,0,0,0|2,0,1]=4 398 B13R0.336 C#CCCCCCOCCOCCC 34a_100000766912_100011215938 [1,0,0,0,0,0|2,0,1]=4 399 B13R0.336 C#CCCCCCOCCOCCC 7a_100000752267_100012094781 [1,0,0,0,0,0|2,0,1]=4 400 B13R0.336 C#CCCCCCOCCOCCC 7a_100000766912_100011215938 [1,0,0,0,0,0|2,0,1]=4 401 B13R0.336 C#CCCCCCOCCOCCO 34a_100000766912_100000692535 [1,0,0,0,0,0|2,0,1]=4 402 B13R0.336 C#CCCCCCOCCOCCO 7a_100000766912_100011215305 [1,0,0,0,0,0|2,0,1]=4 403 B13R0.336 C#CCCCCNCCOCCOC 2230a_100000706060_100000695917 [1,0,0,0,0,0|2,0,1]=4 404 B13R0.336 C#CCCCCNCCOCCOC 2230a_100000745349_100010269958 [1,0,0,0,0,0|2,0,1]=4 405 B13R0.336 C#CCCCCNCCOCCOC 34a_100000706060_100000695917 [1,0,0,0,0,0|2,0,1]=4 406 B13R0.336 C#CCCCCNCCOCCOC 34a_100000745349_100010269958 [1,0,0,0,0,0|2,0,1]=4 407 B13R0.336 C#CCCCCOCCOCCCC 34a_100000210238_100010269958 [1,0,0,0,0,0|2,0,1]=4 408 B13R0.336 C#CCCCCOCCOCCCC 34a_100000766709_100000743108 [1,0,0,0,0,0|2,0,1]=4 409 B13R0.336 C#CCCCCOCCOCCCC 7a_100000210238_100010269958 [1,0,0,0,0,0|2,0,1]=4 410 B13R0.336 C#CCCCCOCCOCCCC 7a_100000766709_100000743108 [1,0,0,0,0,0|2,0,1]=4 411 B13R0.336 C#CCCCCOCCOCCNC 34a_100000228057_100010269958 [1,0,0,0,0,0|2,0,1]=4 412 B13R0.336 C#CCCCCOCCOCCOC 34a_100000766709_100000695917 [1,0,0,0,0,0|1,0,1]=3 413 B13R0.336 C#CCCCCOCCOCCOC 34a_100011215163_100010269958 [1,0,0,0,0,0|1,0,1]=3 414 B13R0.336 C#CCCCCOCCOCCOC 7a_100000766709_100000695917 [1,0,0,0,0,0|1,0,1]=3 415 B13R0.336 C#CCCCCOCCOCCOC 7a_100011215163_100010269958 [1,0,0,0,0,0|1,0,1]=3 416 B13R0.336 C#CCCCCSCCOCCOC 62a_100000695917_100010269958 [1,0,0,0,0,0|1,1,1]=4 417 B13R0.336 C#CCCCCSCCOCCOC 62a_100010269958_100000695917 [1,0,0,0,0,0|1,1,1]=4 418 B13R0.336 C#CCCNCCOCCOCCC 2230a_200011904461_100000688953 [1,0,0,0,0,0|2,0,1]=4 419 B13R0.336 C#CCCNCCOCCOCCC 34a_200011904461_100000688953 [1,0,0,0,0,0|2,0,1]=4 420 B13R0.336 C#CCCNCCOCCOCCO 2230a_100011998139_100000688953 [1,0,0,0,0,0|2,0,1]=4 421 B13R0.336 C#CCCNCCOCCOCCO 34a_100000755551_100000032323 [1,0,0,0,0,0|2,0,1]=4 422 B13R0.336 C#CCCNCCOCCOCCO 34a_100011998139_100000688953 [1,0,0,0,0,0|2,0,1]=4 423 B13R0.336 C#CCCOCCCCOCCCC 34a_200000760531_100000688953 [1,0,0,0,0,0|2,0,1]=4 424 B13R0.336 C#CCCOCCCCOCCCC 7a_200000760531_100000688953 [1,0,0,0,0,0|2,0,1]=4 425 B13R0.336 C#CCCOCCOCCCCCC 34a_100000691444_100000688953 [1,0,0,0,0,0|2,0,1]=4 426 B13R0.336 C#CCCOCCOCCCCCC 7a_100000691444_100000688953 [1,0,0,0,0,0|2,0,1]=4 427 B13R0.336 C#CCCOCCOCCOCCBr 34a_100010132937_100000688953 [1,0,0,0,0,0|2,0,1]=4 428 B13R0.336 C#CCCOCCOCCOCCBr 7a_100010132937_100000688953 [1,0,0,0,0,0|2,0,1]=4 429 B13R0.336 C#CCCOCCOCCOCCCl 34a_100000032323_100000688953 [1,0,0,0,0,0|2,0,1]=4 430 B13R0.336 C#CCCOCCOCCOCCCl 7a_100000032323_100000688953 [1,0,0,0,0,0|2,0,1]=4 431 B13R0.336 C#CCCOCCOCCOCCN 34a_100011998139_100000688953 [1,0,0,0,0,0|2,0,1]=4 432 B13R0.336 C#CCCOCCOCCOCCO 34a_100011215631_100000032323 [1,0,0,0,0,0|1,0,1]=3 433 B13R0.336 C#CCCSCCOCCOCCO 62a_100000032323_100000688953 [1,0,0,0,0,0|1,1,1]=4 434 B13R0.336 C#CCCSCCOCCOCCO 62a_100000688953_100000032323 [1,0,0,0,0,0|1,1,1]=4 435 B13R0.336 C#CCNCCOCCOCCOC 2230a_100012028300_100000038162 [1,0,0,0,0,0|1,0,2]=4 436 B13R0.336 C#CCNCCOCCOCCOC 34a_100000212058_100013367474 [1,0,0,0,0,0|1,0,2]=4 437 B13R0.336 C#CCNCCOCCOCCOC 34a_100012028300_100000184674 [1,0,0,0,0,0|1,0,2]=4 438 B13R0.336 C#CCOCCNCCOCCOC 2230a_100000700922_100000695917 [1,0,0,0,0,0|1,0,2]=4 439 B13R0.336 C#CCOCCNCCOCCOC 2230a_100000745349_100010402529 [1,0,0,0,0,0|1,0,2]=4 440 B13R0.336 C#CCOCCNCCOCCOC 34a_100000700922_100000695917 [1,0,0,0,0,0|1,0,2]=4 441 B13R0.336 C#CCOCCNCCOCCOC 34a_100000745349_100010402529 [1,0,0,0,0,0|1,0,2]=4 442 B13R0.336 C#CCOCCOCCNCCOC 2230a_100000056377_100011201679 [1,0,0,0,0,0|1,0,2]=4 443 B13R0.336 C#CCOCCOCCNCCOC 2230a_100000209980_100010408581 [1,0,0,0,0,0|1,0,2]=4 444 B13R0.336 C#CCOCCOCCNCCOC 34a_100000056377_100011201679 [1,0,0,0,0,0|1,0,2]=4 445 B13R0.336 C#CCOCCOCCOCCCC 34a_100000041007_100000210210 [1,0,0,0,0,0|1,0,2]=4 446 B13R0.336 C#CCOCCOCCOCCCC 34a_100000054580_100000743108 [1,0,0,0,0,0|1,0,2]=4 447 B13R0.336 C#CCOCCOCCOCCCC 34a_100000210227_100010408581 [1,0,0,0,0,0|1,0,2]=4 448 B13R0.336 C#CCOCCOCCOCCCC 34a_100000210238_100010402529 [1,0,0,0,0,0|1,0,2]=4 449 B13R0.336 C#CCOCCOCCOCCCC 34a_100011215186_100000184674 [1,0,0,0,0,0|1,0,2]=4 450 B13R0.336 C#CCOCCOCCOCCCC 7a_100000041007_100000210211 [1,0,0,0,0,0|1,0,2]=4 451 B13R0.336 C#CCOCCOCCOCCCC 7a_100000054580_100000743108 [1,0,0,0,0,0|1,0,2]=4 452 B13R0.336 C#CCOCCOCCOCCCC 7a_100000210227_100010408581 [1,0,0,0,0,0|1,0,2]=4 453 B13R0.336 C#CCOCCOCCOCCCC 7a_100000210238_100010402529 [1,0,0,0,0,0|1,0,2]=4 454 B13R0.336 C#CCOCCOCCOCCCC 7a_100011215186_100000038162 [1,0,0,0,0,0|1,0,2]=4 455 B13R0.336 C#CCOCCOCCOCCNC 2230a_100009980927_200000210301 [1,0,0,0,0,0|1,0,2]=4 456 B13R0.336 C#CCOCCOCCOCCNC 2230a_106832991635_100020624644 [1,0,0,0,0,0|1,0,2]=4 457 B13R0.336 C#CCOCCOCCOCCNC 34a_100000228057_100010402529 [1,0,0,0,0,0|1,0,2]=4 458 B13R0.336 C#CCOCCOCCOCCNC 34a_100009980927_200000210301 [1,0,0,0,0,0|1,0,2]=4 459 B13R0.336 C#CCOCCOCCOCCNC 34a_100102657272_100020624644 [1,0,0,0,0,0|1,0,2]=4 460 B13R0.336 C#CCOCCOCCOCCNC 34a_200014138305_100000184674 [1,0,0,0,0,0|1,0,2]=4 461 B13R0.336 C#CCOCCOCCOCCNC 7a_106832991635_100020624644 [1,0,0,0,0,0|1,0,2]=4 462 B13R0.336 C#CCOCCOCCOCCN[13CH3] 2230a_100009980927_200025704644 [1,0,0,0,0,0|1,0,2]=4 463 B13R0.336 C#CCOCCOCCOCCN[13CH3] 34a_100009980927_200025704644 [1,0,0,0,0,0|1,0,2]=4 464 B13R0.336 C#CCOCCOCCOCCOC 34a_100000041007_100011201679 [1,0,0,0,0,0|0,0,2]=3 465 B13R0.336 C#CCOCCOCCOCCOC 34a_100000054580_100000695917 [1,0,0,0,0,0|0,0,2]=3 466 B13R0.336 C#CCOCCOCCOCCOC 34a_100000210237_100010408581 [1,0,0,0,0,0|0,0,2]=3 467 B13R0.336 C#CCOCCOCCOCCOC 34a_100000210247_100013367474 [1,0,0,0,0,0|0,0,2]=3 468 B13R0.336 C#CCOCCOCCOCCOC 34a_100000688194_100000184674 [1,0,0,0,0,0|0,0,2]=3 469 B13R0.336 C#CCOCCOCCOCCOC 34a_100009872019_200000210301 [1,0,0,0,0,0|0,0,2]=3 470 B13R0.336 C#CCOCCOCCOCCOC 34a_100011215163_100010402529 [1,0,0,0,0,0|0,0,2]=3 471 B13R0.336 C#CCOCCOCCOCCOC 34a_100138415774_100020624644 [1,0,0,0,0,0|0,0,2]=3 472 B13R0.336 C#CCOCCOCCOCCOC 7a_100000041007_100000233755 [1,0,0,0,0,0|0,0,2]=3 473 B13R0.336 C#CCOCCOCCOCCOC 7a_100000054580_100000695917 [1,0,0,0,0,0|0,0,2]=3 474 B13R0.336 C#CCOCCOCCOCCOC 7a_100000688194_100000038162 [1,0,0,0,0,0|0,0,2]=3 475 B13R0.336 C#CCOCCOCCOCCOC 7a_100009872019_200000210301 [1,0,0,0,0,0|0,0,2]=3 476 B13R0.336 C#CCOCCOCCOCCOC 7a_100011215163_100010402529 [1,0,0,0,0,0|0,0,2]=3 477 B13R0.336 C#CCOCCOCCOCCON 34a_100000700252_100010408581 [1,0,0,0,0,0|1,0,2]=4 478 B13R0.336 C#CCOCCOCCOCCO[13CH3] 34a_100009872019_200025704644 [1,0,0,0,0,0|0,0,2]=3 479 B13R0.336 C#CCOCCOCCOCCO[13CH3] 7a_100009872019_200025704644 [1,0,0,0,0,0|0,0,2]=3 480 B13R0.336 C#CCOCCOCCOCCSC 34a_100000041007_100000212216 [1,0,0,0,0,0|0,1,2]=4 481 B13R0.336 C#CCOCCOCCOCCSC 34a_100000230434_100010408581 [1,0,0,0,0,0|0,1,2]=4 482 B13R0.336 C#CCOCCOCCOCCSC 62a_100020624644_200000210301 [1,0,0,0,0,0|0,1,2]=4 483 B13R0.336 C#CCOCCOCCOCCSC 62a_200000210301_100020624644 [1,0,0,0,0,0|0,1,2]=4 484 B13R0.336 C#CCOCCOCCOCCSC 7a_100000041007_100000212216 [1,0,0,0,0,0|0,1,2]=4 485 B13R0.336 C#CCOCCOCCOCCSC 7a_100000230434_100010408581 [1,0,0,0,0,0|0,1,2]=4 486 B13R0.336 C#CCOCCOCCOCCS[13CH3] 62a_100020624644_200025704644 [1,0,0,0,0,0|0,1,2]=4 487 B13R0.336 C#CCOCCOCCOCCS[13CH3] 62a_200025704644_100020624644 [1,0,0,0,0,0|0,1,2]=4 488 B13R0.336 C#CCOCCOCCSCCOC 62a_100000233755_100010408581 [1,0,0,0,0,0|0,1,2]=4 489 B13R0.336 C#CCOCCOCCSCCOC 62a_100010408581_100000233755 [1,0,0,0,0,0|0,1,2]=4 490 B13R0.336 C#CCOCCSCCOCCOC 62a_100000695917_100010402529 [1,0,0,0,0,0|0,1,2]=4 491 B13R0.336 C#CCOCCSCCOCCOC 62a_100010402529_100000695917 [1,0,0,0,0,0|0,1,2]=4 492 B13R0.336 C#CCSCCOCCOCCOC 62a_100000038162_100013367474 [1,0,0,0,0,0|0,1,2]=4 493 B13R0.336 C/C=C/CNCCOCCOCCC 34a_200011904461_100102629194 [1,0,0,0,0,0|2,0,1]=4 494 B13R0.336 C/C=C/CNCCOCCOCCO 34a_100011998139_100102629194 [1,0,0,0,0,0|2,0,1]=4 495 B13R0.336 C/C=C/COCCCCOCCCC 34a_200000760531_100102629194 [1,0,0,0,0,0|2,0,1]=4 496 B13R0.336 C/C=C/COCCCCOCCCC 7a_200000760531_100102629194 [1,0,0,0,0,0|2,0,1]=4 497 B13R0.336 C/C=C/COCCOCCCCCC 34a_100000691444_100102629194 [1,0,0,0,0,0|2,0,1]=4 498 B13R0.336 C/C=C/COCCOCCCCCC 7a_100000691444_100102629194 [1,0,0,0,0,0|2,0,1]=4 499 B13R0.336 C/C=C/COCCOCCOCCBr 34a_100010132937_100102629194 [1,0,0,0,0,0|2,0,1]=4 500 B13R0.336 C/C=C/COCCOCCOCCBr 7a_100010132937_100102629194 [1,0,0,0,0,0|2,0,1]=4 501 B13R0.336 C/C=C/COCCOCCOCCCl 34a_100000032323_100102629194 [1,0,0,0,0,0|2,0,1]=4 502 B13R0.336 C/C=C/COCCOCCOCCCl 7a_100000032323_100102629194 [1,0,0,0,0,0|2,0,1]=4 503 B13R0.336 C/C=C/COCCOCCOCCN 34a_100011998139_100102629194 [1,0,0,0,0,0|2,0,1]=4 504 B13R0.336 C/C=C/COCCOCCOCCO 34a_100016270725_100000032323 [1,0,0,0,0,0|1,0,1]=3 505 B13R0.336 C/C=C/CSCCOCCOCCO 62a_100000032323_100102629194 [1,0,0,0,0,0|1,1,1]=4 506 B13R0.336 C/C=C/CSCCOCCOCCO 62a_100102629194_100000032323 [1,0,0,0,0,0|1,1,1]=4 507 B13R0.336 C=CCCCCCCCOCCOC 34a_100000210237_100012355270 [1,0,0,0,0,0|2,0,1]=4 508 B13R0.336 C=CCCCCCCCOCCOC 34a_100000730831_100011201679 [1,0,0,0,0,0|2,0,1]=4 509 B13R0.336 C=CCCCCCCCOCCOC 7a_100000730831_100000233755 [1,0,0,0,0,0|2,0,1]=4 510 B13R0.336 C=CCCCCCOCCCCOC 34a_100000740925_100000700193 [1,0,0,0,0,0|2,0,1]=4 511 B13R0.336 C=CCCCCCOCCCCOC 34a_100011216702_100000755781 [1,0,0,0,0,0|2,0,1]=4 512 B13R0.336 C=CCCCCCOCCCCOC 7a_100011216702_100000730899 [1,0,0,0,0,0|2,0,1]=4 513 B13R0.336 C=CCCCCCOCCOCCC 34a_100000752267_100000700193 [1,0,0,0,0,0|2,0,1]=4 514 B13R0.336 C=CCCCCCOCCOCCC 34a_100011216702_100011215938 [1,0,0,0,0,0|2,0,1]=4 515 B13R0.336 C=CCCCCCOCCOCCC 7a_100000752267_100000700193 [1,0,0,0,0,0|2,0,1]=4 516 B13R0.336 C=CCCCCCOCCOCCC 7a_100011216702_100011215938 [1,0,0,0,0,0|2,0,1]=4 517 B13R0.336 C=CCCCCCOCCOCCO 34a_100011216702_100000692535 [1,0,0,0,0,0|2,0,1]=4 518 B13R0.336 C=CCCCCCOCCOCCO 7a_100011216702_100011215305 [1,0,0,0,0,0|2,0,1]=4 519 B13R0.336 C=CCCCCNCCOCCOC 2230a_100000703577_100000695917 [1,0,0,0,0,0|2,0,1]=4 520 B13R0.336 C=CCCCCNCCOCCOC 2230a_100000745349_100011215482 [1,0,0,0,0,0|2,0,1]=4 521 B13R0.336 C=CCCCCNCCOCCOC 34a_100000703577_100000695917 [1,0,0,0,0,0|2,0,1]=4 522 B13R0.336 C=CCCCCNCCOCCOC 34a_100000745349_100011215482 [1,0,0,0,0,0|2,0,1]=4 523 B13R0.336 C=CCCCCOCCOCCCC 34a_100000210238_100011215482 [1,0,0,0,0,0|2,0,1]=4 524 B13R0.336 C=CCCCCOCCOCCCC 34a_100000766645_100000743108 [1,0,0,0,0,0|2,0,1]=4 525 B13R0.336 C=CCCCCOCCOCCCC 7a_100000210238_100011215482 [1,0,0,0,0,0|2,0,1]=4 526 B13R0.336 C=CCCCCOCCOCCCC 7a_100000766645_100000743108 [1,0,0,0,0,0|2,0,1]=4 527 B13R0.336 C=CCCCCOCCOCCNC 34a_100000228057_100011215482 [1,0,0,0,0,0|2,0,1]=4 528 B13R0.336 C=CCCCCOCCOCCOC 34a_100000766645_100000695917 [1,0,0,0,0,0|1,0,1]=3 529 B13R0.336 C=CCCCCOCCOCCOC 34a_100011215163_100011215482 [1,0,0,0,0,0|1,0,1]=3 530 B13R0.336 C=CCCCCOCCOCCOC 7a_100000766645_100000695917 [1,0,0,0,0,0|1,0,1]=3 531 B13R0.336 C=CCCCCOCCOCCOC 7a_100011215163_100011215482 [1,0,0,0,0,0|1,0,1]=3 532 B13R0.336 C=CCCCCSCCOCCOC 62a_100000695917_100011215482 [1,0,0,0,0,0|1,1,1]=4 533 B13R0.336 C=CCCCCSCCOCCOC 62a_100011215482_100000695917 [1,0,0,0,0,0|1,1,1]=4 534 B13R0.336 C=CCCNCCOCCOCCC 2230a_200011904461_100000754431 [1,0,0,0,0,0|2,0,1]=4 535 B13R0.336 C=CCCNCCOCCOCCC 34a_200011904461_100000754431 [1,0,0,0,0,0|2,0,1]=4 536 B13R0.336 C=CCCNCCOCCOCCO 2230a_100011998139_100000754431 [1,0,0,0,0,0|2,0,1]=4 537 B13R0.336 C=CCCNCCOCCOCCO 2230a_100015191253_100000032323 [1,0,0,0,0,0|2,0,1]=4 538 B13R0.336 C=CCCNCCOCCOCCO 34a_100011998139_100000754431 [1,0,0,0,0,0|2,0,1]=4 539 B13R0.336 C=CCCOCCCCOCCCC 34a_200000760531_100000754431 [1,0,0,0,0,0|2,0,1]=4 540 B13R0.336 C=CCCOCCCCOCCCC 7a_200000760531_100000754431 [1,0,0,0,0,0|2,0,1]=4 541 B13R0.336 C=CCCOCCOCCCCCC 34a_100000691444_100000754431 [1,0,0,0,0,0|2,0,1]=4 542 B13R0.336 C=CCCOCCOCCCCCC 7a_100000691444_100000754431 [1,0,0,0,0,0|2,0,1]=4 543 B13R0.336 C=CCCOCCOCCOCCBr 34a_100010132937_100000754431 [1,0,0,0,0,0|2,0,1]=4 544 B13R0.336 C=CCCOCCOCCOCCBr 7a_100010132937_100000754431 [1,0,0,0,0,0|2,0,1]=4 545 B13R0.336 C=CCCOCCOCCOCCCl 34a_100000032323_100000754431 [1,0,0,0,0,0|2,0,1]=4 546 B13R0.336 C=CCCOCCOCCOCCCl 7a_100000032323_100000754431 [1,0,0,0,0,0|2,0,1]=4 547 B13R0.336 C=CCCOCCOCCOCCN 34a_100011998139_100000754431 [1,0,0,0,0,0|2,0,1]=4 548 B13R0.336 C=CCCOCCOCCOCCO 34a_100011205117_100000032323 [1,0,0,0,0,0|1,0,1]=3 549 B13R0.336 C=CCCSCCOCCOCCO 62a_100000032323_100000754431 [1,0,0,0,0,0|1,1,1]=4 550 B13R0.336 C=CCCSCCOCCOCCO 62a_100000754431_100000032323 [1,0,0,0,0,0|1,1,1]=4 551 B13R0.336 C=CCNCCOCCOCCOC 2230a_100012028300_100000210623 [1,0,0,0,0,0|1,0,2]=4 552 B13R0.336 C=CCNCCOCCOCCOC 2230a_100020586998_100013367474 [1,0,0,0,0,0|1,0,2]=4 553 B13R0.336 C=CCNCCOCCOCCOC 34a_100012028300_100015514636 [1,0,0,0,0,0|1,0,2]=4 554 B13R0.336 C=CCOCCOCCOCCCC 34a_100000037705_100000743108 [1,0,0,0,0,0|1,0,2]=4 555 B13R0.336 C=CCOCCOCCOCCCC 34a_100000065479_100000210210 [1,0,0,0,0,0|1,0,2]=4 556 B13R0.336 C=CCOCCOCCOCCCC 34a_100011215186_100015514636 [1,0,0,0,0,0|1,0,2]=4 557 B13R0.336 C=CCOCCOCCOCCCC 7a_100000037705_100000743108 [1,0,0,0,0,0|1,0,2]=4 558 B13R0.336 C=CCOCCOCCOCCCC 7a_100000065479_100000210211 [1,0,0,0,0,0|1,0,2]=4 559 B13R0.336 C=CCOCCOCCOCCCC 7a_100011215186_100015514636 [1,0,0,0,0,0|1,0,2]=4 560 B13R0.336 C=CCOCCOCCOCCNC 34a_200014138305_100015514636 [1,0,0,0,0,0|1,0,2]=4 561 B13R0.336 C=CCOCCOCCOCCOC 34a_100000037705_100000695917 [1,0,0,0,0,0|0,0,2]=3 562 B13R0.336 C=CCOCCOCCOCCOC 34a_100000065479_100011201679 [1,0,0,0,0,0|0,0,2]=3 563 B13R0.336 C=CCOCCOCCOCCOC 34a_100000688194_100015514636 [1,0,0,0,0,0|0,0,2]=3 564 B13R0.336 C=CCOCCOCCOCCOC 34a_200000210373_100013367474 [1,0,0,0,0,0|0,0,2]=3 565 B13R0.336 C=CCOCCOCCOCCOC 7a_100000037705_100000695917 [1,0,0,0,0,0|0,0,2]=3 566 B13R0.336 C=CCOCCOCCOCCOC 7a_100000065479_100000233755 [1,0,0,0,0,0|0,0,2]=3 567 B13R0.336 C=CCOCCOCCOCCOC 7a_100000688194_100015514636 [1,0,0,0,0,0|0,0,2]=3 568 B13R0.336 C=CCOCCOCCOCCSC 34a_100000065479_100000212216 [1,0,0,0,0,0|0,1,2]=4 569 B13R0.336 C=CCOCCOCCOCCSC 7a_100000065479_100000212216 [1,0,0,0,0,0|0,1,2]=4 570 B13R0.336 C=CCSCCOCCOCCOC 62a_100000210623_100013367474 [1,0,0,0,0,0|0,1,2]=4 571 B13R0.336 C=CCSCCOCCOCCOC 62a_100013367474_100000210623 [1,0,0,0,0,0|0,1,2]=4 572 B13R0.336 CC#CCNCCOCCOCCC 2230a_200011904461_100000748600 [1,0,0,0,0,0|2,0,1]=4 573 B13R0.336 CC#CCNCCOCCOCCC 34a_200011904461_100000748600 [1,0,0,0,0,0|2,0,1]=4 574 B13R0.336 CC#CCNCCOCCOCCO 2230a_100000685387_100000032323 [1,0,0,0,0,0|2,0,1]=4 575 B13R0.336 CC#CCNCCOCCOCCO 2230a_100011998139_100000748600 [1,0,0,0,0,0|2,0,1]=4 576 B13R0.336 CC#CCNCCOCCOCCO 34a_100000685387_100000032323 [1,0,0,0,0,0|2,0,1]=4 577 B13R0.336 CC#CCNCCOCCOCCO 34a_100011998139_100000748600 [1,0,0,0,0,0|2,0,1]=4 578 B13R0.336 CC#CCOCCCCOCCCC 34a_200000760531_100000748600 [1,0,0,0,0,0|2,0,1]=4 579 B13R0.336 CC#CCOCCCCOCCCC 7a_200000760531_100000748600 [1,0,0,0,0,0|2,0,1]=4 580 B13R0.336 CC#CCOCCOCCCCCC 34a_100000691444_100000748600 [1,0,0,0,0,0|2,0,1]=4 581 B13R0.336 CC#CCOCCOCCCCCC 7a_100000691444_100000748600 [1,0,0,0,0,0|2,0,1]=4 582 B13R0.336 CC#CCOCCOCCOCCBr 34a_100010132937_100000748600 [1,0,0,0,0,0|2,0,1]=4 583 B13R0.336 CC#CCOCCOCCOCCBr 7a_100010132937_100000748600 [1,0,0,0,0,0|2,0,1]=4 584 B13R0.336 CC#CCOCCOCCOCCCl 34a_100000032323_100000748600 [1,0,0,0,0,0|2,0,1]=4 585 B13R0.336 CC#CCOCCOCCOCCCl 7a_100000032323_100000748600 [1,0,0,0,0,0|2,0,1]=4 586 B13R0.336 CC#CCOCCOCCOCCN 34a_100011998139_100000748600 [1,0,0,0,0,0|2,0,1]=4 587 B13R0.336 CC#CCOCCOCCOCCO 34a_100000761923_100000032323 [1,0,0,0,0,0|1,0,1]=3 588 B13R0.336 CC#CCSCCOCCOCCO 62a_100000032323_100000748600 [1,0,0,0,0,0|1,1,1]=4 589 B13R0.336 CC#CCSCCOCCOCCO 62a_100000748600_100000032323 [1,0,0,0,0,0|1,1,1]=4 590 B13R0.336 CC/C=C\CCCCCOCCOC 34a_100016268722_100011201679 [1,0,0,0,0,0|2,0,1]=4 591 B13R0.336 CC/C=C\CCCCCOCCOC 7a_100016268722_100000233755 [1,0,0,0,0,0|2,0,1]=4 592 B13R0.336 CC/C=C\CCNCCOCCOC 2230a_100000745349_100015370543 [1,0,0,0,0,0|2,0,1]=4 593 B13R0.336 CC/C=C\CCNCCOCCOC 34a_100000745349_100015370543 [1,0,0,0,0,0|2,0,1]=4 594 B13R0.336 CC/C=C\CCOCCOCCCC 34a_100000210238_100015370543 [1,0,0,0,0,0|2,0,1]=4 595 B13R0.336 CC/C=C\CCOCCOCCCC 34a_100016288707_100000743108 [1,0,0,0,0,0|2,0,1]=4 596 B13R0.336 CC/C=C\CCOCCOCCCC 7a_100000210238_100015370543 [1,0,0,0,0,0|2,0,1]=4 597 B13R0.336 CC/C=C\CCOCCOCCCC 7a_100016288707_100000743108 [1,0,0,0,0,0|2,0,1]=4 598 B13R0.336 CC/C=C\CCOCCOCCNC 34a_100000228057_100015370543 [1,0,0,0,0,0|2,0,1]=4 599 B13R0.336 CC/C=C\CCOCCOCCOC 34a_100011215163_100015370543 [1,0,0,0,0,0|1,0,1]=3 600 B13R0.336 CC/C=C\CCOCCOCCOC 34a_100016288707_100000695917 [1,0,0,0,0,0|1,0,1]=3 601 B13R0.336 CC/C=C\CCOCCOCCOC 7a_100011215163_100015370543 [1,0,0,0,0,0|1,0,1]=3 602 B13R0.336 CC/C=C\CCOCCOCCOC 7a_100016288707_100000695917 [1,0,0,0,0,0|1,0,1]=3 603 B13R0.336 CC/C=C\CCSCCOCCOC 62a_100000695917_100015370543 [1,0,0,0,0,0|1,1,1]=4 604 B13R0.336 CC/C=C\CCSCCOCCOC 62a_100015370543_100000695917 [1,0,0,0,0,0|1,1,1]=4 605 B13R0.336 CC=C=CCCOCCOCCOC 34a_100011020354_100000695917 [1,0,0,0,0,0|1,0,2]=4 606 B13R0.336 CC=CCCCOCCOCCCC 34a_100020645299_100000743108 [1,0,0,0,0,0|2,0,1]=4 607 B13R0.336 CC=CCCCOCCOCCOC 34a_100020645299_100000695917 [1,0,0,0,0,0|1,0,1]=3 608 B13R0.336 CC=CCNCCOCCOCCC 2230a_200011904461_100000070051 [1,0,0,0,0,0|2,0,1]=4 609 B13R0.336 CC=CCNCCOCCOCCC 34a_200011904461_100000070051 [1,0,0,0,0,0|2,0,1]=4 610 B13R0.336 CC=CCNCCOCCOCCO 2230a_100011998139_100000070051 [1,0,0,0,0,0|2,0,1]=4 611 B13R0.336 CC=CCNCCOCCOCCO 34a_100011998139_100000070051 [1,0,0,0,0,0|2,0,1]=4 612 B13R0.336 CC=CCOCCCCOCCCC 34a_200000760531_100000070051 [1,0,0,0,0,0|2,0,1]=4 613 B13R0.336 CC=CCOCCCCOCCCC 7a_200000760531_100000070051 [1,0,0,0,0,0|2,0,1]=4 614 B13R0.336 CC=CCOCCOCCCCCC 34a_100000691444_100000070051 [1,0,0,0,0,0|2,0,1]=4 615 B13R0.336 CC=CCOCCOCCCCCC 7a_100000691444_100000070051 [1,0,0,0,0,0|2,0,1]=4 616 B13R0.336 CC=CCOCCOCCOCCBr 34a_100010132937_100000070051 [1,0,0,0,0,0|2,0,1]=4 617 B13R0.336 CC=CCOCCOCCOCCBr 7a_100010132937_100000070051 [1,0,0,0,0,0|2,0,1]=4 618 B13R0.336 CC=CCOCCOCCOCCCl 34a_100000032323_100000070051 [1,0,0,0,0,0|2,0,1]=4 619 B13R0.336 CC=CCOCCOCCOCCCl 7a_100000032323_100000070051 [1,0,0,0,0,0|2,0,1]=4 620 B13R0.336 CC=CCOCCOCCOCCN 34a_100011998139_100000070051 [1,0,0,0,0,0|2,0,1]=4 621 B13R0.336 CC=CCSCCOCCOCCO 62a_100000032323_100000070051 [1,0,0,0,0,0|1,1,1]=4 622 B13R0.336 CC=CCSCCOCCOCCO 62a_100000070051_100000032323 [1,0,0,0,0,0|1,1,1]=4 623 B13R0.336 CCC#CCCOCCOCCCC 34a_100000036655_100000743108 [1,0,0,0,0,0|2,0,1]=4 624 B13R0.336 CCC#CCCOCCOCCCC 7a_100000036655_100000743108 [1,0,0,0,0,0|2,0,1]=4 625 B13R0.336 CCC#CCCOCCOCCOC 34a_100000036655_100000695917 [1,0,0,0,0,0|1,0,1]=3 626 B13R0.336 CCC#CCCOCCOCCOC 7a_100000036655_100000695917 [1,0,0,0,0,0|1,0,1]=3 627 B13R0.336 CCC/C=C/COCCOCCCC 34a_100016278788_100000743108 [1,0,0,0,0,0|2,0,1]=4 628 B13R0.336 CCC/C=C/COCCOCCCC 7a_100016278788_100000743108 [1,0,0,0,0,0|2,0,1]=4 629 B13R0.336 CCC/C=C/COCCOCCOC 34a_100016278788_100000695917 [1,0,0,0,0,0|1,0,1]=3 630 B13R0.336 CCC/C=C/COCCOCCOC 7a_100016278788_100000695917 [1,0,0,0,0,0|1,0,1]=3 631 B13R0.336 CCCC#CCCOCCCCOC 34a_100000042726_100000755781 [1,0,0,0,0,0|2,0,1]=4 632 B13R0.336 CCCC#CCCOCCCCOC 7a_100000042726_100000730899 [1,0,0,0,0,0|2,0,1]=4 633 B13R0.336 CCCC#CCCOCCOCCC 34a_100000042726_100011215938 [1,0,0,0,0,0|2,0,1]=4 634 B13R0.336 CCCC#CCCOCCOCCC 7a_100000042726_100011215938 [1,0,0,0,0,0|2,0,1]=4 635 B13R0.336 CCCC#CCCOCCOCCO 34a_100000042726_100000692535 [1,0,0,0,0,0|2,0,1]=4 636 B13R0.336 CCCC#CCCOCCOCCO 7a_100000042726_100011215305 [1,0,0,0,0,0|2,0,1]=4 637 B13R0.336 CCCC#CCOCCOCCCC 34a_100000034806_100000743108 [1,0,0,0,0,0|2,0,1]=4 638 B13R0.336 CCCC#CCOCCOCCCC 7a_100000034806_100000743108 [1,0,0,0,0,0|2,0,1]=4 639 B13R0.336 CCCC#CCOCCOCCOC 34a_100000034806_100000695917 [1,0,0,0,0,0|1,0,1]=3 640 B13R0.336 CCCC#CCOCCOCCOC 7a_100000034806_100000695917 [1,0,0,0,0,0|1,0,1]=3 641 B13R0.336 CCCC/C=C/COCCCCOC 34a_200016272032_100000755781 [1,0,0,0,0,0|2,0,1]=4 642 B13R0.336 CCCC/C=C/COCCCCOC 7a_200016272032_100000730899 [1,0,0,0,0,0|2,0,1]=4 643 B13R0.336 CCCC/C=C/COCCOCCC 34a_200016272032_100011215938 [1,0,0,0,0,0|2,0,1]=4 644 B13R0.336 CCCC/C=C/COCCOCCC 7a_200016272032_100011215938 [1,0,0,0,0,0|2,0,1]=4 645 B13R0.336 CCCC/C=C/COCCOCCO 34a_200016272032_100000692535 [1,0,0,0,0,0|2,0,1]=4 646 B13R0.336 CCCC/C=C/COCCOCCO 7a_200016272032_100011215305 [1,0,0,0,0,0|2,0,1]=4 647 B13R0.336 CCCCC#CCCCOCCOC 34a_100000210237_200000047210 [1,0,0,0,0,0|2,0,1]=4 648 B13R0.336 CCCCC#CCOCCCCOC 34a_200000034558_100000755781 [1,0,0,0,0,0|2,0,1]=4 649 B13R0.336 CCCCC#CCOCCCCOC 7a_200000034558_100000730899 [1,0,0,0,0,0|2,0,1]=4 650 B13R0.336 CCCCC#CCOCCOCCC 34a_200000034558_100011215938 [1,0,0,0,0,0|2,0,1]=4 651 B13R0.336 CCCCC#CCOCCOCCC 7a_200000034558_100011215938 [1,0,0,0,0,0|2,0,1]=4 652 B13R0.336 CCCCC#CCOCCOCCO 34a_200000034558_100000692535 [1,0,0,0,0,0|2,0,1]=4 653 B13R0.336 CCCCC#CCOCCOCCO 7a_200000034558_100011215305 [1,0,0,0,0,0|2,0,1]=4 654 B13R0.336 CCCCC/C=C\CCOCCOC 34a_100016277358_100011201679 [1,0,0,0,0,0|2,0,1]=4 655 B13R0.336 CCCCC/C=C\CCOCCOC 7a_100016277358_100000233755 [1,0,0,0,0,0|2,0,1]=4 656 B13R0.336 CCCCCC#CCCOCCOC 34a_200000042877_100011201679 [1,0,0,0,0,0|2,0,1]=4 657 B13R0.336 CCCCCC#CCCOCCOC 7a_200000042877_100000233755 [1,0,0,0,0,0|2,0,1]=4 658 B13R0.336 CCCCCC/C=C/COCCOC 34a_200016276170_100011201679 [1,0,0,0,0,0|2,0,1]=4 659 B13R0.336 CCCCCC/C=C/COCCOC 7a_200016276170_100000233755 [1,0,0,0,0,0|2,0,1]=4 660 B13R0.336 CCCCCCC#CCOCCOC 34a_200000037284_100011201679 [1,0,0,0,0,0|2,0,1]=4 661 B13R0.336 CCCCCCC#CCOCCOC 7a_200000037284_100000233755 [1,0,0,0,0,0|2,0,1]=4 662 B13R0.336 CCCCCCCCCCCCOC 34a_100000210810_200000210301 [1,0,0,0,0,0|3,0,0]=4 663 B13R0.336 CCCCCCCCCCCCOC 34a_100138415774_100000759014 [1,0,0,0,0,0|3,0,0]=4 664 B13R0.336 CCCCCCCCCCCCOC 7a_100000210810_200000210301 [1,0,0,0,0,0|3,0,0]=4 665 B13R0.336 CCCCCCCCCCCCO[13CH3] 34a_100000210810_200025704644 [1,0,0,0,0,0|3,0,0]=4 666 B13R0.336 CCCCCCCCCCCCO[13CH3] 7a_100000210810_200025704644 [1,0,0,0,0,0|3,0,0]=4 667 B13R0.336 CCCCCCCCCCOCCC 34a_100000210258_100000210320 [1,0,0,0,0,0|3,0,0]=4 668 B13R0.336 CCCCCCCCCCOCCC 34a_100000210711_100000210303 [1,0,0,0,0,0|3,0,0]=4 669 B13R0.336 CCCCCCCCCCOCCC 7a_100000210711_100000210303 [1,0,0,0,0,0|3,0,0]=4 670 B13R0.336 CCCCCCCCCCOCCO 34a_100000210711_100000211926 [1,0,0,0,0,0|3,0,0]=4 671 B13R0.336 CCCCCCCCCCOCCO 7a_100000210711_100000211926 [1,0,0,0,0,0|3,0,0]=4 672 B13R0.336 CCCCCCCCCNCCOC 2230a_100000209980_100011214924 [1,0,0,0,0,0|3,0,0]=4 673 B13R0.336 CCCCCCCCCNCCOC 2230a_100000212291_100011201679 [1,0,0,0,0,0|3,0,0]=4 674 B13R0.336 CCCCCCCCCNCCOC 34a_100000212291_100011201679 [1,0,0,0,0,0|3,0,0]=4 675 B13R0.336 CCCCCCCCCOCCCC 34a_100000210227_100011214924 [1,0,0,0,0,0|3,0,0]=4 676 B13R0.336 CCCCCCCCCOCCCC 34a_100000210712_100000210210 [1,0,0,0,0,0|3,0,0]=4 677 B13R0.336 CCCCCCCCCOCCCC 7a_100000210227_100000210328 [1,0,0,0,0,0|3,0,0]=4 678 B13R0.336 CCCCCCCCCOCCCC 7a_100000210712_100000210211 [1,0,0,0,0,0|3,0,0]=4 679 B13R0.336 CCCCCCCCCOCCOC 34a_100000210237_100011214924 [1,0,0,0,0,0|2,0,0]=3 680 B13R0.336 CCCCCCCCCOCCOC 34a_100000210712_100011201679 [1,0,0,0,0,0|2,0,0]=3 681 B13R0.336 CCCCCCCCCOCCOC 7a_100000210712_100000233755 [1,0,0,0,0,0|2,0,0]=3 682 B13R0.336 CCCCCCCCCOCCON 34a_100000700252_100011214924 [1,0,0,0,0,0|3,0,0]=4 683 B13R0.336 CCCCCCCCCOCCSC 34a_100000210712_100000212216 [1,0,0,0,0,0|2,1,0]=4 684 B13R0.336 CCCCCCCCCOCCSC 34a_100000230434_100011214924 [1,0,0,0,0,0|2,1,0]=4 685 B13R0.336 CCCCCCCCCOCCSC 7a_100000210712_100000212216 [1,0,0,0,0,0|2,1,0]=4 686 B13R0.336 CCCCCCCCCOCCSC 7a_100000230434_100000210328 [1,0,0,0,0,0|2,1,0]=4 687 B13R0.336 CCCCCCCCCSCCOC 62a_100000233755_100000210670 [1,0,0,0,0,0|2,1,0]=4 688 B13R0.336 CCCCCCCNCCCCOC 2230a_100000229938_100000730899 [1,0,0,0,0,0|3,0,0]=4 689 B13R0.336 CCCCCCCNCCOCCC 2230a_100000229938_100011215938 [1,0,0,0,0,0|3,0,0]=4 690 B13R0.336 CCCCCCCNCCOCCC 2230a_100161115042_100000210681 [1,0,0,0,0,0|3,0,0]=4 691 B13R0.336 CCCCCCCNCCOCCC 34a_100161115042_100000210614 [1,0,0,0,0,0|3,0,0]=4 692 B13R0.336 CCCCCCCNCCOCCO 2230a_100000211614_100000210681 [1,0,0,0,0,0|3,0,0]=4 693 B13R0.336 CCCCCCCNCCOCCO 2230a_100000229938_100011215305 [1,0,0,0,0,0|3,0,0]=4 694 B13R0.336 CCCCCCCNCCOCCO 34a_100000211614_100000210614 [1,0,0,0,0,0|3,0,0]=4 695 B13R0.336 CCCCCCCNCOCCOC 2230a_100000229938_100000231047 [1,0,0,0,0,0|3,0,0]=4 696 B13R0.336 CCCCCCCOCCCCCC 34a_100000210259_100000210614 [1,0,0,0,0,0|3,0,0]=4 697 B13R0.336 CCCCCCCOCCCCCC 34a_100000210272_100000210314 [1,0,0,0,0,0|3,0,0]=4 698 B13R0.336 CCCCCCCOCCCCCC 7a_100000210259_100000210614 [1,0,0,0,0,0|3,0,0]=4 699 B13R0.336 CCCCCCCOCCCCCC 7a_100000210272_100000210314 [1,0,0,0,0,0|3,0,0]=4 700 B13R0.336 CCCCCCCOCCCCCO 34a_100000210272_100000746330 [1,0,0,0,0,0|3,0,0]=4 701 B13R0.336 CCCCCCCOCCCCCO 7a_100000210272_100000746330 [1,0,0,0,0,0|3,0,0]=4 702 B13R0.336 CCCCCCCOCCCCOC 34a_100000210272_100000755781 [1,0,0,0,0,0|2,0,0]=3 703 B13R0.336 CCCCCCCOCCCCOC 34a_100000740925_100000210614 [1,0,0,0,0,0|2,0,0]=3 704 B13R0.336 CCCCCCCOCCCCOC 7a_100000210272_100000730899 [1,0,0,0,0,0|2,0,0]=3 705 B13R0.336 CCCCCCCOCCCCSC 34a_100011217163_100000210614 [1,0,0,0,0,0|2,1,0]=4 706 B13R0.336 CCCCCCCOCCCCSC 7a_100011217163_100000210614 [1,0,0,0,0,0|2,1,0]=4 707 B13R0.336 CCCCCCCOCCOCCBr 34a_100000692535_100000210614 [1,0,0,0,0,0|3,0,0]=4 708 B13R0.336 CCCCCCCOCCOCCBr 7a_100000692535_100000210614 [1,0,0,0,0,0|3,0,0]=4 709 B13R0.336 CCCCCCCOCCOCCC 34a_100000210272_100011215938 [1,0,0,0,0,0|2,0,0]=3 710 B13R0.336 CCCCCCCOCCOCCC 34a_100000752267_100000210614 [1,0,0,0,0,0|2,0,0]=3 711 B13R0.336 CCCCCCCOCCOCCC 7a_100000210272_100011215938 [1,0,0,0,0,0|2,0,0]=3 712 B13R0.336 CCCCCCCOCCOCCC 7a_100000752267_100000210614 [1,0,0,0,0,0|2,0,0]=3 713 B13R0.336 CCCCCCCOCCOCCCl 34a_100011215305_100000210614 [1,0,0,0,0,0|3,0,0]=4 714 B13R0.336 CCCCCCCOCCOCCCl 7a_100011215305_100000210614 [1,0,0,0,0,0|3,0,0]=4 715 B13R0.336 CCCCCCCOCCOCCF 34a_200015357709_100000210614 [1,0,0,0,0,0|3,0,0]=4 716 B13R0.336 CCCCCCCOCCOCCF 7a_200015357709_100000210614 [1,0,0,0,0,0|3,0,0]=4 717 B13R0.336 CCCCCCCOCCOCCI 34a_100012149058_100000210614 [1,0,0,0,0,0|3,0,0]=4 718 B13R0.336 CCCCCCCOCCOCCI 7a_100012149058_100000210614 [1,0,0,0,0,0|3,0,0]=4 719 B13R0.336 CCCCCCCOCCOCCN 34a_100000211614_100000210614 [1,0,0,0,0,0|3,0,0]=4 720 B13R0.336 CCCCCCCOCCOCCO 34a_100000210272_100000692535 [1,0,0,0,0,0|2,0,0]=3 721 B13R0.336 CCCCCCCOCCOCCO 7a_100000210272_100011215305 [1,0,0,0,0,0|2,0,0]=3 722 B13R0.336 CCCCCCCOCCSCCC 34a_200000230433_100000210614 [1,0,0,0,0,0|2,1,0]=4 723 B13R0.336 CCCCCCCOCCSCCC 7a_200000230433_100000210614 [1,0,0,0,0,0|2,1,0]=4 724 B13R0.336 CCCCCCCOCOCCCC 34a_100000210272_100011995733 [1,0,0,0,0,0|3,0,0]=4 725 B13R0.336 CCCCCCCSCCCCOC 62a_100000210614_100000730899 [1,0,0,0,0,0|2,1,0]=4 726 B13R0.336 CCCCCCCSCCCCOC 62a_100000730899_100000210316 [1,0,0,0,0,0|2,1,0]=4 727 B13R0.336 CCCCCCCSCCOCCC 62a_100000210614_100011215938 [1,0,0,0,0,0|2,1,0]=4 728 B13R0.336 CCCCCCCSCCOCCC 62a_100011215938_100000210316 [1,0,0,0,0,0|2,1,0]=4 729 B13R0.336 CCCCCCCSCCOCCO 62a_100000210614_100011215305 [1,0,0,0,0,0|2,1,0]=4 730 B13R0.336 CCCCCCCSCCOCCO 62a_100011215305_100000210316 [1,0,0,0,0,0|2,1,0]=4 731 B13R0.336 CCCCCCCSCOCCOC 62a_100000210614_100000231047 [1,0,0,0,0,0|2,1,0]=4 732 B13R0.336 CCCCCCCSCOCCOC 62a_100000231047_100000210316 [1,0,0,0,0,0|2,1,0]=4 733 B13R0.336 CCCCCCNCCCCCOC 2230a_100000747528_100000210314 [1,0,0,0,0,0|3,0,0]=4 734 B13R0.336 CCCCCCNCCCCCOC 34a_100000747528_100000210314 [1,0,0,0,0,0|3,0,0]=4 735 B13R0.336 CCCCCCNCCOCCCC 2230a_100000210581_100000743108 [1,0,0,0,0,0|3,0,0]=4 736 B13R0.336 CCCCCCNCCOCCOC 2230a_100000210581_100000695917 [1,0,0,0,0,0|2,0,0]=3 737 B13R0.336 CCCCCCNCCOCCOC 2230a_100000745349_100000210314 [1,0,0,0,0,0|2,0,0]=3 738 B13R0.336 CCCCCCNCCOCCOC 34a_100000745349_100000210314 [1,0,0,0,0,0|2,0,0]=3 739 B13R0.336 CCCCCCOCCCCCNC 34a_100000722520_100000210314 [1,0,0,0,0,0|3,0,0]=4 740 B13R0.336 CCCCCCOCCOCCC#N 7a_100000691444_100000184422 [1,0,0,0,0,0|3,0,0]=4 741 B13R0.336 CCCCCCOCCOCCCC 34a_100000210238_100000210314 [1,0,0,0,0,0|2,0,0]=3 742 B13R0.336 CCCCCCOCCOCCCC 34a_100000210259_100000743108 [1,0,0,0,0,0|2,0,0]=3 743 B13R0.336 CCCCCCOCCOCCCC 34a_100000691444_100000210210 [1,0,0,0,0,0|2,0,0]=3 744 B13R0.336 CCCCCCOCCOCCCC 7a_100000210238_100000210314 [1,0,0,0,0,0|2,0,0]=3 745 B13R0.336 CCCCCCOCCOCCCC 7a_100000210259_100000743108 [1,0,0,0,0,0|2,0,0]=3 746 B13R0.336 CCCCCCOCCOCCCC 7a_100000691444_100000210211 [1,0,0,0,0,0|2,0,0]=3 747 B13R0.336 CCCCCCOCCOCCCF 34a_100000691444_100011934791 [1,0,0,0,0,0|3,0,0]=4 748 B13R0.336 CCCCCCOCCOCCCF 7a_100000691444_100011934791 [1,0,0,0,0,0|3,0,0]=4 749 B13R0.336 CCCCCCOCCOCCCO 34a_100000691444_100000230001 [1,0,0,0,0,0|3,0,0]=4 750 B13R0.336 CCCCCCOCCOCCCO 7a_100000691444_100011215043 [1,0,0,0,0,0|3,0,0]=4 751 B13R0.336 CCCCCCOCCOCCNC 34a_100000228057_100000210314 [1,0,0,0,0,0|2,0,0]=3 752 B13R0.336 CCCCCCOCCOCCOC 34a_100000032842_200000210301 [1,0,0,0,0,0|1,0,0]=2 753 B13R0.336 CCCCCCOCCOCCOC 34a_100000210259_100000695917 [1,0,0,0,0,0|1,0,0]=2 754 B13R0.336 CCCCCCOCCOCCOC 34a_100000691444_100011201679 [1,0,0,0,0,0|1,0,0]=2 755 B13R0.336 CCCCCCOCCOCCOC 34a_100011215163_100000210314 [1,0,0,0,0,0|1,0,0]=2 756 B13R0.336 CCCCCCOCCOCCOC 7a_100000032842_200000210301 [1,0,0,0,0,0|1,0,0]=2 757 B13R0.336 CCCCCCOCCOCCOC 7a_100000210259_100000695917 [1,0,0,0,0,0|1,0,0]=2 758 B13R0.336 CCCCCCOCCOCCOC 7a_100000691444_100000233755 [1,0,0,0,0,0|1,0,0]=2 759 B13R0.336 CCCCCCOCCOCCOC 7a_100011215163_100000210314 [1,0,0,0,0,0|1,0,0]=2 760 B13R0.336 CCCCCCOCCOCCO[13CH3] 34a_100000032842_200025704644 [1,0,0,0,0,0|1,0,0]=2 761 B13R0.336 CCCCCCOCCOCCO[13CH3] 7a_100000032842_200025704644 [1,0,0,0,0,0|1,0,0]=2 762 B13R0.336 CCCCCCOCCOCCSC 34a_100000691444_100000212216 [1,0,0,0,0,0|1,1,0]=3 763 B13R0.336 CCCCCCOCCOCCSC 7a_100000691444_100000212216 [1,0,0,0,0,0|1,1,0]=3 764 B13R0.336 CCCCCCOCCSCCCC 34a_200000230436_100000210314 [1,0,0,0,0,0|2,1,0]=4 765 B13R0.336 CCCCCCOCCSCCCC 7a_200000230436_100000210314 [1,0,0,0,0,0|2,1,0]=4 766 B13R0.336 CCCCCCSCCOCCCC 62a_100000210314_100000743108 [1,0,0,0,0,0|2,1,0]=4 767 B13R0.336 CCCCCCSCCOCCCC 62a_100000743108_100000210757 [1,0,0,0,0,0|2,1,0]=4 768 B13R0.336 CCCCCCSCCOCCOC 62a_100000210314_100000695917 [1,0,0,0,0,0|1,1,0]=3 769 B13R0.336 CCCCCCSCCOCCOC 62a_100000695917_100000210757 [1,0,0,0,0,0|1,1,0]=3 770 B13R0.336 CCCCCNCCCOCCOC 2230a_100000206027_100000210326 [1,0,0,0,0,0|3,0,0]=4 771 B13R0.336 CCCCCNCCCOCCOC 2230a_100000209983_100011216529 [1,0,0,0,0,0|3,0,0]=4 772 B13R0.336 CCCCCNCCCOCCOC 34a_100000206027_100000718602 [1,0,0,0,0,0|3,0,0]=4 773 B13R0.336 CCCCCOCCCOCCOC 34a_100000210253_100011216529 [1,0,0,0,0,0|3,0,0]=4 774 B13R0.336 CCCCCOCCCOCCOC 7a_100000210253_100011216529 [1,0,0,0,0,0|3,0,0]=4 775 B13R0.336 CCCCCSCCCOCCOC 62a_100000210326_100011216529 [1,0,0,0,0,0|3,0,0]=4 776 B13R0.336 CCCCCSCCCOCCOC 62a_100011216529_100000210326 [1,0,0,0,0,0|3,0,0]=4 777 B13R0.336 CCCCNCCCCOCCCC 34a_200011216965_100000210210 [1,0,0,0,0,0|3,0,0]=4 778 B13R0.336 CCCCNCCCCOCCOC 34a_200011216965_100011201679 [1,0,0,0,0,0|2,0,0]=3 779 B13R0.336 CCCCNCCCCOCCSC 34a_200011216965_100000212216 [1,0,0,0,0,0|2,1,0]=4 780 B13R0.336 CCCCNCCOCCOCCC 2230a_200011904461_100000210211 [1,0,0,0,0,0|2,0,0]=3 781 B13R0.336 CCCCNCCOCCOCCC 34a_200011904461_100000210210 [1,0,0,0,0,0|2,0,0]=3 782 B13R0.336 CCCCNCCOCCOCCO 2230a_100000102301_100000032323 [1,0,0,0,0,0|2,0,0]=3 783 B13R0.336 CCCCNCCOCCOCCO 2230a_100011998139_100000210211 [1,0,0,0,0,0|2,0,0]=3 784 B13R0.336 CCCCNCCOCCOCCO 34a_100011998139_100000210210 [1,0,0,0,0,0|2,0,0]=3 785 B13R0.336 CCCCNCCOCCOCCO 7a_106832991798_100000032323 [1,0,0,0,0,0|2,0,0]=3 786 B13R0.336 CCCCOCCCCCCCCO 34a_100000210227_100000033203 [1,0,0,0,0,0|3,0,0]=4 787 B13R0.336 CCCCOCCCCCCCCO 7a_100000210227_100000033203 [1,0,0,0,0,0|3,0,0]=4 788 B13R0.336 CCCCOCCCCOCCC#N 7a_200000760531_100000184422 [1,0,0,0,0,0|3,0,0]=4 789 B13R0.336 CCCCOCCCCOCCCC 34a_200000760531_100000210210 [1,0,0,0,0,0|2,0,0]=3 790 B13R0.336 CCCCOCCCCOCCCC 7a_200000760531_100000210211 [1,0,0,0,0,0|2,0,0]=3 791 B13R0.336 CCCCOCCCCOCCCF 34a_200000760531_100011934791 [1,0,0,0,0,0|3,0,0]=4 792 B13R0.336 CCCCOCCCCOCCCF 7a_200000760531_100011934791 [1,0,0,0,0,0|3,0,0]=4 793 B13R0.336 CCCCOCCCCOCCCO 34a_200000760531_100000230001 [1,0,0,0,0,0|3,0,0]=4 794 B13R0.336 CCCCOCCCCOCCCO 7a_200000760531_100011215043 [1,0,0,0,0,0|3,0,0]=4 795 B13R0.336 CCCCOCCCCOCCOC 34a_200000760531_100011201679 [1,0,0,0,0,0|1,0,0]=2 796 B13R0.336 CCCCOCCCCOCCOC 7a_200000760531_100000233755 [1,0,0,0,0,0|1,0,0]=2 797 B13R0.336 CCCCOCCCCOCCSC 34a_200000760531_100000212216 [1,0,0,0,0,0|1,1,0]=3 798 B13R0.336 CCCCOCCCCOCCSC 7a_200000760531_100000212216 [1,0,0,0,0,0|1,1,0]=3 799 B13R0.336 CCCCOCCCNCCCOC 2230a_200000211371_100000740836 [1,0,0,0,0,0|3,0,0]=4 800 B13R0.336 CCCCOCCCNCCCOC 34a_200000211371_100000740836 [1,0,0,0,0,0|3,0,0]=4 801 B13R0.336 CCCCOCCCOCCCOC 34a_200011215475_100000210210 [1,0,0,0,0,0|3,0,0]=4 802 B13R0.336 CCCCOCCCOCCCOC 34a_200011215613_100000740836 [1,0,0,0,0,0|3,0,0]=4 803 B13R0.336 CCCCOCCCOCCCOC 7a_200011215475_100000210211 [1,0,0,0,0,0|3,0,0]=4 804 B13R0.336 CCCCOCCCOCCCOC 7a_200011215613_100000740836 [1,0,0,0,0,0|3,0,0]=4 805 B13R0.336 CCCCOCCNCCCCCO 2230a_100000762737_100000743108 [1,0,0,0,0,0|3,0,0]=4 806 B13R0.336 CCCCOCCNCCCCCO 34a_100000762737_100000743108 [1,0,0,0,0,0|3,0,0]=4 807 B13R0.336 CCCCOCCNCCOCCC 2230a_100161115042_100000743108 [1,0,0,0,0,0|2,0,0]=3 808 B13R0.336 CCCCOCCNCCOCCC 34a_100161115042_100000743108 [1,0,0,0,0,0|2,0,0]=3 809 B13R0.336 CCCCOCCNCCOCCO 2230a_100000211614_100000743108 [1,0,0,0,0,0|2,0,0]=3 810 B13R0.336 CCCCOCCNCCOCCO 34a_100000211614_100000743108 [1,0,0,0,0,0|2,0,0]=3 811 B13R0.336 CCCCOCCNCCSCCC 2230a_100020603323_100000743108 [1,0,0,0,0,0|2,1,0]=4 812 B13R0.336 CCCCOCCNCCSCCO 2230a_100011219999_100000743108 [1,0,0,0,0,0|2,1,0]=4 813 B13R0.336 CCCCOCCOCCCCC#N 7a_100000210238_100000211819 [1,0,0,0,0,0|3,0,0]=4 814 B13R0.336 CCCCOCCOCCCCC=O 7a_100000210238_100000139335 [1,0,0,0,0,0|3,0,0]=4 815 B13R0.336 CCCCOCCOCCCCCBr 34a_100000746331_100000743108 [1,0,0,0,0,0|3,0,0]=4 816 B13R0.336 CCCCOCCOCCCCCBr 7a_100000746331_100000743108 [1,0,0,0,0,0|3,0,0]=4 817 B13R0.336 CCCCOCCOCCCCCCl 34a_100000746330_100000743108 [1,0,0,0,0,0|3,0,0]=4 818 B13R0.336 CCCCOCCOCCCCCCl 7a_100000746330_100000743108 [1,0,0,0,0,0|3,0,0]=4 819 B13R0.336 CCCCOCCOCCCCCF 34a_100000210238_100000729378 [1,0,0,0,0,0|3,0,0]=4 820 B13R0.336 CCCCOCCOCCCCCF 7a_100000210238_100000729378 [1,0,0,0,0,0|3,0,0]=4 821 B13R0.336 CCCCOCCOCCCCCI 34a_200012148887_100000743108 [1,0,0,0,0,0|3,0,0]=4 822 B13R0.336 CCCCOCCOCCCCCI 7a_200012148887_100000743108 [1,0,0,0,0,0|3,0,0]=4 823 B13R0.336 CCCCOCCOCCCCCN 34a_100000762737_100000743108 [1,0,0,0,0,0|3,0,0]=4 824 B13R0.336 CCCCOCCOCCCCCO 34a_100000210238_100000746330 [1,0,0,0,0,0|2,0,0]=3 825 B13R0.336 CCCCOCCOCCCCCO 7a_100000210238_100000746330 [1,0,0,0,0,0|2,0,0]=3 826 B13R0.336 CCCCOCCOCCCCOC 34a_100000210238_100000755781 [1,0,0,0,0,0|1,0,0]=2 827 B13R0.336 CCCCOCCOCCCCOC 34a_100000740925_100000743108 [1,0,0,0,0,0|1,0,0]=2 828 B13R0.336 CCCCOCCOCCCCOC 7a_100000210238_100000730899 [1,0,0,0,0,0|1,0,0]=2 829 B13R0.336 CCCCOCCOCCCCSC 34a_100011217163_100000743108 [1,0,0,0,0,0|1,1,0]=3 830 B13R0.336 CCCCOCCOCCCCSC 7a_100011217163_100000743108 [1,0,0,0,0,0|1,1,0]=3 831 B13R0.336 CCCCOCCOCCCOCC 34a_100000210238_100012232248 [1,0,0,0,0,0|3,0,0]=4 832 B13R0.336 CCCCOCCOCCCOCC 34a_100000757476_100000743108 [1,0,0,0,0,0|3,0,0]=4 833 B13R0.336 CCCCOCCOCCCOCC 7a_100000210238_100012232248 [1,0,0,0,0,0|3,0,0]=4 834 B13R0.336 CCCCOCCOCCCOCC 7a_100000757476_100000743108 [1,0,0,0,0,0|3,0,0]=4 835 B13R0.336 CCCCOCCOCCCSCC 34a_100011216438_100000743108 [1,0,0,0,0,0|3,0,0]=4 836 B13R0.336 CCCCOCCOCCCSCC 7a_100011216438_100000743108 [1,0,0,0,0,0|3,0,0]=4 837 B13R0.336 CCCCOCCOCCOCC#N 7a_100000210238_200000047693 [1,0,0,0,0,0|2,0,1]=4 838 B13R0.336 CCCCOCCOCCOCC#N 7a_100011215186_100011215382 [1,0,0,0,0,0|2,0,1]=4 839 B13R0.336 CCCCOCCOCCOCC=O 34a_100011215186_200009817547 [1,0,0,0,0,0|1,0,2]=4 840 B13R0.336 CCCCOCCOCCOCC=O 7a_100011215186_200015260668 [1,0,0,0,0,0|1,0,2]=4 841 B13R0.336 CCCCOCCOCCOCCBr 34a_100000692535_100000743108 [1,0,0,0,0,0|2,0,0]=3 842 B13R0.336 CCCCOCCOCCOCCBr 34a_100010132937_100000210210 [1,0,0,0,0,0|2,0,0]=3 843 B13R0.336 CCCCOCCOCCOCCBr 7a_100000692535_100000743108 [1,0,0,0,0,0|2,0,0]=3 844 B13R0.336 CCCCOCCOCCOCCBr 7a_100010132937_100000210211 [1,0,0,0,0,0|2,0,0]=3 845 B13R0.336 CCCCOCCOCCOCCC 34a_100000210238_100011215938 [1,0,0,0,0,0|1,0,0]=2 846 B13R0.336 CCCCOCCOCCOCCC 34a_100000752267_100000743108 [1,0,0,0,0,0|1,0,0]=2 847 B13R0.336 CCCCOCCOCCOCCC 34a_100011215186_100000210303 [1,0,0,0,0,0|1,0,0]=2 848 B13R0.336 CCCCOCCOCCOCCC 7a_100000210238_100011215938 [1,0,0,0,0,0|1,0,0]=2 849 B13R0.336 CCCCOCCOCCOCCC 7a_100000752267_100000743108 [1,0,0,0,0,0|1,0,0]=2 850 B13R0.336 CCCCOCCOCCOCCC 7a_100011215186_100000210303 [1,0,0,0,0,0|1,0,0]=2 851 B13R0.336 CCCCOCCOCCOCCCl 34a_100000032323_100000210210 [1,0,0,0,0,0|2,0,0]=3 852 B13R0.336 CCCCOCCOCCOCCCl 34a_100011215305_100000743108 [1,0,0,0,0,0|2,0,0]=3 853 B13R0.336 CCCCOCCOCCOCCCl 7a_100000032323_100000210211 [1,0,0,0,0,0|2,0,0]=3 854 B13R0.336 CCCCOCCOCCOCCCl 7a_100011215305_100000743108 [1,0,0,0,0,0|2,0,0]=3 855 B13R0.336 CCCCOCCOCCOCCF 34a_100011215186_100011217306 [1,0,0,0,0,0|2,0,0]=3 856 B13R0.336 CCCCOCCOCCOCCF 34a_200015357709_100000743108 [1,0,0,0,0,0|2,0,0]=3 857 B13R0.336 CCCCOCCOCCOCCF 7a_100011215186_100011217306 [1,0,0,0,0,0|2,0,0]=3 858 B13R0.336 CCCCOCCOCCOCCF 7a_200015357709_100000743108 [1,0,0,0,0,0|2,0,0]=3 859 B13R0.336 CCCCOCCOCCOCCI 34a_100012149058_100000743108 [1,0,0,0,0,0|2,0,0]=3 860 B13R0.336 CCCCOCCOCCOCCI 7a_100012149058_100000743108 [1,0,0,0,0,0|2,0,0]=3 861 B13R0.336 CCCCOCCOCCOCCN 34a_100000211614_100000743108 [1,0,0,0,0,0|2,0,0]=3 862 B13R0.336 CCCCOCCOCCOCCN 34a_100011998139_100000210210 [1,0,0,0,0,0|2,0,0]=3 863 B13R0.336 CCCCOCCOCCOCCO 34a_100000210227_100000032323 [1,0,0,0,0,0|1,0,0]=2 864 B13R0.336 CCCCOCCOCCOCCO 34a_100000210238_100000692535 [1,0,0,0,0,0|1,0,0]=2 865 B13R0.336 CCCCOCCOCCOCCO 34a_100011215186_100000211926 [1,0,0,0,0,0|1,0,0]=2 866 B13R0.336 CCCCOCCOCCOCCO 7a_100000210227_100000032323 [1,0,0,0,0,0|1,0,0]=2 867 B13R0.336 CCCCOCCOCCOCCO 7a_100000210238_100011215305 [1,0,0,0,0,0|1,0,0]=2 868 B13R0.336 CCCCOCCOCCOCCO 7a_100011215186_100000211926 [1,0,0,0,0,0|1,0,0]=2 869 B13R0.336 CCCCOCCOCCOCSC 34a_100011215186_100011218213 [1,0,0,0,0,0|1,1,0]=3 870 B13R0.336 CCCCOCCOCCSCCC 34a_200000230433_100000743108 [1,0,0,0,0,0|1,1,0]=3 871 B13R0.336 CCCCOCCOCCSCCC 7a_200000230433_100000743108 [1,0,0,0,0,0|1,1,0]=3 872 B13R0.336 CCCCOCCOCOCCCC 34a_100000210238_100011995733 [1,0,0,0,0,0|2,0,0]=3 873 B13R0.336 CCCCOCCSCCCCCO 62a_100000743108_100000746330 [1,0,0,0,0,0|2,1,0]=4 874 B13R0.336 CCCCOCCSCCCCCO 62a_100000746330_100000743108 [1,0,0,0,0,0|2,1,0]=4 875 B13R0.336 CCCCOCCSCCCCOC 62a_100000730899_100000743108 [1,0,0,0,0,0|1,1,0]=3 876 B13R0.336 CCCCOCCSCCCCOC 62a_100000743108_100000730899 [1,0,0,0,0,0|1,1,0]=3 877 B13R0.336 CCCCOCCSCCOCCC 62a_100000743108_100011215938 [1,0,0,0,0,0|1,1,0]=3 878 B13R0.336 CCCCOCCSCCOCCC 62a_100011215938_100000743108 [1,0,0,0,0,0|1,1,0]=3 879 B13R0.336 CCCCOCCSCCOCCO 62a_100000743108_100011215305 [1,0,0,0,0,0|1,1,0]=3 880 B13R0.336 CCCCOCCSCCOCCO 62a_100011215305_100000743108 [1,0,0,0,0,0|1,1,0]=3 881 B13R0.336 CCCCOCCSCOCCCC 62a_100000743108_100011995733 [1,0,0,0,0,0|2,1,0]=4 882 B13R0.336 CCCCOCCSCOCCCC 62a_100011995733_100000743108 [1,0,0,0,0,0|2,1,0]=4 883 B13R0.336 CCCCOCCSCOCCOC 62a_100000231047_100000743108 [1,0,0,0,0,0|1,1,0]=3 884 B13R0.336 CCCCOCCSCOCCOC 62a_100000743108_100000231047 [1,0,0,0,0,0|1,1,0]=3 885 B13R0.336 CCCCOCNCCCCCOC 2230a_100000747528_100011995733 [1,0,0,0,0,0|3,0,0]=4 886 B13R0.336 CCCCOCNCCCCCOC 34a_100000747528_100011995733 [1,0,0,0,0,0|3,0,0]=4 887 B13R0.336 CCCCOCNCCCOCCC 2230a_100011217757_100011995733 [1,0,0,0,0,0|3,0,0]=4 888 B13R0.336 CCCCOCNCCCOCCC 34a_100011217757_100011995733 [1,0,0,0,0,0|3,0,0]=4 889 B13R0.336 CCCCOCNCCOCCOC 2230a_100000745349_100011995733 [1,0,0,0,0,0|2,0,0]=3 890 B13R0.336 CCCCOCNCCOCCOC 34a_100000745349_100011995733 [1,0,0,0,0,0|2,0,0]=3 891 B13R0.336 CCCCOCOCCCCCNC 34a_100000722520_100011995733 [1,0,0,0,0,0|3,0,0]=4 892 B13R0.336 CCCCOCOCCOCCNC 34a_100000228057_100011995733 [1,0,0,0,0,0|2,0,0]=3 893 B13R0.336 CCCCOCOCCOCCOC 34a_100011215163_100011995733 [1,0,0,0,0,0|1,0,0]=2 894 B13R0.336 CCCCOCOCCSCCCC 34a_200000230436_100011995733 [1,0,0,0,0,0|2,1,0]=4 895 B13R0.336 CCCCOCSCCOCCOC 62a_100000695917_100011995733 [1,0,0,0,0,0|1,1,0]=3 896 B13R0.336 CCCCOCSCCOCCOC 62a_100011995733_100000695917 [1,0,0,0,0,0|1,1,0]=3 897 B13R0.336 CCCCSCCNCCCCOC 2230a_100025743550_100000730899 [1,0,0,0,0,0|2,1,0]=4 898 B13R0.336 CCCCSCCNCCOCCC 2230a_100025743550_100011215938 [1,0,0,0,0,0|2,1,0]=4 899 B13R0.336 CCCCSCCNCCOCCO 2230a_100025743550_100011215305 [1,0,0,0,0,0|2,1,0]=4 900 B13R0.336 CCCCSCCNCOCCOC 2230a_100025743550_100000231047 [1,0,0,0,0,0|2,1,0]=4 901 B13R0.336 CCCCSCCOCCCCCO 34a_200000230436_100000746330 [1,0,0,0,0,0|2,1,0]=4 902 B13R0.336 CCCCSCCOCCCCCO 7a_200000230436_100000746330 [1,0,0,0,0,0|2,1,0]=4 903 B13R0.336 CCCCSCCOCCCCOC 34a_200000230436_100000755781 [1,0,0,0,0,0|1,1,0]=3 904 B13R0.336 CCCCSCCOCCCCOC 7a_200000230436_100000730899 [1,0,0,0,0,0|1,1,0]=3 905 B13R0.336 CCCCSCCOCCOCCC 34a_200000230436_100011215938 [1,0,0,0,0,0|1,1,0]=3 906 B13R0.336 CCCCSCCOCCOCCC 7a_200000230436_100011215938 [1,0,0,0,0,0|1,1,0]=3 907 B13R0.336 CCCCSCCOCCOCCO 34a_200000230436_100000692535 [1,0,0,0,0,0|1,1,0]=3 908 B13R0.336 CCCCSCCOCCOCCO 62a_100000032323_100000210210 [1,0,0,0,0,0|1,1,0]=3 909 B13R0.336 CCCCSCCOCCOCCO 62a_100000210211_100000032323 [1,0,0,0,0,0|1,1,0]=3 910 B13R0.336 CCCCSCCOCCOCCO 7a_200000230436_100011215305 [1,0,0,0,0,0|1,1,0]=3 911 B13R0.336 CCCNCCCOCCOCCO 2230a_100011996194_100000210303 [1,0,0,0,0,0|3,0,0]=4 912 B13R0.336 CCCNCCCOCCOCCO 34a_100011996194_100000210303 [1,0,0,0,0,0|3,0,0]=4 913 B13R0.336 CCCNCCOCCOCCOC 2230a_100012028300_100000210303 [1,0,0,0,0,0|1,0,0]=2 914 B13R0.336 CCCNCCOCCOCCOC 34a_100012028300_100000210303 [1,0,0,0,0,0|1,0,0]=2 915 B13R0.336 CCCOCCCNCCCCOC 2230a_100011217757_100000730899 [1,0,0,0,0,0|3,0,0]=4 916 B13R0.336 CCCOCCCNCCCCOC 34a_100011217757_100000755781 [1,0,0,0,0,0|3,0,0]=4 917 B13R0.336 CCCOCCCNCOCCOC 2230a_100011217757_100000231047 [1,0,0,0,0,0|2,0,0]=3 918 B13R0.336 CCCOCCNCCCCCOC 2230a_100000747528_100011215938 [1,0,0,0,0,0|2,0,0]=3 919 B13R0.336 CCCOCCNCCCCCOC 34a_100000747528_100011215938 [1,0,0,0,0,0|2,0,0]=3 920 B13R0.336 CCCOCCNCCOCCOC 2230a_100000745349_100011215938 [1,0,0,0,0,0|1,0,0]=2 921 B13R0.336 CCCOCCNCCOCCOC 2230a_100161115042_100000695917 [1,0,0,0,0,0|1,0,0]=2 922 B13R0.336 CCCOCCNCCOCCOC 34a_100000745349_100011215938 [1,0,0,0,0,0|1,0,0]=2 923 B13R0.336 CCCOCCNCCOCCOC 34a_100161115042_100000695917 [1,0,0,0,0,0|1,0,0]=2 924 B13R0.336 CCCOCCOCCCCCC#N 7a_100000752267_100009813376 [1,0,0,0,0,0|3,0,0]=4 925 B13R0.336 CCCOCCOCCCCCC=O 7a_100000752267_100000139337 [1,0,0,0,0,0|3,0,0]=4 926 B13R0.336 CCCOCCOCCCCCCBr 34a_100011215345_100011215938 [1,0,0,0,0,0|3,0,0]=4 927 B13R0.336 CCCOCCOCCCCCCBr 7a_100011215345_100011215938 [1,0,0,0,0,0|3,0,0]=4 928 B13R0.336 CCCOCCOCCCCCCCl 34a_100000766143_100011215938 [1,0,0,0,0,0|3,0,0]=4 929 B13R0.336 CCCOCCOCCCCCCCl 7a_100000766143_100011215938 [1,0,0,0,0,0|3,0,0]=4 930 B13R0.336 CCCOCCOCCCCCCF 34a_100000732779_100011215938 [1,0,0,0,0,0|3,0,0]=4 931 B13R0.336 CCCOCCOCCCCCCF 34a_100000752267_100015922095 [1,0,0,0,0,0|3,0,0]=4 932 B13R0.336 CCCOCCOCCCCCCF 7a_100000732779_100011215938 [1,0,0,0,0,0|3,0,0]=4 933 B13R0.336 CCCOCCOCCCCCCF 7a_100000752267_100015922095 [1,0,0,0,0,0|3,0,0]=4 934 B13R0.336 CCCOCCOCCCCCCN 34a_100000686447_100011215938 [1,0,0,0,0,0|3,0,0]=4 935 B13R0.336 CCCOCCOCCCCCCO 34a_100000752267_100000766143 [1,0,0,0,0,0|3,0,0]=4 936 B13R0.336 CCCOCCOCCCCCCO 7a_100000752267_100000766143 [1,0,0,0,0,0|3,0,0]=4 937 B13R0.336 CCCOCCOCCCCCNC 34a_100000722520_100011215938 [1,0,0,0,0,0|2,0,0]=3 938 B13R0.336 CCCOCCOCCNCCC#N 2230a_200011904461_100011215226 [1,0,0,0,0,0|3,0,0]=4 939 B13R0.336 CCCOCCOCCNCCCF 2230a_200011904461_100011934791 [1,0,0,0,0,0|3,0,0]=4 940 B13R0.336 CCCOCCOCCNCCCF 34a_200011904461_100011934791 [1,0,0,0,0,0|3,0,0]=4 941 B13R0.336 CCCOCCOCCNCCCO 2230a_200011904461_100000230001 [1,0,0,0,0,0|3,0,0]=4 942 B13R0.336 CCCOCCOCCNCCCO 34a_200011904461_100000230001 [1,0,0,0,0,0|3,0,0]=4 943 B13R0.336 CCCOCCOCCNCCOC 2230a_200011904461_100011201679 [1,0,0,0,0,0|1,0,0]=2 944 B13R0.336 CCCOCCOCCNCCOC 34a_200011904461_100011201679 [1,0,0,0,0,0|1,0,0]=2 945 B13R0.336 CCCOCCOCCNCCSC 2230a_200011904461_100000751147 [1,0,0,0,0,0|1,1,0]=3 946 B13R0.336 CCCOCCOCCNCCSC 34a_200011904461_100000212216 [1,0,0,0,0,0|1,1,0]=3 947 B13R0.336 CCCOCCOCCOCCCN 34a_100011996194_100000210303 [1,0,0,0,0,0|2,0,0]=3 948 B13R0.336 CCCOCCOCCOCCNC 34a_100000228057_100011215938 [1,0,0,0,0,0|1,0,0]=2 949 B13R0.336 CCCOCCOCCOCCNC 34a_200014138305_100000210303 [1,0,0,0,0,0|1,0,0]=2 950 B13R0.336 CCCOCCOCCOCCOC 34a_100000210258_100013367474 [1,0,0,0,0,0|0,0,0]=1 951 B13R0.336 CCCOCCOCCOCCOC 34a_100000688194_100000210303 [1,0,0,0,0,0|0,0,0]=1 952 B13R0.336 CCCOCCOCCOCCOC 34a_100000752267_100000695917 [1,0,0,0,0,0|0,0,0]=1 953 B13R0.336 CCCOCCOCCOCCOC 34a_100011215163_100011215938 [1,0,0,0,0,0|0,0,0]=1 954 B13R0.336 CCCOCCOCCOCCOC 7a_100000688194_100000210303 [1,0,0,0,0,0|0,0,0]=1 955 B13R0.336 CCCOCCOCCOCCOC 7a_100000752267_100000695917 [1,0,0,0,0,0|0,0,0]=1 956 B13R0.336 CCCOCCOCCOCCOC 7a_100011215163_100011215938 [1,0,0,0,0,0|0,0,0]=1 957 B13R0.336 CCCOCCSCCOCCOC 62a_100000695917_100011215938 [1,0,0,0,0,0|0,1,0]=2 958 B13R0.336 CCCOCCSCCOCCOC 62a_100011215938_100000695917 [1,0,0,0,0,0|0,1,0]=2 959 B13R0.336 CCCSCCNCCOCCOC 2230a_100020603323_100000695917 [1,0,0,0,0,0|1,1,0]=3 960 B13R0.336 CCCSCCOCCOCCOC 34a_200000230433_100000695917 [1,0,0,0,0,0|0,1,0]=2 961 B13R0.336 CCCSCCOCCOCCOC 62a_100000210303_100013367474 [1,0,0,0,0,0|0,1,0]=2 962 B13R0.336 CCCSCCOCCOCCOC 62a_100013367474_100000210303 [1,0,0,0,0,0|0,1,0]=2 963 B13R0.336 CCCSCCOCCOCCOC 7a_200000230433_100000695917 [1,0,0,0,0,0|0,1,0]=2 964 B13R0.336 CCOCCCNCCOCCOC 2230a_100000210961_100000695917 [1,0,0,0,0,0|3,0,0]=4 965 B13R0.336 CCOCCCNCCOCCOC 2230a_100000745349_100012232248 [1,0,0,0,0,0|3,0,0]=4 966 B13R0.336 CCOCCCNCCOCCOC 34a_100000210961_100000695917 [1,0,0,0,0,0|3,0,0]=4 967 B13R0.336 CCOCCCNCCOCCOC 34a_100000745349_100012232248 [1,0,0,0,0,0|3,0,0]=4 968 B13R0.336 CCOCCCOCCOCCNC 34a_100000228057_100012232248 [1,0,0,0,0,0|3,0,0]=4 969 B13R0.336 CCOCCCOCCOCCOC 34a_100000757476_100000695917 [1,0,0,0,0,0|2,0,0]=3 970 B13R0.336 CCOCCCOCCOCCOC 34a_100011215163_100012232248 [1,0,0,0,0,0|2,0,0]=3 971 B13R0.336 CCOCCCOCCOCCOC 7a_100000757476_100000695917 [1,0,0,0,0,0|2,0,0]=3 972 B13R0.336 CCOCCCOCCOCCOC 7a_100011215163_100012232248 [1,0,0,0,0,0|2,0,0]=3 973 B13R0.336 CCOCCCSCCOCCOC 62a_100000695917_100012232248 [1,0,0,0,0,0|2,1,0]=4 974 B13R0.336 CCOCCCSCCOCCOC 62a_100012232248_100000695917 [1,0,0,0,0,0|2,1,0]=4 975 B13R0.336 CCOCSCCOCCOCCO 62a_100000032323_100000739092 [1,0,0,0,0,0|2,1,0]=4 976 B13R0.336 CCOCSCCOCCOCCO 62a_100000739092_100000032323 [1,0,0,0,0,0|2,1,0]=4 977 B13R0.336 CCSCCCOCCOCCOC 34a_100011216438_100000695917 [1,0,0,0,0,0|2,0,0]=3 978 B13R0.336 CCSCCCOCCOCCOC 7a_100011216438_100000695917 [1,0,0,0,0,0|2,0,0]=3 979 B13R0.336 CNCCCCCOCCCCCO 34a_100000722520_100000746330 [1,0,0,0,0,0|3,0,0]=4 980 B13R0.336 CNCCCCCOCCCCOC 34a_100000722520_100000755781 [1,0,0,0,0,0|2,0,0]=3 981 B13R0.336 CNCCCCCOCCOCCO 34a_100000722520_100000692535 [1,0,0,0,0,0|2,0,0]=3 982 B13R0.336 CNCCCOCCCOCCOC 34a_100000213112_100011216529 [1,0,0,0,0,0|3,0,0]=4 983 B13R0.336 CNCCOCCOCCCCCF 34a_100000228057_100000729378 [1,0,0,0,0,0|3,0,0]=4 984 B13R0.336 CNCCOCCOCCCCCO 34a_100000228057_100000746330 [1,0,0,0,0,0|2,0,0]=3 985 B13R0.336 CNCCOCCOCCCCOC 34a_100000228057_100000755781 [1,0,0,0,0,0|1,0,0]=2 986 B13R0.336 CNCCOCCOCCOCC=O 34a_200014138305_200009817547 [1,0,0,0,0,0|1,0,2]=4 987 B13R0.336 CNCCOCCOCCOCCF 34a_200014138305_100011217306 [1,0,0,0,0,0|2,0,0]=3 988 B13R0.336 CNCCOCCOCCOCCO 2230a_103437854208_200000210301 [1,0,0,0,0,0|1,0,0]=2 989 B13R0.336 CNCCOCCOCCOCCO 2230a_106832991635_100010166562 [1,0,0,0,0,0|1,0,0]=2 990 B13R0.336 CNCCOCCOCCOCCO 34a_100000228057_100000692535 [1,0,0,0,0,0|1,0,0]=2 991 B13R0.336 CNCCOCCOCCOCCO 34a_100102657272_100010166562 [1,0,0,0,0,0|1,0,0]=2 992 B13R0.336 CNCCOCCOCCOCCO 34a_103437854208_200000210301 [1,0,0,0,0,0|1,0,0]=2 993 B13R0.336 CNCCOCCOCCOCCO 34a_200014138305_100000211926 [1,0,0,0,0,0|1,0,0]=2 994 B13R0.336 CNCCOCCOCCOCCO 7a_106832991635_100010166562 [1,0,0,0,0,0|1,0,0]=2 995 B13R0.336 CNCCOCCOCCOCSC 34a_200014138305_100011218213 [1,0,0,0,0,0|1,1,0]=3 996 B13R0.336 COCCCCCCCCCCCO 34a_100138415774_100009812471 [1,0,0,0,0,0|3,0,0]=4 997 B13R0.336 COCCCCCCNCCCOC 34a_100150723488_100011998445 [1,0,0,0,0,0|3,0,0]=4 998 B13R0.336 COCCCCCCOCCCOC 34a_100000740835_100011998445 [1,0,0,0,0,0|3,0,0]=4 999 B13R0.336 COCCCCCCOCCCOC 34a_200012092642_100000740836 [1,0,0,0,0,0|3,0,0]=4 1000 B13R0.336 COCCCCCCOCCCOC 7a_200012092642_100000740836 [1,0,0,0,0,0|3,0,0]=4 1001 B13R0.336 COCCCCCCSCCCOC 62a_100000709357_100011998445 [1,0,0,0,0,0|3,0,0]=4 1002 B13R0.336 COCCCCCCSCCCOC 62a_100011998445_100000709357 [1,0,0,0,0,0|3,0,0]=4 1003 B13R0.336 COCCCCCNCCCCCO 2230a_100000747528_100000746330 [1,0,0,0,0,0|3,0,0]=4 1004 B13R0.336 COCCCCCNCCCCCO 34a_100000747528_100000746330 [1,0,0,0,0,0|3,0,0]=4 1005 B13R0.336 COCCCCCNCCCCOC 2230a_100000747528_100000730899 [1,0,0,0,0,0|2,0,0]=3 1006 B13R0.336 COCCCCCNCCCCOC 34a_100000747528_100000755781 [1,0,0,0,0,0|2,0,0]=3 1007 B13R0.336 COCCCCCNCCOCCO 2230a_100000747528_100011215305 [1,0,0,0,0,0|2,0,0]=3 1008 B13R0.336 COCCCCCNCCOCCO 34a_100000747528_100000692535 [1,0,0,0,0,0|2,0,0]=3 1009 B13R0.336 COCCCCCNCOCCOC 2230a_100000747528_100000231047 [1,0,0,0,0,0|2,0,0]=3 1010 B13R0.336 COCCCCNCCOCCOC 2230a_100000745349_100000730899 [1,0,0,0,0,0|1,0,0]=2 1011 B13R0.336 COCCCCNCCOCCOC 34a_100000745349_100000755781 [1,0,0,0,0,0|1,0,0]=2 1012 B13R0.336 COCCCCOCCCCCCBr 34a_100011215345_100000755781 [1,0,0,0,0,0|3,0,0]=4 1013 B13R0.336 COCCCCOCCCCCCBr 7a_100011215345_100000730899 [1,0,0,0,0,0|3,0,0]=4 1014 B13R0.336 COCCCCOCCCCCCCl 34a_100000766143_100000755781 [1,0,0,0,0,0|3,0,0]=4 1015 B13R0.336 COCCCCOCCCCCCCl 7a_100000766143_100000730899 [1,0,0,0,0,0|3,0,0]=4 1016 B13R0.336 COCCCCOCCCCCCF 34a_100000732779_100000755781 [1,0,0,0,0,0|3,0,0]=4 1017 B13R0.336 COCCCCOCCCCCCF 34a_100000740925_100015922095 [1,0,0,0,0,0|3,0,0]=4 1018 B13R0.336 COCCCCOCCCCCCF 7a_100000732779_100000730899 [1,0,0,0,0,0|3,0,0]=4 1019 B13R0.336 COCCCCOCCCCCCN 34a_100000686447_100000755781 [1,0,0,0,0,0|3,0,0]=4 1020 B13R0.336 COCCCCOCCCCCCO 34a_100000740925_100000766143 [1,0,0,0,0,0|3,0,0]=4 1021 B13R0.336 COCCCCOCCOCCOC 34a_100000740925_100000695917 [1,0,0,0,0,0|0,0,0]=1 1022 B13R0.336 COCCCCOCCOCCOC 34a_100011215163_100000755781 [1,0,0,0,0,0|0,0,0]=1 1023 B13R0.336 COCCCCOCCOCCOC 7a_100011215163_100000730899 [1,0,0,0,0,0|0,0,0]=1 1024 B13R0.336 COCCCCSCCOCCOC 62a_100000695917_100000730899 [1,0,0,0,0,0|0,1,0]=2 1025 B13R0.336 COCCCCSCCOCCOC 62a_100000730899_100000695917 [1,0,0,0,0,0|0,1,0]=2 1026 B13R0.336 COCCCNCCCOCCOC 2230a_100000206027_100000740836 [1,0,0,0,0,0|2,0,0]=3 1027 B13R0.336 COCCCNCCCOCCOC 34a_100000206027_100000740836 [1,0,0,0,0,0|2,0,0]=3 1028 B13R0.336 COCCCNCCCOCCOC 34a_100150723488_100011216529 [1,0,0,0,0,0|2,0,0]=3 1029 B13R0.336 COCCCOCCCOCCOC 34a_100000740835_100011216529 [1,0,0,0,0,0|2,0,0]=3 1030 B13R0.336 COCCCOCCCOCCOC 34a_200011215475_100011201679 [1,0,0,0,0,0|2,0,0]=3 1031 B13R0.336 COCCCOCCCOCCOC 7a_200011215475_100000233755 [1,0,0,0,0,0|2,0,0]=3 1032 B13R0.336 COCCCOCCCOCCSC 34a_200011215475_100000212216 [1,0,0,0,0,0|2,1,0]=4 1033 B13R0.336 COCCCOCCCOCCSC 7a_200011215475_100000212216 [1,0,0,0,0,0|2,1,0]=4 1034 B13R0.336 COCCCSCCCOCCOC 62a_100000709357_100011216529 [1,0,0,0,0,0|2,0,0]=3 1035 B13R0.336 COCCCSCCCOCCOC 62a_100011216529_100000709357 [1,0,0,0,0,0|2,0,0]=3 1036 B13R0.336 COCCNCCCCCCCCO 2230a_100000209980_100000033203 [1,0,0,0,0,0|3,0,0]=4 1037 B13R0.336 COCCNCCCCCCCCO 2230a_102515433106_100011201679 [1,0,0,0,0,0|3,0,0]=4 1038 B13R0.336 COCCNCCCCCCCCO 34a_102515433106_100011201679 [1,0,0,0,0,0|3,0,0]=4 1039 B13R0.336 COCCNCCOCCOCCO 2230a_100000209980_100000032323 [1,0,0,0,0,0|1,0,0]=2 1040 B13R0.336 COCCNCCOCCOCCO 2230a_100011998139_100011201679 [1,0,0,0,0,0|1,0,0]=2 1041 B13R0.336 COCCNCCOCCOCCO 34a_100011998139_100011201679 [1,0,0,0,0,0|1,0,0]=2 1042 B13R0.336 COCCOCCCCCCCCBr 34a_100009813846_100011201679 [1,0,0,0,0,0|3,0,0]=4 1043 B13R0.336 COCCOCCCCCCCCBr 7a_100009813846_100000233755 [1,0,0,0,0,0|3,0,0]=4 1044 B13R0.336 COCCOCCCCCCCCCl 34a_100000033203_100011201679 [1,0,0,0,0,0|3,0,0]=4 1045 B13R0.336 COCCOCCCCCCCCCl 7a_100000033203_100000233755 [1,0,0,0,0,0|3,0,0]=4 1046 B13R0.336 COCCOCCCCCCCCN 34a_102515433106_100011201679 [1,0,0,0,0,0|3,0,0]=4 1047 B13R0.336 COCCOCCCCCCCCO 34a_100000210237_100000033203 [1,0,0,0,0,0|2,0,0]=3 1048 B13R0.336 COCCOCCCCCNCCN 34a_103619048469_100011201679 [1,0,0,0,0,0|3,0,0]=4 1049 B13R0.336 COCCOCCCNCCCCO 2230a_100000206027_100000210776 [1,0,0,0,0,0|3,0,0]=4 1050 B13R0.336 COCCOCCCNCCCCO 2230a_100000750430_100011216529 [1,0,0,0,0,0|3,0,0]=4 1051 B13R0.336 COCCOCCCNCCCCO 34a_100000206027_100011216708 [1,0,0,0,0,0|3,0,0]=4 1052 B13R0.336 COCCOCCCNCCCCO 34a_100000750430_100011216529 [1,0,0,0,0,0|3,0,0]=4 1053 B13R0.336 COCCOCCCNCCCSC 2230a_100000749238_100011216529 [1,0,0,0,0,0|2,1,0]=4 1054 B13R0.336 COCCOCCCOCCCSC 34a_100000690336_100011216529 [1,0,0,0,0,0|2,1,0]=4 1055 B13R0.336 COCCOCCCOCCCSC 7a_100000690336_100011216529 [1,0,0,0,0,0|2,1,0]=4 1056 B13R0.336 COCCOCCCSCCCCO 62a_100000210776_100011216529 [1,0,0,0,0,0|3,0,0]=4 1057 B13R0.336 COCCOCCCSCCCCO 62a_100011216529_100000210776 [1,0,0,0,0,0|3,0,0]=4 1058 B13R0.336 COCCOCCNCCCCC#N 2230a_100000745349_100000211819 [1,0,0,0,0,0|3,0,0]=4 1059 B13R0.336 COCCOCCNCCCCC=O 2230a_100000745349_100000139335 [1,0,0,0,0,0|3,0,0]=4 1060 B13R0.336 COCCOCCNCCCCCF 2230a_100000745349_100000729378 [1,0,0,0,0,0|3,0,0]=4 1061 B13R0.336 COCCOCCNCCCCCF 34a_100000745349_100000729378 [1,0,0,0,0,0|3,0,0]=4 1062 B13R0.336 COCCOCCNCCCCCO 2230a_100000745349_100000746330 [1,0,0,0,0,0|2,0,0]=3 1063 B13R0.336 COCCOCCNCCCCCO 2230a_100000762737_100000695917 [1,0,0,0,0,0|2,0,0]=3 1064 B13R0.336 COCCOCCNCCCCCO 34a_100000745349_100000746330 [1,0,0,0,0,0|2,0,0]=3 1065 B13R0.336 COCCOCCNCCCCCO 34a_100000762737_100000695917 [1,0,0,0,0,0|2,0,0]=3 1066 B13R0.336 COCCOCCNCCOCC#N 2230a_100000745349_200000047693 [1,0,0,0,0,0|2,0,1]=4 1067 B13R0.336 COCCOCCNCCOCCO 2230a_100000211614_100000695917 [1,0,0,0,0,0|1,0,0]=2 1068 B13R0.336 COCCOCCNCCOCCO 2230a_100000745349_100011215305 [1,0,0,0,0,0|1,0,0]=2 1069 B13R0.336 COCCOCCNCCOCCO 34a_100000211614_100000695917 [1,0,0,0,0,0|1,0,0]=2 1070 B13R0.336 COCCOCCNCCOCCO 34a_100000745349_100000692535 [1,0,0,0,0,0|1,0,0]=2 1071 B13R0.336 COCCOCCNCCSCCO 2230a_100011219999_100000695917 [1,0,0,0,0,0|1,1,0]=3 1072 B13R0.336 COCCOCCNCOCCOC 2230a_100000745349_100000231047 [1,0,0,0,0,0|1,0,0]=2 1073 B13R0.336 COCCOCCOCCCCC#N 7a_100011215163_100000211819 [1,0,0,0,0,0|2,0,0]=3 1074 B13R0.336 COCCOCCOCCCCC=O 7a_100011215163_100000139335 [1,0,0,0,0,0|2,0,0]=3 1075 B13R0.336 COCCOCCOCCCCCBr 34a_100000746331_100000695917 [1,0,0,0,0,0|2,0,0]=3 1076 B13R0.336 COCCOCCOCCCCCBr 7a_100000746331_100000695917 [1,0,0,0,0,0|2,0,0]=3 1077 B13R0.336 COCCOCCOCCCCCCl 34a_100000746330_100000695917 [1,0,0,0,0,0|2,0,0]=3 1078 B13R0.336 COCCOCCOCCCCCCl 7a_100000746330_100000695917 [1,0,0,0,0,0|2,0,0]=3 1079 B13R0.336 COCCOCCOCCCCCF 34a_100011215163_100000729378 [1,0,0,0,0,0|2,0,0]=3 1080 B13R0.336 COCCOCCOCCCCCF 7a_100011215163_100000729378 [1,0,0,0,0,0|2,0,0]=3 1081 B13R0.336 COCCOCCOCCCCCI 34a_200012148887_100000695917 [1,0,0,0,0,0|2,0,0]=3 1082 B13R0.336 COCCOCCOCCCCCI 7a_200012148887_100000695917 [1,0,0,0,0,0|2,0,0]=3 1083 B13R0.336 COCCOCCOCCCCCN 34a_100000762737_100000695917 [1,0,0,0,0,0|2,0,0]=3 1084 B13R0.336 COCCOCCOCCCCCO 34a_100011215163_100000746330 [1,0,0,0,0,0|1,0,0]=2 1085 B13R0.336 COCCOCCOCCCCCO 7a_100011215163_100000746330 [1,0,0,0,0,0|1,0,0]=2 1086 B13R0.336 COCCOCCOCCCCSC 34a_100011217163_100000695917 [1,0,0,0,0,0|0,1,0]=2 1087 B13R0.336 COCCOCCOCCCCSC 7a_100011217163_100000695917 [1,0,0,0,0,0|0,1,0]=2 1088 B13R0.336 COCCOCCOCCNCC#N 2230a_100012028300_100011215382 [1,0,0,0,0,0|2,0,1]=4 1089 B13R0.336 COCCOCCOCCNCC=O 2230a_100012028300_200015260668 [1,0,0,0,0,0|1,0,2]=4 1090 B13R0.336 COCCOCCOCCNCC=O 34a_100012028300_200009817547 [1,0,0,0,0,0|1,0,2]=4 1091 B13R0.336 COCCOCCOCCNCCF 2230a_100012028300_100011217306 [1,0,0,0,0,0|2,0,0]=3 1092 B13R0.336 COCCOCCOCCNCCF 34a_100000724931_100013367474 [1,0,0,0,0,0|2,0,0]=3 1093 B13R0.336 COCCOCCOCCNCCF 34a_100012028300_100011217306 [1,0,0,0,0,0|2,0,0]=3 1094 B13R0.336 COCCOCCOCCNCCO 2230a_100012028300_100000211926 [1,0,0,0,0,0|1,0,0]=2 1095 B13R0.336 COCCOCCOCCNCCO 2230a_100016997473_100013367474 [1,0,0,0,0,0|1,0,0]=2 1096 B13R0.336 COCCOCCOCCNCCO 34a_100012028300_100000211926 [1,0,0,0,0,0|1,0,0]=2 1097 B13R0.336 COCCOCCOCCNCCO 34a_100016990907_100013367474 [1,0,0,0,0,0|1,0,0]=2 1098 B13R0.336 COCCOCCOCCNCOC 2230a_100012028300_100000766300 [1,0,0,0,0,0|1,0,0]=2 1099 B13R0.336 COCCOCCOCCNCSC 2230a_100012028300_100011218213 [1,0,0,0,0,0|1,1,0]=3 1100 B13R0.336 COCCOCCOCCNCSC 34a_100012028300_100011218213 [1,0,0,0,0,0|1,1,0]=3 1101 B13R0.336 COCCOCCOCCOCC#N 7a_100000688194_100011215382 [1,0,0,0,0,0|1,0,1]=3 1102 B13R0.336 COCCOCCOCCOCC#N 7a_100011215163_200000047693 [1,0,0,0,0,0|1,0,1]=3 1103 B13R0.336 COCCOCCOCCOCC=O 34a_100000688194_200009817547 [1,0,0,0,0,0|0,0,2]=3 1104 B13R0.336 COCCOCCOCCOCC=O 7a_100000688194_200015260668 [1,0,0,0,0,0|0,0,2]=3 1105 B13R0.336 COCCOCCOCCOCCBr 34a_100000211926_100013367474 [1,0,0,0,0,0|1,0,0]=2 1106 B13R0.336 COCCOCCOCCOCCBr 34a_100000692535_100000695917 [1,0,0,0,0,0|1,0,0]=2 1107 B13R0.336 COCCOCCOCCOCCBr 34a_100010132935_200000210301 [1,0,0,0,0,0|1,0,0]=2 1108 B13R0.336 COCCOCCOCCOCCBr 34a_100010132937_100011201679 [1,0,0,0,0,0|1,0,0]=2 1109 B13R0.336 COCCOCCOCCOCCBr 7a_100000692535_100000695917 [1,0,0,0,0,0|1,0,0]=2 1110 B13R0.336 COCCOCCOCCOCCBr 7a_100010132935_200000210301 [1,0,0,0,0,0|1,0,0]=2 1111 B13R0.336 COCCOCCOCCOCCBr 7a_100010132937_100000233755 [1,0,0,0,0,0|1,0,0]=2 1112 B13R0.336 COCCOCCOCCOCCCl 34a_100000032323_100011201679 [1,0,0,0,0,0|1,0,0]=2 1113 B13R0.336 COCCOCCOCCOCCCl 34a_100010166562_200000210301 [1,0,0,0,0,0|1,0,0]=2 1114 B13R0.336 COCCOCCOCCOCCCl 34a_100011215305_100000695917 [1,0,0,0,0,0|1,0,0]=2 1115 B13R0.336 COCCOCCOCCOCCCl 7a_100000032323_100000233755 [1,0,0,0,0,0|1,0,0]=2 1116 B13R0.336 COCCOCCOCCOCCCl 7a_100010166562_200000210301 [1,0,0,0,0,0|1,0,0]=2 1117 B13R0.336 COCCOCCOCCOCCCl 7a_100011215305_100000695917 [1,0,0,0,0,0|1,0,0]=2 1118 B13R0.336 COCCOCCOCCOCCF 34a_100000688194_100011217306 [1,0,0,0,0,0|1,0,0]=2 1119 B13R0.336 COCCOCCOCCOCCF 34a_200015357709_100000695917 [1,0,0,0,0,0|1,0,0]=2 1120 B13R0.336 COCCOCCOCCOCCF 7a_100000688194_100011217306 [1,0,0,0,0,0|1,0,0]=2 1121 B13R0.336 COCCOCCOCCOCCF 7a_200015357709_100000695917 [1,0,0,0,0,0|1,0,0]=2 1122 B13R0.336 COCCOCCOCCOCCI 34a_100012149058_100000695917 [1,0,0,0,0,0|1,0,0]=2 1123 B13R0.336 COCCOCCOCCOCCI 7a_100012149058_100000695917 [1,0,0,0,0,0|1,0,0]=2 1124 B13R0.336 COCCOCCOCCOCCN 34a_100000210304_100013367474 [1,0,0,0,0,0|1,0,0]=2 1125 B13R0.336 COCCOCCOCCOCCN 34a_100000211614_100000695917 [1,0,0,0,0,0|1,0,0]=2 1126 B13R0.336 COCCOCCOCCOCCN 34a_100011998139_100011201679 [1,0,0,0,0,0|1,0,0]=2 1127 B13R0.336 COCCOCCOCCOCCN 34a_103437854208_200000210301 [1,0,0,0,0,0|1,0,0]=2 1128 B13R0.336 COCCOCCOCCOCCO 34a_100000210237_100000032323 [1,0,0,0,0,0|0,0,0]=1 1129 B13R0.336 COCCOCCOCCOCCO 34a_100000688194_100000211926 [1,0,0,0,0,0|0,0,0]=1 1130 B13R0.336 COCCOCCOCCOCCO 34a_100011215163_100000692535 [1,0,0,0,0,0|0,0,0]=1 1131 B13R0.336 COCCOCCOCCOCCO 34a_100138415774_100010166562 [1,0,0,0,0,0|0,0,0]=1 1132 B13R0.336 COCCOCCOCCOCCO 7a_100000688194_100000211926 [1,0,0,0,0,0|0,0,0]=1 1133 B13R0.336 COCCOCCOCCOCCO 7a_100011215163_100011215305 [1,0,0,0,0,0|0,0,0]=1 1134 B13R0.336 COCCOCCOCCOCSC 34a_100000688194_100011218213 [1,0,0,0,0,0|0,1,0]=2 1135 B13R0.336 COCCOCCOCCSCC#N 62a_100011215382_100013367474 [1,0,0,0,0,0|1,1,1]=4 1136 B13R0.336 COCCOCCOCCSCC#N 62a_100013367474_100011215382 [1,0,0,0,0,0|1,1,1]=4 1137 B13R0.336 COCCOCCOCCSCC=O 62a_100013367474_200015260668 [1,0,0,0,0,0|0,1,2]=4 1138 B13R0.336 COCCOCCOCCSCC=O 62a_200015260668_100013367474 [1,0,0,0,0,0|0,1,2]=4 1139 B13R0.336 COCCOCCOCCSCCF 62a_100011217306_100013367474 [1,0,0,0,0,0|1,1,0]=3 1140 B13R0.336 COCCOCCOCCSCCF 62a_100013367474_100011217306 [1,0,0,0,0,0|1,1,0]=3 1141 B13R0.336 COCCOCCOCCSCCO 62a_100000211926_100013367474 [1,0,0,0,0,0|0,1,0]=2 1142 B13R0.336 COCCOCCOCCSCCO 62a_100013367474_100000211926 [1,0,0,0,0,0|0,1,0]=2 1143 B13R0.336 COCCOCCOCCSCOC 62a_100000766300_100013367474 [1,0,0,0,0,0|0,1,0]=2 1144 B13R0.336 COCCOCCOCCSCOC 62a_100013367474_100000766300 [1,0,0,0,0,0|0,1,0]=2 1145 B13R0.336 COCCOCCOCCSCSC 62a_100011218213_100013367474 [1,0,0,0,0,0|0,2,0]=3 1146 B13R0.336 COCCOCCOCCSCSC 62a_100013367474_100011218213 [1,0,0,0,0,0|0,2,0]=3 1147 B13R0.336 COCCOCCSCCCCC#N 62a_100000695917_100000211819 [1,0,0,0,0,0|2,1,0]=4 1148 B13R0.336 COCCOCCSCCCCC#N 62a_100011219923_100000695917 [1,0,0,0,0,0|2,1,0]=4 1149 B13R0.336 COCCOCCSCCCCC=O 62a_100000139335_100000695917 [1,0,0,0,0,0|2,1,0]=4 1150 B13R0.336 COCCOCCSCCCCC=O 62a_100000695917_100000139335 [1,0,0,0,0,0|2,1,0]=4 1151 B13R0.336 COCCOCCSCCCCCF 62a_100000695917_100000729378 [1,0,0,0,0,0|2,1,0]=4 1152 B13R0.336 COCCOCCSCCCCCF 62a_100000729378_100000695917 [1,0,0,0,0,0|2,1,0]=4 1153 B13R0.336 COCCOCCSCCCCCO 62a_100000695917_100000746330 [1,0,0,0,0,0|1,1,0]=3 1154 B13R0.336 COCCOCCSCCCCCO 62a_100000746330_100000695917 [1,0,0,0,0,0|1,1,0]=3 1155 B13R0.336 COCCOCCSCCOCC#N 62a_100000695917_200000047693 [1,0,0,0,0,0|1,1,1]=4 1156 B13R0.336 COCCOCCSCCOCC#N 62a_200000047693_100000695917 [1,0,0,0,0,0|1,1,1]=4 1157 B13R0.336 COCCOCCSCCOCCO 62a_100000695917_100011215305 [1,0,0,0,0,0|0,1,0]=2 1158 B13R0.336 COCCOCCSCCOCCO 62a_100011215305_100000695917 [1,0,0,0,0,0|0,1,0]=2 1159 B13R0.336 COCCOCCSCOCCOC 62a_100000231047_100000695917 [1,0,0,0,0,0|0,1,0]=2 1160 B13R0.336 COCCOCCSCOCCOC 62a_100000695917_100000231047 [1,0,0,0,0,0|0,1,0]=2 1161 B13R0.336 COCCOCNCCCCCCO 2230a_100000686447_100000231047 [1,0,0,0,0,0|3,0,0]=4 1162 B13R0.336 COCCOCSCCCCCCO 62a_100000231047_100000766143 [1,0,0,0,0,0|3,0,0]=4 1163 B13R0.336 COCCOCSCCCCCCO 62a_100000766143_100000231047 [1,0,0,0,0,0|3,0,0]=4 1164 B13R0.336 COCCSCCCCCCCCO 62a_100000033203_100000233755 [1,0,0,0,0,0|2,1,0]=4 1165 B13R0.336 COCCSCCCCCCCCO 62a_100000233755_100000033203 [1,0,0,0,0,0|2,1,0]=4 1166 B13R0.336 COCCSCCOCCOCCO 62a_100000032323_100000233755 [1,0,0,0,0,0|0,1,0]=2 1167 B13R0.336 COCCSCCOCCOCCO 62a_100000233755_100000032323 [1,0,0,0,0,0|0,1,0]=2 1168 B13R0.336 COCNCCCOCCOCCO 2230a_100011996194_100000766300 [1,0,0,0,0,0|2,0,0]=3 1169 B13R0.336 CSCCNCCOCCOCCO 2230a_100011998139_100000751147 [1,0,0,0,0,0|1,1,0]=3 1170 B13R0.336 CSCCNCCOCCOCCO 2230a_100020590264_100000032323 [1,0,0,0,0,0|1,1,0]=3 1171 B13R0.336 CSCCNCCOCCOCCO 34a_100011998139_100000212216 [1,0,0,0,0,0|1,1,0]=3 1172 B13R0.336 CSCCOCCCCCCCCO 34a_100000230434_100000033203 [1,0,0,0,0,0|2,1,0]=4 1173 B13R0.336 CSCCOCCCCCCCCO 7a_100000230434_100000033203 [1,0,0,0,0,0|2,1,0]=4 1174 B13R0.336 CSCCOCCOCCOCCBr 34a_100010132937_100000212216 [1,0,0,0,0,0|1,1,0]=3 1175 B13R0.336 CSCCOCCOCCOCCBr 7a_100010132937_100000212216 [1,0,0,0,0,0|1,1,0]=3 1176 B13R0.336 CSCCOCCOCCOCCCl 34a_100000032323_100000212216 [1,0,0,0,0,0|1,1,0]=3 1177 B13R0.336 CSCCOCCOCCOCCCl 7a_100000032323_100000212216 [1,0,0,0,0,0|1,1,0]=3 1178 B13R0.336 CSCCOCCOCCOCCN 34a_100011998139_100000212216 [1,0,0,0,0,0|1,1,0]=3 1179 B13R0.336 CSCCOCCOCCOCCO 34a_100000230434_100000032323 [1,0,0,0,0,0|0,1,0]=2 1180 B13R0.336 CSCCOCCOCCOCCO 62a_100010166562_200000210301 [1,0,0,0,0,0|0,1,0]=2 1181 B13R0.336 CSCCOCCOCCOCCO 62a_200000210301_100010166562 [1,0,0,0,0,0|0,1,0]=2 1182 B13R0.336 CSCCOCCOCCOCCO 7a_100000230434_100000032323 [1,0,0,0,0,0|0,1,0]=2 1183 B13R0.336 CSCCSCCOCCOCCO 62a_100000032323_100000751147 [1,0,0,0,0,0|0,2,0]=3 1184 B13R0.336 CSCCSCCOCCOCCO 62a_100000212216_100000032323 [1,0,0,0,0,0|0,2,0]=3 1185 B13R0.336 CSCNCCCOCCOCCO 2230a_100011996194_100011218213 [1,0,0,0,0,0|2,1,0]=4 1186 B13R0.336 CSCNCCCOCCOCCO 34a_100011996194_100011218213 [1,0,0,0,0,0|2,1,0]=4 1187 B13R0.336 CSCOCCOCCOCCCN 34a_100011996194_100011218213 [1,0,0,0,0,0|2,1,0]=4 1188 B13R0.336 FCCCOCCOCCOCCBr 34a_100010132937_100011934791 [1,0,0,0,0,0|3,0,0]=4 1189 B13R0.336 FCCCOCCOCCOCCBr 7a_100010132937_100011934791 [1,0,0,0,0,0|3,0,0]=4 1190 B13R0.336 FCCCOCCOCCOCCCl 34a_100000032323_100011934791 [1,0,0,0,0,0|3,0,0]=4 1191 B13R0.336 FCCCOCCOCCOCCCl 7a_100000032323_100011934791 [1,0,0,0,0,0|3,0,0]=4 1192 B13R0.336 N#CCCNCCOCCOCCO 2230a_100011998139_100011215226 [1,0,0,0,0,0|3,0,0]=4 1193 B13R0.336 N#CCCOCCOCCOCCBr 7a_100010132937_100000184422 [1,0,0,0,0,0|3,0,0]=4 1194 B13R0.336 N#CCCOCCOCCOCCCl 7a_100000032323_100000184422 [1,0,0,0,0,0|3,0,0]=4 1195 B13R0.336 N#CCCSCCOCCOCCO 62a_100000032323_100011215226 [1,0,0,0,0,0|2,1,0]=4 1196 B13R0.336 N#CCCSCCOCCOCCO 62a_100011215226_100000032323 [1,0,0,0,0,0|2,1,0]=4 1197 B13R0.336 NCCCCCCOCCOCCO 34a_100000686447_100000692535 [1,0,0,0,0,0|3,0,0]=4 1198 B13R0.336 NCCCOCCOCCOCCF 34a_100011996194_100011217306 [1,0,0,0,0,0|3,0,0]=4 1199 B13R0.336 NCCCOCCOCCOCCO 34a_100000182051_100000032323 [1,0,0,0,0,0|2,0,0]=3 1200 B13R0.336 NCCCOCCOCCOCCO 34a_100011996194_100000211926 [1,0,0,0,0,0|2,0,0]=3 1201 B13R0.336 NCCOCCOCCOCCCF 34a_100011998139_100011934791 [1,0,0,0,0,0|3,0,0]=4 1202 B13R0.336 NCCOCCOCCOCCCO 34a_100011998139_100000230001 [1,0,0,0,0,0|3,0,0]=4 1203 B13R0.336 NOCCOCCCCCCCCO 34a_100000700252_100000033203 [1,0,0,0,0,0|3,0,0]=4 1204 B13R0.336 NOCCOCCOCCOCCO 34a_100000700252_100000032323 [1,0,0,0,0,0|1,0,0]=2 1205 B13R0.336 OCCCNCCOCCOCCO 2230a_100011998139_100000230001 [1,0,0,0,0,0|3,0,0]=4 1206 B13R0.336 OCCCNCCOCCOCCO 34a_100011998139_100000230001 [1,0,0,0,0,0|3,0,0]=4 1207 B13R0.336 OCCCOCCOCCOCCBr 34a_100010132937_100000230001 [1,0,0,0,0,0|3,0,0]=4 1208 B13R0.336 OCCCOCCOCCOCCBr 7a_100010132937_100011215043 [1,0,0,0,0,0|3,0,0]=4 1209 B13R0.336 OCCCOCCOCCOCCCl 34a_100000032323_100000230001 [1,0,0,0,0,0|3,0,0]=4 1210 B13R0.336 OCCCOCCOCCOCCCl 7a_100000032323_100011215043 [1,0,0,0,0,0|3,0,0]=4 1211 B13R0.336 OCCCSCCOCCOCCO 62a_100000032323_100011215043 [1,0,0,0,0,0|2,1,0]=4 1212 B13R0.336 OCCCSCCOCCOCCO 62a_100011215043_100000032323 [1,0,0,0,0,0|2,1,0]=4 1213 B13R0.336 OCCOCCOCCCCCCBr 34a_100011215345_100000692535 [1,0,0,0,0,0|3,0,0]=4 1214 B13R0.336 OCCOCCOCCCCCCBr 7a_100011215345_100011215305 [1,0,0,0,0,0|3,0,0]=4 1215 B13R0.336 OCCOCCOCCCCCCCl 34a_100000766143_100000692535 [1,0,0,0,0,0|3,0,0]=4 1216 B13R0.336 OCCOCCOCCCCCCCl 7a_100000766143_100011215305 [1,0,0,0,0,0|3,0,0]=4 1217 B13R0.336 OCCOCCOCCCCCCF 34a_100000732779_100000692535 [1,0,0,0,0,0|3,0,0]=4 1218 B13R0.336 OCCOCCOCCCCCCF 7a_100000732779_100011215305 [1,0,0,0,0,0|3,0,0]=4 1219 B13R0.336 OCCOCCOCCNCCCF 2230a_100011998139_100011934791 [1,0,0,0,0,0|3,0,0]=4 1220 B13R0.336 OCCOCCOCCNCCCF 2230a_100015189416_100000032323 [1,0,0,0,0,0|3,0,0]=4 1221 B13R0.336 OCCOCCOCCNCCCF 34a_100011998139_100011934791 [1,0,0,0,0,0|3,0,0]=4 1222 B13R0.336 OCCOCCOCCNCCCF 34a_100015189416_100000032323 [1,0,0,0,0,0|3,0,0]=4 1223 B13R0.336 OCCOCCOCCOCCCBr 34a_100011217188_100000032323 [1,0,0,0,0,0|2,0,0]=3 1224 B13R0.336 OCCOCCOCCOCCCCl 34a_100000230001_100000032323 [1,0,0,0,0,0|2,0,0]=3 1225 B13R0.336 OCCOCCOCCOCCCF 34a_100000759539_100000032323 [1,0,0,0,0,0|2,0,0]=3 1226 B13R0.336 OCCOCCOCCSCCCF 62a_100000032323_100011934791 [1,0,0,0,0,0|2,1,0]=4 1227 B13R0.336 OCCOCCOCCSCCCF 62a_100011934791_100000032323 [1,0,0,0,0,0|2,1,0]=4 1228 B13R0.336 [13CH3]NCCOCCOCCOCCO 2230a_103437854208_200025704644 [1,0,0,0,0,0|1,0,0]=2 1229 B13R0.336 [13CH3]NCCOCCOCCOCCO 34a_103437854208_200025704644 [1,0,0,0,0,0|1,0,0]=2 1230 B13R0.336 [13CH3]OCCOCCOCCOCCBr 34a_100010132935_200025704644 [1,0,0,0,0,0|1,0,0]=2 1231 B13R0.336 [13CH3]OCCOCCOCCOCCBr 7a_100010132935_200025704644 [1,0,0,0,0,0|1,0,0]=2 1232 B13R0.336 [13CH3]OCCOCCOCCOCCCl 34a_100010166562_200025704644 [1,0,0,0,0,0|1,0,0]=2 1233 B13R0.336 [13CH3]OCCOCCOCCOCCCl 7a_100010166562_200025704644 [1,0,0,0,0,0|1,0,0]=2 1234 B13R0.336 [13CH3]OCCOCCOCCOCCN 34a_103437854208_200025704644 [1,0,0,0,0,0|1,0,0]=2 1235 B13R0.336 [13CH3]SCCOCCOCCOCCO 62a_100010166562_200025704644 [1,0,0,0,0,0|0,1,0]=2 1236 B13R0.336 [13CH3]SCCOCCOCCOCCO 62a_200025704644_100010166562 [1,0,0,0,0,0|0,1,0]=2 1237 B15R0.70 C#CCCCCCCOCCOCCOC 34a_100011215163_100012276617 [0,1,0,0,0,0|2,0,1]=4 1238 B15R0.70 C#CCCCCCCOCCOCCOC 34a_100011217361_100000695917 [0,1,0,0,0,0|2,0,1]=4 1239 B15R0.70 C#CCCCCCCOCCOCCOC 7a_100011215163_100012276617 [0,1,0,0,0,0|2,0,1]=4 1240 B15R0.70 C#CCCCCCCOCCOCCOC 7a_100011217361_100000695917 [0,1,0,0,0,0|2,0,1]=4 1241 B15R0.70 C#CCCCCCOCCCOCCOC 34a_100000766912_100011216529 [0,1,0,0,0,0|2,0,1]=4 1242 B15R0.70 C#CCCCCCOCCCOCCOC 7a_100000766912_100011216529 [0,1,0,0,0,0|2,0,1]=4 1243 B15R0.70 C#CCCCCCOCCOCCOCC 34a_100000210240_100012094781 [0,1,0,0,0,0|2,0,1]=4 1244 B15R0.70 C#CCCCCCOCCOCCOCC 34a_100000766912_100011211534 [0,1,0,0,0,0|2,0,1]=4 1245 B15R0.70 C#CCCCCCOCCOCCOCC 7a_100000210240_100012094781 [0,1,0,0,0,0|2,0,1]=4 1246 B15R0.70 C#CCCCCCOCCOCCOCC 7a_100000766912_100011211534 [0,1,0,0,0,0|2,0,1]=4 1247 B15R0.70 C#CCCCNCCOCCOCCOC 2230a_100012028300_100000731252 [0,1,0,0,0,0|2,0,1]=4 1248 B15R0.70 C#CCCCNCCOCCOCCOC 34a_100000718082_100013367474 [0,1,0,0,0,0|2,0,1]=4 1249 B15R0.70 C#CCCCNCCOCCOCCOC 34a_100012028300_100000695029 [0,1,0,0,0,0|2,0,1]=4 1250 B15R0.70 C#CCCCOCCOCCOCCCC 34a_100011215186_100000695029 [0,1,0,0,0,0|2,0,1]=4 1251 B15R0.70 C#CCCCOCCOCCOCCCC 7a_100011215186_100011215417 [0,1,0,0,0,0|2,0,1]=4 1252 B15R0.70 C#CCCCOCCOCCOCCNC 34a_200014138305_100000695029 [0,1,0,0,0,0|2,0,1]=4 1253 B15R0.70 C#CCCCOCCOCCOCCOC 34a_100000215630_100013367474 [0,1,0,0,0,0|1,0,1]=3 1254 B15R0.70 C#CCCCOCCOCCOCCOC 34a_100000688194_100000695029 [0,1,0,0,0,0|1,0,1]=3 1255 B15R0.70 C#CCCCOCCOCCOCCOC 7a_100000215630_100013367474 [0,1,0,0,0,0|1,0,1]=3 1256 B15R0.70 C#CCCCOCCOCCOCCOC 7a_100000688194_100011215417 [0,1,0,0,0,0|1,0,1]=3 1257 B15R0.70 C#CCCCSCCOCCOCCOC 62a_100011215417_100013367474 [0,1,0,0,0,0|1,1,1]=4 1258 B15R0.70 C#CCCCSCCOCCOCCOC 62a_100013367474_100011215417 [0,1,0,0,0,0|1,1,1]=4 1259 B15R0.70 C#CCCNCCOCCOCCOCC 2230a_100012282185_100000688953 [0,1,0,0,0,0|2,0,1]=4 1260 B15R0.70 C#CCCNCCOCCOCCOCC 34a_100012282185_100000688953 [0,1,0,0,0,0|2,0,1]=4 1261 B15R0.70 C#CCCOCCOCCOCCOCC 34a_100000033264_100000688953 [0,1,0,0,0,0|1,0,1]=3 1262 B15R0.70 C#CCCOCCOCCOCCOCC 7a_100000033264_100000688953 [0,1,0,0,0,0|1,0,1]=3 1263 B15R0.70 C/C=C/CCOCCOCCOCCOC 34a_100016278192_100013367474 [0,1,0,0,0,0|1,0,0]=2 1264 B15R0.70 C/C=C/CNCCOCCOCCOCC 34a_100012282185_100102629194 [0,1,0,0,0,0|2,0,1]=4 1265 B15R0.70 C/C=C/COCCOCCOCCOCC 34a_100000033264_100102629194 [0,1,0,0,0,0|1,0,1]=3 1266 B15R0.70 C/C=C/COCCOCCOCCOCC 7a_100000033264_100102629194 [0,1,0,0,0,0|1,0,1]=3 1267 B15R0.70 C=CCCCCCCOCCOCCOC 34a_100011215163_100011215473 [0,1,0,0,0,0|2,0,1]=4 1268 B15R0.70 C=CCCCCCCOCCOCCOC 34a_200011216477_100000695917 [0,1,0,0,0,0|2,0,1]=4 1269 B15R0.70 C=CCCCCCCOCCOCCOC 7a_100011215163_100011215473 [0,1,0,0,0,0|2,0,1]=4 1270 B15R0.70 C=CCCCCCCOCCOCCOC 7a_200011216477_100000695917 [0,1,0,0,0,0|2,0,1]=4 1271 B15R0.70 C=CCCCCCOCCCOCCOC 34a_100011216702_100011216529 [0,1,0,0,0,0|2,0,1]=4 1272 B15R0.70 C=CCCCCCOCCCOCCOC 7a_100011216702_100011216529 [0,1,0,0,0,0|2,0,1]=4 1273 B15R0.70 C=CCCCCCOCCOCCOCC 34a_100000210240_100000700193 [0,1,0,0,0,0|2,0,1]=4 1274 B15R0.70 C=CCCCCCOCCOCCOCC 34a_100011216702_100011211534 [0,1,0,0,0,0|2,0,1]=4 1275 B15R0.70 C=CCCCCCOCCOCCOCC 7a_100000210240_100000700193 [0,1,0,0,0,0|2,0,1]=4 1276 B15R0.70 C=CCCCCCOCCOCCOCC 7a_100011216702_100011211534 [0,1,0,0,0,0|2,0,1]=4 1277 B15R0.70 C=CCCCNCCOCCOCCOC 2230a_100000700776_100013367474 [0,1,0,0,0,0|2,0,1]=4 1278 B15R0.70 C=CCCCNCCOCCOCCOC 2230a_100012028300_100011713584 [0,1,0,0,0,0|2,0,1]=4 1279 B15R0.70 C=CCCCNCCOCCOCCOC 34a_100000700776_100013367474 [0,1,0,0,0,0|2,0,1]=4 1280 B15R0.70 C=CCCCNCCOCCOCCOC 34a_100012028300_100000757094 [0,1,0,0,0,0|2,0,1]=4 1281 B15R0.70 C=CCCCOCCOCCOCCCC 34a_100011215186_100000757094 [0,1,0,0,0,0|2,0,1]=4 1282 B15R0.70 C=CCCCOCCOCCOCCCC 7a_100011215186_100000757094 [0,1,0,0,0,0|2,0,1]=4 1283 B15R0.70 C=CCCCOCCOCCOCCNC 34a_200014138305_100000757094 [0,1,0,0,0,0|2,0,1]=4 1284 B15R0.70 C=CCCCOCCOCCOCCOC 34a_100000688194_100000757094 [0,1,0,0,0,0|1,0,1]=3 1285 B15R0.70 C=CCCCOCCOCCOCCOC 34a_100000758997_100013367474 [0,1,0,0,0,0|1,0,1]=3 1286 B15R0.70 C=CCCCOCCOCCOCCOC 7a_100000688194_100000757094 [0,1,0,0,0,0|1,0,1]=3 1287 B15R0.70 C=CCCCOCCOCCOCCOC 7a_100000758997_100013367474 [0,1,0,0,0,0|1,0,1]=3 1288 B15R0.70 C=CCCCSCCOCCOCCOC 62a_100011713584_100013367474 [0,1,0,0,0,0|1,1,1]=4 1289 B15R0.70 C=CCCCSCCOCCOCCOC 62a_100013367474_100000757094 [0,1,0,0,0,0|1,1,1]=4 1290 B15R0.70 C=CCCNCCOCCOCCOCC 2230a_100012282185_100000754431 [0,1,0,0,0,0|2,0,1]=4 1291 B15R0.70 C=CCCNCCOCCOCCOCC 34a_100012282185_100000754431 [0,1,0,0,0,0|2,0,1]=4 1292 B15R0.70 C=CCCOCCOCCOCCOCC 34a_100000033264_100000754431 [0,1,0,0,0,0|1,0,1]=3 1293 B15R0.70 C=CCCOCCOCCOCCOCC 7a_100000033264_100000754431 [0,1,0,0,0,0|1,0,1]=3 1294 B15R0.70 C=COCCNCCOCCOCCOC 2230a_100012028300_100000039644 [0,1,0,0,0,0|1,0,1]=3 1295 B15R0.70 C=COCCNCCOCCOCCOC 34a_100012028300_100000039644 [0,1,0,0,0,0|1,0,1]=3 1296 B15R0.70 C=COCCOCCOCCCCCCC 34a_100000039918_100000210614 [0,1,0,0,0,0|2,0,1]=4 1297 B15R0.70 C=COCCOCCOCCCCCCC 7a_100000039918_100000210614 [0,1,0,0,0,0|2,0,1]=4 1298 B15R0.70 C=COCCOCCOCCOCCCC 34a_100000039918_100000743108 [0,1,0,0,0,0|1,0,1]=3 1299 B15R0.70 C=COCCOCCOCCOCCCC 34a_100011215186_100000039644 [0,1,0,0,0,0|1,0,1]=3 1300 B15R0.70 C=COCCOCCOCCOCCCC 7a_100000039918_100000743108 [0,1,0,0,0,0|1,0,1]=3 1301 B15R0.70 C=COCCOCCOCCOCCCC 7a_100011215186_100000039644 [0,1,0,0,0,0|1,0,1]=3 1302 B15R0.70 C=COCCOCCOCCOCCCN 34a_100011996194_100000039644 [0,1,0,0,0,0|2,0,1]=4 1303 B15R0.70 C=COCCOCCOCCOCCNC 34a_200014138305_100000039644 [0,1,0,0,0,0|1,0,1]=3 1304 B15R0.70 C=COCCOCCOCCOCCOC 34a_100000033082_100013367474 [0,1,0,0,0,0|0,0,1]=2 1305 B15R0.70 C=COCCOCCOCCOCCOC 34a_100000039918_100000695917 [0,1,0,0,0,0|0,0,1]=2 1306 B15R0.70 C=COCCOCCOCCOCCOC 34a_100000688194_100000039644 [0,1,0,0,0,0|0,0,1]=2 1307 B15R0.70 C=COCCOCCOCCOCCOC 7a_100000039918_100000695917 [0,1,0,0,0,0|0,0,1]=2 1308 B15R0.70 C=COCCOCCOCCOCCOC 7a_100000688194_100000039644 [0,1,0,0,0,0|0,0,1]=2 1309 B15R0.70 C=COCCSCCOCCOCCOC 62a_100000039644_100013367474 [0,1,0,0,0,0|0,1,1]=3 1310 B15R0.70 C=COCCSCCOCCOCCOC 62a_100013367474_100000039644 [0,1,0,0,0,0|0,1,1]=3 1311 B15R0.70 CC#CCCOCCOCCOCCOC 34a_100000750427_100013367474 [0,1,0,0,0,0|1,0,0]=2 1312 B15R0.70 CC#CCNCCOCCOCCOCC 2230a_100012282185_100000748600 [0,1,0,0,0,0|2,0,1]=4 1313 B15R0.70 CC#CCNCCOCCOCCOCC 34a_100012282185_100000748600 [0,1,0,0,0,0|2,0,1]=4 1314 B15R0.70 CC#CCOCCOCCOCCOCC 34a_100000033264_100000748600 [0,1,0,0,0,0|1,0,1]=3 1315 B15R0.70 CC#CCOCCOCCOCCOCC 7a_100000033264_100000748600 [0,1,0,0,0,0|1,0,1]=3 1316 B15R0.70 CC/C=C\CCCCOCCOCCOC 34a_100016287862_100000695917 [0,1,0,0,0,0|2,0,1]=4 1317 B15R0.70 CC/C=C\CCCCOCCOCCOC 7a_100016287862_100000695917 [0,1,0,0,0,0|2,0,1]=4 1318 B15R0.70 CC/C=C\CNCCOCCOCCOC 2230a_100012028300_100103147603 [0,1,0,0,0,0|2,0,1]=4 1319 B15R0.70 CC/C=C\CNCCOCCOCCOC 34a_100012028300_100103147603 [0,1,0,0,0,0|2,0,1]=4 1320 B15R0.70 CC/C=C\COCCOCCOCCCC 34a_100011215186_100103147603 [0,1,0,0,0,0|2,0,1]=4 1321 B15R0.70 CC/C=C\COCCOCCOCCCC 7a_100011215186_100103147603 [0,1,0,0,0,0|2,0,1]=4 1322 B15R0.70 CC/C=C\COCCOCCOCCNC 34a_200014138305_100103147603 [0,1,0,0,0,0|2,0,1]=4 1323 B15R0.70 CC/C=C\COCCOCCOCCOC 34a_100000688194_100103147603 [0,1,0,0,0,0|1,0,1]=3 1324 B15R0.70 CC/C=C\COCCOCCOCCOC 34a_100016268518_100013367474 [0,1,0,0,0,0|1,0,1]=3 1325 B15R0.70 CC/C=C\COCCOCCOCCOC 7a_100000688194_100103147603 [0,1,0,0,0,0|1,0,1]=3 1326 B15R0.70 CC/C=C\CSCCOCCOCCOC 62a_100013367474_100103147603 [0,1,0,0,0,0|1,1,1]=4 1327 B15R0.70 CC/C=C\CSCCOCCOCCOC 62a_100103147603_100013367474 [0,1,0,0,0,0|1,1,1]=4 1328 B15R0.70 CC=CCNCCOCCOCCOCC 2230a_100012282185_100000070051 [0,1,0,0,0,0|2,0,1]=4 1329 B15R0.70 CC=CCNCCOCCOCCOCC 34a_100012282185_100000070051 [0,1,0,0,0,0|2,0,1]=4 1330 B15R0.70 CC=CCOCCOCCOCCOCC 34a_100000033264_100000070051 [0,1,0,0,0,0|1,0,1]=3 1331 B15R0.70 CC=CCOCCOCCOCCOCC 7a_100000033264_100000070051 [0,1,0,0,0,0|1,0,1]=3 1332 B15R0.70 CCC#CCNCCOCCOCCOC 2230a_100012028300_100009813939 [0,1,0,0,0,0|2,0,1]=4 1333 B15R0.70 CCC#CCNCCOCCOCCOC 34a_100012028300_100009813939 [0,1,0,0,0,0|2,0,1]=4 1334 B15R0.70 CCC#CCOCCOCCOCCCC 34a_100011215186_100009813939 [0,1,0,0,0,0|2,0,1]=4 1335 B15R0.70 CCC#CCOCCOCCOCCCC 7a_100011215186_100009813939 [0,1,0,0,0,0|2,0,1]=4 1336 B15R0.70 CCC#CCOCCOCCOCCNC 34a_200014138305_100009813939 [0,1,0,0,0,0|2,0,1]=4 1337 B15R0.70 CCC#CCOCCOCCOCCOC 34a_100000032950_100013367474 [0,1,0,0,0,0|1,0,1]=3 1338 B15R0.70 CCC#CCOCCOCCOCCOC 34a_100000688194_100009813939 [0,1,0,0,0,0|1,0,1]=3 1339 B15R0.70 CCC#CCOCCOCCOCCOC 7a_100000688194_100009813939 [0,1,0,0,0,0|1,0,1]=3 1340 B15R0.70 CCC#CCSCCOCCOCCOC 62a_100009813939_100013367474 [0,1,0,0,0,0|1,1,1]=4 1341 B15R0.70 CCC#CCSCCOCCOCCOC 62a_100013367474_100009813939 [0,1,0,0,0,0|1,1,1]=4 1342 B15R0.70 CCCC#CCCOCCCOCCOC 34a_100000042726_100011216529 [0,1,0,0,0,0|2,0,1]=4 1343 B15R0.70 CCCC#CCCOCCCOCCOC 7a_100000042726_100011216529 [0,1,0,0,0,0|2,0,1]=4 1344 B15R0.70 CCCC#CCCOCCOCCOCC 34a_100000042726_100011211534 [0,1,0,0,0,0|2,0,1]=4 1345 B15R0.70 CCCC#CCCOCCOCCOCC 7a_100000042726_100011211534 [0,1,0,0,0,0|2,0,1]=4 1346 B15R0.70 CCCC/C=C/COCCCOCCOC 34a_200016272032_100011216529 [0,1,0,0,0,0|2,0,1]=4 1347 B15R0.70 CCCC/C=C/COCCCOCCOC 7a_200016272032_100011216529 [0,1,0,0,0,0|2,0,1]=4 1348 B15R0.70 CCCC/C=C/COCCOCCOCC 34a_200016272032_100011211534 [0,1,0,0,0,0|2,0,1]=4 1349 B15R0.70 CCCC/C=C/COCCOCCOCC 7a_200016272032_100011211534 [0,1,0,0,0,0|2,0,1]=4 1350 B15R0.70 CCCC/C=C\CCOCCOCCCC 34a_200016286491_100000743108 [0,1,0,0,0,0|3,0,0]=4 1351 B15R0.70 CCCC/C=C\CCOCCOCCCC 7a_200016286491_100000743108 [0,1,0,0,0,0|3,0,0]=4 1352 B15R0.70 CCCC/C=C\CCOCCOCCOC 34a_200016286491_100000695917 [0,1,0,0,0,0|2,0,0]=3 1353 B15R0.70 CCCC/C=C\CCOCCOCCOC 7a_200016286491_100000695917 [0,1,0,0,0,0|2,0,0]=3 1354 B15R0.70 CCCCC#CCCOCCOCCCC 34a_100000037610_100000743108 [0,1,0,0,0,0|3,0,0]=4 1355 B15R0.70 CCCCC#CCCOCCOCCCC 7a_100000037610_100000743108 [0,1,0,0,0,0|3,0,0]=4 1356 B15R0.70 CCCCC#CCCOCCOCCOC 34a_100000037610_100000695917 [0,1,0,0,0,0|2,0,0]=3 1357 B15R0.70 CCCCC#CCCOCCOCCOC 7a_100000037610_100000695917 [0,1,0,0,0,0|2,0,0]=3 1358 B15R0.70 CCCCC#CCOCCCOCCOC 34a_200000034558_100011216529 [0,1,0,0,0,0|2,0,1]=4 1359 B15R0.70 CCCCC#CCOCCCOCCOC 7a_200000034558_100011216529 [0,1,0,0,0,0|2,0,1]=4 1360 B15R0.70 CCCCC#CCOCCOCCOCC 34a_200000034558_100011211534 [0,1,0,0,0,0|2,0,1]=4 1361 B15R0.70 CCCCC#CCOCCOCCOCC 7a_200000034558_100011211534 [0,1,0,0,0,0|2,0,1]=4 1362 B15R0.70 CCCCC/C=C/COCCOCCOC 34a_100016258190_100000695917 [0,1,0,0,0,0|2,0,1]=4 1363 B15R0.70 CCCCC/C=C/COCCOCCOC 7a_100016258190_100000695917 [0,1,0,0,0,0|2,0,1]=4 1364 B15R0.70 CCCCCC#CCOCCOCCOC 34a_100011215163_100009816472 [0,1,0,0,0,0|2,0,1]=4 1365 B15R0.70 CCCCCC#CCOCCOCCOC 34a_200000033628_100000695917 [0,1,0,0,0,0|2,0,1]=4 1366 B15R0.70 CCCCCC#CCOCCOCCOC 7a_100011215163_100009816472 [0,1,0,0,0,0|2,0,1]=4 1367 B15R0.70 CCCCCC#CCOCCOCCOC 7a_200000033628_100000695917 [0,1,0,0,0,0|2,0,1]=4 1368 B15R0.70 CCCCCCCCCCCOCCOC 34a_100000210237_100011215454 [0,1,0,0,0,0|3,0,0]=4 1369 B15R0.70 CCCCCCCCCCCOCCOC 34a_100000210809_100011201679 [0,1,0,0,0,0|3,0,0]=4 1370 B15R0.70 CCCCCCCCCCCOCCOC 34a_100010166600_200000210301 [0,1,0,0,0,0|3,0,0]=4 1371 B15R0.70 CCCCCCCCCCCOCCOC 7a_100000210809_100000233755 [0,1,0,0,0,0|3,0,0]=4 1372 B15R0.70 CCCCCCCCCCCOCCOC 7a_100010166600_200000210301 [0,1,0,0,0,0|3,0,0]=4 1373 B15R0.70 CCCCCCCCCCCOCCO[13CH3] 34a_100010166600_200025704644 [0,1,0,0,0,0|3,0,0]=4 1374 B15R0.70 CCCCCCCCCCCOCCO[13CH3] 7a_100010166600_200025704644 [0,1,0,0,0,0|3,0,0]=4 1375 B15R0.70 CCCCCCCCCCOCCCOC 34a_100000210711_100000740836 [0,1,0,0,0,0|3,0,0]=4 1376 B15R0.70 CCCCCCCCCCOCCCOC 34a_100000740835_100000210320 [0,1,0,0,0,0|3,0,0]=4 1377 B15R0.70 CCCCCCCCCCOCCCOC 7a_100000210711_100000740836 [0,1,0,0,0,0|3,0,0]=4 1378 B15R0.70 CCCCCCCCCCOCCOCC 34a_100000210136_100000210320 [0,1,0,0,0,0|3,0,0]=4 1379 B15R0.70 CCCCCCCCCCOCCOCC 34a_100000210711_100000210147 [0,1,0,0,0,0|3,0,0]=4 1380 B15R0.70 CCCCCCCCCCOCCOCC 7a_100000210136_100000210320 [0,1,0,0,0,0|3,0,0]=4 1381 B15R0.70 CCCCCCCCCCOCCOCC 7a_100000210711_100011215890 [0,1,0,0,0,0|3,0,0]=4 1382 B15R0.70 CCCCCCCCCNCOCCOC 2230a_100000212291_100000231047 [0,1,0,0,0,0|3,0,0]=4 1383 B15R0.70 CCCCCCCCCSCOCCOC 62a_100000231047_100000210670 [0,1,0,0,0,0|3,0,0]=4 1384 B15R0.70 CCCCCCCCNCCOCCOC 2230a_100000229939_100000695917 [0,1,0,0,0,0|3,0,0]=4 1385 B15R0.70 CCCCCCCCNCCOCCOC 2230a_100000745349_100000210759 [0,1,0,0,0,0|3,0,0]=4 1386 B15R0.70 CCCCCCCCNCCOCCOC 34a_100000229939_100000695917 [0,1,0,0,0,0|3,0,0]=4 1387 B15R0.70 CCCCCCCCNCCOCCOC 34a_100000745349_100000210759 [0,1,0,0,0,0|3,0,0]=4 1388 B15R0.70 CCCCCCCCOCCOCCCC 34a_100000210232_100000743108 [0,1,0,0,0,0|3,0,0]=4 1389 B15R0.70 CCCCCCCCOCCOCCCC 34a_100000210238_100000210759 [0,1,0,0,0,0|3,0,0]=4 1390 B15R0.70 CCCCCCCCOCCOCCCC 7a_100000210232_100000743108 [0,1,0,0,0,0|3,0,0]=4 1391 B15R0.70 CCCCCCCCOCCOCCCC 7a_100000210238_100000210759 [0,1,0,0,0,0|3,0,0]=4 1392 B15R0.70 CCCCCCCCOCCOCCNC 34a_100000228057_100000210759 [0,1,0,0,0,0|3,0,0]=4 1393 B15R0.70 CCCCCCCCOCCOCCOC 34a_100000210232_100000695917 [0,1,0,0,0,0|2,0,0]=3 1394 B15R0.70 CCCCCCCCOCCOCCOC 34a_100011215163_100000210759 [0,1,0,0,0,0|2,0,0]=3 1395 B15R0.70 CCCCCCCCOCCOCCOC 7a_100000210232_100000695917 [0,1,0,0,0,0|2,0,0]=3 1396 B15R0.70 CCCCCCCCOCCOCCOC 7a_100011215163_100000210759 [0,1,0,0,0,0|2,0,0]=3 1397 B15R0.70 CCCCCCCCSCCOCCOC 62a_100000210759_100000695917 [0,1,0,0,0,0|2,1,0]=4 1398 B15R0.70 CCCCCCCCSCCOCCOC 62a_100000695917_100000210317 [0,1,0,0,0,0|2,1,0]=4 1399 B15R0.70 CCCCCCCNCCCOCCOC 2230a_100000206027_100000210681 [0,1,0,0,0,0|3,0,0]=4 1400 B15R0.70 CCCCCCCNCCCOCCOC 2230a_100000229938_100011216529 [0,1,0,0,0,0|3,0,0]=4 1401 B15R0.70 CCCCCCCNCCCOCCOC 34a_100000206027_100000210614 [0,1,0,0,0,0|3,0,0]=4 1402 B15R0.70 CCCCCCCNCCOCCOCC 2230a_100000229938_100011211534 [0,1,0,0,0,0|3,0,0]=4 1403 B15R0.70 CCCCCCCNCCOCCOCC 2230a_100102712874_100000210681 [0,1,0,0,0,0|3,0,0]=4 1404 B15R0.70 CCCCCCCNCCOCCOCC 34a_100102712874_100000210614 [0,1,0,0,0,0|3,0,0]=4 1405 B15R0.70 CCCCCCCOCCCCCCOC 34a_100000210272_100011998445 [0,1,0,0,0,0|3,0,0]=4 1406 B15R0.70 CCCCCCCOCCCCCCOC 34a_200012092642_100000210614 [0,1,0,0,0,0|3,0,0]=4 1407 B15R0.70 CCCCCCCOCCCCCCOC 7a_100000210272_100011998445 [0,1,0,0,0,0|3,0,0]=4 1408 B15R0.70 CCCCCCCOCCCCCCOC 7a_200012092642_100000210614 [0,1,0,0,0,0|3,0,0]=4 1409 B15R0.70 CCCCCCCOCCCOCCCC 34a_200011215613_100000210614 [0,1,0,0,0,0|3,0,0]=4 1410 B15R0.70 CCCCCCCOCCCOCCCC 7a_200011215613_100000210614 [0,1,0,0,0,0|3,0,0]=4 1411 B15R0.70 CCCCCCCOCCCOCCOC 34a_100000210272_100011216529 [0,1,0,0,0,0|2,0,0]=3 1412 B15R0.70 CCCCCCCOCCCOCCOC 7a_100000210272_100011216529 [0,1,0,0,0,0|2,0,0]=3 1413 B15R0.70 CCCCCCCOCCOCCCCC 34a_100011215259_100000210614 [0,1,0,0,0,0|3,0,0]=4 1414 B15R0.70 CCCCCCCOCCOCCCCC 7a_100011215259_100000210614 [0,1,0,0,0,0|3,0,0]=4 1415 B15R0.70 CCCCCCCOCCOCCOCC 34a_100000210240_100000210614 [0,1,0,0,0,0|2,0,0]=3 1416 B15R0.70 CCCCCCCOCCOCCOCC 34a_100000210272_100011211534 [0,1,0,0,0,0|2,0,0]=3 1417 B15R0.70 CCCCCCCOCCOCCOCC 7a_100000210240_100000210614 [0,1,0,0,0,0|2,0,0]=3 1418 B15R0.70 CCCCCCCOCCOCCOCC 7a_100000210272_100011211534 [0,1,0,0,0,0|2,0,0]=3 1419 B15R0.70 CCCCCCCSCCCOCCOC 62a_100000210614_100011216529 [0,1,0,0,0,0|2,1,0]=4 1420 B15R0.70 CCCCCCCSCCCOCCOC 62a_100011216529_100000210316 [0,1,0,0,0,0|2,1,0]=4 1421 B15R0.70 CCCCCCCSCCOCCOCC 62a_100000210614_100011211534 [0,1,0,0,0,0|2,1,0]=4 1422 B15R0.70 CCCCCCCSCCOCCOCC 62a_100011211534_100000210316 [0,1,0,0,0,0|2,1,0]=4 1423 B15R0.70 CCCCCNCCOCCOCCCC 34a_100000224656_100000743108 [0,1,0,0,0,0|3,0,0]=4 1424 B15R0.70 CCCCCNCCOCCOCCOC 2230a_100000209983_100013367474 [0,1,0,0,0,0|2,0,0]=3 1425 B15R0.70 CCCCCNCCOCCOCCOC 2230a_100012028300_100000210326 [0,1,0,0,0,0|2,0,0]=3 1426 B15R0.70 CCCCCNCCOCCOCCOC 34a_100000224656_100000695917 [0,1,0,0,0,0|2,0,0]=3 1427 B15R0.70 CCCCCNCCOCCOCCOC 34a_100012028300_100000718602 [0,1,0,0,0,0|2,0,0]=3 1428 B15R0.70 CCCCCOCCOCCOCCCC 34a_100011215186_100000718602 [0,1,0,0,0,0|2,0,0]=3 1429 B15R0.70 CCCCCOCCOCCOCCCC 34a_100011215259_100000743108 [0,1,0,0,0,0|2,0,0]=3 1430 B15R0.70 CCCCCOCCOCCOCCCC 7a_100011215186_100000210326 [0,1,0,0,0,0|2,0,0]=3 1431 B15R0.70 CCCCCOCCOCCOCCCC 7a_100011215259_100000743108 [0,1,0,0,0,0|2,0,0]=3 1432 B15R0.70 CCCCCOCCOCCOCCCN 34a_100011996194_100000718602 [0,1,0,0,0,0|3,0,0]=4 1433 B15R0.70 CCCCCOCCOCCOCCNC 34a_200014138305_100000718602 [0,1,0,0,0,0|2,0,0]=3 1434 B15R0.70 CCCCCOCCOCCOCCOC 34a_100000210253_100013367474 [0,1,0,0,0,0|1,0,0]=2 1435 B15R0.70 CCCCCOCCOCCOCCOC 34a_100000688194_100000718602 [0,1,0,0,0,0|1,0,0]=2 1436 B15R0.70 CCCCCOCCOCCOCCOC 34a_100011215259_100000695917 [0,1,0,0,0,0|1,0,0]=2 1437 B15R0.70 CCCCCOCCOCCOCCOC 7a_100000210253_100013367474 [0,1,0,0,0,0|1,0,0]=2 1438 B15R0.70 CCCCCOCCOCCOCCOC 7a_100000688194_100000210326 [0,1,0,0,0,0|1,0,0]=2 1439 B15R0.70 CCCCCOCCOCCOCCOC 7a_100011215259_100000695917 [0,1,0,0,0,0|1,0,0]=2 1440 B15R0.70 CCCCCSCCOCCOCCOC 62a_100000210326_100013367474 [0,1,0,0,0,0|1,1,0]=3 1441 B15R0.70 CCCCCSCCOCCOCCOC 62a_100013367474_100000210326 [0,1,0,0,0,0|1,1,0]=3 1442 B15R0.70 CCCCNCCOCCOCCOCC 2230a_100012282185_100000210211 [0,1,0,0,0,0|2,0,0]=3 1443 B15R0.70 CCCCNCCOCCOCCOCC 34a_100012282185_100000210210 [0,1,0,0,0,0|2,0,0]=3 1444 B15R0.70 CCCCOCCCCOCCCCOC 34a_200000760531_100000755781 [0,1,0,0,0,0|3,0,0]=4 1445 B15R0.70 CCCCOCCCCOCCCCOC 7a_200000760531_100000730899 [0,1,0,0,0,0|3,0,0]=4 1446 B15R0.70 CCCCOCCCCOCOCCCC 34a_200000760531_100011995733 [0,1,0,0,0,0|3,0,0]=4 1447 B15R0.70 CCCCOCCCNCCOCCCC 2230a_200000211371_100000743108 [0,1,0,0,0,0|3,0,0]=4 1448 B15R0.70 CCCCOCCCNCCOCCCC 34a_200000211371_100000743108 [0,1,0,0,0,0|3,0,0]=4 1449 B15R0.70 CCCCOCCCNCCOCCOC 2230a_200000211371_100000695917 [0,1,0,0,0,0|2,0,0]=3 1450 B15R0.70 CCCCOCCCNCCOCCOC 34a_200000211371_100000695917 [0,1,0,0,0,0|2,0,0]=3 1451 B15R0.70 CCCCOCCCOCCOCCCC 34a_200011215613_100000743108 [0,1,0,0,0,0|2,0,0]=3 1452 B15R0.70 CCCCOCCCOCCOCCCC 7a_200011215613_100000743108 [0,1,0,0,0,0|2,0,0]=3 1453 B15R0.70 CCCCOCCCOCCOCCOC 34a_200011215613_100000695917 [0,1,0,0,0,0|1,0,0]=2 1454 B15R0.70 CCCCOCCCOCCOCCOC 7a_200011215613_100000695917 [0,1,0,0,0,0|1,0,0]=2 1455 B15R0.70 CCCCOCCNCCCOCCOC 2230a_100000206027_100000743108 [0,1,0,0,0,0|2,0,0]=3 1456 B15R0.70 CCCCOCCNCCCOCCOC 34a_100000206027_100000743108 [0,1,0,0,0,0|2,0,0]=3 1457 B15R0.70 CCCCOCCNCCOCCOCC 2230a_100102712874_100000743108 [0,1,0,0,0,0|2,0,0]=3 1458 B15R0.70 CCCCOCCNCCOCCOCC 34a_100102712874_100000743108 [0,1,0,0,0,0|2,0,0]=3 1459 B15R0.70 CCCCOCCOCCCCCCCBr 34a_100000760002_100000743108 [0,1,0,0,0,0|3,0,0]=4 1460 B15R0.70 CCCCOCCOCCCCCCCBr 7a_100000760002_100000743108 [0,1,0,0,0,0|3,0,0]=4 1461 B15R0.70 CCCCOCCOCCCCCCCN 34a_100011996573_100000743108 [0,1,0,0,0,0|3,0,0]=4 1462 B15R0.70 CCCCOCCOCCCCCCCO 34a_100000210238_100000760002 [0,1,0,0,0,0|3,0,0]=4 1463 B15R0.70 CCCCOCCOCCCCCCCO 7a_100000210238_100000760002 [0,1,0,0,0,0|3,0,0]=4 1464 B15R0.70 CCCCOCCOCCCCCCOC 34a_100000210238_100011998445 [0,1,0,0,0,0|2,0,0]=3 1465 B15R0.70 CCCCOCCOCCCCCCOC 34a_200012092642_100000743108 [0,1,0,0,0,0|2,0,0]=3 1466 B15R0.70 CCCCOCCOCCCCCCOC 7a_100000210238_100011998445 [0,1,0,0,0,0|2,0,0]=3 1467 B15R0.70 CCCCOCCOCCCCCCOC 7a_200012092642_100000743108 [0,1,0,0,0,0|2,0,0]=3 1468 B15R0.70 CCCCOCCOCCCOCCCN 34a_100011310245_100000743108 [0,1,0,0,0,0|3,0,0]=4 1469 B15R0.70 CCCCOCCOCCCOCCOC 34a_100000210238_100011216529 [0,1,0,0,0,0|1,0,0]=2 1470 B15R0.70 CCCCOCCOCCCOCCOC 7a_100000210238_100011216529 [0,1,0,0,0,0|1,0,0]=2 1471 B15R0.70 CCCCOCCOCCOCC#CCO 34a_100011215186_200000047223 [0,1,0,0,0,0|2,0,1]=4 1472 B15R0.70 CCCCOCCOCCOCC#CCO 7a_100011215186_200000047223 [0,1,0,0,0,0|2,0,1]=4 1473 B15R0.70 CCCCOCCOCCOCCCC#N 7a_100011215186_100000687738 [0,1,0,0,0,0|2,0,1]=4 1474 B15R0.70 CCCCOCCOCCOCCCC=O 7a_100011215186_200011292268 [0,1,0,0,0,0|2,0,1]=4 1475 B15R0.70 CCCCOCCOCCOCCCCF 34a_100011215186_100000729493 [0,1,0,0,0,0|2,0,0]=3 1476 B15R0.70 CCCCOCCOCCOCCCCF 7a_100011215186_100000729493 [0,1,0,0,0,0|2,0,0]=3 1477 B15R0.70 CCCCOCCOCCOCCCCO 34a_100011215186_100011216708 [0,1,0,0,0,0|2,0,0]=3 1478 B15R0.70 CCCCOCCOCCOCCCCO 7a_100011215186_100000210776 [0,1,0,0,0,0|2,0,0]=3 1479 B15R0.70 CCCCOCCOCCOCCCOC 34a_100011215186_100000740836 [0,1,0,0,0,0|1,0,0]=2 1480 B15R0.70 CCCCOCCOCCOCCCOC 7a_100011215186_100000740836 [0,1,0,0,0,0|1,0,0]=2 1481 B15R0.70 CCCCOCCOCCOCCN=[N+]=[N-] 34a_100000210227_100010820720 [0,1,0,0,0,0|3,0,0]=4 1482 B15R0.70 CCCCOCCOCCOCCN=[N+]=[N-] 7a_100000210227_100010820720 [0,1,0,0,0,0|3,0,0]=4 1483 B15R0.70 CCCCOCCOCCOCCOCC 34a_100000033264_100000210210 [0,1,0,0,0,0|1,0,0]=2 1484 B15R0.70 CCCCOCCOCCOCCOCC 34a_100000210238_100011211534 [0,1,0,0,0,0|1,0,0]=2 1485 B15R0.70 CCCCOCCOCCOCCOCC 34a_100000210240_100000743108 [0,1,0,0,0,0|1,0,0]=2 1486 B15R0.70 CCCCOCCOCCOCCOCC 34a_100000700218_100000210202 [0,1,0,0,0,0|1,0,0]=2 1487 B15R0.70 CCCCOCCOCCOCCOCC 34a_100011215186_100000210147 [0,1,0,0,0,0|1,0,0]=2 1488 B15R0.70 CCCCOCCOCCOCCOCC 7a_100000033264_100000210211 [0,1,0,0,0,0|1,0,0]=2 1489 B15R0.70 CCCCOCCOCCOCCOCC 7a_100000210238_100011211534 [0,1,0,0,0,0|1,0,0]=2 1490 B15R0.70 CCCCOCCOCCOCCOCC 7a_100000210240_100000743108 [0,1,0,0,0,0|1,0,0]=2 1491 B15R0.70 CCCCOCCOCCOCCOCC 7a_100000700218_100000210202 [0,1,0,0,0,0|1,0,0]=2 1492 B15R0.70 CCCCOCCOCCOCCOCC 7a_100011215186_100011215890 [0,1,0,0,0,0|1,0,0]=2 1493 B15R0.70 CCCCOCCOCCOCCOCF 34a_100000700218_100015361967 [0,1,0,0,0,0|1,0,0]=2 1494 B15R0.70 CCCCOCCOCCOCCOCF 7a_100000700218_100015361967 [0,1,0,0,0,0|1,0,0]=2 1495 B15R0.70 CCCCOCCOCCOCCSCC 34a_100011215186_100000757381 [0,1,0,0,0,0|1,1,0]=3 1496 B15R0.70 CCCCOCCOCCOCCSCC 7a_100011215186_100000757381 [0,1,0,0,0,0|1,1,0]=3 1497 B15R0.70 CCCCOCCSCCCCCCOC 62a_100000743108_100011998445 [0,1,0,0,0,0|2,1,0]=4 1498 B15R0.70 CCCCOCCSCCCCCCOC 62a_100011998445_100000743108 [0,1,0,0,0,0|2,1,0]=4 1499 B15R0.70 CCCCOCCSCCCOCCOC 62a_100000743108_100011216529 [0,1,0,0,0,0|1,1,0]=3 1500 B15R0.70 CCCCOCCSCCCOCCOC 62a_100011216529_100000743108 [0,1,0,0,0,0|1,1,0]=3 1501 B15R0.70 CCCCOCCSCCOCCOCC 62a_100000743108_100011211534 [0,1,0,0,0,0|1,1,0]=3 1502 B15R0.70 CCCCOCCSCCOCCOCC 62a_100011211534_100000743108 [0,1,0,0,0,0|1,1,0]=3 1503 B15R0.70 CCCCOCOCCCOCCCOC 34a_200011215475_100011995733 [0,1,0,0,0,0|3,0,0]=4 1504 B15R0.70 CCCCSCCNCCCOCCOC 2230a_100025743550_100011216529 [0,1,0,0,0,0|2,1,0]=4 1505 B15R0.70 CCCCSCCNCCOCCOCC 2230a_100025743550_100011211534 [0,1,0,0,0,0|2,1,0]=4 1506 B15R0.70 CCCCSCCOCCCCCCOC 34a_200000230436_100011998445 [0,1,0,0,0,0|2,1,0]=4 1507 B15R0.70 CCCCSCCOCCCCCCOC 7a_200000230436_100011998445 [0,1,0,0,0,0|2,1,0]=4 1508 B15R0.70 CCCCSCCOCCCOCCOC 34a_200000230436_100011216529 [0,1,0,0,0,0|1,1,0]=3 1509 B15R0.70 CCCCSCCOCCCOCCOC 7a_200000230436_100011216529 [0,1,0,0,0,0|1,1,0]=3 1510 B15R0.70 CCCCSCCOCCOCCOCC 34a_200000230436_100011211534 [0,1,0,0,0,0|1,1,0]=3 1511 B15R0.70 CCCCSCCOCCOCCOCC 7a_200000230436_100011211534 [0,1,0,0,0,0|1,1,0]=3 1512 B15R0.70 CCNCCOCCOCCOCCOC 2230a_100012359593_100000210202 [0,1,0,0,0,0|1,0,0]=2 1513 B15R0.70 CCNCCOCCOCCOCCOC 2230a_100015525214_100012349117 [0,1,0,0,0,0|1,0,0]=2 1514 B15R0.70 CCNCCOCCOCCOCCOC 34a_100012359593_100000210202 [0,1,0,0,0,0|1,0,0]=2 1515 B15R0.70 CCOCCNCCOCCOCCOC 2230a_100012028300_100011215890 [0,1,0,0,0,0|1,0,0]=2 1516 B15R0.70 CCOCCNCCOCCOCCOC 2230a_102516460346_100013367474 [0,1,0,0,0,0|1,0,0]=2 1517 B15R0.70 CCOCCNCCOCCOCCOC 34a_100012028300_100000210147 [0,1,0,0,0,0|1,0,0]=2 1518 B15R0.70 CCOCCNCCOCCOCCOC 34a_102516460346_100013367474 [0,1,0,0,0,0|1,0,0]=2 1519 B15R0.70 CCOCCOCCNCCCCCOC 2230a_100000747528_100011211534 [0,1,0,0,0,0|2,0,0]=3 1520 B15R0.70 CCOCCOCCNCCCCCOC 34a_100000747528_100011211534 [0,1,0,0,0,0|2,0,0]=3 1521 B15R0.70 CCOCCOCCNCCOCCOC 2230a_100000745349_100011211534 [0,1,0,0,0,0|1,0,0]=2 1522 B15R0.70 CCOCCOCCNCCOCCOC 2230a_100102712874_100000695917 [0,1,0,0,0,0|1,0,0]=2 1523 B15R0.70 CCOCCOCCNCCOCCOC 34a_100000745349_100011211534 [0,1,0,0,0,0|1,0,0]=2 1524 B15R0.70 CCOCCOCCNCCOCCOC 34a_100102712874_100000695917 [0,1,0,0,0,0|1,0,0]=2 1525 B15R0.70 CCOCCOCCOCCCCCC#N 7a_100000210240_100009813376 [0,1,0,0,0,0|3,0,0]=4 1526 B15R0.70 CCOCCOCCOCCCCCC=O 7a_100000210240_100000139337 [0,1,0,0,0,0|3,0,0]=4 1527 B15R0.70 CCOCCOCCOCCCCCCBr 34a_100011215345_100011211534 [0,1,0,0,0,0|3,0,0]=4 1528 B15R0.70 CCOCCOCCOCCCCCCBr 7a_100011215345_100011211534 [0,1,0,0,0,0|3,0,0]=4 1529 B15R0.70 CCOCCOCCOCCCCCCCl 34a_100000766143_100011211534 [0,1,0,0,0,0|3,0,0]=4 1530 B15R0.70 CCOCCOCCOCCCCCCCl 7a_100000766143_100011211534 [0,1,0,0,0,0|3,0,0]=4 1531 B15R0.70 CCOCCOCCOCCCCCCF 34a_100000210240_100015922095 [0,1,0,0,0,0|3,0,0]=4 1532 B15R0.70 CCOCCOCCOCCCCCCF 34a_100000732779_100011211534 [0,1,0,0,0,0|3,0,0]=4 1533 B15R0.70 CCOCCOCCOCCCCCCF 7a_100000210240_100015922095 [0,1,0,0,0,0|3,0,0]=4 1534 B15R0.70 CCOCCOCCOCCCCCCF 7a_100000732779_100011211534 [0,1,0,0,0,0|3,0,0]=4 1535 B15R0.70 CCOCCOCCOCCCCCCN 34a_100000686447_100011211534 [0,1,0,0,0,0|3,0,0]=4 1536 B15R0.70 CCOCCOCCOCCCCCCO 34a_100000210240_100000766143 [0,1,0,0,0,0|3,0,0]=4 1537 B15R0.70 CCOCCOCCOCCCCCCO 7a_100000210240_100000766143 [0,1,0,0,0,0|3,0,0]=4 1538 B15R0.70 CCOCCOCCOCCCCCNC 34a_100000722520_100011211534 [0,1,0,0,0,0|2,0,0]=3 1539 B15R0.70 CCOCCOCCOCCNCCC#N 2230a_100012282185_100011215226 [0,1,0,0,0,0|3,0,0]=4 1540 B15R0.70 CCOCCOCCOCCNCCCF 2230a_100012282185_100011934791 [0,1,0,0,0,0|3,0,0]=4 1541 B15R0.70 CCOCCOCCOCCNCCCF 34a_100012282185_100011934791 [0,1,0,0,0,0|3,0,0]=4 1542 B15R0.70 CCOCCOCCOCCNCCCO 2230a_100012282185_100000230001 [0,1,0,0,0,0|3,0,0]=4 1543 B15R0.70 CCOCCOCCOCCNCCCO 34a_100012282185_100000230001 [0,1,0,0,0,0|3,0,0]=4 1544 B15R0.70 CCOCCOCCOCCNCCOC 2230a_100012282185_100011201679 [0,1,0,0,0,0|1,0,0]=2 1545 B15R0.70 CCOCCOCCOCCNCCOC 34a_100012282185_100011201679 [0,1,0,0,0,0|1,0,0]=2 1546 B15R0.70 CCOCCOCCOCCNCCSC 2230a_100012282185_100000751147 [0,1,0,0,0,0|1,1,0]=3 1547 B15R0.70 CCOCCOCCOCCNCCSC 34a_100012282185_100000212216 [0,1,0,0,0,0|1,1,0]=3 1548 B15R0.70 CCOCCOCCOCCOCCC#N 7a_100000033264_100000184422 [0,1,0,0,0,0|2,0,0]=3 1549 B15R0.70 CCOCCOCCOCCOCCCF 34a_100000033264_100011934791 [0,1,0,0,0,0|2,0,0]=3 1550 B15R0.70 CCOCCOCCOCCOCCCF 7a_100000033264_100011934791 [0,1,0,0,0,0|2,0,0]=3 1551 B15R0.70 CCOCCOCCOCCOCCCN 34a_100011996194_100000210147 [0,1,0,0,0,0|2,0,0]=3 1552 B15R0.70 CCOCCOCCOCCOCCCO 34a_100000033264_100000230001 [0,1,0,0,0,0|2,0,0]=3 1553 B15R0.70 CCOCCOCCOCCOCCCO 7a_100000033264_100011215043 [0,1,0,0,0,0|2,0,0]=3 1554 B15R0.70 CCOCCOCCOCCOCCNC 34a_100000228057_100011211534 [0,1,0,0,0,0|1,0,0]=2 1555 B15R0.70 CCOCCOCCOCCOCCNC 34a_100036875364_100000210202 [0,1,0,0,0,0|1,0,0]=2 1556 B15R0.70 CCOCCOCCOCCOCCNC 34a_200014138305_100000210147 [0,1,0,0,0,0|1,0,0]=2 1557 B15R0.70 CCOCCOCCOCCOCCOC 34a_100000033264_100011201679 [0,1,0,0,0,0|0,0,0]=1 1558 B15R0.70 CCOCCOCCOCCOCCOC 34a_100000210136_100013367474 [0,1,0,0,0,0|0,0,0]=1 1559 B15R0.70 CCOCCOCCOCCOCCOC 34a_100000210240_100000695917 [0,1,0,0,0,0|0,0,0]=1 1560 B15R0.70 CCOCCOCCOCCOCCOC 34a_100000688194_100000210147 [0,1,0,0,0,0|0,0,0]=1 1561 B15R0.70 CCOCCOCCOCCOCCOC 34a_100010185881_200000210301 [0,1,0,0,0,0|0,0,0]=1 1562 B15R0.70 CCOCCOCCOCCOCCOC 34a_100011215163_100011211534 [0,1,0,0,0,0|0,0,0]=1 1563 B15R0.70 CCOCCOCCOCCOCCOC 34a_100011218579_100000210202 [0,1,0,0,0,0|0,0,0]=1 1564 B15R0.70 CCOCCOCCOCCOCCOC 34a_100121572206_100012349117 [0,1,0,0,0,0|0,0,0]=1 1565 B15R0.70 CCOCCOCCOCCOCCOC 7a_100000033264_100000233755 [0,1,0,0,0,0|0,0,0]=1 1566 B15R0.70 CCOCCOCCOCCOCCOC 7a_100000210136_100013367474 [0,1,0,0,0,0|0,0,0]=1 1567 B15R0.70 CCOCCOCCOCCOCCOC 7a_100000210240_100000695917 [0,1,0,0,0,0|0,0,0]=1 1568 B15R0.70 CCOCCOCCOCCOCCOC 7a_100000688194_100011215890 [0,1,0,0,0,0|0,0,0]=1 1569 B15R0.70 CCOCCOCCOCCOCCOC 7a_100010185881_200000210301 [0,1,0,0,0,0|0,0,0]=1 1570 B15R0.70 CCOCCOCCOCCOCCOC 7a_100011215163_100011211534 [0,1,0,0,0,0|0,0,0]=1 1571 B15R0.70 CCOCCOCCOCCOCCOC 7a_100011218579_100000210202 [0,1,0,0,0,0|0,0,0]=1 1572 B15R0.70 CCOCCOCCOCCOCCON 34a_200121571635_100000210202 [0,1,0,0,0,0|1,0,0]=2 1573 B15R0.70 CCOCCOCCOCCOCCO[13CH3] 34a_100010185881_200025704644 [0,1,0,0,0,0|0,0,0]=1 1574 B15R0.70 CCOCCOCCOCCOCCO[13CH3] 7a_100010185881_200025704644 [0,1,0,0,0,0|0,0,0]=1 1575 B15R0.70 CCOCCOCCOCCOCCSC 34a_100000033264_100000212216 [0,1,0,0,0,0|0,1,0]=2 1576 B15R0.70 CCOCCOCCOCCOCCSC 7a_100000033264_100000212216 [0,1,0,0,0,0|0,1,0]=2 1577 B15R0.70 CCOCCOCCSCCOCCOC 62a_100000695917_100011211534 [0,1,0,0,0,0|0,1,0]=2 1578 B15R0.70 CCOCCOCCSCCOCCOC 62a_100011211534_100000695917 [0,1,0,0,0,0|0,1,0]=2 1579 B15R0.70 CCOCCSCCOCCOCCOC 62a_100000210147_100013367474 [0,1,0,0,0,0|0,1,0]=2 1580 B15R0.70 CCOCCSCCOCCOCCOC 62a_100013367474_100011215890 [0,1,0,0,0,0|0,1,0]=2 1581 B15R0.70 CCSCCNCCOCCOCCOC 2230a_100000106463_100013367474 [0,1,0,0,0,0|1,1,0]=3 1582 B15R0.70 CCSCCNCCOCCOCCOC 2230a_100012028300_100000757381 [0,1,0,0,0,0|1,1,0]=3 1583 B15R0.70 CCSCCNCCOCCOCCOC 34a_100012028300_100000757381 [0,1,0,0,0,0|1,1,0]=3 1584 B15R0.70 CCSCCOCCOCCOCCCN 34a_100011996194_100000757381 [0,1,0,0,0,0|2,1,0]=4 1585 B15R0.70 CCSCCOCCOCCOCCNC 34a_200014138305_100000757381 [0,1,0,0,0,0|1,1,0]=3 1586 B15R0.70 CCSCCOCCOCCOCCOC 34a_100000212035_100013367474 [0,1,0,0,0,0|0,1,0]=2 1587 B15R0.70 CCSCCOCCOCCOCCOC 34a_100000688194_100000757381 [0,1,0,0,0,0|0,1,0]=2 1588 B15R0.70 CCSCCOCCOCCOCCOC 62a_100000210202_100012349117 [0,1,0,0,0,0|0,1,0]=2 1589 B15R0.70 CCSCCOCCOCCOCCOC 62a_100012349117_100000210202 [0,1,0,0,0,0|0,1,0]=2 1590 B15R0.70 CCSCCOCCOCCOCCOC 7a_100000212035_100013367474 [0,1,0,0,0,0|0,1,0]=2 1591 B15R0.70 CCSCCOCCOCCOCCOC 7a_100000688194_100000757381 [0,1,0,0,0,0|0,1,0]=2 1592 B15R0.70 CCSCCSCCOCCOCCOC 62a_100000757381_100013367474 [0,1,0,0,0,0|0,2,0]=3 1593 B15R0.70 CCSCCSCCOCCOCCOC 62a_100013367474_100000757381 [0,1,0,0,0,0|0,2,0]=3 1594 B15R0.70 CNCCCCCOCCCCCCOC 34a_100000722520_100011998445 [0,1,0,0,0,0|3,0,0]=4 1595 B15R0.70 CNCCCCCOCCCOCCOC 34a_100000722520_100011216529 [0,1,0,0,0,0|2,0,0]=3 1596 B15R0.70 CNCCCOCCOCCOCCOC 34a_100000213112_100013367474 [0,1,0,0,0,0|1,0,0]=2 1597 B15R0.70 CNCCOCCOCCCCCCCO 34a_100000228057_100000760002 [0,1,0,0,0,0|3,0,0]=4 1598 B15R0.70 CNCCOCCOCCCCCCOC 34a_100000228057_100011998445 [0,1,0,0,0,0|2,0,0]=3 1599 B15R0.70 CNCCOCCOCCCOCCOC 34a_100000228057_100011216529 [0,1,0,0,0,0|1,0,0]=2 1600 B15R0.70 CNCCOCCOCCOCC#CCO 34a_200014138305_200000047223 [0,1,0,0,0,0|2,0,1]=4 1601 B15R0.70 CNCCOCCOCCOCCCCF 34a_200014138305_100000729493 [0,1,0,0,0,0|2,0,0]=3 1602 B15R0.70 CNCCOCCOCCOCCCCO 34a_200014138305_100011216708 [0,1,0,0,0,0|2,0,0]=3 1603 B15R0.70 CNCCOCCOCCOCCCOC 34a_200014138305_100000740836 [0,1,0,0,0,0|1,0,0]=2 1604 B15R0.70 CNCCOCCOCCOCCN=[N+]=[N-] 2230a_100000043633_200000210301 [0,1,0,0,0,0|3,0,0]=4 1605 B15R0.70 CNCCOCCOCCOCCN=[N+]=[N-] 2230a_106832991635_100010820719 [0,1,0,0,0,0|3,0,0]=4 1606 B15R0.70 CNCCOCCOCCOCCN=[N+]=[N-] 34a_100102657272_100010820719 [0,1,0,0,0,0|3,0,0]=4 1607 B15R0.70 CNCCOCCOCCOCCN=[N+]=[N-] 7a_106832991635_100010820719 [0,1,0,0,0,0|3,0,0]=4 1608 B15R0.70 CNCCOCCOCCOCCOCF 34a_100036875364_100015361967 [0,1,0,0,0,0|1,0,0]=2 1609 B15R0.70 COCCCCCCNCCCCCOC 2230a_100000747528_100011998445 [0,1,0,0,0,0|3,0,0]=4 1610 B15R0.70 COCCCCCCNCCCCCOC 34a_100000747528_100011998445 [0,1,0,0,0,0|3,0,0]=4 1611 B15R0.70 COCCCCCCNCCOCCOC 2230a_100000745349_100011998445 [0,1,0,0,0,0|2,0,0]=3 1612 B15R0.70 COCCCCCCNCCOCCOC 34a_100000745349_100011998445 [0,1,0,0,0,0|2,0,0]=3 1613 B15R0.70 COCCCCCCOCCOCCOC 34a_100011215163_100011998445 [0,1,0,0,0,0|1,0,0]=2 1614 B15R0.70 COCCCCCCOCCOCCOC 34a_200012092642_100000695917 [0,1,0,0,0,0|1,0,0]=2 1615 B15R0.70 COCCCCCCOCCOCCOC 7a_100011215163_100011998445 [0,1,0,0,0,0|1,0,0]=2 1616 B15R0.70 COCCCCCCOCCOCCOC 7a_200012092642_100000695917 [0,1,0,0,0,0|1,0,0]=2 1617 B15R0.70 COCCCCCCSCCOCCOC 62a_100000695917_100011998445 [0,1,0,0,0,0|1,1,0]=3 1618 B15R0.70 COCCCCCCSCCOCCOC 62a_100011998445_100000695917 [0,1,0,0,0,0|1,1,0]=3 1619 B15R0.70 COCCCCCNCCCOCCOC 2230a_100000747528_100011216529 [0,1,0,0,0,0|2,0,0]=3 1620 B15R0.70 COCCCCCNCCCOCCOC 34a_100000747528_100011216529 [0,1,0,0,0,0|2,0,0]=3 1621 B15R0.70 COCCCCOCCCOCCCOC 34a_200011215475_100000755781 [0,1,0,0,0,0|3,0,0]=4 1622 B15R0.70 COCCCCOCCCOCCCOC 7a_200011215475_100000730899 [0,1,0,0,0,0|3,0,0]=4 1623 B15R0.70 COCCCNCCOCCOCCOC 2230a_100012028300_100000740836 [0,1,0,0,0,0|1,0,0]=2 1624 B15R0.70 COCCCNCCOCCOCCOC 34a_100012028300_100000740836 [0,1,0,0,0,0|1,0,0]=2 1625 B15R0.70 COCCCNCCOCCOCCOC 34a_100150723488_100013367474 [0,1,0,0,0,0|1,0,0]=2 1626 B15R0.70 COCCCOCCOCCOCCCN 34a_100011996194_100000740836 [0,1,0,0,0,0|2,0,0]=3 1627 B15R0.70 COCCCOCCOCCOCCOC 34a_100000688194_100000740836 [0,1,0,0,0,0|0,0,0]=1 1628 B15R0.70 COCCCOCCOCCOCCOC 34a_100000740835_100013367474 [0,1,0,0,0,0|0,0,0]=1 1629 B15R0.70 COCCCOCCOCCOCCOC 7a_100000688194_100000740836 [0,1,0,0,0,0|0,0,0]=1 1630 B15R0.70 COCCCSCCOCCOCCOC 62a_100000709357_100013367474 [0,1,0,0,0,0|0,1,0]=2 1631 B15R0.70 COCCCSCCOCCOCCOC 62a_100013367474_100000709357 [0,1,0,0,0,0|0,1,0]=2 1632 B15R0.70 COCCNCCOCCOCCN=[N+]=[N-] 2230a_100000209980_100010820720 [0,1,0,0,0,0|3,0,0]=4 1633 B15R0.70 COCCNCCOCCOCCN=[N+]=[N-] 2230a_100160470849_100011201679 [0,1,0,0,0,0|3,0,0]=4 1634 B15R0.70 COCCOCCCCCCCCCCBr 34a_100009813290_100011201679 [0,1,0,0,0,0|3,0,0]=4 1635 B15R0.70 COCCOCCCCCCCCCCBr 7a_100009813290_100000233755 [0,1,0,0,0,0|3,0,0]=4 1636 B15R0.70 COCCOCCCCCCCCCCCl 34a_200000033068_100011201679 [0,1,0,0,0,0|3,0,0]=4 1637 B15R0.70 COCCOCCCCCCCCCCCl 7a_200000033068_100000233755 [0,1,0,0,0,0|3,0,0]=4 1638 B15R0.70 COCCOCCCCCCCCCCN 34a_100000066964_100011201679 [0,1,0,0,0,0|3,0,0]=4 1639 B15R0.70 COCCOCCCCCCCCCCO 34a_100000210237_100009813290 [0,1,0,0,0,0|3,0,0]=4 1640 B15R0.70 COCCOCCCNCCOCCOC 2230a_100000206027_100000695917 [0,1,0,0,0,0|1,0,0]=2 1641 B15R0.70 COCCOCCCNCCOCCOC 2230a_100000745349_100011216529 [0,1,0,0,0,0|1,0,0]=2 1642 B15R0.70 COCCOCCCNCCOCCOC 34a_100000206027_100000695917 [0,1,0,0,0,0|1,0,0]=2 1643 B15R0.70 COCCOCCCNCCOCCOC 34a_100000745349_100011216529 [0,1,0,0,0,0|1,0,0]=2 1644 B15R0.70 COCCOCCCOCCCCCCBr 34a_100011215345_100011216529 [0,1,0,0,0,0|3,0,0]=4 1645 B15R0.70 COCCOCCCOCCCCCCBr 7a_100011215345_100011216529 [0,1,0,0,0,0|3,0,0]=4 1646 B15R0.70 COCCOCCCOCCCCCCCl 34a_100000766143_100011216529 [0,1,0,0,0,0|3,0,0]=4 1647 B15R0.70 COCCOCCCOCCCCCCCl 7a_100000766143_100011216529 [0,1,0,0,0,0|3,0,0]=4 1648 B15R0.70 COCCOCCCOCCCCCCF 34a_100000732779_100011216529 [0,1,0,0,0,0|3,0,0]=4 1649 B15R0.70 COCCOCCCOCCCCCCF 7a_100000732779_100011216529 [0,1,0,0,0,0|3,0,0]=4 1650 B15R0.70 COCCOCCCOCCCCCCN 34a_100000686447_100011216529 [0,1,0,0,0,0|3,0,0]=4 1651 B15R0.70 COCCOCCCOCCOCCOC 34a_100011215163_100011216529 [0,1,0,0,0,0|0,0,0]=1 1652 B15R0.70 COCCOCCCOCCOCCOC 7a_100011215163_100011216529 [0,1,0,0,0,0|0,0,0]=1 1653 B15R0.70 COCCOCCCSCCOCCOC 62a_100000695917_100011216529 [0,1,0,0,0,0|0,1,0]=2 1654 B15R0.70 COCCOCCCSCCOCCOC 62a_100011216529_100000695917 [0,1,0,0,0,0|0,1,0]=2 1655 B15R0.70 COCCOCCNCCCCCCCO 2230a_100000745349_100000760002 [0,1,0,0,0,0|3,0,0]=4 1656 B15R0.70 COCCOCCNCCCCCCCO 2230a_100011996573_100000695917 [0,1,0,0,0,0|3,0,0]=4 1657 B15R0.70 COCCOCCNCCCCCCCO 34a_100000745349_100000760002 [0,1,0,0,0,0|3,0,0]=4 1658 B15R0.70 COCCOCCNCCCCCCCO 34a_100011996573_100000695917 [0,1,0,0,0,0|3,0,0]=4 1659 B15R0.70 COCCOCCNCCCOCCCO 2230a_100011310245_100000695917 [0,1,0,0,0,0|3,0,0]=4 1660 B15R0.70 COCCOCCNCCCOCCCO 34a_100011310245_100000695917 [0,1,0,0,0,0|3,0,0]=4 1661 B15R0.70 COCCOCCNCCOCCN=[N+]=[N-] 2230a_100102953956_100000695917 [0,1,0,0,0,0|3,0,0]=4 1662 B15R0.70 COCCOCCOCCCCCCC#N 7a_100011215163_100009813337 [0,1,0,0,0,0|2,0,1]=4 1663 B15R0.70 COCCOCCOCCCCCCCBr 34a_100000760002_100000695917 [0,1,0,0,0,0|2,0,0]=3 1664 B15R0.70 COCCOCCOCCCCCCCBr 7a_100000760002_100000695917 [0,1,0,0,0,0|2,0,0]=3 1665 B15R0.70 COCCOCCOCCCCCCCN 34a_100011996573_100000695917 [0,1,0,0,0,0|2,0,0]=3 1666 B15R0.70 COCCOCCOCCCCCCCO 34a_100011215163_100000760002 [0,1,0,0,0,0|2,0,0]=3 1667 B15R0.70 COCCOCCOCCCCCCCO 7a_100011215163_100000760002 [0,1,0,0,0,0|2,0,0]=3 1668 B15R0.70 COCCOCCOCCCOCCCN 34a_100011310245_100000695917 [0,1,0,0,0,0|2,0,0]=3 1669 B15R0.70 COCCOCCOCCNCC#CCO 2230a_100012028300_200000047223 [0,1,0,0,0,0|2,0,1]=4 1670 B15R0.70 COCCOCCOCCNCC#CCO 34a_100012028300_200000047223 [0,1,0,0,0,0|2,0,1]=4 1671 B15R0.70 COCCOCCOCCNCCCC#N 2230a_100012028300_100000687738 [0,1,0,0,0,0|2,0,1]=4 1672 B15R0.70 COCCOCCOCCNCCCC=O 2230a_100012028300_200011292268 [0,1,0,0,0,0|2,0,1]=4 1673 B15R0.70 COCCOCCOCCNCCCCF 2230a_100012028300_100000729493 [0,1,0,0,0,0|2,0,0]=3 1674 B15R0.70 COCCOCCOCCNCCCCF 34a_100012028300_100000729493 [0,1,0,0,0,0|2,0,0]=3 1675 B15R0.70 COCCOCCOCCNCCCCO 2230a_100000750430_100013367474 [0,1,0,0,0,0|2,0,0]=3 1676 B15R0.70 COCCOCCOCCNCCCCO 2230a_100012028300_100000210776 [0,1,0,0,0,0|2,0,0]=3 1677 B15R0.70 COCCOCCOCCNCCCCO 34a_100000750430_100013367474 [0,1,0,0,0,0|2,0,0]=3 1678 B15R0.70 COCCOCCOCCNCCCCO 34a_100012028300_100011216708 [0,1,0,0,0,0|2,0,0]=3 1679 B15R0.70 COCCOCCOCCNCCCSC 2230a_100000749238_100013367474 [0,1,0,0,0,0|1,1,0]=3 1680 B15R0.70 COCCOCCOCCOCC#CCCl 34a_200000047223_100013367474 [0,1,0,0,0,0|1,0,1]=3 1681 B15R0.70 COCCOCCOCCOCC#CCO 34a_100000688194_200000047223 [0,1,0,0,0,0|1,0,1]=3 1682 B15R0.70 COCCOCCOCCOCC#CCO 7a_100000688194_200000047223 [0,1,0,0,0,0|1,0,1]=3 1683 B15R0.70 COCCOCCOCCOCCCC#N 7a_100000688194_100000687738 [0,1,0,0,0,0|1,0,1]=3 1684 B15R0.70 COCCOCCOCCOCCCC=O 7a_100000688194_200011292268 [0,1,0,0,0,0|1,0,1]=3 1685 B15R0.70 COCCOCCOCCOCCCCBr 34a_100011216708_100013367474 [0,1,0,0,0,0|1,0,0]=2 1686 B15R0.70 COCCOCCOCCOCCCCCl 34a_100000210776_100013367474 [0,1,0,0,0,0|1,0,0]=2 1687 B15R0.70 COCCOCCOCCOCCCCCl 7a_100000210776_100013367474 [0,1,0,0,0,0|1,0,0]=2 1688 B15R0.70 COCCOCCOCCOCCCCF 34a_100000688194_100000729493 [0,1,0,0,0,0|1,0,0]=2 1689 B15R0.70 COCCOCCOCCOCCCCF 34a_100011995726_100013367474 [0,1,0,0,0,0|1,0,0]=2 1690 B15R0.70 COCCOCCOCCOCCCCF 7a_100000688194_100000729493 [0,1,0,0,0,0|1,0,0]=2 1691 B15R0.70 COCCOCCOCCOCCCCF 7a_100011995726_100013367474 [0,1,0,0,0,0|1,0,0]=2 1692 B15R0.70 COCCOCCOCCOCCCCI 34a_200012148704_100013367474 [0,1,0,0,0,0|1,0,0]=2 1693 B15R0.70 COCCOCCOCCOCCCCN 34a_100000750430_100013367474 [0,1,0,0,0,0|1,0,0]=2 1694 B15R0.70 COCCOCCOCCOCCCCO 34a_100000688194_100011216708 [0,1,0,0,0,0|1,0,0]=2 1695 B15R0.70 COCCOCCOCCOCCCCO 7a_100000688194_100000210776 [0,1,0,0,0,0|1,0,0]=2 1696 B15R0.70 COCCOCCOCCOCCCSC 34a_100000690336_100013367474 [0,1,0,0,0,0|0,1,0]=2 1697 B15R0.70 COCCOCCOCCOCCCSC 7a_100000690336_100013367474 [0,1,0,0,0,0|0,1,0]=2 1698 B15R0.70 COCCOCCOCCOCCN=[N+]=[N-] 34a_100000210237_100010820720 [0,1,0,0,0,0|2,0,0]=3 1699 B15R0.70 COCCOCCOCCOCCN=[N+]=[N-] 34a_100138415774_100010820719 [0,1,0,0,0,0|2,0,0]=3 1700 B15R0.70 COCCOCCOCCOCCN=[N+]=[N-] 7a_100010008387_200000210301 [0,1,0,0,0,0|2,0,0]=3 1701 B15R0.70 COCCOCCOCCOCCNCF 34a_100012359593_100015361967 [0,1,0,0,0,0|1,0,0]=2 1702 B15R0.70 COCCOCCOCCOCCOCF 34a_100011218579_100015361967 [0,1,0,0,0,0|0,0,0]=1 1703 B15R0.70 COCCOCCOCCOCCOCF 7a_100011218579_100015361967 [0,1,0,0,0,0|0,0,0]=1 1704 B15R0.70 COCCOCCOCCOCCSCF 62a_100012349117_100015361967 [0,1,0,0,0,0|0,1,0]=2 1705 B15R0.70 COCCOCCOCCOCCSCF 62a_100015361967_100012349117 [0,1,0,0,0,0|0,1,0]=2 1706 B15R0.70 COCCOCCOCCSCC#CCO 62a_100013367474_200000047223 [0,1,0,0,0,0|1,1,1]=4 1707 B15R0.70 COCCOCCOCCSCC#CCO 62a_200000047223_100013367474 [0,1,0,0,0,0|1,1,1]=4 1708 B15R0.70 COCCOCCOCCSCCCC#N 62a_100000687738_100013367474 [0,1,0,0,0,0|1,1,1]=4 1709 B15R0.70 COCCOCCOCCSCCCC#N 62a_100013367474_100000687738 [0,1,0,0,0,0|1,1,1]=4 1710 B15R0.70 COCCOCCOCCSCCCC=O 62a_100013367474_200011292268 [0,1,0,0,0,0|1,1,1]=4 1711 B15R0.70 COCCOCCOCCSCCCC=O 62a_200011292268_100013367474 [0,1,0,0,0,0|1,1,1]=4 1712 B15R0.70 COCCOCCOCCSCCCCF 62a_100000729493_100013367474 [0,1,0,0,0,0|1,1,0]=3 1713 B15R0.70 COCCOCCOCCSCCCCF 62a_100013367474_100000729493 [0,1,0,0,0,0|1,1,0]=3 1714 B15R0.70 COCCOCCOCCSCCCCO 62a_100000210776_100013367474 [0,1,0,0,0,0|1,1,0]=3 1715 B15R0.70 COCCOCCOCCSCCCCO 62a_100013367474_100000210776 [0,1,0,0,0,0|1,1,0]=3 1716 B15R0.70 COCCOCCOCCSCCSC#N 62a_100000034367_100013367474 [0,1,0,0,0,0|0,2,1]=4 1717 B15R0.70 COCCOCCOCCSCCSC#N 62a_100013367474_100000034367 [0,1,0,0,0,0|0,2,1]=4 1718 B15R0.70 COCCOCCSCCCCCCCO 62a_100000695917_100000760002 [0,1,0,0,0,0|2,1,0]=4 1719 B15R0.70 COCCOCCSCCCCCCCO 62a_100000760002_100000695917 [0,1,0,0,0,0|2,1,0]=4 1720 B15R0.70 COCCSCCOCCOCCN=[N+]=[N-] 62a_100000233755_100010820720 [0,1,0,0,0,0|2,1,0]=4 1721 B15R0.70 COCCSCCOCCOCCN=[N+]=[N-] 62a_100010820720_100000233755 [0,1,0,0,0,0|2,1,0]=4 1722 B15R0.70 CSCCOCCOCCOCCN=[N+]=[N-] 34a_100000230434_100010820720 [0,1,0,0,0,0|2,1,0]=4 1723 B15R0.70 CSCCOCCOCCOCCN=[N+]=[N-] 62a_100010820719_200000210301 [0,1,0,0,0,0|2,1,0]=4 1724 B15R0.70 CSCCOCCOCCOCCN=[N+]=[N-] 62a_200000210301_100010820719 [0,1,0,0,0,0|2,1,0]=4 1725 B15R0.70 CSCCOCCOCCOCCN=[N+]=[N-] 7a_100000230434_100010820720 [0,1,0,0,0,0|2,1,0]=4 1726 B15R0.70 NCCCOCCOCCOCCCCF 34a_100011996194_100000729493 [0,1,0,0,0,0|3,0,0]=4 1727 B15R0.70 NCCCOCCOCCOCCCCO 34a_100011996194_100011216708 [0,1,0,0,0,0|3,0,0]=4 1728 B15R0.70 NOCCOCCOCCOCCOCF 34a_200121571635_100015361967 [0,1,0,0,0,0|1,0,0]=2 1729 B15R0.70 [13CH3]NCCOCCOCCOCCN=[N+]=[N-] 2230a_100000043633_200025704644 [0,1,0,0,0,0|3,0,0]=4 1730 B15R0.70 [13CH3]OCCOCCOCCOCCN=[N+]=[N-] 7a_100010008387_200025704644 [0,1,0,0,0,0|2,0,0]=3 1731 B15R0.70 [13CH3]SCCOCCOCCOCCN=[N+]=[N-] 62a_100010820719_200025704644 [0,1,0,0,0,0|2,1,0]=4 1732 B15R0.70 [13CH3]SCCOCCOCCOCCN=[N+]=[N-] 62a_200025704644_100010820719 [0,1,0,0,0,0|2,1,0]=4 1733 B15R0.70 [N-]=[N+]=NCCOCCOCCOCCON 34a_100000700252_100010820720 [0,1,0,0,0,0|3,0,0]=4 1734 B15R0.81 C#CCCOCCOCCOCC(=O)OC 34a_100011023656_100000688953 [0,1,0,0,0,0|1,0,2]=4 1735 B15R0.81 C#CCCOCCOCCOCC(=O)OC 7a_100011023656_100000688953 [0,1,0,0,0,0|1,0,2]=4 1736 B15R0.81 C/C=C/COCCOCCOCC(=O)OC 34a_100011023656_100102629194 [0,1,0,0,0,0|1,0,2]=4 1737 B15R0.81 C/C=C/COCCOCCOCC(=O)OC 7a_100011023656_100102629194 [0,1,0,0,0,0|1,0,2]=4 1738 B15R0.81 C=C(C#N)COCCOCCOCCOC 34a_100000688194_100000694840 [0,1,0,0,0,0|2,0,1]=4 1739 B15R0.81 C=CC(C)COCCOCCOCCOC 34a_100011215527_100013367474 [0,1,0,0,0,0|1,0,1]=3 1740 B15R0.81 C=CC(C)COCCOCCOCCOC 7a_100011215527_100013367474 [0,1,0,0,0,0|1,0,1]=3 1741 B15R0.81 C=CC(O)CNCCOCCOCCOC 2230a_100012028300_100000730141 [0,1,0,0,0,0|2,0,1]=4 1742 B15R0.81 C=CC(O)CNCCOCCOCCOC 34a_100012028300_100000730141 [0,1,0,0,0,0|2,0,1]=4 1743 B15R0.81 C=CC(O)COCCOCCOCCCC 34a_100011215186_100000730141 [0,1,0,0,0,0|2,0,1]=4 1744 B15R0.81 C=CC(O)COCCOCCOCCCC 7a_100011215186_100000730141 [0,1,0,0,0,0|2,0,1]=4 1745 B15R0.81 C=CC(O)COCCOCCOCCNC 34a_200014138305_100000730141 [0,1,0,0,0,0|2,0,1]=4 1746 B15R0.81 C=CC(O)COCCOCCOCCOC 34a_100000688194_100000730141 [0,1,0,0,0,0|1,0,1]=3 1747 B15R0.81 C=CC(O)COCCOCCOCCOC 7a_100000688194_100000730141 [0,1,0,0,0,0|1,0,1]=3 1748 B15R0.81 C=CC(O)CSCCOCCOCCOC 62a_100000730141_100013367474 [0,1,0,0,0,0|1,1,1]=4 1749 B15R0.81 C=CC(O)CSCCOCCOCCOC 62a_100013367474_100000730141 [0,1,0,0,0,0|1,1,1]=4 1750 B15R0.81 C=CCCOCCOCCOCC(=O)OC 34a_100011023656_100000754431 [0,1,0,0,0,0|1,0,2]=4 1751 B15R0.81 C=CCCOCCOCCOCC(=O)OC 7a_100011023656_100000754431 [0,1,0,0,0,0|1,0,2]=4 1752 B15R0.81 C=C[C@H](N)COCCOCCOCCOC 34a_100016989147_100013367474 [0,1,0,0,0,0|1,0,1]=3 1753 B15R0.81 CC#CCOCCOCCOCC(=O)OC 34a_100011023656_100000748600 [0,1,0,0,0,0|1,0,2]=4 1754 B15R0.81 CC#CCOCCOCCOCC(=O)OC 7a_100011023656_100000748600 [0,1,0,0,0,0|1,0,2]=4 1755 B15R0.81 CC=CCOCCOCCOCC(=O)OC 34a_100011023656_100000070051 [0,1,0,0,0,0|1,0,2]=4 1756 B15R0.81 CC=CCOCCOCCOCC(=O)OC 7a_100011023656_100000070051 [0,1,0,0,0,0|1,0,2]=4 1757 B15R0.81 CCC(=O)COCCOCCOCCOC 1458a_100012826494_100000210202 [0,1,0,0,0,0|1,0,1]=3 1758 B15R0.81 CCC(=O)COCCOCCOCCOC 34a_100000725409_100013367474 [0,1,0,0,0,0|1,0,1]=3 1759 B15R0.81 CCC(=O)COCCOCCOCCOC 7a_100000688194_100000747405 [0,1,0,0,0,0|1,0,1]=3 1760 B15R0.81 CCC(=O)CSCCOCCOCCOC 62a_100000747405_100013367474 [0,1,0,0,0,0|1,1,1]=4 1761 B15R0.81 CCC(=O)CSCCOCCOCCOC 62a_100013367474_100000747405 [0,1,0,0,0,0|1,1,1]=4 1762 B15R0.81 CCC(C)CNCCOCCOCCOC 2230a_100012028300_100000748023 [0,1,0,0,0,0|2,0,0]=3 1763 B15R0.81 CCC(C)CNCCOCCOCCOC 2230a_100020588543_100013367474 [0,1,0,0,0,0|2,0,0]=3 1764 B15R0.81 CCC(C)CNCCOCCOCCOC 270004a_100012028300_100000243153 [0,1,0,0,0,0|2,0,0]=3 1765 B15R0.81 CCC(C)CNCCOCCOCCOC 34a_100012028300_100000748023 [0,1,0,0,0,0|2,0,0]=3 1766 B15R0.81 CCC(C)COCCOCCOCCCN 34a_100011996194_100000748023 [0,1,0,0,0,0|3,0,0]=4 1767 B15R0.81 CCC(C)COCCOCCOCCNC 34a_200014138305_100000748023 [0,1,0,0,0,0|2,0,0]=3 1768 B15R0.81 CCC(C)COCCOCCOCCOC 34a_100000688194_100000748023 [0,1,0,0,0,0|1,0,0]=2 1769 B15R0.81 CCC(C)COCCOCCOCCOC 7a_100000688194_100000748023 [0,1,0,0,0,0|1,0,0]=2 1770 B15R0.81 CCC(C)CSCCOCCOCCOC 62a_100000748023_100013367474 [0,1,0,0,0,0|1,1,0]=3 1771 B15R0.81 CCC(C)CSCCOCCOCCOC 62a_100013367474_100000748023 [0,1,0,0,0,0|1,1,0]=3 1772 B15R0.81 CCC(O)CNCCOCCOCCOC 2230a_100011218483_100013367474 [0,1,0,0,0,0|2,0,0]=3 1773 B15R0.81 CCC(O)CNCCOCCOCCOC 2230a_100012028300_100011218378 [0,1,0,0,0,0|2,0,0]=3 1774 B15R0.81 CCC(O)CNCCOCCOCCOC 34a_100012028300_100011218378 [0,1,0,0,0,0|2,0,0]=3 1775 B15R0.81 CCC(O)COCCOCCOCCCN 34a_100011996194_100011218378 [0,1,0,0,0,0|3,0,0]=4 1776 B15R0.81 CCC(O)COCCOCCOCCNC 34a_200014138305_100011218378 [0,1,0,0,0,0|2,0,0]=3 1777 B15R0.81 CCC(O)COCCOCCOCCOC 34a_100000688194_100011218378 [0,1,0,0,0,0|1,0,0]=2 1778 B15R0.81 CCC(O)COCCOCCOCCOC 7a_100000688194_100011218378 [0,1,0,0,0,0|1,0,0]=2 1779 B15R0.81 CCC(O)CSCCOCCOCCOC 62a_100011218378_100013367474 [0,1,0,0,0,0|1,1,0]=3 1780 B15R0.81 CCC(O)CSCCOCCOCCOC 62a_100013367474_100011218378 [0,1,0,0,0,0|1,1,0]=3 1781 B15R0.81 CCCCCCCCCCOCC(C)OC 34a_100000690652_100000210320 [0,1,0,0,0,0|3,0,0]=4 1782 B15R0.81 CCCCCCCOCCOCC(=O)OC 34a_100000210272_100000090808 [0,1,0,0,0,0|2,0,1]=4 1783 B15R0.81 CCCCCCCOCCOCC(=O)OC 7a_100000210272_100000090808 [0,1,0,0,0,0|2,0,1]=4 1784 B15R0.81 CCCCOCCOCCCCC(=O)OC 34a_100000059025_100000743108 [0,1,0,0,0,0|2,0,1]=4 1785 B15R0.81 CCCCOCCOCCCCC(=O)OC 34a_100000210238_100000204269 [0,1,0,0,0,0|2,0,1]=4 1786 B15R0.81 CCCCOCCOCCCCC(=O)OC 7a_100000059025_100000743108 [0,1,0,0,0,0|2,0,1]=4 1787 B15R0.81 CCCCOCCOCCCCC(=O)OC 7a_100000210238_100000204269 [0,1,0,0,0,0|2,0,1]=4 1788 B15R0.81 CCCCOCCOCCOCC(=O)CC 7a_100011215186_100000747405 [0,1,0,0,0,0|2,0,1]=4 1789 B15R0.81 CCCCOCCOCCOCC(=O)NC 34a_100011215186_100000183359 [0,1,0,0,0,0|2,0,1]=4 1790 B15R0.81 CCCCOCCOCCOCC(=O)NC 7a_100011215186_100000183359 [0,1,0,0,0,0|2,0,1]=4 1791 B15R0.81 CCCCOCCOCCOCC(=O)OC 34a_100000210238_100000090808 [0,1,0,0,0,0|1,0,1]=3 1792 B15R0.81 CCCCOCCOCCOCC(=O)OC 34a_100011023656_100000210210 [0,1,0,0,0,0|1,0,1]=3 1793 B15R0.81 CCCCOCCOCCOCC(=O)OC 34a_100011215186_100000747449 [0,1,0,0,0,0|1,0,1]=3 1794 B15R0.81 CCCCOCCOCCOCC(=O)OC 7a_100000210238_100000090808 [0,1,0,0,0,0|1,0,1]=3 1795 B15R0.81 CCCCOCCOCCOCC(=O)OC 7a_100011023656_100000210211 [0,1,0,0,0,0|1,0,1]=3 1796 B15R0.81 CCCCOCCOCCOCC(=O)OC 7a_100011215186_100000747449 [0,1,0,0,0,0|1,0,1]=3 1797 B15R0.81 CCCCOCCOCCOCC(C)CC 34a_100011215186_100000748023 [0,1,0,0,0,0|2,0,0]=3 1798 B15R0.81 CCCCOCCOCCOCC(C)CC 7a_100011215186_100000748023 [0,1,0,0,0,0|2,0,0]=3 1799 B15R0.81 CCCCOCCOCCOCC(O)CC 34a_100011215186_100011218378 [0,1,0,0,0,0|2,0,0]=3 1800 B15R0.81 CCCCOCCOCCOCC(O)CC 7a_100011215186_100011218378 [0,1,0,0,0,0|2,0,0]=3 1801 B15R0.81 CCCCOCCOCCOCC(O)CO 34a_100011215186_100011219619 [0,1,0,0,0,0|3,0,0]=4 1802 B15R0.81 CCCCOCCOCCOCC(O)CO 7a_100011215186_100011219619 [0,1,0,0,0,0|3,0,0]=4 1803 B15R0.81 CCCCOCCOCCOC[C@@H](C)CC 34a_100011215186_100009816398 [0,1,0,0,0,0|2,0,0]=3 1804 B15R0.81 CCCCOCCOCCOC[C@@H](C)CC 7a_100011215186_100009816398 [0,1,0,0,0,0|2,0,0]=3 1805 B15R0.81 CCCCOCCOCCOC[C@@H](C)CO 34a_100011215186_100000059175 [0,1,0,0,0,0|3,0,0]=4 1806 B15R0.81 CCCCOCCOCCOC[C@@H](C)CO 7a_100011215186_100000059175 [0,1,0,0,0,0|3,0,0]=4 1807 B15R0.81 CCCCOCCOCCOC[C@@H](O)CF 34a_100011215186_100015614560 [0,1,0,0,0,0|3,0,0]=4 1808 B15R0.81 CCCCOCCOCCOC[C@@H](O)CF 7a_100011215186_100015614560 [0,1,0,0,0,0|3,0,0]=4 1809 B15R0.81 CCCCOCCOCCOC[C@@H](O)CO 34a_100011215186_100009815848 [0,1,0,0,0,0|3,0,0]=4 1810 B15R0.81 CCCCOCCOCCOC[C@@H](O)CO 7a_100011215186_100009815848 [0,1,0,0,0,0|3,0,0]=4 1811 B15R0.81 CCCCOCCSCCOCC(=O)OC 62a_100000090808_100000743108 [0,1,0,0,0,0|1,1,1]=4 1812 B15R0.81 CCCCOCCSCCOCC(=O)OC 62a_100000743108_100000090808 [0,1,0,0,0,0|1,1,1]=4 1813 B15R0.81 CCCCSCCOCCOCC(=O)OC 34a_200000230436_100000090808 [0,1,0,0,0,0|1,1,1]=4 1814 B15R0.81 CCCCSCCOCCOCC(=O)OC 7a_200000230436_100000090808 [0,1,0,0,0,0|1,1,1]=4 1815 B15R0.81 CC[C@H](C)CNCCOCCOCCOC 2230a_100012028300_100009816398 [0,1,0,0,0,0|2,0,0]=3 1816 B15R0.81 CC[C@H](C)CNCCOCCOCCOC 34a_100012028300_100009816398 [0,1,0,0,0,0|2,0,0]=3 1817 B15R0.81 CC[C@H](C)COCCOCCOCCCN 34a_100011996194_100009816398 [0,1,0,0,0,0|3,0,0]=4 1818 B15R0.81 CC[C@H](C)COCCOCCOCCNC 34a_200014138305_100009816398 [0,1,0,0,0,0|2,0,0]=3 1819 B15R0.81 CC[C@H](C)COCCOCCOCCOC 34a_100000688194_100009816398 [0,1,0,0,0,0|1,0,0]=2 1820 B15R0.81 CC[C@H](C)COCCOCCOCCOC 7a_100000688194_100009816398 [0,1,0,0,0,0|1,0,0]=2 1821 B15R0.81 CC[C@H](C)COCCOCCOCCOC 7a_100009816381_100013367474 [0,1,0,0,0,0|1,0,0]=2 1822 B15R0.81 CC[C@H](C)CSCCOCCOCCOC 62a_100009816398_100013367474 [0,1,0,0,0,0|1,1,0]=3 1823 B15R0.81 CC[C@H](C)CSCCOCCOCCOC 62a_100013367474_100009816398 [0,1,0,0,0,0|1,1,0]=3 1824 B15R0.81 CNC(=O)CNCCOCCOCCOC 2230a_100000693194_100013367474 [0,1,0,0,0,0|2,0,1]=4 1825 B15R0.81 CNC(=O)CNCCOCCOCCOC 2230a_100012028300_100000183359 [0,1,0,0,0,0|2,0,1]=4 1826 B15R0.81 CNC(=O)CNCCOCCOCCOC 34a_100012028300_100000183359 [0,1,0,0,0,0|2,0,1]=4 1827 B15R0.81 CNC(=O)COCCOCCOCCOC 11a_106832991635_100012826494 [0,1,0,0,0,0|1,0,1]=3 1828 B15R0.81 CNC(=O)COCCOCCOCCOC 1626a_100102657272_100012826494 [0,1,0,0,0,0|1,0,1]=3 1829 B15R0.81 CNC(=O)COCCOCCOCCOC 240690a_100102657272_100012826494 [0,1,0,0,0,0|1,0,1]=3 1830 B15R0.81 CNC(=O)COCCOCCOCCOC 34a_100000688194_100000183359 [0,1,0,0,0,0|1,0,1]=3 1831 B15R0.81 CNC(=O)COCCOCCOCCOC 34a_100000750040_100013367474 [0,1,0,0,0,0|1,0,1]=3 1832 B15R0.81 CNC(=O)COCCOCCOCCOC 527a_100102657272_100012826494 [0,1,0,0,0,0|1,0,1]=3 1833 B15R0.81 CNC(=O)COCCOCCOCCOC 7a_100000688194_100000183359 [0,1,0,0,0,0|1,0,1]=3 1834 B15R0.81 CNC(=O)CSCCOCCOCCOC 62a_100000183359_100013367474 [0,1,0,0,0,0|1,1,1]=4 1835 B15R0.81 CNC(=O)CSCCOCCOCCOC 62a_100013367474_100000183359 [0,1,0,0,0,0|1,1,1]=4 1836 B15R0.81 CNCCCCCOCCOCC(=O)OC 34a_100000722520_100000090808 [0,1,0,0,0,0|2,0,1]=4 1837 B15R0.81 CNCCOCCOCCCCC(=O)OC 34a_100000228057_100000204269 [0,1,0,0,0,0|2,0,1]=4 1838 B15R0.81 CNCCOCCOCCOCC(=O)NC 34a_200014138305_100000183359 [0,1,0,0,0,0|2,0,1]=4 1839 B15R0.81 CNCCOCCOCCOCC(=O)OC 34a_100000228057_100000090808 [0,1,0,0,0,0|1,0,1]=3 1840 B15R0.81 CNCCOCCOCCOCC(=O)OC 34a_200014138305_100000747449 [0,1,0,0,0,0|1,0,1]=3 1841 B15R0.81 CNCCOCCOCCOCC(O)CO 34a_200014138305_100011219619 [0,1,0,0,0,0|3,0,0]=4 1842 B15R0.81 CNCCOCCOCCOC[C@@H](C)CO 34a_200014138305_100000059175 [0,1,0,0,0,0|3,0,0]=4 1843 B15R0.81 CNCCOCCOCCOC[C@@H](O)CF 34a_200014138305_100015614560 [0,1,0,0,0,0|3,0,0]=4 1844 B15R0.81 CNCCOCCOCCOC[C@@H](O)CO 34a_200014138305_100009815848 [0,1,0,0,0,0|3,0,0]=4 1845 B15R0.81 COC(=O)COCCOCCOCCC#N 7a_100011023656_100000184422 [0,1,0,0,0,0|2,0,1]=4 1846 B15R0.81 COC(=O)COCCOCCOCCCF 34a_100011023656_100011934791 [0,1,0,0,0,0|2,0,1]=4 1847 B15R0.81 COC(=O)COCCOCCOCCCF 7a_100011023656_100011934791 [0,1,0,0,0,0|2,0,1]=4 1848 B15R0.81 COC(=O)COCCOCCOCCCN 34a_100011996194_100000747449 [0,1,0,0,0,0|2,0,1]=4 1849 B15R0.81 COC(=O)COCCOCCOCCCO 34a_100011023656_100000230001 [0,1,0,0,0,0|2,0,1]=4 1850 B15R0.81 COC(=O)COCCOCCOCCCO 7a_100011023656_100011215043 [0,1,0,0,0,0|2,0,1]=4 1851 B15R0.81 COC(=O)COCCOCCOCCSC 34a_100011023656_100000212216 [0,1,0,0,0,0|0,1,1]=3 1852 B15R0.81 COC(=O)COCCOCCOCCSC 7a_100011023656_100000212216 [0,1,0,0,0,0|0,1,1]=3 1853 B15R0.81 COCCCCCNCCOCC(=O)OC 2230a_100000747528_100000090808 [0,1,0,0,0,0|2,0,1]=4 1854 B15R0.81 COCCCCCNCCOCC(=O)OC 34a_100000747528_100000090808 [0,1,0,0,0,0|2,0,1]=4 1855 B15R0.81 COCCOCCCCCCCC(=O)OC 34a_100000210237_100010004213 [0,1,0,0,0,0|2,0,1]=4 1856 B15R0.81 COCCOCCCCCCCC(=O)OC 34a_100011022521_100011201679 [0,1,0,0,0,0|2,0,1]=4 1857 B15R0.81 COCCOCCCCCCCC(=O)OC 7a_100011022521_100000233755 [0,1,0,0,0,0|2,0,1]=4 1858 B15R0.81 COCCOCCNCCCCC(=O)OC 2230a_100000745349_100000204269 [0,1,0,0,0,0|2,0,1]=4 1859 B15R0.81 COCCOCCNCCCCC(=O)OC 34a_100000745349_100000204269 [0,1,0,0,0,0|2,0,1]=4 1860 B15R0.81 COCCOCCNCCOCC(=O)OC 2230a_100000745349_100000090808 [0,1,0,0,0,0|1,0,1]=3 1861 B15R0.81 COCCOCCNCCOCC(=O)OC 34a_100000745349_100000090808 [0,1,0,0,0,0|1,0,1]=3 1862 B15R0.81 COCCOCCOCCCCC(=O)OC 34a_100000059025_100000695917 [0,1,0,0,0,0|1,0,1]=3 1863 B15R0.81 COCCOCCOCCCCC(=O)OC 34a_100011215163_100000204269 [0,1,0,0,0,0|1,0,1]=3 1864 B15R0.81 COCCOCCOCCCCC(=O)OC 7a_100000059025_100000695917 [0,1,0,0,0,0|1,0,1]=3 1865 B15R0.81 COCCOCCOCCCCC(=O)OC 7a_100011215163_100000204269 [0,1,0,0,0,0|1,0,1]=3 1866 B15R0.81 COCCOCCOCCNCC(=O)OC 2230a_100012028300_100000747449 [0,1,0,0,0,0|1,0,1]=3 1867 B15R0.81 COCCOCCOCCNCC(=O)OC 34a_100012028300_100000747449 [0,1,0,0,0,0|1,0,1]=3 1868 B15R0.81 COCCOCCOCCNCC(C)CO 34a_100000744482_100013367474 [0,1,0,0,0,0|3,0,0]=4 1869 B15R0.81 COCCOCCOCCNCC(O)CO 2230a_100012028300_100011219619 [0,1,0,0,0,0|3,0,0]=4 1870 B15R0.81 COCCOCCOCCNCC(O)CO 34a_100012028300_100011219619 [0,1,0,0,0,0|3,0,0]=4 1871 B15R0.81 COCCOCCOCCNC[C@@H](C)CO 2230a_100012028300_100000059175 [0,1,0,0,0,0|3,0,0]=4 1872 B15R0.81 COCCOCCOCCNC[C@@H](C)CO 34a_100012028300_100000059175 [0,1,0,0,0,0|3,0,0]=4 1873 B15R0.81 COCCOCCOCCNC[C@@H](C)OC 2230a_100020591295_100013367474 [0,1,0,0,0,0|1,0,0]=2 1874 B15R0.81 COCCOCCOCCNC[C@@H](F)CO 34a_100015665980_100013367474 [0,1,0,0,0,0|3,0,0]=4 1875 B15R0.81 COCCOCCOCCNC[C@@H](O)CF 2230a_100012028300_100015614560 [0,1,0,0,0,0|3,0,0]=4 1876 B15R0.81 COCCOCCOCCNC[C@@H](O)CF 34a_100012028300_100015614560 [0,1,0,0,0,0|3,0,0]=4 1877 B15R0.81 COCCOCCOCCNC[C@@H](O)CO 2230a_100012028300_100009815848 [0,1,0,0,0,0|3,0,0]=4 1878 B15R0.81 COCCOCCOCCNC[C@@H](O)CO 34a_100012028300_100009815848 [0,1,0,0,0,0|3,0,0]=4 1879 B15R0.81 COCCOCCOCCNC[C@H](O)CO 2230a_100020644852_100013367474 [0,1,0,0,0,0|3,0,0]=4 1880 B15R0.81 COCCOCCOCCOCC(=O)CF 1458a_100012826494_100015361967 [0,1,0,0,0,0|2,0,1]=4 1881 B15R0.81 COCCOCCOCCOCC(=O)OC 34a_100000688194_100000747449 [0,1,0,0,0,0|0,0,1]=2 1882 B15R0.81 COCCOCCOCCOCC(=O)OC 34a_100011023656_100011201679 [0,1,0,0,0,0|0,0,1]=2 1883 B15R0.81 COCCOCCOCCOCC(=O)OC 34a_100011215163_100000090808 [0,1,0,0,0,0|0,0,1]=2 1884 B15R0.81 COCCOCCOCCOCC(=O)OC 7a_100000688194_100000747449 [0,1,0,0,0,0|0,0,1]=2 1885 B15R0.81 COCCOCCOCCOCC(=O)OC 7a_100011023656_100000233755 [0,1,0,0,0,0|0,0,1]=2 1886 B15R0.81 COCCOCCOCCOCC(=O)OC 7a_100011215163_100000090808 [0,1,0,0,0,0|0,0,1]=2 1887 B15R0.81 COCCOCCOCCOCC(C)CN 34a_100000744482_100013367474 [0,1,0,0,0,0|2,0,0]=3 1888 B15R0.81 COCCOCCOCCOCC(C)OC 34a_100000690652_100013367474 [0,1,0,0,0,0|0,0,0]=1 1889 B15R0.81 COCCOCCOCCOCC(Cl)CCl 34a_100000033668_100013367474 [0,1,0,0,0,0|2,0,0]=3 1890 B15R0.81 COCCOCCOCCOCC(O)CO 34a_100000688194_100011219619 [0,1,0,0,0,0|2,0,0]=3 1891 B15R0.81 COCCOCCOCCOCC(O)CO 7a_100000688194_100011219619 [0,1,0,0,0,0|2,0,0]=3 1892 B15R0.81 COCCOCCOCCOC[C@@H](C)CO 34a_100000688194_100000059175 [0,1,0,0,0,0|2,0,0]=3 1893 B15R0.81 COCCOCCOCCOC[C@@H](C)CO 7a_100000688194_100000059175 [0,1,0,0,0,0|2,0,0]=3 1894 B15R0.81 COCCOCCOCCOC[C@@H](O)CF 34a_100000688194_100015614560 [0,1,0,0,0,0|2,0,0]=3 1895 B15R0.81 COCCOCCOCCOC[C@@H](O)CF 7a_100000688194_100015614560 [0,1,0,0,0,0|2,0,0]=3 1896 B15R0.81 COCCOCCOCCOC[C@@H](O)CO 34a_100000688194_100009815848 [0,1,0,0,0,0|2,0,0]=3 1897 B15R0.81 COCCOCCOCCOC[C@@H](O)CO 7a_100000688194_100009815848 [0,1,0,0,0,0|2,0,0]=3 1898 B15R0.81 COCCOCCOCCOC[C@H](F)CN 34a_100015665980_100013367474 [0,1,0,0,0,0|2,0,0]=3 1899 B15R0.81 COCCOCCOCCSCC(=O)OC 62a_100000747449_100013367474 [0,1,0,0,0,0|0,1,1]=3 1900 B15R0.81 COCCOCCOCCSCC(=O)OC 62a_100013367474_100000747449 [0,1,0,0,0,0|0,1,1]=3 1901 B15R0.81 COCCOCCOCCSCC(O)CO 62a_100011219619_100013367474 [0,1,0,0,0,0|2,1,0]=4 1902 B15R0.81 COCCOCCOCCSCC(O)CO 62a_100013367474_100011219619 [0,1,0,0,0,0|2,1,0]=4 1903 B15R0.81 COCCOCCOCCSC[C@@H](C)CO 62a_100000059175_100013367474 [0,1,0,0,0,0|2,1,0]=4 1904 B15R0.81 COCCOCCOCCSC[C@@H](C)CO 62a_100013367474_100000059175 [0,1,0,0,0,0|2,1,0]=4 1905 B15R0.81 COCCOCCOCCSC[C@@H](O)CF 62a_100013367474_100015614560 [0,1,0,0,0,0|2,1,0]=4 1906 B15R0.81 COCCOCCOCCSC[C@@H](O)CF 62a_100015614560_100013367474 [0,1,0,0,0,0|2,1,0]=4 1907 B15R0.81 COCCOCCOCCSC[C@@H](O)CO 62a_100009815848_100013367474 [0,1,0,0,0,0|2,1,0]=4 1908 B15R0.81 COCCOCCOCCSC[C@@H](O)CO 62a_100013367474_100009815848 [0,1,0,0,0,0|2,1,0]=4 1909 B15R0.81 COCCOCCSCCCCC(=O)OC 62a_100000204269_100000695917 [0,1,0,0,0,0|1,1,1]=4 1910 B15R0.81 COCCOCCSCCCCC(=O)OC 62a_100000695917_100000204269 [0,1,0,0,0,0|1,1,1]=4 1911 B15R0.81 COCCOCCSCCOCC(=O)OC 62a_100000090808_100000695917 [0,1,0,0,0,0|0,1,1]=3 1912 B15R0.81 COCCOCCSCCOCC(=O)OC 62a_100000695917_100000090808 [0,1,0,0,0,0|0,1,1]=3 1913 B15R0.133 CCCCCCCC(=O)CCOCCOC 1458a_100000211969_100000695917 [0,1,0,0,0,0|3,0,0]=4 1914 B15R0.133 CCCCCCCC(=O)CCOCCOC 1458a_100000745395_100000210614 [0,1,0,0,0,0|3,0,0]=4 1915 B15R0.133 CCCCCCCN(C)CCOCCOC 2230a_100000228206_100000695917 [0,1,0,0,0,0|3,0,0]=4 1916 B15R0.133 CCCCCCCN(C)CCOCCOC 269982a_100000228206_100000695917 [0,1,0,0,0,0|3,0,0]=4 1917 B15R0.133 CCCCOCCC(=O)CCCCCOC 1458a_100011935119_100000743108 [0,1,0,0,0,0|3,0,0]=4 1918 B15R0.133 CCCCOCCC(=O)CCOCCOC 1458a_100000745395_100000743108 [0,1,0,0,0,0|2,0,0]=3 1919 B15R0.133 COCCCCCC(=O)CCOCCOC 1458a_100011935119_100000695917 [0,1,0,0,0,0|2,0,0]=3 1920 B15R0.133 COCCOCCC(=O)CCOCCOC 1458a_100000745395_100000695917 [0,1,0,0,0,0|1,0,0]=2 1921 B15R0.149 CCCCCCC(C)NCCOCCOC 2230a_100000210919_100000695917 [0,1,0,0,0,0|3,0,0]=4 1922 B15R0.149 CCCCCCC(C)NCCOCCOC 2230a_100000745349_100011215978 [0,1,0,0,0,0|3,0,0]=4 1923 B15R0.149 CCCCCCC(C)NCCOCCOC 270004a_100000745349_100000210826 [0,1,0,0,0,0|3,0,0]=4 1924 B15R0.149 CCCCCCC(C)NCCOCCOC 34a_100000210919_100000695917 [0,1,0,0,0,0|3,0,0]=4 1925 B15R0.149 CCCCCCC(C)NCCOCCOC 34a_100000745349_100011215978 [0,1,0,0,0,0|3,0,0]=4 1926 B15R0.149 CCCCCCC(C)OCCOCCCC 34a_100000210238_100011215978 [0,1,0,0,0,0|3,0,0]=4 1927 B15R0.149 CCCCCCC(C)OCCOCCCC 34a_100000210265_100000743108 [0,1,0,0,0,0|3,0,0]=4 1928 B15R0.149 CCCCCCC(C)OCCOCCCC 7a_100000210238_100011215978 [0,1,0,0,0,0|3,0,0]=4 1929 B15R0.149 CCCCCCC(C)OCCOCCCC 7a_100000210265_100000743108 [0,1,0,0,0,0|3,0,0]=4 1930 B15R0.149 CCCCCCC(C)OCCOCCNC 34a_100000228057_100011215978 [0,1,0,0,0,0|3,0,0]=4 1931 B15R0.149 CCCCCCC(C)OCCOCCOC 34a_100000210265_100000695917 [0,1,0,0,0,0|2,0,0]=3 1932 B15R0.149 CCCCCCC(C)OCCOCCOC 34a_100011215163_100011215978 [0,1,0,0,0,0|2,0,0]=3 1933 B15R0.149 CCCCCCC(C)OCCOCCOC 7a_100000210265_100000695917 [0,1,0,0,0,0|2,0,0]=3 1934 B15R0.149 CCCCCCC(C)OCCOCCOC 7a_100011215163_100011215978 [0,1,0,0,0,0|2,0,0]=3 1935 B15R0.149 CCCCCCC(C)SCCOCCOC 62a_100000695917_100011215978 [0,1,0,0,0,0|2,1,0]=4 1936 B15R0.149 CCCCCCC(C)SCCOCCOC 62a_100011215978_100000695917 [0,1,0,0,0,0|2,1,0]=4 1937 B15R0.149 CCCCCCCCC(C)COCCOC 34a_200012125181_100011201679 [0,1,0,0,0,0|3,0,0]=4 1938 B15R0.149 CCCCCCCCC(C)COCCOC 7a_200012125181_100000233755 [0,1,0,0,0,0|3,0,0]=4 1939 B15R0.149 CCCCCCCOC(C)COCCCC 34a_100011217071_100000210614 [0,1,0,0,0,0|3,0,0]=4 1940 B15R0.149 CCCCCCCOC(C)COCCCC 7a_100011217071_100000210614 [0,1,0,0,0,0|3,0,0]=4 1941 B15R0.149 CCCCOCC(=O)CCCOCCOC 1458a_100000757543_100011216529 [0,1,0,0,0,0|2,0,1]=4 1942 B15R0.149 CCCCOCC(=O)NCCOCCOC 11a_100000745349_100000757543 [0,1,0,0,0,0|2,0,1]=4 1943 B15R0.149 CCCCOCC(=O)NCCOCCOC 1626a_100000745349_100000757543 [0,1,0,0,0,0|2,0,1]=4 1944 B15R0.149 CCCCOCC(=O)NCCOCCOC 240690a_100000745349_100000757543 [0,1,0,0,0,0|2,0,1]=4 1945 B15R0.149 CCCCOCC(=O)NCCOCCOC 527a_100000745349_100000757543 [0,1,0,0,0,0|2,0,1]=4 1946 B15R0.149 CCCCOCC(C)OCCOCCOC 34a_100011217071_100000695917 [0,1,0,0,0,0|1,0,0]=2 1947 B15R0.149 CCCCOCC(C)OCCOCCOC 7a_100011217071_100000695917 [0,1,0,0,0,0|1,0,0]=2 1948 B15R0.149 CCCCOCCOC(C)COCCCC 34a_100011217071_100000743108 [0,1,0,0,0,0|2,0,0]=3 1949 B15R0.149 CCCCOCCOC(C)COCCCC 7a_100011217071_100000743108 [0,1,0,0,0,0|2,0,0]=3 1950 B15R0.149 COCCCCCCC(=O)COCCOC 1458a_100000211095_100011998445 [0,1,0,0,0,0|2,0,1]=4 1951 B15R0.149 COCCCCCNC(=O)COCCOC 11a_100000747528_100000211095 [0,1,0,0,0,0|2,0,1]=4 1952 B15R0.149 COCCCCCNC(=O)COCCOC 1626a_100000747528_100000211095 [0,1,0,0,0,0|2,0,1]=4 1953 B15R0.149 COCCCCCNC(=O)COCCOC 240690a_100000747528_100000211095 [0,1,0,0,0,0|2,0,1]=4 1954 B15R0.149 COCCCCCNC(=O)COCCOC 527a_100000747528_100000211095 [0,1,0,0,0,0|2,0,1]=4 1955 B15R0.149 COCCOCCCC(=O)COCCOC 1458a_100000211095_100011216529 [0,1,0,0,0,0|1,0,1]=3 1956 B15R0.149 COCCOCCNC(=O)COCCOC 11a_100000745349_100000211095 [0,1,0,0,0,0|1,0,1]=3 1957 B15R0.149 COCCOCCNC(=O)COCCOC 1626a_100000745349_100000211095 [0,1,0,0,0,0|1,0,1]=3 1958 B15R0.149 COCCOCCNC(=O)COCCOC 240690a_100000745349_100000211095 [0,1,0,0,0,0|1,0,1]=3 1959 B15R0.149 COCCOCCNC(=O)COCCOC 527a_100000745349_100000211095 [0,1,0,0,0,0|1,0,1]=3 1960 B15R0.164 C=C(Br)CCOCCOCCOCCOC 34a_100009813270_100013367474 [0,1,0,0,0,0|1,0,1]=3 1961 B15R0.164 C=C(C)CCNCCOCCOCCOC 2230a_100012028300_100000730704 [0,1,0,0,0,0|2,0,0]=3 1962 B15R0.164 C=C(C)CCNCCOCCOCCOC 34a_100012028300_100000730704 [0,1,0,0,0,0|2,0,0]=3 1963 B15R0.164 C=C(C)CCOCCOCCOCCCC 34a_100011215186_100000730704 [0,1,0,0,0,0|2,0,0]=3 1964 B15R0.164 C=C(C)CCOCCOCCOCCCC 7a_100011215186_100000730704 [0,1,0,0,0,0|2,0,0]=3 1965 B15R0.164 C=C(C)CCOCCOCCOCCCN 34a_100011996194_100000730704 [0,1,0,0,0,0|3,0,0]=4 1966 B15R0.164 C=C(C)CCOCCOCCOCCNC 34a_200014138305_100000730704 [0,1,0,0,0,0|2,0,0]=3 1967 B15R0.164 C=C(C)CCOCCOCCOCCOC 34a_100000688194_100000730704 [0,1,0,0,0,0|1,0,0]=2 1968 B15R0.164 C=C(C)CCOCCOCCOCCOC 34a_100000764851_100013367474 [0,1,0,0,0,0|1,0,0]=2 1969 B15R0.164 C=C(C)CCOCCOCCOCCOC 7a_100000688194_100000730704 [0,1,0,0,0,0|1,0,0]=2 1970 B15R0.164 C=C(C)CCSCCOCCOCCOC 62a_100000730704_100013367474 [0,1,0,0,0,0|1,1,0]=3 1971 B15R0.164 C=C(C)CCSCCOCCOCCOC 62a_100013367474_100000730704 [0,1,0,0,0,0|1,1,0]=3 1972 B15R0.164 CC(C)CCOCCOCCOCCCN 34a_100011996194_100000210312 [0,1,0,0,0,0|3,0,0]=4 1973 B15R0.164 CC(O)CCOCCOCCOCCCN 34a_100011996194_100012276601 [0,1,0,0,0,0|3,0,0]=4 1974 B15R0.164 CCCCOCCOCCCCCC(C)C 34a_100000210238_100000210682 [0,1,0,0,0,0|3,0,0]=4 1975 B15R0.164 CCCCOCCOCCCCCC(C)C 34a_100011995859_100000743108 [0,1,0,0,0,0|3,0,0]=4 1976 B15R0.164 CCCCOCCOCCCCCC(C)C 7a_100000210238_100000210682 [0,1,0,0,0,0|3,0,0]=4 1977 B15R0.164 CCCCOCCOCCCCCC(C)C 7a_100011995859_100000743108 [0,1,0,0,0,0|3,0,0]=4 1978 B15R0.164 CCCCOCCOCCOCC=C(C)C 34a_100011215186_100000761012 [0,1,0,0,0,0|2,0,1]=4 1979 B15R0.164 CCCCOCCOCCOCC=C(C)C 7a_100011215186_100000761012 [0,1,0,0,0,0|2,0,1]=4 1980 B15R0.164 CCCCOCCOCCOCCC(=O)C 7a_100011215186_100000053229 [0,1,0,0,0,0|2,0,0]=3 1981 B15R0.164 CCCCOCCOCCOCCC(=O)N 34a_100011215186_100000731001 [0,1,0,0,0,0|3,0,0]=4 1982 B15R0.164 CCCCOCCOCCOCCC(=O)N 7a_100011215186_100000744528 [0,1,0,0,0,0|3,0,0]=4 1983 B15R0.164 CCCCOCCOCCOCCC(C)C 34a_100011215186_100000210312 [0,1,0,0,0,0|2,0,0]=3 1984 B15R0.164 CCCCOCCOCCOCCC(C)C 7a_100011215186_100000210626 [0,1,0,0,0,0|2,0,0]=3 1985 B15R0.164 CCCCOCCOCCOCCC(C)O 34a_100011215186_100012276601 [0,1,0,0,0,0|2,0,0]=3 1986 B15R0.164 CCCCOCCOCCOCCC(C)O 7a_100011215186_100012276601 [0,1,0,0,0,0|2,0,0]=3 1987 B15R0.164 CCCCOCCOCCOCCN(C)C 7a_100011215186_100000755713 [0,1,0,0,0,0|2,0,0]=3 1988 B15R0.164 CCCCOCCOCCOCOC(=O)C 34a_100011215186_100009813279 [0,1,0,0,0,0|3,0,0]=4 1989 B15R0.164 CCCCOCCOCCOCOC(C)C 34a_100011215186_100000709892 [0,1,0,0,0,0|3,0,0]=4 1990 B15R0.164 CNCCOCCOCCCCCC(C)C 34a_100000228057_100000210682 [0,1,0,0,0,0|3,0,0]=4 1991 B15R0.164 CNCCOCCOCCOCC=C(C)C 34a_200014138305_100000761012 [0,1,0,0,0,0|2,0,1]=4 1992 B15R0.164 CNCCOCCOCCOCCC(=O)N 34a_200014138305_100000731001 [0,1,0,0,0,0|3,0,0]=4 1993 B15R0.164 CNCCOCCOCCOCCC(C)C 34a_200014138305_100000210312 [0,1,0,0,0,0|2,0,0]=3 1994 B15R0.164 CNCCOCCOCCOCCC(C)O 34a_200014138305_100012276601 [0,1,0,0,0,0|2,0,0]=3 1995 B15R0.164 CNCCOCCOCCOCOC(=O)C 34a_200014138305_100009813279 [0,1,0,0,0,0|3,0,0]=4 1996 B15R0.164 CNCCOCCOCCOCOC(C)C 34a_200014138305_100000709892 [0,1,0,0,0,0|3,0,0]=4 1997 B15R0.164 COCCOCCNCCCCCC(C)C 2230a_100000745349_100000210682 [0,1,0,0,0,0|3,0,0]=4 1998 B15R0.164 COCCOCCNCCCCCC(C)C 2230a_100011290863_100000695917 [0,1,0,0,0,0|3,0,0]=4 1999 B15R0.164 COCCOCCNCCCCCC(C)C 34a_100000745349_100000210682 [0,1,0,0,0,0|3,0,0]=4 2000 B15R0.164 COCCOCCNCCCCCC(C)C 34a_100011290863_100000695917 [0,1,0,0,0,0|3,0,0]=4 2001 B15R0.164 COCCOCCOCCCCCB(O)O 34a_100011215163_200009817188 [0,1,0,0,0,0|3,0,0]=4 2002 B15R0.164 COCCOCCOCCCCCB(O)O 7a_100011215163_200009817188 [0,1,0,0,0,0|3,0,0]=4 2003 B15R0.164 COCCOCCOCCCCCC(=O)N 34a_100000123541_100000695917 [0,1,0,0,0,0|3,0,0]=4 2004 B15R0.164 COCCOCCOCCCCCC(=O)N 34a_100011215163_100009817443 [0,1,0,0,0,0|3,0,0]=4 2005 B15R0.164 COCCOCCOCCCCCC(=O)N 7a_100000123541_100000695917 [0,1,0,0,0,0|3,0,0]=4 2006 B15R0.164 COCCOCCOCCCCCC(=O)N 7a_100011215163_100009817443 [0,1,0,0,0,0|3,0,0]=4 2007 B15R0.164 COCCOCCOCCCCCC(=O)[O-] 7a_100102619762_100000695917 [0,1,0,0,0,0|3,0,0]=4 2008 B15R0.164 COCCOCCOCCCCCC(C)C 34a_100011215163_100000210682 [0,1,0,0,0,0|2,0,0]=3 2009 B15R0.164 COCCOCCOCCCCCC(C)C 34a_100011995859_100000695917 [0,1,0,0,0,0|2,0,0]=3 2010 B15R0.164 COCCOCCOCCCCCC(C)C 7a_100011215163_100000210682 [0,1,0,0,0,0|2,0,0]=3 2011 B15R0.164 COCCOCCOCCCCCC(C)C 7a_100011995859_100000695917 [0,1,0,0,0,0|2,0,0]=3 2012 B15R0.164 COCCOCCOCCCCNC(C)C 34a_100011521146_100000695917 [0,1,0,0,0,0|3,0,0]=4 2013 B15R0.164 COCCOCCOCCCCOC(=O)C 34a_100000073216_100000695917 [0,1,0,0,0,0|3,0,0]=4 2014 B15R0.164 COCCOCCOCCCCOC(=O)C 34a_100011215163_100000033659 [0,1,0,0,0,0|3,0,0]=4 2015 B15R0.164 COCCOCCOCCCCOC(=O)C 7a_100000073216_100000695917 [0,1,0,0,0,0|3,0,0]=4 2016 B15R0.164 COCCOCCOCCCCOC(=O)C 7a_100011215163_100000033659 [0,1,0,0,0,0|3,0,0]=4 2017 B15R0.164 COCCOCCOCCCCSC(=O)C 34a_100011215163_200010402107 [0,1,0,0,0,0|3,0,0]=4 2018 B15R0.164 COCCOCCOCCCCSC(=O)C 7a_100011215163_200010402107 [0,1,0,0,0,0|3,0,0]=4 2019 B15R0.164 COCCOCCOCCNCC=C(C)C 2230a_100012028300_100000761012 [0,1,0,0,0,0|2,0,1]=4 2020 B15R0.164 COCCOCCOCCNCC=C(C)C 34a_100000718196_100013367474 [0,1,0,0,0,0|2,0,1]=4 2021 B15R0.164 COCCOCCOCCNCC=C(C)C 34a_100012028300_100000761012 [0,1,0,0,0,0|2,0,1]=4 2022 B15R0.164 COCCOCCOCCNCCC(=O)N 2230a_100012028300_100000744528 [0,1,0,0,0,0|3,0,0]=4 2023 B15R0.164 COCCOCCOCCNCCC(=O)N 34a_100012028300_100000731001 [0,1,0,0,0,0|3,0,0]=4 2024 B15R0.164 COCCOCCOCCNCCC(C)C 2230a_100012028300_100000210312 [0,1,0,0,0,0|2,0,0]=3 2025 B15R0.164 COCCOCCOCCNCCC(C)C 269862a_100012028300_100000185833 [0,1,0,0,0,0|2,0,0]=3 2026 B15R0.164 COCCOCCOCCNCCC(C)C 34a_100012028300_100000210312 [0,1,0,0,0,0|2,0,0]=3 2027 B15R0.164 COCCOCCOCCNCCC(C)O 2230a_100012028300_100012276601 [0,1,0,0,0,0|2,0,0]=3 2028 B15R0.164 COCCOCCOCCNCCC(C)O 2230a_200000755665_100013367474 [0,1,0,0,0,0|2,0,0]=3 2029 B15R0.164 COCCOCCOCCNCCC(C)O 34a_100012028300_100012276601 [0,1,0,0,0,0|2,0,0]=3 2030 B15R0.164 COCCOCCOCCNCOC(=O)C 34a_100012028300_100009813279 [0,1,0,0,0,0|3,0,0]=4 2031 B15R0.164 COCCOCCOCCNCOC(C)C 2230a_100012028300_100000709892 [0,1,0,0,0,0|3,0,0]=4 2032 B15R0.164 COCCOCCOCCNCOC(C)C 34a_100012028300_100000709892 [0,1,0,0,0,0|3,0,0]=4 2033 B15R0.164 COCCOCCOCCOCC=C(C)C 34a_100000688194_100000761012 [0,1,0,0,0,0|1,0,1]=3 2034 B15R0.164 COCCOCCOCCOCC=C(C)C 34a_100000753907_100013367474 [0,1,0,0,0,0|1,0,1]=3 2035 B15R0.164 COCCOCCOCCOCC=C(C)C 7a_100000688194_100000761012 [0,1,0,0,0,0|1,0,1]=3 2036 B15R0.164 COCCOCCOCCOCCC(=O)C 1458a_100000070787_100012349117 [0,1,0,0,0,0|1,0,0]=2 2037 B15R0.164 COCCOCCOCCOCCC(=O)C 1458a_100012359594_200000210301 [0,1,0,0,0,0|1,0,0]=2 2038 B15R0.164 COCCOCCOCCOCCC(=O)C 34a_100000759926_100013367474 [0,1,0,0,0,0|1,0,0]=2 2039 B15R0.164 COCCOCCOCCOCCC(=O)C 7a_100000688194_100000053229 [0,1,0,0,0,0|1,0,0]=2 2040 B15R0.164 COCCOCCOCCOCCC(=O)C 7a_100000759926_100013367474 [0,1,0,0,0,0|1,0,0]=2 2041 B15R0.164 COCCOCCOCCOCCC(=O)N 34a_100000688194_100000731001 [0,1,0,0,0,0|2,0,0]=3 2042 B15R0.164 COCCOCCOCCOCCC(=O)N 34a_100000757172_100013367474 [0,1,0,0,0,0|2,0,0]=3 2043 B15R0.164 COCCOCCOCCOCCC(=O)N 7a_100000688194_100000744528 [0,1,0,0,0,0|2,0,0]=3 2044 B15R0.164 COCCOCCOCCOCCC(=O)N 7a_100000757172_100013367474 [0,1,0,0,0,0|2,0,0]=3 2045 B15R0.164 COCCOCCOCCOCCC(=O)[13CH3] 1458a_100012359594_200025704644 [0,1,0,0,0,0|1,0,0]=2 2046 B15R0.164 COCCOCCOCCOCCC(C)Br 34a_100009893172_100013367474 [0,1,0,0,0,0|1,0,0]=2 2047 B15R0.164 COCCOCCOCCOCCC(C)C 34a_100000210254_100013367474 [0,1,0,0,0,0|1,0,0]=2 2048 B15R0.164 COCCOCCOCCOCCC(C)C 34a_100000688194_100000210312 [0,1,0,0,0,0|1,0,0]=2 2049 B15R0.164 COCCOCCOCCOCCC(C)C 7a_100000210254_100013367474 [0,1,0,0,0,0|1,0,0]=2 2050 B15R0.164 COCCOCCOCCOCCC(C)C 7a_100000688194_100000210626 [0,1,0,0,0,0|1,0,0]=2 2051 B15R0.164 COCCOCCOCCOCCC(C)O 34a_100000688194_100012276601 [0,1,0,0,0,0|1,0,0]=2 2052 B15R0.164 COCCOCCOCCOCCC(C)O 7a_100000688194_100012276601 [0,1,0,0,0,0|1,0,0]=2 2053 B15R0.164 COCCOCCOCCOCCC(F)F 34a_100103093639_100013367474 [0,1,0,0,0,0|2,0,0]=3 2054 B15R0.164 COCCOCCOCCOCCN(C)C 2230a_100102631434_100012349117 [0,1,0,0,0,0|1,0,0]=2 2055 B15R0.164 COCCOCCOCCOCCN(C)C 269982a_100102631434_100012349117 [0,1,0,0,0,0|1,0,0]=2 2056 B15R0.164 COCCOCCOCCOCCN(C)C 7a_100000688194_100000755713 [0,1,0,0,0,0|1,0,0]=2 2057 B15R0.164 COCCOCCOCCOCC[C@@H](C)N 34a_100000706166_100013367474 [0,1,0,0,0,0|1,0,0]=2 2058 B15R0.164 COCCOCCOCCOCOC(=O)C 34a_100000688194_100009813279 [0,1,0,0,0,0|2,0,0]=3 2059 B15R0.164 COCCOCCOCCOCOC(C)C 34a_100000688194_100000709892 [0,1,0,0,0,0|2,0,0]=3 2060 B15R0.164 COCCOCCOCCSCC=C(C)C 62a_100000761012_100013367474 [0,1,0,0,0,0|1,1,1]=4 2061 B15R0.164 COCCOCCOCCSCC=C(C)C 62a_100013367474_100000761012 [0,1,0,0,0,0|1,1,1]=4 2062 B15R0.164 COCCOCCOCCSCCC(=O)C 62a_100000053229_100013367474 [0,1,0,0,0,0|1,1,0]=3 2063 B15R0.164 COCCOCCOCCSCCC(=O)C 62a_100013367474_100000053229 [0,1,0,0,0,0|1,1,0]=3 2064 B15R0.164 COCCOCCOCCSCCC(=O)N 62a_100000744528_100013367474 [0,1,0,0,0,0|2,1,0]=4 2065 B15R0.164 COCCOCCOCCSCCC(=O)N 62a_100013367474_100000744528 [0,1,0,0,0,0|2,1,0]=4 2066 B15R0.164 COCCOCCOCCSCCC(C)C 62a_100000210312_100013367474 [0,1,0,0,0,0|1,1,0]=3 2067 B15R0.164 COCCOCCOCCSCCC(C)C 62a_100013367474_100000210312 [0,1,0,0,0,0|1,1,0]=3 2068 B15R0.164 COCCOCCOCCSCCC(C)O 62a_100012276601_100013367474 [0,1,0,0,0,0|1,1,0]=3 2069 B15R0.164 COCCOCCOCCSCCC(C)O 62a_100013367474_100012276601 [0,1,0,0,0,0|1,1,0]=3 2070 B15R0.164 COCCOCCOCCSCCN(C)C 62a_100013367474_100000755713 [0,1,0,0,0,0|1,1,0]=3 2071 B15R0.164 COCCOCCOCCSCOC(=O)C 62a_100000076356_100013367474 [0,1,0,0,0,0|2,1,0]=4 2072 B15R0.164 COCCOCCOCCSCOC(=O)C 62a_100013367474_100000076356 [0,1,0,0,0,0|2,1,0]=4 2073 B15R0.164 COCCOCCOCCSCOC(C)C 62a_100000709892_100013367474 [0,1,0,0,0,0|2,1,0]=4 2074 B15R0.164 COCCOCCOCCSCOC(C)C 62a_100013367474_100000709892 [0,1,0,0,0,0|2,1,0]=4 2075 B15R0.164 COCCOCCSCCCCCC(C)C 62a_100000210682_100000695917 [0,1,0,0,0,0|2,1,0]=4 2076 B15R0.164 COCCOCCSCCCCCC(C)C 62a_100000695917_100000210682 [0,1,0,0,0,0|2,1,0]=4 2077 B15R0.322 CCCCCC(=O)COCCOCCOC 1458a_100011214951_100000210326 [0,1,0,0,0,0|2,0,1]=4 2078 B15R0.322 CCCCCC(=O)COCCOCCOC 34a_100011215163_200012276598 [0,1,0,0,0,0|2,0,1]=4 2079 B15R0.322 CCCCCC(=O)COCCOCCOC 7a_100011215163_200012276598 [0,1,0,0,0,0|2,0,1]=4 2080 B15R0.322 CCCCCCCCCC(C)OCCOC 34a_100011218016_100011201679 [0,1,0,0,0,0|3,0,0]=4 2081 B15R0.322 CCCCCCCCCC(C)OCCOC 7a_100011218016_100000233755 [0,1,0,0,0,0|3,0,0]=4 2082 B15R0.322 CCCCCCCOCC(=O)OCCOC 34a_100000210272_200000040189 [0,1,0,0,0,0|2,0,1]=4 2083 B15R0.322 CCCCCCCOCC(=O)OCCOC 7a_100000210272_200000040189 [0,1,0,0,0,0|2,0,1]=4 2084 B15R0.322 CCCCNC(=O)COCCOCCOC 11a_100000102301_100011214951 [0,1,0,0,0,0|2,0,1]=4 2085 B15R0.322 CCCCNC(=O)COCCOCCOC 1626a_100000102301_100011214951 [0,1,0,0,0,0|2,0,1]=4 2086 B15R0.322 CCCCNC(=O)COCCOCCOC 240690a_100000102301_100011214951 [0,1,0,0,0,0|2,0,1]=4 2087 B15R0.322 CCCCNC(=O)COCCOCCOC 34a_100011215163_100000182744 [0,1,0,0,0,0|2,0,1]=4 2088 B15R0.322 CCCCNC(=O)COCCOCCOC 527a_100000102301_100011214951 [0,1,0,0,0,0|2,0,1]=4 2089 B15R0.322 CCCCNC(=O)COCCOCCOC 7a_100011215163_100000182744 [0,1,0,0,0,0|2,0,1]=4 2090 B15R0.322 CCCCOC(=O)CNCCOCCOC 2230a_100000745349_100000211628 [0,1,0,0,0,0|2,0,1]=4 2091 B15R0.322 CCCCOC(=O)CNCCOCCOC 34a_100000745349_100000211628 [0,1,0,0,0,0|2,0,1]=4 2092 B15R0.322 CCCCOC(=O)COCCOCCNC 34a_100000228057_100000211628 [0,1,0,0,0,0|2,0,1]=4 2093 B15R0.322 CCCCOC(=O)COCCOCCOC 34a_100011215163_100000211628 [0,1,0,0,0,0|1,0,1]=3 2094 B15R0.322 CCCCOC(=O)COCCOCCOC 7a_100011215163_100000211628 [0,1,0,0,0,0|1,0,1]=3 2095 B15R0.322 CCCCOC(=O)CSCCOCCOC 62a_100000211628_100000695917 [0,1,0,0,0,0|1,1,1]=4 2096 B15R0.322 CCCCOC(=O)CSCCOCCOC 62a_100000695917_100000211628 [0,1,0,0,0,0|1,1,1]=4 2097 B15R0.322 CCCCOCCOCC(=O)CCCOC 1458a_100011216887_100000740836 [0,1,0,0,0,0|2,0,1]=4 2098 B15R0.322 CCCCOCCOCC(=O)NCCOC 1626a_100000209980_100011216887 [0,1,0,0,0,0|2,0,1]=4 2099 B15R0.322 CCCCOCCOCC(=O)NCCOC 240690a_100000209980_100011216887 [0,1,0,0,0,0|2,0,1]=4 2100 B15R0.322 CCCCOCCOCC(=O)NCCOC 34a_100000210238_100000183275 [0,1,0,0,0,0|2,0,1]=4 2101 B15R0.322 CCCCOCCOCC(=O)NCCOC 527a_100000209980_100011216887 [0,1,0,0,0,0|2,0,1]=4 2102 B15R0.322 CCCCOCCOCC(=O)NCCOC 7a_100000210238_100000183275 [0,1,0,0,0,0|2,0,1]=4 2103 B15R0.322 CCCCOCCOCC(=O)OCCCC 34a_100000210238_100000211628 [0,1,0,0,0,0|2,0,1]=4 2104 B15R0.322 CCCCOCCOCC(=O)OCCCC 7a_100000210238_100000211628 [0,1,0,0,0,0|2,0,1]=4 2105 B15R0.322 CCCCOCCOCC(=O)OCCOC 34a_100000210238_200000040189 [0,1,0,0,0,0|1,0,1]=3 2106 B15R0.322 CCCCOCCOCC(=O)OCCOC 7a_100000210238_200000040189 [0,1,0,0,0,0|1,0,1]=3 2107 B15R0.322 CCCCOCCSCC(=O)OCCOC 62a_100000743108_200000040189 [0,1,0,0,0,0|1,1,1]=4 2108 B15R0.322 CCCCOCCSCC(=O)OCCOC 62a_200000040189_100000743108 [0,1,0,0,0,0|1,1,1]=4 2109 B15R0.322 CCCCSCCOCC(=O)OCCOC 34a_200000230436_200000040189 [0,1,0,0,0,0|1,1,1]=4 2110 B15R0.322 CCCCSCCOCC(=O)OCCOC 7a_200000230436_200000040189 [0,1,0,0,0,0|1,1,1]=4 2111 B15R0.322 CNCCCCCOCC(=O)OCCOC 34a_100000722520_200000040189 [0,1,0,0,0,0|2,0,1]=4 2112 B15R0.322 CNCCOCCOCC(=O)NCCOC 34a_100000228057_100000183275 [0,1,0,0,0,0|2,0,1]=4 2113 B15R0.322 CNCCOCCOCC(=O)OCCOC 34a_100000228057_200000040189 [0,1,0,0,0,0|1,0,1]=3 2114 B15R0.322 COCCCC(=O)COCCOCCOC 1458a_100011214951_100000740836 [0,1,0,0,0,0|1,0,1]=3 2115 B15R0.322 COCCCC(C)OCCCOCCOC 34a_200011539412_100011216529 [0,1,0,0,0,0|3,0,0]=4 2116 B15R0.322 COCCCC(C)OCCCOCCOC 7a_200011539412_100011216529 [0,1,0,0,0,0|3,0,0]=4 2117 B15R0.322 COCCCCCNCC(=O)OCCOC 2230a_100000747528_200000040189 [0,1,0,0,0,0|2,0,1]=4 2118 B15R0.322 COCCCCCNCC(=O)OCCOC 34a_100000747528_200000040189 [0,1,0,0,0,0|2,0,1]=4 2119 B15R0.322 COCCNC(=O)CNCCOCCOC 2230a_100000745349_100000183275 [0,1,0,0,0,0|2,0,1]=4 2120 B15R0.322 COCCNC(=O)CNCCOCCOC 2230a_100000754632_100000695917 [0,1,0,0,0,0|2,0,1]=4 2121 B15R0.322 COCCNC(=O)CNCCOCCOC 34a_100000745349_100000183275 [0,1,0,0,0,0|2,0,1]=4 2122 B15R0.322 COCCNC(=O)COCCOCCOC 1626a_100000209980_100011214951 [0,1,0,0,0,0|1,0,1]=3 2123 B15R0.322 COCCNC(=O)COCCOCCOC 240690a_100000209980_100011214951 [0,1,0,0,0,0|1,0,1]=3 2124 B15R0.322 COCCNC(=O)COCCOCCOC 34a_100011215163_100000183275 [0,1,0,0,0,0|1,0,1]=3 2125 B15R0.322 COCCNC(=O)COCCOCCOC 527a_100000209980_100011214951 [0,1,0,0,0,0|1,0,1]=3 2126 B15R0.322 COCCNC(=O)COCCOCCOC 7a_100011215163_100000183275 [0,1,0,0,0,0|1,0,1]=3 2127 B15R0.322 COCCNC(=O)CSCCOCCOC 62a_100000183275_100000695917 [0,1,0,0,0,0|1,1,1]=4 2128 B15R0.322 COCCNC(=O)CSCCOCCOC 62a_100000695917_100000183275 [0,1,0,0,0,0|1,1,1]=4 2129 B15R0.322 COCCOCCNCC(=O)OCCOC 2230a_100000745349_200000040189 [0,1,0,0,0,0|1,0,1]=3 2130 B15R0.322 COCCOCCNCC(=O)OCCOC 34a_100000745349_200000040189 [0,1,0,0,0,0|1,0,1]=3 2131 B15R0.322 COCCOCCOCC(=O)NCCSC 11a_100020590264_100011214951 [0,1,0,0,0,0|1,1,1]=4 2132 B15R0.322 COCCOCCOCC(=O)NCCSC 1626a_100020590264_100011214951 [0,1,0,0,0,0|1,1,1]=4 2133 B15R0.322 COCCOCCOCC(=O)NCCSC 240690a_100020590264_100011214951 [0,1,0,0,0,0|1,1,1]=4 2134 B15R0.322 COCCOCCOCC(=O)NCCSC 527a_100020590264_100011214951 [0,1,0,0,0,0|1,1,1]=4 2135 B15R0.322 COCCOCCOCC(=O)OCCOC 34a_100011215163_200000040189 [0,1,0,0,0,0|0,0,1]=2 2136 B15R0.322 COCCOCCOCC(=O)OCCOC 7a_100011215163_200000040189 [0,1,0,0,0,0|0,0,1]=2 2137 B15R0.322 COCCOCCOC[C@@H](N)CCCCN 34a_100016993712_100000695917 [0,1,0,0,0,0|3,0,0]=4 2138 B15R0.322 COCCOCCSCC(=O)OCCOC 62a_100000695917_200000040189 [0,1,0,0,0,0|0,1,1]=3 2139 B15R0.322 COCCOCCSCC(=O)OCCOC 62a_200000040189_100000695917 [0,1,0,0,0,0|0,1,1]=3 2140 B15R0.366 C#CCC(C)OCCOCCOCCOC 34a_100000685586_100013367474 [0,1,0,0,0,0|1,0,1]=3 2141 B15R0.366 C#CCC(C)OCCOCCOCCOC 7a_100000685586_100013367474 [0,1,0,0,0,0|1,0,1]=3 2142 B15R0.366 C/C=C/C(C)OCCOCCOCCOC 34a_200102604097_100013367474 [0,1,0,0,0,0|1,0,1]=3 2143 B15R0.366 C=CC[C@@H](C)OCCOCCOCCOC 34a_100000731007_100013367474 [0,1,0,0,0,0|1,0,1]=3 2144 B15R0.366 C=CC[C@@H](C)OCCOCCOCCOC 7a_100000731007_100013367474 [0,1,0,0,0,0|1,0,1]=3 2145 B15R0.366 CC#CC(C)OCCOCCOCCOC 34a_100011216543_100013367474 [0,1,0,0,0,0|1,0,1]=3 2146 B15R0.366 CCCC(=O)NCCOCCOCCOC 1626a_100012028300_100000211992 [0,1,0,0,0,0|2,0,1]=4 2147 B15R0.366 CCCC(=O)NCCOCCOCCOC 240690a_100012028300_100000211992 [0,1,0,0,0,0|2,0,1]=4 2148 B15R0.366 CCCC(C)CCCOCCOCCOC 34a_100011713154_100000695917 [0,1,0,0,0,0|2,0,0]=3 2149 B15R0.366 CCCC(C)CCCOCCOCCOC 7a_100011713154_100000695917 [0,1,0,0,0,0|2,0,0]=3 2150 B15R0.366 CCCC(C)NCCOCCOCCOC 2230a_100000741246_100013367474 [0,1,0,0,0,0|2,0,0]=3 2151 B15R0.366 CCCC(C)NCCOCCOCCOC 2230a_100012028300_100000766640 [0,1,0,0,0,0|2,0,0]=3 2152 B15R0.366 CCCC(C)NCCOCCOCCOC 270004a_100012028300_100000211909 [0,1,0,0,0,0|2,0,0]=3 2153 B15R0.366 CCCC(C)NCCOCCOCCOC 34a_100012028300_100000766640 [0,1,0,0,0,0|2,0,0]=3 2154 B15R0.366 CCCC(C)OCCOCCOCCCN 34a_100011996194_100000766640 [0,1,0,0,0,0|3,0,0]=4 2155 B15R0.366 CCCC(C)OCCOCCOCCNC 34a_200014138305_100000766640 [0,1,0,0,0,0|2,0,0]=3 2156 B15R0.366 CCCC(C)OCCOCCOCCOC 34a_100000688194_100000766640 [0,1,0,0,0,0|1,0,0]=2 2157 B15R0.366 CCCC(C)OCCOCCOCCOC 34a_100000764384_100013367474 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[0,1,0,0,0,0|3,0,0]=4 2258 B15R0.2002 COCCOCCOCCN(C)CCCO 2230a_100000213112_100013367474 [0,1,0,0,0,0|3,0,0]=4 2259 B15R0.2002 COCCOCCOCCN(C)CCCO 2230a_200000716983_100000230001 [0,1,0,0,0,0|3,0,0]=4 2260 B15R0.2002 COCCOCCOCCN(C)CCCO 269982a_100000213112_100013367474 [0,1,0,0,0,0|3,0,0]=4 2261 B15R0.2002 COCCOCCOCCN(C)CCCO 269982a_200000716983_100011215043 [0,1,0,0,0,0|3,0,0]=4 2262 B15R0.2002 COCCOCCOCCN(C)CCCO 34a_200000716983_100000230001 [0,1,0,0,0,0|3,0,0]=4 2263 B15R0.2002 COCCOCCOCCN(C)CCOC 2230a_100000743101_100013367474 [0,1,0,0,0,0|1,0,0]=2 2264 B15R0.2002 COCCOCCOCCN(C)CCOC 2230a_200000716983_100011201679 [0,1,0,0,0,0|1,0,0]=2 2265 B15R0.2002 COCCOCCOCCN(C)CCOC 269982a_100000743101_100013367474 [0,1,0,0,0,0|1,0,0]=2 2266 B15R0.2002 COCCOCCOCCN(C)CCOC 269982a_200000716983_100000233755 [0,1,0,0,0,0|1,0,0]=2 2267 B15R0.2002 COCCOCCOCCN(C)CCOC 34a_200000716983_100011201679 [0,1,0,0,0,0|1,0,0]=2 2268 B15R0.2002 COCCOCCOCCN(C)CCSC 2230a_100000686725_100013367474 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CCCCCCCOCC1CCCCO1 7a_100000211370_100000210614 [0,0,0,1,0,0|3,0,0]=4 2281 B15R1.35 CCCCCCCOCC1CCCOC1 34a_100000210272_100000741521 [0,0,0,1,0,0|3,0,0]=4 2282 B15R1.35 CCCCCCCOCC1CCCOC1 34a_100000741520_100000210614 [0,0,0,1,0,0|3,0,0]=4 2283 B15R1.35 CCCCCCCOCC1CCCOC1 7a_100000210272_100000741521 [0,0,0,1,0,0|3,0,0]=4 2284 B15R1.35 CCCCCCCOC[C@@H]1CNCCO1 34a_100015189573_100000210614 [0,0,0,1,0,0|3,0,0]=4 2285 B15R1.35 CCCCCCCOC[C@@H]1COCCN1 34a_100000717676_100000210614 [0,0,0,1,0,0|3,0,0]=4 2286 B15R1.35 CCCCCCCOC[C@H]1COCCO1 34a_100009875890_100000210614 [0,0,0,1,0,0|2,0,0]=3 2287 B15R1.35 CCCCOCCNCC1CCCCO1 2230a_100000174945_100000743108 [0,0,0,1,0,0|3,0,0]=4 2288 B15R1.35 CCCCOCCNCC1CCCCO1 34a_100000174945_100000743108 [0,0,0,1,0,0|3,0,0]=4 2289 B15R1.35 CCCCOCCNCC1CCCOC1 2230a_100000720124_100000743108 [0,0,0,1,0,0|3,0,0]=4 2290 B15R1.35 CCCCOCCNCC1CCCOC1 34a_100000720124_100000743108 [0,0,0,1,0,0|3,0,0]=4 2291 B15R1.35 CCCCOCCNC[C@H]1COCCO1 2230a_100010981119_100000743108 [0,0,0,1,0,0|2,0,0]=3 2292 B15R1.35 CCCCOCCNC[C@H]1COCCO1 34a_100010981119_100000743108 [0,0,0,1,0,0|2,0,0]=3 2293 B15R1.35 CCCCOCCOCC1CCCCC1 34a_100000210238_100000211423 [0,0,0,1,0,0|3,0,0]=4 2294 B15R1.35 CCCCOCCOCC1CCCCC1 34a_100000212181_100000743108 [0,0,0,1,0,0|3,0,0]=4 2295 B15R1.35 CCCCOCCOCC1CCCCC1 7a_100000210238_100000211423 [0,0,0,1,0,0|3,0,0]=4 2296 B15R1.35 CCCCOCCOCC1CCCCC1 7a_100000212181_100000743108 [0,0,0,1,0,0|3,0,0]=4 2297 B15R1.35 CCCCOCCOCC1CCCCN1 34a_100000210821_100000743108 [0,0,0,1,0,0|3,0,0]=4 2298 B15R1.35 CCCCOCCOCC1CCCCO1 34a_100000210238_100000211543 [0,0,0,1,0,0|2,0,0]=3 2299 B15R1.35 CCCCOCCOCC1CCCCO1 34a_100000211370_100000743108 [0,0,0,1,0,0|2,0,0]=3 2300 B15R1.35 CCCCOCCOCC1CCCCO1 7a_100000210238_100000211543 [0,0,0,1,0,0|2,0,0]=3 2301 B15R1.35 CCCCOCCOCC1CCCCO1 7a_100000211370_100000743108 [0,0,0,1,0,0|2,0,0]=3 2302 B15R1.35 CCCCOCCOCC1CCCNC1 34a_100000211344_100000743108 [0,0,0,1,0,0|3,0,0]=4 2303 B15R1.35 CCCCOCCOCC1CCCOC1 34a_100000210238_100000741521 [0,0,0,1,0,0|2,0,0]=3 2304 B15R1.35 CCCCOCCOCC1CCCOC1 34a_100000741520_100000743108 [0,0,0,1,0,0|2,0,0]=3 2305 B15R1.35 CCCCOCCOCC1CCCOC1 7a_100000210238_100000741521 [0,0,0,1,0,0|2,0,0]=3 2306 B15R1.35 CCCCOCCOC[C@@H]1CNCCO1 34a_100015189573_100000743108 [0,0,0,1,0,0|2,0,0]=3 2307 B15R1.35 CCCCOCCOC[C@@H]1COCCN1 34a_100000717676_100000743108 [0,0,0,1,0,0|2,0,0]=3 2308 B15R1.35 CCCCOCCOC[C@H]1COCCO1 34a_100009875890_100000743108 [0,0,0,1,0,0|1,0,0]=2 2309 B15R1.35 CCCCOCCSCC1CCCCO1 62a_100000211543_100000743108 [0,0,0,1,0,0|2,1,0]=4 2310 B15R1.35 CCCCOCCSCC1CCCCO1 62a_100000743108_100000211543 [0,0,0,1,0,0|2,1,0]=4 2311 B15R1.35 CCCCOCCSCC1CCCOC1 62a_100000741521_100000743108 [0,0,0,1,0,0|2,1,0]=4 2312 B15R1.35 CCCCOCCSCC1CCCOC1 62a_100000743108_100000741521 [0,0,0,1,0,0|2,1,0]=4 2313 B15R1.35 CCCCSCCOCC1CCCCO1 34a_200000230436_100000211543 [0,0,0,1,0,0|2,1,0]=4 2314 B15R1.35 CCCCSCCOCC1CCCCO1 7a_200000230436_100000211543 [0,0,0,1,0,0|2,1,0]=4 2315 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[0,0,0,1,0,0|3,0,0]=4 2327 B15R1.35 COCCOCCCCC1CCCCC1 7a_100011215267_100000233755 [0,0,0,1,0,0|3,0,0]=4 2328 B15R1.35 COCCOCCCNC1CCCOC1 2230a_100000719290_100011216529 [0,0,0,1,0,0|3,0,0]=4 2329 B15R1.35 COCCOCCCNC1CCCOC1 270004a_100000206027_100000753404 [0,0,0,1,0,0|3,0,0]=4 2330 B15R1.35 COCCOCCCNC1CCCOC1 34a_100000206027_100000693364 [0,0,0,1,0,0|3,0,0]=4 2331 B15R1.35 COCCOCCCNC1CCCOC1 34a_100000719290_100011216529 [0,0,0,1,0,0|3,0,0]=4 2332 B15R1.35 COCCOCCCOC1CCCCO1 34a_100000033831_100011216529 [0,0,0,1,0,0|3,0,0]=4 2333 B15R1.35 COCCOCCCOC1CCCCO1 34a_100000210237_100000700653 [0,0,0,1,0,0|3,0,0]=4 2334 B15R1.35 COCCOCCCOC1CCCOC1 34a_100000754041_100011216529 [0,0,0,1,0,0|3,0,0]=4 2335 B15R1.35 COCCOCCCSC1CCCOC1 62a_100011216529_100000693364 [0,0,0,1,0,0|3,0,0]=4 2336 B15R1.35 COCCOCCNCC1CCCCC1 2230a_100000210473_100000695917 [0,0,0,1,0,0|3,0,0]=4 2337 B15R1.35 COCCOCCNCC1CCCCC1 2230a_100000745349_100000211423 [0,0,0,1,0,0|3,0,0]=4 2338 B15R1.35 COCCOCCNCC1CCCCC1 269862a_100000745349_100000211278 [0,0,0,1,0,0|3,0,0]=4 2339 B15R1.35 COCCOCCNCC1CCCCC1 34a_100000210473_100000695917 [0,0,0,1,0,0|3,0,0]=4 2340 B15R1.35 COCCOCCNCC1CCCCC1 34a_100000745349_100000211423 [0,0,0,1,0,0|3,0,0]=4 2341 B15R1.35 COCCOCCNCC1CCCCO1 2230a_100000174945_100000695917 [0,0,0,1,0,0|2,0,0]=3 2342 B15R1.35 COCCOCCNCC1CCCCO1 2230a_100000745349_100000211543 [0,0,0,1,0,0|2,0,0]=3 2343 B15R1.35 COCCOCCNCC1CCCCO1 34a_100000174945_100000695917 [0,0,0,1,0,0|2,0,0]=3 2344 B15R1.35 COCCOCCNCC1CCCCO1 34a_100000745349_100000211543 [0,0,0,1,0,0|2,0,0]=3 2345 B15R1.35 COCCOCCNCC1CCCOC1 2230a_100000720124_100000695917 [0,0,0,1,0,0|2,0,0]=3 2346 B15R1.35 COCCOCCNCC1CCCOC1 2230a_100000745349_100000741521 [0,0,0,1,0,0|2,0,0]=3 2347 B15R1.35 COCCOCCNCC1CCCOC1 34a_100000720124_100000695917 [0,0,0,1,0,0|2,0,0]=3 2348 B15R1.35 COCCOCCNCC1CCCOC1 34a_100000745349_100000741521 [0,0,0,1,0,0|2,0,0]=3 2349 B15R1.35 COCCOCCNC[C@H]1COCCO1 2230a_100010981119_100000695917 [0,0,0,1,0,0|1,0,0]=2 2350 B15R1.35 COCCOCCNC[C@H]1COCCO1 34a_100010981119_100000695917 [0,0,0,1,0,0|1,0,0]=2 2351 B15R1.35 COCCOCCOCC1CC=CCC1 34a_100000210713_100000695917 [0,0,0,1,0,0|2,0,1]=4 2352 B15R1.35 COCCOCCOCC1CCC=CO1 34a_100011217868_100000695917 [0,0,0,1,0,0|1,0,2]=4 2353 B15R1.35 COCCOCCOCC1CCCCC1 34a_100000212181_100000695917 [0,0,0,1,0,0|2,0,0]=3 2354 B15R1.35 COCCOCCOCC1CCCCC1 34a_100011215163_100000211423 [0,0,0,1,0,0|2,0,0]=3 2355 B15R1.35 COCCOCCOCC1CCCCC1 7a_100000212181_100000695917 [0,0,0,1,0,0|2,0,0]=3 2356 B15R1.35 COCCOCCOCC1CCCCC1 7a_100011215163_100000211423 [0,0,0,1,0,0|2,0,0]=3 2357 B15R1.35 COCCOCCOCC1CCCCN1 34a_100000210821_100000695917 [0,0,0,1,0,0|2,0,0]=3 2358 B15R1.35 COCCOCCOCC1CCCCO1 34a_100000211370_100000695917 [0,0,0,1,0,0|1,0,0]=2 2359 B15R1.35 COCCOCCOCC1CCCCO1 34a_100011215163_100000211543 [0,0,0,1,0,0|1,0,0]=2 2360 B15R1.35 COCCOCCOCC1CCCCO1 7a_100000211370_100000695917 [0,0,0,1,0,0|1,0,0]=2 2361 B15R1.35 COCCOCCOCC1CCCCO1 7a_100011215163_100000211543 [0,0,0,1,0,0|1,0,0]=2 2362 B15R1.35 COCCOCCOCC1CCCNC1 34a_100000211344_100000695917 [0,0,0,1,0,0|2,0,0]=3 2363 B15R1.35 COCCOCCOCC1CCCOC1 34a_100000741520_100000695917 [0,0,0,1,0,0|1,0,0]=2 2364 B15R1.35 COCCOCCOCC1CCCOC1 34a_100011215163_100000741521 [0,0,0,1,0,0|1,0,0]=2 2365 B15R1.35 COCCOCCOCC1CCCOC1 7a_100011215163_100000741521 [0,0,0,1,0,0|1,0,0]=2 2366 B15R1.35 COCCOCCOCC1CCNCC1 34a_100000738675_100000695917 [0,0,0,1,0,0|3,0,0]=4 2367 B15R1.35 COCCOCCOCC1CCOCC1 34a_100000749013_100000695917 [0,0,0,1,0,0|3,0,0]=4 2368 B15R1.35 COCCOCCOCC1CCOCC1 34a_100011215163_100000754603 [0,0,0,1,0,0|3,0,0]=4 2369 B15R1.35 COCCOCCOCC1CCOCC1 7a_100011215163_100000754603 [0,0,0,1,0,0|3,0,0]=4 2370 B15R1.35 COCCOCCOCC1CCSCC1 34a_100000070558_100000695917 [0,0,0,1,0,0|3,0,0]=4 2371 B15R1.35 COCCOCCOCC1CCSCC1 7a_100000070558_100000695917 [0,0,0,1,0,0|3,0,0]=4 2372 B15R1.35 COCCOCCOC[C@@H]1CNCCO1 34a_100015189573_100000695917 [0,0,0,1,0,0|1,0,0]=2 2373 B15R1.35 COCCOCCOC[C@@H]1COCCN1 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B15R1.220 CCCCOCCOC1CCCCC1C 7a_100000211207_100000743108 [0,0,0,1,0,0|3,0,0]=4 2386 B15R1.220 CCCCOCCOC1CNCCC1C 34a_100000696640_100000743108 [0,0,0,1,0,0|3,0,0]=4 2387 B15R1.220 CCCCOCCOC1COCCC1=O 34a_100000210238_100012180262 [0,0,0,1,0,0|3,0,0]=4 2388 B15R1.220 CCCCOCCOC1COCCC1=O 7a_100000210238_100012180262 [0,0,0,1,0,0|3,0,0]=4 2389 B15R1.220 CCCCOCCO[C@H]1COCC[C@H]1N 34a_100016994285_100000743108 [0,0,0,1,0,0|3,0,0]=4 2390 B15R1.220 CNCCOCCOC1COCCC1=O 34a_100000228057_100012180262 [0,0,0,1,0,0|3,0,0]=4 2391 B15R1.220 COCCOCCNC1CCCCC1C 2230a_100000211402_100000695917 [0,0,0,1,0,0|3,0,0]=4 2392 B15R1.220 COCCOCCNC1CCCCC1C 269862a_100000745349_100000210921 [0,0,0,1,0,0|3,0,0]=4 2393 B15R1.220 COCCOCCNC1CCCCC1C 270004a_100000745349_100000210921 [0,0,0,1,0,0|3,0,0]=4 2394 B15R1.220 COCCOCCNC1CCCCC1C 34a_100000211402_100000695917 [0,0,0,1,0,0|3,0,0]=4 2395 B15R1.220 COCCOCCNC1COCCC1=O 34a_100000745349_100012180262 [0,0,0,1,0,0|3,0,0]=4 2396 B15R1.220 COCCOCCN[C@H]1COCC[C@@H]1O 2230a_100015739063_100000695917 [0,0,0,1,0,0|3,0,0]=4 2397 B15R1.220 COCCOCCOC1CCCCC1=O 34a_100011214950_100000695917 [0,0,0,1,0,0|3,0,0]=4 2398 B15R1.220 COCCOCCOC1CCCCC1=O 34a_100011215163_100000754470 [0,0,0,1,0,0|3,0,0]=4 2399 B15R1.220 COCCOCCOC1CCCCC1=O 7a_100011215163_100000204591 [0,0,0,1,0,0|3,0,0]=4 2400 B15R1.220 COCCOCCOC1CCCCC1C 34a_100000211207_100000695917 [0,0,0,1,0,0|2,0,0]=3 2401 B15R1.220 COCCOCCOC1CCCCC1C 7a_100000211207_100000695917 [0,0,0,1,0,0|2,0,0]=3 2402 B15R1.220 COCCOCCOC1CCCCC1Cl 34a_100000038908_100000695917 [0,0,0,1,0,0|3,0,0]=4 2403 B15R1.220 COCCOCCOC1CCCCC1Cl 7a_100000038908_100000695917 [0,0,0,1,0,0|3,0,0]=4 2404 B15R1.220 COCCOCCOC1CCCCC1F 34a_100011215163_100015423560 [0,0,0,1,0,0|3,0,0]=4 2405 B15R1.220 COCCOCCOC1CCCCC1O 34a_100011215163_100000038908 [0,0,0,1,0,0|3,0,0]=4 2406 B15R1.220 COCCOCCOC1CCNCC1C 34a_100011998114_100000695917 [0,0,0,1,0,0|3,0,0]=4 2407 B15R1.220 COCCOCCOC1CNCCC1C 34a_100000696640_100000695917 [0,0,0,1,0,0|2,0,0]=3 2408 B15R1.220 COCCOCCOC1COCCC1=O 34a_100011215163_100012180262 [0,0,0,1,0,0|2,0,0]=3 2409 B15R1.220 COCCOCCOC1COCCC1=O 7a_100011215163_100012180262 [0,0,0,1,0,0|2,0,0]=3 2410 B15R1.220 COCCOCCO[C@@H]1CCCC[C@H]1F 34a_100009816020_100000695917 [0,0,0,1,0,0|3,0,0]=4 2411 B15R1.220 COCCOCCO[C@@H]1CCCC[C@H]1F 7a_100009816020_100000695917 [0,0,0,1,0,0|3,0,0]=4 2412 B15R1.220 COCCOCCO[C@H]1CCCC[C@H]1N 34a_100015191688_100000695917 [0,0,0,1,0,0|3,0,0]=4 2413 B15R1.220 COCCOCCO[C@H]1COCC[C@H]1N 34a_100016994285_100000695917 [0,0,0,1,0,0|2,0,0]=3 2414 B15R1.220 COCCOCCSC1COCCC1=O 62a_100000695917_100012180262 [0,0,0,1,0,0|2,1,0]=4 2415 B15R1.220 COCCOCCSC1COCCC1=O 62a_100012180262_100000695917 [0,0,0,1,0,0|2,1,0]=4 2416 B15R1.228 COCCOCCOCCN[C@@H]1C[C@@H]1F 2230a_100015190264_100013367474 [0,0,0,1,0,0|3,0,0]=4 2417 B15R1.228 COCCOCCOCCN[C@@H]1C[C@H]1F 2230a_100025746932_100013367474 [0,0,0,1,0,0|3,0,0]=4 2418 B15R1.228 COCCOCCOCCN[C@@H]1C[C@H]1F 34a_100025746932_100013367474 [0,0,0,1,0,0|3,0,0]=4 2419 B15R1.229 CCCCCCCCCCOC1COC1 34a_100000210711_100009818527 [0,0,0,1,0,0|3,0,0]=4 2420 B15R1.229 CCCCCCCCCCOC1COC1 7a_100000210711_100009818527 [0,0,0,1,0,0|3,0,0]=4 2421 B15R1.229 CCCCOCCOCCOC1CCC1 34a_100011215186_100000749161 [0,0,0,1,0,0|2,0,0]=3 2422 B15R1.229 CCCCOCCOCCOC1COC1 34a_100011215186_100009818527 [0,0,0,1,0,0|1,0,0]=2 2423 B15R1.229 CCCCOCCOCCOC1COC1 7a_100011215186_100009818527 [0,0,0,1,0,0|1,0,0]=2 2424 B15R1.229 CNCCOCCOCCOC1CCC1 34a_200014138305_100000749161 [0,0,0,1,0,0|2,0,0]=3 2425 B15R1.229 CNCCOCCOCCOC1COC1 34a_200014138305_100009818527 [0,0,0,1,0,0|1,0,0]=2 2426 B15R1.229 COCCOCCCOCCC1COC1 34a_100009855314_100011216529 [0,0,0,1,0,0|3,0,0]=4 2427 B15R1.229 COCCOCCOCCNC1CCC1 2230a_100000749019_100013367474 [0,0,0,1,0,0|2,0,0]=3 2428 B15R1.229 COCCOCCOCCNC1CCC1 270004a_100012028300_100000241760 [0,0,0,1,0,0|2,0,0]=3 2429 B15R1.229 COCCOCCOCCNC1CCC1 34a_100000749019_100013367474 [0,0,0,1,0,0|2,0,0]=3 2430 B15R1.229 COCCOCCOCCNC1CCC1 34a_100012028300_100000749161 [0,0,0,1,0,0|2,0,0]=3 2431 B15R1.229 COCCOCCOCCNC1COC1 2230a_100016991112_100013367474 [0,0,0,1,0,0|1,0,0]=2 2432 B15R1.229 COCCOCCOCCNC1COC1 34a_100012028300_100009818527 [0,0,0,1,0,0|1,0,0]=2 2433 B15R1.229 COCCOCCOCCOC1CCC1 34a_100000688194_100000749161 [0,0,0,1,0,0|1,0,0]=2 2434 B15R1.229 COCCOCCOCCOC1CCC1 34a_100000748187_100013367474 [0,0,0,1,0,0|1,0,0]=2 2435 B15R1.229 COCCOCCOCCOC1COC1 34a_100000688194_100009818527 [0,0,0,1,0,0|0,0,0]=1 2436 B15R1.229 COCCOCCOCCOC1COC1 7a_100000688194_100009818527 [0,0,0,1,0,0|0,0,0]=1 2437 B15R1.229 COCCOCCOCCOC1CSC1 7a_100000072292_100013367474 [0,0,0,1,0,0|0,1,0]=2 2438 B15R1.229 COCCOCCOCCSC1CCC1 62a_100013367474_100000749161 [0,0,0,1,0,0|1,1,0]=3 2439 B15R1.229 COCCOCCOCCSC1COC1 62a_100013367474_100009818527 [0,0,0,1,0,0|0,1,0]=2 2440 B15R1.229 NCCCOCCOCCOC1CCC1 34a_100011996194_100000749161 [0,0,0,1,0,0|3,0,0]=4 2441 B15R1.229 NCCCOCCOCCOC1COC1 34a_100011996194_100009818527 [0,0,0,1,0,0|2,0,0]=3 2442 B15R1.242 COCCOCN1CCCCC1COC 2230a_100015184032_100000231047 [0,0,0,1,0,0|3,0,0]=4 2443 B15R1.242 COCCOCN1CCCCC1COC 269982a_100015184032_100000231047 [0,0,0,1,0,0|3,0,0]=4 2444 B15R1.528 CCCCCCCOCCC1CCOC1 34a_100011879284_100000210614 [0,0,0,1,0,0|3,0,0]=4 2445 B15R1.528 CCCCOCCOCCC1CCCC1 34a_100000210238_100000760354 [0,0,0,1,0,0|3,0,0]=4 2446 B15R1.528 CCCCOCCOCCC1CCCC1 34a_100000749090_100000743108 [0,0,0,1,0,0|3,0,0]=4 2447 B15R1.528 CCCCOCCOCCC1CCCC1 7a_100000210238_100000760354 [0,0,0,1,0,0|3,0,0]=4 2448 B15R1.528 CCCCOCCOCCC1CCCC1 7a_100000749090_100000743108 [0,0,0,1,0,0|3,0,0]=4 2449 B15R1.528 CCCCOCCOCCC1CCNC1 34a_100016987287_100000743108 [0,0,0,1,0,0|3,0,0]=4 2450 B15R1.528 CCCCOCCOCCC1CCOC1 34a_100011879284_100000743108 [0,0,0,1,0,0|2,0,0]=3 2451 B15R1.528 CCCCOCCOCCN1CCCC1 7a_100000210238_100000004467 [0,0,0,1,0,0|3,0,0]=4 2452 B15R1.528 CNCCOCCOCCC1CCCC1 34a_100000228057_100000760354 [0,0,0,1,0,0|3,0,0]=4 2453 B15R1.528 COCCOCCCNCC1CCOC1 2230a_100000206027_100000702531 [0,0,0,1,0,0|3,0,0]=4 2454 B15R1.528 COCCOCCCNCC1CCOC1 2230a_100000737293_100011216529 [0,0,0,1,0,0|3,0,0]=4 2455 B15R1.528 COCCOCCCNCC1CCOC1 34a_100000206027_100011261433 [0,0,0,1,0,0|3,0,0]=4 2456 B15R1.528 COCCOCCCNCC1CCOC1 34a_100000737293_100011216529 [0,0,0,1,0,0|3,0,0]=4 2457 B15R1.528 COCCOCCCOCC1CCOC1 34a_100000740260_100011216529 [0,0,0,1,0,0|3,0,0]=4 2458 B15R1.528 COCCOCCCSCC1CCOC1 62a_100000702531_100011216529 [0,0,0,1,0,0|3,0,0]=4 2459 B15R1.528 COCCOCCCSCC1CCOC1 62a_100011216529_100000702531 [0,0,0,1,0,0|3,0,0]=4 2460 B15R1.528 COCCOCCNCCC1CCCC1 2230a_100000739158_100000695917 [0,0,0,1,0,0|3,0,0]=4 2461 B15R1.528 COCCOCCNCCC1CCCC1 2230a_100000745349_100000760354 [0,0,0,1,0,0|3,0,0]=4 2462 B15R1.528 COCCOCCNCCC1CCCC1 34a_100000739158_100000695917 [0,0,0,1,0,0|3,0,0]=4 2463 B15R1.528 COCCOCCNCCC1CCCC1 34a_100000745349_100000760354 [0,0,0,1,0,0|3,0,0]=4 2464 B15R1.528 COCCOCCOCCC1CCCC1 34a_100000749090_100000695917 [0,0,0,1,0,0|2,0,0]=3 2465 B15R1.528 COCCOCCOCCC1CCCC1 34a_100011215163_100000760354 [0,0,0,1,0,0|2,0,0]=3 2466 B15R1.528 COCCOCCOCCC1CCCC1 7a_100000749090_100000695917 [0,0,0,1,0,0|2,0,0]=3 2467 B15R1.528 COCCOCCOCCC1CCCC1 7a_100011215163_100000760354 [0,0,0,1,0,0|2,0,0]=3 2468 B15R1.528 COCCOCCOCCC1CCNC1 34a_100016987287_100000695917 [0,0,0,1,0,0|2,0,0]=3 2469 B15R1.528 COCCOCCOCCC1CCOC1 34a_100011879284_100000695917 [0,0,0,1,0,0|1,0,0]=2 2470 B15R1.528 COCCOCCOCCN1CC=CC1 269982a_100015195280_100013367474 [0,0,0,1,0,0|2,0,1]=4 2471 B15R1.528 COCCOCCOCCN1CCCC1 2230a_100000188435_100013367474 [0,0,0,1,0,0|2,0,0]=3 2472 B15R1.528 COCCOCCOCCN1CCCC1 269982a_100000188435_100013367474 [0,0,0,1,0,0|2,0,0]=3 2473 B15R1.528 COCCOCCOCCN1CCCC1 7a_100011215163_100000004467 [0,0,0,1,0,0|2,0,0]=3 2474 B15R1.528 COCCOCCOCCN1CCSC1 2230a_100011215254_100013367474 [0,0,0,1,0,0|1,1,0]=3 2475 B15R1.528 COCCOCCOCCN1CCSC1 269982a_100011215254_100013367474 [0,0,0,1,0,0|1,1,0]=3 2476 B15R1.528 COCCOCCSCCC1CCCC1 62a_100000695917_100000760354 [0,0,0,1,0,0|2,1,0]=4 2477 B15R1.528 COCCOCCSCCC1CCCC1 62a_100000760354_100000695917 [0,0,0,1,0,0|2,1,0]=4 2478 B15R1.528 COCCOCCSCCN1CCCC1 62a_100000695917_100000004467 [0,0,0,1,0,0|2,1,0]=4 2479 B15R1.528 COCCOCCSCCN1CCCC1 62a_100000700749_100000695917 [0,0,0,1,0,0|2,1,0]=4 2480 B15R1.553 CCC1CCCC1NCCOCCOC 269862a_100000745349_100000749056 [0,0,0,1,0,0|3,0,0]=4 2481 B15R1.553 CCC1CCCC1NCCOCCOC 270004a_100000745349_100000749056 [0,0,0,1,0,0|3,0,0]=4 2482 B15R1.553 COCCOCCO[C@@H]1CCC[C@H]1C#N 34a_100011907464_100000695917 [0,0,0,1,0,0|3,0,0]=4 2483 B15R1.553 COCCOCCO[C@@H]1CCC[C@H]1C#N 7a_100011907464_100000695917 [0,0,0,1,0,0|3,0,0]=4 2484 B15R1.1045 CCC1CCCCN1CCOCCOC 2230a_100000210034_100000695917 [0,0,0,1,0,0|3,0,0]=4 2485 B15R1.1045 CCC1CCCCN1CCOCCOC 269982a_100000210034_100000695917 [0,0,0,1,0,0|3,0,0]=4 2486 B15R1.1045 CCC1CCCCN1CCOCCOC 34a_100000210034_100000695917 [0,0,0,1,0,0|3,0,0]=4 2487 B15R1.1045 CCCCOCCN1CCOC[C@@H]1CC 2230a_100016988097_100000743108 [0,0,0,1,0,0|3,0,0]=4 2488 B15R1.1045 CCCCOCCN1CCOC[C@@H]1CC 269982a_100016988097_100000743108 [0,0,0,1,0,0|3,0,0]=4 2489 B15R1.1045 CCCCOCCN1CCOC[C@@H]1CC 34a_100016988097_100000743108 [0,0,0,1,0,0|3,0,0]=4 2490 B15R1.1045 CC[C@H]1COCCN1CCOCCOC 2230a_100016988097_100000695917 [0,0,0,1,0,0|2,0,0]=3 2491 B15R1.1045 CC[C@H]1COCCN1CCOCCOC 269982a_100016988097_100000695917 [0,0,0,1,0,0|2,0,0]=3 2492 B15R1.1045 CC[C@H]1COCCN1CCOCCOC 34a_100016988097_100000695917 [0,0,0,1,0,0|2,0,0]=3 2493 B15R1.1045 COCCOCCN1CCOC[C@H]1CO 2230a_100000717676_100000695917 [0,0,0,1,0,0|3,0,0]=4 2494 B15R1.1045 COCCOCCN1CCOC[C@H]1CO 269982a_100000717676_100000695917 [0,0,0,1,0,0|3,0,0]=4 2495 B15R1.1045 COCCOCCN1CCOC[C@H]1CO 34a_100000717676_100000695917 [0,0,0,1,0,0|3,0,0]=4 2496 B15R1.1189 COCCCC1CCCCN1CCOC 2230a_100011804088_100011201679 [0,0,0,1,0,0|3,0,0]=4 2497 B15R1.1189 COCCCC1CCCCN1CCOC 269982a_100011804088_100000233755 [0,0,0,1,0,0|3,0,0]=4 2498 B15R1.1189 COCCCC1CCCCN1CCOC 34a_100011804088_100011201679 [0,0,0,1,0,0|3,0,0]=4 2499 B15R1.1948 CCCCOCCN1CCC[C@H]1COC 2230a_100020646714_100000743108 [0,0,0,1,0,0|3,0,0]=4 2500 B15R1.1948 CCCCOCCN1CCC[C@H]1COC 269982a_100020646714_100000743108 [0,0,0,1,0,0|3,0,0]=4 2501 B15R1.1948 CCCCOCCN1CCC[C@H]1COC 34a_100020646714_100000743108 [0,0,0,1,0,0|3,0,0]=4 2502 B15R1.1948 COCCOCCN1CCC[C@H]1COC 2230a_100020646714_100000695917 [0,0,0,1,0,0|2,0,0]=3 2503 B15R1.1948 COCCOCCN1CCC[C@H]1COC 269982a_100020646714_100000695917 [0,0,0,1,0,0|2,0,0]=3 2504 B15R1.1948 COCCOCCN1CCC[C@H]1COC 34a_100020646714_100000695917 [0,0,0,1,0,0|2,0,0]=3 2505 B15R1.1951 COCCOCCN1CCCCCCC1 2230a_100000211400_100000695917 [0,0,0,1,0,0|3,0,0]=4 2506 B15R1.1951 COCCOCCN1CCCCCCC1 269982a_100000211400_100000695917 [0,0,0,1,0,0|3,0,0]=4 2507 B15R1.1951 COCCOCCN1CCCCCCC1 34a_100000211400_100000695917 [0,0,0,1,0,0|3,0,0]=4 2508 B15R1.3515 CCCCOCCOCC1CCCN1C 34a_100000743107_100000743108 [0,0,0,1,0,0|3,0,0]=4 2509 B15R1.3515 COCCOCCOCC1CCCN1C 34a_100000743107_100000695917 [0,0,0,1,0,0|2,0,0]=3 2510 B15R1.3523 COCCOCCOCCC1CCC1=O 7a_100011215163_200016118888 [0,0,0,1,0,0|3,0,0]=4 2511 B15R1.3523 COCCOCCOCCN1CCC1C 269982a_100000755817_100013367474 [0,0,0,1,0,0|2,0,0]=3 2512 B15R1.3523 COCCOCCOCCN1CCC1C 34a_100000755817_100013367474 [0,0,0,1,0,0|2,0,0]=3 2513 B15R1.5367 COCCOCCCN1CCC1COC 2230a_100015195929_100011216529 [0,0,0,1,0,0|3,0,0]=4 2514 B15R1.5367 COCCOCCCN1CCC1COC 269982a_100015195929_100011216529 [0,0,0,1,0,0|3,0,0]=4 2515 B15R1.5367 COCCOCCCN1CCC1COC 34a_100015195929_100011216529 [0,0,0,1,0,0|3,0,0]=4 2516 B15R1.6328 CCCCOCCOC1CCCCCC1 34a_100000210238_100011217769 [0,0,0,1,0,0|3,0,0]=4 2517 B15R1.6328 CCCCOCCOC1CCCCCC1 34a_100000210887_100000743108 [0,0,0,1,0,0|3,0,0]=4 2518 B15R1.6328 CCCCOCCOC1CCCCCC1 7a_100000210887_100000743108 [0,0,0,1,0,0|3,0,0]=4 2519 B15R1.6328 CNCCOCCOC1CCCCCC1 34a_100000228057_100011217769 [0,0,0,1,0,0|3,0,0]=4 2520 B15R1.6328 COCCOCCNC1CCCCCC1 2230a_100000210984_100000695917 [0,0,0,1,0,0|3,0,0]=4 2521 B15R1.6328 COCCOCCNC1CCCCCC1 270004a_100000745349_100000210131 [0,0,0,1,0,0|3,0,0]=4 2522 B15R1.6328 COCCOCCNC1CCCCCC1 34a_100000210984_100000695917 [0,0,0,1,0,0|3,0,0]=4 2523 B15R1.6328 COCCOCCNC1CCCCCC1 34a_100000745349_100011217769 [0,0,0,1,0,0|3,0,0]=4 2524 B15R1.6328 COCCOCCNC1CSCCSC1 270004a_100000745349_100000068409 [0,0,0,1,0,0|1,2,0]=4 2525 B15R1.6328 COCCOCCOC1CCCCCC1 34a_100000210887_100000695917 [0,0,0,1,0,0|2,0,0]=3 2526 B15R1.6328 COCCOCCOC1CCCCCC1 34a_100011215163_100011217769 [0,0,0,1,0,0|2,0,0]=3 2527 B15R1.6328 COCCOCCOC1CCCCCC1 7a_100000210887_100000695917 [0,0,0,1,0,0|2,0,0]=3 2528 B15R1.6328 COCCOCCSC1CCCCCC1 62a_100000695917_100011217769 [0,0,0,1,0,0|2,1,0]=4 2529 B15R1.6328 COCCOCCSC1CCCCCC1 62a_100011217769_100000695917 [0,0,0,1,0,0|2,1,0]=4 2530 B15R1.9199 CCCCCCCCCCOCC1CO1 34a_100000210711_102125554688 [0,0,0,1,0,0|3,0,0]=4 2531 B15R1.9199 CCCCCCCCCCOCC1CO1 7a_100000210711_102125554688 [0,0,0,1,0,0|3,0,0]=4 2532 B15R1.9199 CCCCCCCCCCOC[C@@H]1CO1 34a_100000757423_100000210320 [0,0,0,1,0,0|3,0,0]=4 2533 B15R1.9199 CCCCCCCCCCOC[C@@H]1CO1 7a_100000210711_100000745022 [0,0,0,1,0,0|3,0,0]=4 2534 B15R1.9199 CCCCOCCOCCOCC1CC1 34a_100011215186_100000742324 [0,0,0,1,0,0|2,0,0]=3 2535 B15R1.9199 CCCCOCCOCCOCC1CC1 7a_100011215186_100000742324 [0,0,0,1,0,0|2,0,0]=3 2536 B15R1.9199 CCCCOCCOCCOCC1CO1 34a_100011215186_102125554688 [0,0,0,1,0,0|1,0,0]=2 2537 B15R1.9199 CCCCOCCOCCOCC1CO1 7a_100011215186_102125554688 [0,0,0,1,0,0|1,0,0]=2 2538 B15R1.9199 CCCCOCCOCCOCC1CS1 7a_100011215186_100000031435 [0,0,0,1,0,0|1,1,0]=3 2539 B15R1.9199 CCCCOCCOCCOC[C@@H]1CO1 7a_100011215186_100000745022 [0,0,0,1,0,0|1,0,0]=2 2540 B15R1.9199 CNCCOCCOCCOCC1CC1 34a_200014138305_100000742324 [0,0,0,1,0,0|2,0,0]=3 2541 B15R1.9199 CNCCOCCOCCOCC1CO1 34a_200014138305_102125554688 [0,0,0,1,0,0|1,0,0]=2 2542 B15R1.9199 COCCCOCCCCOCC1CO1 34a_100010889290_100000740836 [0,0,0,1,0,0|3,0,0]=4 2543 B15R1.9199 COCCCOCCCCOCC1CO1 7a_100010889290_100000740836 [0,0,0,1,0,0|3,0,0]=4 2544 B15R1.9199 COCCOCCCNCCCC1CO1 2230a_100000206027_100000733510 [0,0,0,1,0,0|3,0,0]=4 2545 B15R1.9199 COCCOCCCNCCCC1CO1 34a_100000206027_100000733510 [0,0,0,1,0,0|3,0,0]=4 2546 B15R1.9199 COCCOCCCSCCCC1CO1 62a_100000733510_100011216529 [0,0,0,1,0,0|3,0,0]=4 2547 B15R1.9199 COCCOCCCSCCCC1CO1 62a_100011216529_100000733510 [0,0,0,1,0,0|3,0,0]=4 2548 B15R1.9199 COCCOCCOCCNCC1CC1 2230a_100000735609_100013367474 [0,0,0,1,0,0|2,0,0]=3 2549 B15R1.9199 COCCOCCOCCNCC1CC1 2230a_100012028300_100000742324 [0,0,0,1,0,0|2,0,0]=3 2550 B15R1.9199 COCCOCCOCCNCC1CC1 269862a_100012028300_100000741477 [0,0,0,1,0,0|2,0,0]=3 2551 B15R1.9199 COCCOCCOCCNCC1CC1 34a_100000735609_100013367474 [0,0,0,1,0,0|2,0,0]=3 2552 B15R1.9199 COCCOCCOCCNCC1CC1 34a_100012028300_100000742324 [0,0,0,1,0,0|2,0,0]=3 2553 B15R1.9199 COCCOCCOCCNCC1CO1 2230a_100012028300_100011216344 [0,0,0,1,0,0|1,0,0]=2 2554 B15R1.9199 COCCOCCOCCNCC1CO1 34a_100012028300_102125554688 [0,0,0,1,0,0|1,0,0]=2 2555 B15R1.9199 COCCOCCOCCOCC1CC1 34a_100000211283_100013367474 [0,0,0,1,0,0|1,0,0]=2 2556 B15R1.9199 COCCOCCOCCOCC1CC1 34a_100000688194_100000742324 [0,0,0,1,0,0|1,0,0]=2 2557 B15R1.9199 COCCOCCOCCOCC1CC1 7a_100000688194_100000742324 [0,0,0,1,0,0|1,0,0]=2 2558 B15R1.9199 COCCOCCOCCOCC1CO1 34a_100000688194_102125554688 [0,0,0,1,0,0|0,0,0]=1 2559 B15R1.9199 COCCOCCOCCOCC1CO1 7a_100000688194_102125554688 [0,0,0,1,0,0|0,0,0]=1 2560 B15R1.9199 COCCOCCOCCOCC1CS1 7a_100000688194_100000031435 [0,0,0,1,0,0|0,1,0]=2 2561 B15R1.9199 COCCOCCOCCOC[C@@H]1CO1 34a_100000757423_100013367474 [0,0,0,1,0,0|0,0,0]=1 2562 B15R1.9199 COCCOCCOCCOC[C@@H]1CO1 7a_100000688194_100000745022 [0,0,0,1,0,0|0,0,0]=1 2563 B15R1.9199 COCCOCCOCCSCC1CC1 62a_100000756562_100013367474 [0,0,0,1,0,0|1,1,0]=3 2564 B15R1.9199 COCCOCCOCCSCC1CC1 62a_100013367474_100000742324 [0,0,0,1,0,0|1,1,0]=3 2565 B15R1.9199 COCCOCCOCCSCC1CO1 62a_100013367474_102125554688 [0,0,0,1,0,0|0,1,0]=2 2566 B15R1.9199 COCCOCCOCCSCC1CO1 62a_102125554688_100013367474 [0,0,0,1,0,0|0,1,0]=2 2567 B15R1.9199 COCCOCCOCCSCC1CS1 62a_100000031435_100013367474 [0,0,0,1,0,0|0,2,0]=3 2568 B15R1.9199 COCCOCCOCCSCC1CS1 62a_100013367474_100000031435 [0,0,0,1,0,0|0,2,0]=3 2569 B15R1.9199 COCCOCCOCCSC[C@@H]1CO1 62a_100000745022_100013367474 [0,0,0,1,0,0|0,1,0]=2 2570 B15R1.9199 COCCOCCOCCSC[C@@H]1CO1 62a_100013367474_100000745022 [0,0,0,1,0,0|0,1,0]=2 2571 B15R1.9199 NCCCOCCOCCOCC1CC1 34a_100011996194_100000742324 [0,0,0,1,0,0|3,0,0]=4 2572 B15R1.9199 NCCCOCCOCCOCC1CO1 34a_100011996194_102125554688 [0,0,0,1,0,0|2,0,0]=3 2573 B12R0.5 C#CCCCCCCOCCOC 34a_100000210237_100012276617 [2,0,0,0,0,0|1,0,1]=4 2574 B12R0.5 C#CCCCCCCOCCOC 34a_100011217361_100011201679 [2,0,0,0,0,0|1,0,1]=4 2575 B12R0.5 C#CCCCCCCOCCOC 7a_100011217361_100000233755 [2,0,0,0,0,0|1,0,1]=4 2576 B12R0.5 C#CCCCCOCCCCOC 34a_100000740925_100010269958 [2,0,0,0,0,0|1,0,1]=4 2577 B12R0.5 C#CCCCCOCCCCOC 34a_100000766709_100000755781 [2,0,0,0,0,0|1,0,1]=4 2578 B12R0.5 C#CCCCCOCCCCOC 7a_100000766709_100000730899 [2,0,0,0,0,0|1,0,1]=4 2579 B12R0.5 C#CCCCCOCCOCCC 34a_100000752267_100010269958 [2,0,0,0,0,0|1,0,1]=4 2580 B12R0.5 C#CCCCCOCCOCCC 34a_100000766709_100011215938 [2,0,0,0,0,0|1,0,1]=4 2581 B12R0.5 C#CCCCCOCCOCCC 7a_100000752267_100010269958 [2,0,0,0,0,0|1,0,1]=4 2582 B12R0.5 C#CCCCCOCCOCCC 7a_100000766709_100011215938 [2,0,0,0,0,0|1,0,1]=4 2583 B12R0.5 C#CCCCCOCCOCCO 34a_100000766709_100000692535 [2,0,0,0,0,0|1,0,1]=4 2584 B12R0.5 C#CCCCCOCCOCCO 7a_100000766709_100011215305 [2,0,0,0,0,0|1,0,1]=4 2585 B12R0.5 C#CCCCOCCOCCOC 34a_100000215630_100000695917 [2,0,0,0,0,0|0,0,2]=4 2586 B12R0.5 C#CCCCOCCOCCOC 34a_100011215163_100000695029 [2,0,0,0,0,0|0,0,2]=4 2587 B12R0.5 C#CCCCOCCOCCOC 7a_100000215630_100000695917 [2,0,0,0,0,0|0,0,2]=4 2588 B12R0.5 C#CCCCOCCOCCOC 7a_100011215163_100011215417 [2,0,0,0,0,0|0,0,2]=4 2589 B12R0.5 C#CCCOCCCCCCOC 34a_100011215631_100011998445 [2,0,0,0,0,0|1,0,1]=4 2590 B12R0.5 C#CCCOCCCCCCOC 34a_200012092642_100000688953 [2,0,0,0,0,0|1,0,1]=4 2591 B12R0.5 C#CCCOCCCCCCOC 7a_200012092642_100000688953 [2,0,0,0,0,0|1,0,1]=4 2592 B12R0.5 C#CCCOCCCOCCOC 34a_100011215631_100011216529 [2,0,0,0,0,0|1,0,1]=4 2593 B12R0.5 C#CCCOCCOCCCCC 34a_100011215259_100000688953 [2,0,0,0,0,0|1,0,1]=4 2594 B12R0.5 C#CCCOCCOCCCCC 7a_100011215259_100000688953 [2,0,0,0,0,0|1,0,1]=4 2595 B12R0.5 C#CCCOCCOCCOCC 34a_100000210240_100000688953 [2,0,0,0,0,0|1,0,1]=4 2596 B12R0.5 C#CCCOCCOCCOCC 34a_100011215631_100011211534 [2,0,0,0,0,0|1,0,1]=4 2597 B12R0.5 C#CCCOCCOCCOCC 7a_100000210240_100000688953 [2,0,0,0,0,0|1,0,1]=4 2598 B12R0.5 C#CCOCCOCCCCOC 34a_100000054580_100000755781 [2,0,0,0,0,0|0,0,2]=4 2599 B12R0.5 C#CCOCCOCCCCOC 34a_100000740925_100010402529 [2,0,0,0,0,0|0,0,2]=4 2600 B12R0.5 C#CCOCCOCCCCOC 7a_100000054580_100000730899 [2,0,0,0,0,0|0,0,2]=4 2601 B12R0.5 C#CCOCCOCCOCCC 34a_100000041007_100000210303 [2,0,0,0,0,0|0,0,2]=4 2602 B12R0.5 C#CCOCCOCCOCCC 34a_100000054580_100011215938 [2,0,0,0,0,0|0,0,2]=4 2603 B12R0.5 C#CCOCCOCCOCCC 34a_100000210258_100010408581 [2,0,0,0,0,0|0,0,2]=4 2604 B12R0.5 C#CCOCCOCCOCCC 34a_100000752267_100010402529 [2,0,0,0,0,0|0,0,2]=4 2605 B12R0.5 C#CCOCCOCCOCCC 7a_100000041007_100000210303 [2,0,0,0,0,0|0,0,2]=4 2606 B12R0.5 C#CCOCCOCCOCCC 7a_100000054580_100011215938 [2,0,0,0,0,0|0,0,2]=4 2607 B12R0.5 C#CCOCCOCCOCCC 7a_100000752267_100010402529 [2,0,0,0,0,0|0,0,2]=4 2608 B12R0.5 C#CCOCCOCCOCCO 34a_100000041007_100000211926 [2,0,0,0,0,0|0,0,2]=4 2609 B12R0.5 C#CCOCCOCCOCCO 34a_100000054580_100000692535 [2,0,0,0,0,0|0,0,2]=4 2610 B12R0.5 C#CCOCCOCCOCCO 34a_100000210247_100000032323 [2,0,0,0,0,0|0,0,2]=4 2611 B12R0.5 C#CCOCCOCCOCCO 7a_100000041007_100000211926 [2,0,0,0,0,0|0,0,2]=4 2612 B12R0.5 C#CCOCCOCCOCCO 7a_100000054580_100011215305 [2,0,0,0,0,0|0,0,2]=4 2613 B12R0.5 C/C=C/CCOCCOCCOC 34a_100016278192_100000695917 [2,0,0,0,0,0|0,0,2]=4 2614 B12R0.5 C/C=C/COCCCCCCOC 34a_100016270725_100011998445 [2,0,0,0,0,0|1,0,1]=4 2615 B12R0.5 C/C=C/COCCCCCCOC 34a_200012092642_100102629194 [2,0,0,0,0,0|1,0,1]=4 2616 B12R0.5 C/C=C/COCCCCCCOC 7a_200012092642_100102629194 [2,0,0,0,0,0|1,0,1]=4 2617 B12R0.5 C/C=C/COCCCOCCOC 34a_100016270725_100011216529 [2,0,0,0,0,0|1,0,1]=4 2618 B12R0.5 C/C=C/COCCOCCCCC 34a_100011215259_100102629194 [2,0,0,0,0,0|1,0,1]=4 2619 B12R0.5 C/C=C/COCCOCCCCC 7a_100011215259_100102629194 [2,0,0,0,0,0|1,0,1]=4 2620 B12R0.5 C/C=C/COCCOCCOCC 34a_100000210240_100102629194 [2,0,0,0,0,0|1,0,1]=4 2621 B12R0.5 C/C=C/COCCOCCOCC 34a_100016270725_100011211534 [2,0,0,0,0,0|1,0,1]=4 2622 B12R0.5 C/C=C/COCCOCCOCC 7a_100000210240_100102629194 [2,0,0,0,0,0|1,0,1]=4 2623 B12R0.5 C=CCCCCCCOCCOC 34a_100000210237_100011215473 [2,0,0,0,0,0|1,0,1]=4 2624 B12R0.5 C=CCCCCCCOCCOC 34a_200011216477_100011201679 [2,0,0,0,0,0|1,0,1]=4 2625 B12R0.5 C=CCCCCCCOCCOC 7a_200011216477_100000233755 [2,0,0,0,0,0|1,0,1]=4 2626 B12R0.5 C=CCCCCOCCCCOC 34a_100000740925_100011215482 [2,0,0,0,0,0|1,0,1]=4 2627 B12R0.5 C=CCCCCOCCCCOC 34a_100000766645_100000755781 [2,0,0,0,0,0|1,0,1]=4 2628 B12R0.5 C=CCCCCOCCCCOC 7a_100000766645_100000730899 [2,0,0,0,0,0|1,0,1]=4 2629 B12R0.5 C=CCCCCOCCOCCC 34a_100000752267_100011215482 [2,0,0,0,0,0|1,0,1]=4 2630 B12R0.5 C=CCCCCOCCOCCC 34a_100000766645_100011215938 [2,0,0,0,0,0|1,0,1]=4 2631 B12R0.5 C=CCCCCOCCOCCC 7a_100000752267_100011215482 [2,0,0,0,0,0|1,0,1]=4 2632 B12R0.5 C=CCCCCOCCOCCC 7a_100000766645_100011215938 [2,0,0,0,0,0|1,0,1]=4 2633 B12R0.5 C=CCCCCOCCOCCO 34a_100000766645_100000692535 [2,0,0,0,0,0|1,0,1]=4 2634 B12R0.5 C=CCCCCOCCOCCO 7a_100000766645_100011215305 [2,0,0,0,0,0|1,0,1]=4 2635 B12R0.5 C=CCCCOCCOCCOC 34a_100000758997_100000695917 [2,0,0,0,0,0|0,0,2]=4 2636 B12R0.5 C=CCCCOCCOCCOC 34a_100011215163_100000757094 [2,0,0,0,0,0|0,0,2]=4 2637 B12R0.5 C=CCCCOCCOCCOC 7a_100000758997_100000695917 [2,0,0,0,0,0|0,0,2]=4 2638 B12R0.5 C=CCCCOCCOCCOC 7a_100011215163_100000757094 [2,0,0,0,0,0|0,0,2]=4 2639 B12R0.5 C=CCCOCCCCCCOC 34a_100011205117_100011998445 [2,0,0,0,0,0|1,0,1]=4 2640 B12R0.5 C=CCCOCCCCCCOC 34a_200012092642_100000754431 [2,0,0,0,0,0|1,0,1]=4 2641 B12R0.5 C=CCCOCCCCCCOC 7a_200012092642_100000754431 [2,0,0,0,0,0|1,0,1]=4 2642 B12R0.5 C=CCCOCCCOCCOC 34a_100011205117_100011216529 [2,0,0,0,0,0|1,0,1]=4 2643 B12R0.5 C=CCCOCCOCCCCC 34a_100011215259_100000754431 [2,0,0,0,0,0|1,0,1]=4 2644 B12R0.5 C=CCCOCCOCCCCC 7a_100011215259_100000754431 [2,0,0,0,0,0|1,0,1]=4 2645 B12R0.5 C=CCCOCCOCCOCC 34a_100000210240_100000754431 [2,0,0,0,0,0|1,0,1]=4 2646 B12R0.5 C=CCCOCCOCCOCC 34a_100011205117_100011211534 [2,0,0,0,0,0|1,0,1]=4 2647 B12R0.5 C=CCCOCCOCCOCC 7a_100000210240_100000754431 [2,0,0,0,0,0|1,0,1]=4 2648 B12R0.5 C=CCOCCOCCCCOC 34a_100000037705_100000755781 [2,0,0,0,0,0|0,0,2]=4 2649 B12R0.5 C=CCOCCOCCCCOC 7a_100000037705_100000730899 [2,0,0,0,0,0|0,0,2]=4 2650 B12R0.5 C=CCOCCOCCOCCC 34a_100000037705_100011215938 [2,0,0,0,0,0|0,0,2]=4 2651 B12R0.5 C=CCOCCOCCOCCC 34a_100000065479_100000210303 [2,0,0,0,0,0|0,0,2]=4 2652 B12R0.5 C=CCOCCOCCOCCC 7a_100000037705_100011215938 [2,0,0,0,0,0|0,0,2]=4 2653 B12R0.5 C=CCOCCOCCOCCC 7a_100000065479_100000210303 [2,0,0,0,0,0|0,0,2]=4 2654 B12R0.5 C=CCOCCOCCOCCO 34a_100000037705_100000692535 [2,0,0,0,0,0|0,0,2]=4 2655 B12R0.5 C=CCOCCOCCOCCO 34a_100000065479_100000211926 [2,0,0,0,0,0|0,0,2]=4 2656 B12R0.5 C=CCOCCOCCOCCO 34a_200000210373_100000032323 [2,0,0,0,0,0|0,0,2]=4 2657 B12R0.5 C=CCOCCOCCOCCO 7a_100000037705_100011215305 [2,0,0,0,0,0|0,0,2]=4 2658 B12R0.5 C=CCOCCOCCOCCO 7a_100000065479_100000211926 [2,0,0,0,0,0|0,0,2]=4 2659 B12R0.5 C=COCCOCCOCCOC 34a_100000033082_100000695917 [2,0,0,0,0,0|0,0,2]=4 2660 B12R0.5 C=COCCOCCOCCOC 34a_100000039918_100011201679 [2,0,0,0,0,0|0,0,2]=4 2661 B12R0.5 C=COCCOCCOCCOC 34a_100011215163_100000039644 [2,0,0,0,0,0|0,0,2]=4 2662 B12R0.5 C=COCCOCCOCCOC 7a_100000039918_100000233755 [2,0,0,0,0,0|0,0,2]=4 2663 B12R0.5 C=COCCOCCOCCOC 7a_100011215163_100000039644 [2,0,0,0,0,0|0,0,2]=4 2664 B12R0.5 CC#CCCOCCOCCOC 34a_100000750427_100000695917 [2,0,0,0,0,0|0,0,2]=4 2665 B12R0.5 CC#CCOCCCCCCOC 34a_100000761923_100011998445 [2,0,0,0,0,0|1,0,1]=4 2666 B12R0.5 CC#CCOCCCCCCOC 34a_200012092642_100000748600 [2,0,0,0,0,0|1,0,1]=4 2667 B12R0.5 CC#CCOCCCCCCOC 7a_200012092642_100000748600 [2,0,0,0,0,0|1,0,1]=4 2668 B12R0.5 CC#CCOCCCOCCOC 34a_100000761923_100011216529 [2,0,0,0,0,0|1,0,1]=4 2669 B12R0.5 CC#CCOCCOCCCCC 34a_100011215259_100000748600 [2,0,0,0,0,0|1,0,1]=4 2670 B12R0.5 CC#CCOCCOCCCCC 7a_100011215259_100000748600 [2,0,0,0,0,0|1,0,1]=4 2671 B12R0.5 CC#CCOCCOCCOCC 34a_100000210240_100000748600 [2,0,0,0,0,0|1,0,1]=4 2672 B12R0.5 CC#CCOCCOCCOCC 34a_100000761923_100011211534 [2,0,0,0,0,0|1,0,1]=4 2673 B12R0.5 CC#CCOCCOCCOCC 7a_100000210240_100000748600 [2,0,0,0,0,0|1,0,1]=4 2674 B12R0.5 CC/C=C\CCCCOCCOC 34a_100016287862_100011201679 [2,0,0,0,0,0|1,0,1]=4 2675 B12R0.5 CC/C=C\CCCCOCCOC 7a_100016287862_100000233755 [2,0,0,0,0,0|1,0,1]=4 2676 B12R0.5 CC/C=C\CCOCCCCOC 34a_100000740925_100015370543 [2,0,0,0,0,0|1,0,1]=4 2677 B12R0.5 CC/C=C\CCOCCCCOC 34a_100016288707_100000755781 [2,0,0,0,0,0|1,0,1]=4 2678 B12R0.5 CC/C=C\CCOCCCCOC 7a_100016288707_100000730899 [2,0,0,0,0,0|1,0,1]=4 2679 B12R0.5 CC/C=C\CCOCCOCCC 34a_100000752267_100015370543 [2,0,0,0,0,0|1,0,1]=4 2680 B12R0.5 CC/C=C\CCOCCOCCC 34a_100016288707_100011215938 [2,0,0,0,0,0|1,0,1]=4 2681 B12R0.5 CC/C=C\CCOCCOCCC 7a_100000752267_100015370543 [2,0,0,0,0,0|1,0,1]=4 2682 B12R0.5 CC/C=C\CCOCCOCCC 7a_100016288707_100011215938 [2,0,0,0,0,0|1,0,1]=4 2683 B12R0.5 CC/C=C\CCOCCOCCO 34a_100016288707_100000692535 [2,0,0,0,0,0|1,0,1]=4 2684 B12R0.5 CC/C=C\CCOCCOCCO 7a_100016288707_100011215305 [2,0,0,0,0,0|1,0,1]=4 2685 B12R0.5 CC/C=C\COCCOCCOC 34a_100011215163_100103147603 [2,0,0,0,0,0|0,0,2]=4 2686 B12R0.5 CC/C=C\COCCOCCOC 34a_100016268518_100000695917 [2,0,0,0,0,0|0,0,2]=4 2687 B12R0.5 CC/C=C\COCCOCCOC 7a_100011215163_100103147603 [2,0,0,0,0,0|0,0,2]=4 2688 B12R0.5 CC=CCCCOCCCCOC 34a_100020645299_100000755781 [2,0,0,0,0,0|1,0,1]=4 2689 B12R0.5 CC=CCCCOCCOCCC 34a_100020645299_100011215938 [2,0,0,0,0,0|1,0,1]=4 2690 B12R0.5 CC=CCCCOCCOCCO 34a_100020645299_100000692535 [2,0,0,0,0,0|1,0,1]=4 2691 B12R0.5 CC=CCOCCCCCCOC 34a_200012092642_100000070051 [2,0,0,0,0,0|1,0,1]=4 2692 B12R0.5 CC=CCOCCCCCCOC 7a_200012092642_100000070051 [2,0,0,0,0,0|1,0,1]=4 2693 B12R0.5 CC=CCOCCOCCCCC 34a_100011215259_100000070051 [2,0,0,0,0,0|1,0,1]=4 2694 B12R0.5 CC=CCOCCOCCCCC 7a_100011215259_100000070051 [2,0,0,0,0,0|1,0,1]=4 2695 B12R0.5 CC=CCOCCOCCOCC 34a_100000210240_100000070051 [2,0,0,0,0,0|1,0,1]=4 2696 B12R0.5 CC=CCOCCOCCOCC 7a_100000210240_100000070051 [2,0,0,0,0,0|1,0,1]=4 2697 B12R0.5 CCC#CCCOCCCCOC 34a_100000036655_100000755781 [2,0,0,0,0,0|1,0,1]=4 2698 B12R0.5 CCC#CCCOCCCCOC 7a_100000036655_100000730899 [2,0,0,0,0,0|1,0,1]=4 2699 B12R0.5 CCC#CCCOCCOCCC 34a_100000036655_100011215938 [2,0,0,0,0,0|1,0,1]=4 2700 B12R0.5 CCC#CCCOCCOCCC 7a_100000036655_100011215938 [2,0,0,0,0,0|1,0,1]=4 2701 B12R0.5 CCC#CCCOCCOCCO 34a_100000036655_100000692535 [2,0,0,0,0,0|1,0,1]=4 2702 B12R0.5 CCC#CCCOCCOCCO 7a_100000036655_100011215305 [2,0,0,0,0,0|1,0,1]=4 2703 B12R0.5 CCC#CCOCCOCCOC 34a_100000032950_100000695917 [2,0,0,0,0,0|0,0,2]=4 2704 B12R0.5 CCC#CCOCCOCCOC 34a_100011215163_100009813939 [2,0,0,0,0,0|0,0,2]=4 2705 B12R0.5 CCC#CCOCCOCCOC 7a_100011215163_100009813939 [2,0,0,0,0,0|0,0,2]=4 2706 B12R0.5 CCC/C=C/COCCCCOC 34a_100016278788_100000755781 [2,0,0,0,0,0|1,0,1]=4 2707 B12R0.5 CCC/C=C/COCCCCOC 7a_100016278788_100000730899 [2,0,0,0,0,0|1,0,1]=4 2708 B12R0.5 CCC/C=C/COCCOCCC 34a_100016278788_100011215938 [2,0,0,0,0,0|1,0,1]=4 2709 B12R0.5 CCC/C=C/COCCOCCC 7a_100016278788_100011215938 [2,0,0,0,0,0|1,0,1]=4 2710 B12R0.5 CCC/C=C/COCCOCCO 34a_100016278788_100000692535 [2,0,0,0,0,0|1,0,1]=4 2711 B12R0.5 CCC/C=C/COCCOCCO 7a_100016278788_100011215305 [2,0,0,0,0,0|1,0,1]=4 2712 B12R0.5 CCCC#CCOCCCCOC 34a_100000034806_100000755781 [2,0,0,0,0,0|1,0,1]=4 2713 B12R0.5 CCCC#CCOCCCCOC 7a_100000034806_100000730899 [2,0,0,0,0,0|1,0,1]=4 2714 B12R0.5 CCCC#CCOCCOCCC 34a_100000034806_100011215938 [2,0,0,0,0,0|1,0,1]=4 2715 B12R0.5 CCCC#CCOCCOCCC 7a_100000034806_100011215938 [2,0,0,0,0,0|1,0,1]=4 2716 B12R0.5 CCCC#CCOCCOCCO 34a_100000034806_100000692535 [2,0,0,0,0,0|1,0,1]=4 2717 B12R0.5 CCCC#CCOCCOCCO 7a_100000034806_100011215305 [2,0,0,0,0,0|1,0,1]=4 2718 B12R0.5 CCCC/C=C\CCOCCOC 34a_200016286491_100011201679 [2,0,0,0,0,0|1,0,1]=4 2719 B12R0.5 CCCC/C=C\CCOCCOC 7a_200016286491_100000233755 [2,0,0,0,0,0|1,0,1]=4 2720 B12R0.5 CCCCC#CCCOCCOC 34a_100000037610_100011201679 [2,0,0,0,0,0|1,0,1]=4 2721 B12R0.5 CCCCC#CCCOCCOC 7a_100000037610_100000233755 [2,0,0,0,0,0|1,0,1]=4 2722 B12R0.5 CCCCC/C=C/COCCOC 34a_100016258190_100011201679 [2,0,0,0,0,0|1,0,1]=4 2723 B12R0.5 CCCCC/C=C/COCCOC 7a_100016258190_100000233755 [2,0,0,0,0,0|1,0,1]=4 2724 B12R0.5 CCCCCC#CCOCCOC 34a_100000210237_100009816472 [2,0,0,0,0,0|1,0,1]=4 2725 B12R0.5 CCCCCC#CCOCCOC 34a_200000033628_100011201679 [2,0,0,0,0,0|1,0,1]=4 2726 B12R0.5 CCCCCC#CCOCCOC 7a_200000033628_100000233755 [2,0,0,0,0,0|1,0,1]=4 2727 B12R0.5 CCCCCCCCCCCOC 34a_100000210809_200000210301 [2,0,0,0,0,0|2,0,0]=4 2728 B12R0.5 CCCCCCCCCCCOC 34a_100138415774_100011215454 [2,0,0,0,0,0|2,0,0]=4 2729 B12R0.5 CCCCCCCCCCCOC 7a_100000210809_200000210301 [2,0,0,0,0,0|2,0,0]=4 2730 B12R0.5 CCCCCCCCCCCO[13CH3] 34a_100000210809_200025704644 [2,0,0,0,0,0|2,0,0]=4 2731 B12R0.5 CCCCCCCCCCCO[13CH3] 7a_100000210809_200025704644 [2,0,0,0,0,0|2,0,0]=4 2732 B12R0.5 CCCCCCCCCOCCC 34a_100000210258_100011214924 [2,0,0,0,0,0|2,0,0]=4 2733 B12R0.5 CCCCCCCCCOCCC 34a_100000210712_100000210303 [2,0,0,0,0,0|2,0,0]=4 2734 B12R0.5 CCCCCCCCCOCCC 7a_100000210712_100000210303 [2,0,0,0,0,0|2,0,0]=4 2735 B12R0.5 CCCCCCCCCOCCO 34a_100000210712_100000211926 [2,0,0,0,0,0|2,0,0]=4 2736 B12R0.5 CCCCCCCCCOCCO 7a_100000210712_100000211926 [2,0,0,0,0,0|2,0,0]=4 2737 B12R0.5 CCCCCCCCNCCOC 2230a_100000209980_100000210759 [2,0,0,0,0,0|2,0,0]=4 2738 B12R0.5 CCCCCCCCNCCOC 2230a_100000229939_100011201679 [2,0,0,0,0,0|2,0,0]=4 2739 B12R0.5 CCCCCCCCNCCOC 34a_100000229939_100011201679 [2,0,0,0,0,0|2,0,0]=4 2740 B12R0.5 CCCCCCCCOCCCC 34a_100000210227_100000210759 [2,0,0,0,0,0|2,0,0]=4 2741 B12R0.5 CCCCCCCCOCCCC 34a_100000210232_100000210210 [2,0,0,0,0,0|2,0,0]=4 2742 B12R0.5 CCCCCCCCOCCCC 7a_100000210227_100000210759 [2,0,0,0,0,0|2,0,0]=4 2743 B12R0.5 CCCCCCCCOCCCC 7a_100000210232_100000210211 [2,0,0,0,0,0|2,0,0]=4 2744 B12R0.5 CCCCCCCCOCCOC 34a_100000210232_100011201679 [2,0,0,0,0,0|1,0,0]=3 2745 B12R0.5 CCCCCCCCOCCOC 34a_100000210237_100000210759 [2,0,0,0,0,0|1,0,0]=3 2746 B12R0.5 CCCCCCCCOCCOC 7a_100000210232_100000233755 [2,0,0,0,0,0|1,0,0]=3 2747 B12R0.5 CCCCCCCCOCCON 34a_100000700252_100000210759 [2,0,0,0,0,0|2,0,0]=4 2748 B12R0.5 CCCCCCCCOCCSC 34a_100000210232_100000212216 [2,0,0,0,0,0|1,1,0]=4 2749 B12R0.5 CCCCCCCCOCCSC 34a_100000230434_100000210759 [2,0,0,0,0,0|1,1,0]=4 2750 B12R0.5 CCCCCCCCOCCSC 7a_100000210232_100000212216 [2,0,0,0,0,0|1,1,0]=4 2751 B12R0.5 CCCCCCCCOCCSC 7a_100000230434_100000210759 [2,0,0,0,0,0|1,1,0]=4 2752 B12R0.5 CCCCCCCCSCCOC 62a_100000210759_100000233755 [2,0,0,0,0,0|1,1,0]=4 2753 B12R0.5 CCCCCCCCSCCOC 62a_100000233755_100000210317 [2,0,0,0,0,0|1,1,0]=4 2754 B12R0.5 CCCCCCCOCCCCC 34a_100000210253_100000210614 [2,0,0,0,0,0|2,0,0]=4 2755 B12R0.5 CCCCCCCOCCCCC 34a_100000210272_100000718602 [2,0,0,0,0,0|2,0,0]=4 2756 B12R0.5 CCCCCCCOCCCCC 7a_100000210253_100000210614 [2,0,0,0,0,0|2,0,0]=4 2757 B12R0.5 CCCCCCCOCCCCC 7a_100000210272_100000210326 [2,0,0,0,0,0|2,0,0]=4 2758 B12R0.5 CCCCCCCOCCCCO 34a_100000210272_100011216708 [2,0,0,0,0,0|2,0,0]=4 2759 B12R0.5 CCCCCCCOCCCCO 7a_100000210272_100000210776 [2,0,0,0,0,0|2,0,0]=4 2760 B12R0.5 CCCCCCCOCCCOC 34a_100000210272_100000740836 [2,0,0,0,0,0|2,0,0]=4 2761 B12R0.5 CCCCCCCOCCCOC 34a_100000740835_100000210614 [2,0,0,0,0,0|2,0,0]=4 2762 B12R0.5 CCCCCCCOCCCOC 7a_100000210272_100000740836 [2,0,0,0,0,0|2,0,0]=4 2763 B12R0.5 CCCCCCCOCCOCC 34a_100000210136_100000210614 [2,0,0,0,0,0|2,0,0]=4 2764 B12R0.5 CCCCCCCOCCOCC 34a_100000210272_100000210147 [2,0,0,0,0,0|2,0,0]=4 2765 B12R0.5 CCCCCCCOCCOCC 7a_100000210136_100000210614 [2,0,0,0,0,0|2,0,0]=4 2766 B12R0.5 CCCCCCCOCCOCC 7a_100000210272_100011215890 [2,0,0,0,0,0|2,0,0]=4 2767 B12R0.5 CCCCCCNCCCCOC 2230a_100000210581_100000730899 [2,0,0,0,0,0|2,0,0]=4 2768 B12R0.5 CCCCCCNCCOCCC 2230a_100000210581_100011215938 [2,0,0,0,0,0|2,0,0]=4 2769 B12R0.5 CCCCCCNCCOCCC 2230a_100161115042_100000210314 [2,0,0,0,0,0|2,0,0]=4 2770 B12R0.5 CCCCCCNCCOCCC 34a_100161115042_100000210314 [2,0,0,0,0,0|2,0,0]=4 2771 B12R0.5 CCCCCCNCCOCCO 2230a_100000210581_100011215305 [2,0,0,0,0,0|2,0,0]=4 2772 B12R0.5 CCCCCCNCCOCCO 2230a_100000211614_100000210314 [2,0,0,0,0,0|2,0,0]=4 2773 B12R0.5 CCCCCCNCCOCCO 34a_100000211614_100000210314 [2,0,0,0,0,0|2,0,0]=4 2774 B12R0.5 CCCCCCNCOCCOC 2230a_100000210581_100000231047 [2,0,0,0,0,0|2,0,0]=4 2775 B12R0.5 CCCCCCOCCCCCC 34a_100000210259_100000210314 [2,0,0,0,0,0|2,0,0]=4 2776 B12R0.5 CCCCCCOCCCCCC 7a_100000210259_100000210314 [2,0,0,0,0,0|2,0,0]=4 2777 B12R0.5 CCCCCCOCCCCCO 34a_100000210259_100000746330 [2,0,0,0,0,0|2,0,0]=4 2778 B12R0.5 CCCCCCOCCCCCO 7a_100000210259_100000746330 [2,0,0,0,0,0|2,0,0]=4 2779 B12R0.5 CCCCCCOCCCCOC 34a_100000210259_100000755781 [2,0,0,0,0,0|1,0,0]=3 2780 B12R0.5 CCCCCCOCCCCOC 34a_100000740925_100000210314 [2,0,0,0,0,0|1,0,0]=3 2781 B12R0.5 CCCCCCOCCCCOC 7a_100000210259_100000730899 [2,0,0,0,0,0|1,0,0]=3 2782 B12R0.5 CCCCCCOCCCCSC 34a_100011217163_100000210314 [2,0,0,0,0,0|1,1,0]=4 2783 B12R0.5 CCCCCCOCCCCSC 7a_100011217163_100000210314 [2,0,0,0,0,0|1,1,0]=4 2784 B12R0.5 CCCCCCOCCOCCBr 34a_100000692535_100000210314 [2,0,0,0,0,0|2,0,0]=4 2785 B12R0.5 CCCCCCOCCOCCBr 7a_100000692535_100000210314 [2,0,0,0,0,0|2,0,0]=4 2786 B12R0.5 CCCCCCOCCOCCC 34a_100000210259_100011215938 [2,0,0,0,0,0|1,0,0]=3 2787 B12R0.5 CCCCCCOCCOCCC 34a_100000691444_100000210303 [2,0,0,0,0,0|1,0,0]=3 2788 B12R0.5 CCCCCCOCCOCCC 34a_100000752267_100000210314 [2,0,0,0,0,0|1,0,0]=3 2789 B12R0.5 CCCCCCOCCOCCC 7a_100000210259_100011215938 [2,0,0,0,0,0|1,0,0]=3 2790 B12R0.5 CCCCCCOCCOCCC 7a_100000691444_100000210303 [2,0,0,0,0,0|1,0,0]=3 2791 B12R0.5 CCCCCCOCCOCCC 7a_100000752267_100000210314 [2,0,0,0,0,0|1,0,0]=3 2792 B12R0.5 CCCCCCOCCOCCCl 34a_100011215305_100000210314 [2,0,0,0,0,0|2,0,0]=4 2793 B12R0.5 CCCCCCOCCOCCCl 7a_100011215305_100000210314 [2,0,0,0,0,0|2,0,0]=4 2794 B12R0.5 CCCCCCOCCOCCF 34a_100000691444_100011217306 [2,0,0,0,0,0|2,0,0]=4 2795 B12R0.5 CCCCCCOCCOCCF 34a_200015357709_100000210314 [2,0,0,0,0,0|2,0,0]=4 2796 B12R0.5 CCCCCCOCCOCCF 7a_100000691444_100011217306 [2,0,0,0,0,0|2,0,0]=4 2797 B12R0.5 CCCCCCOCCOCCF 7a_200015357709_100000210314 [2,0,0,0,0,0|2,0,0]=4 2798 B12R0.5 CCCCCCOCCOCCI 34a_100012149058_100000210314 [2,0,0,0,0,0|2,0,0]=4 2799 B12R0.5 CCCCCCOCCOCCI 7a_100012149058_100000210314 [2,0,0,0,0,0|2,0,0]=4 2800 B12R0.5 CCCCCCOCCOCCN 34a_100000211614_100000210314 [2,0,0,0,0,0|2,0,0]=4 2801 B12R0.5 CCCCCCOCCOCCO 34a_100000210259_100000692535 [2,0,0,0,0,0|1,0,0]=3 2802 B12R0.5 CCCCCCOCCOCCO 34a_100000691444_100000211926 [2,0,0,0,0,0|1,0,0]=3 2803 B12R0.5 CCCCCCOCCOCCO 7a_100000210259_100011215305 [2,0,0,0,0,0|1,0,0]=3 2804 B12R0.5 CCCCCCOCCOCCO 7a_100000691444_100000211926 [2,0,0,0,0,0|1,0,0]=3 2805 B12R0.5 CCCCCCOCCOCSC 34a_100000691444_100011218213 [2,0,0,0,0,0|1,1,0]=4 2806 B12R0.5 CCCCCCOCCSCCC 34a_200000230433_100000210314 [2,0,0,0,0,0|1,1,0]=4 2807 B12R0.5 CCCCCCOCCSCCC 7a_200000230433_100000210314 [2,0,0,0,0,0|1,1,0]=4 2808 B12R0.5 CCCCCCOCOCCCC 34a_100000210259_100011995733 [2,0,0,0,0,0|2,0,0]=4 2809 B12R0.5 CCCCCCSCCCCOC 62a_100000210314_100000730899 [2,0,0,0,0,0|1,1,0]=4 2810 B12R0.5 CCCCCCSCCCCOC 62a_100000730899_100000210757 [2,0,0,0,0,0|1,1,0]=4 2811 B12R0.5 CCCCCCSCCOCCC 62a_100000210314_100011215938 [2,0,0,0,0,0|1,1,0]=4 2812 B12R0.5 CCCCCCSCCOCCC 62a_100011215938_100000210757 [2,0,0,0,0,0|1,1,0]=4 2813 B12R0.5 CCCCCCSCCOCCO 62a_100000210314_100011215305 [2,0,0,0,0,0|1,1,0]=4 2814 B12R0.5 CCCCCCSCCOCCO 62a_100011215305_100000210757 [2,0,0,0,0,0|1,1,0]=4 2815 B12R0.5 CCCCCCSCOCCOC 62a_100000210314_100000231047 [2,0,0,0,0,0|1,1,0]=4 2816 B12R0.5 CCCCCCSCOCCOC 62a_100000231047_100000210757 [2,0,0,0,0,0|1,1,0]=4 2817 B12R0.5 CCCCCNCCCCCOC 2230a_100000747528_100000210326 [2,0,0,0,0,0|2,0,0]=4 2818 B12R0.5 CCCCCNCCCCCOC 34a_100000747528_100000718602 [2,0,0,0,0,0|2,0,0]=4 2819 B12R0.5 CCCCCNCCOCCCC 2230a_100000209983_100000743108 [2,0,0,0,0,0|2,0,0]=4 2820 B12R0.5 CCCCCNCCOCCCC 34a_100000224656_100000210210 [2,0,0,0,0,0|2,0,0]=4 2821 B12R0.5 CCCCCNCCOCCOC 2230a_100000209983_100000695917 [2,0,0,0,0,0|1,0,0]=3 2822 B12R0.5 CCCCCNCCOCCOC 2230a_100000745349_100000210326 [2,0,0,0,0,0|1,0,0]=3 2823 B12R0.5 CCCCCNCCOCCOC 34a_100000224656_100011201679 [2,0,0,0,0,0|1,0,0]=3 2824 B12R0.5 CCCCCNCCOCCOC 34a_100000745349_100000718602 [2,0,0,0,0,0|1,0,0]=3 2825 B12R0.5 CCCCCNCCOCCSC 34a_100000224656_100000212216 [2,0,0,0,0,0|1,1,0]=4 2826 B12R0.5 CCCCCOCCCCCNC 34a_100000722520_100000718602 [2,0,0,0,0,0|2,0,0]=4 2827 B12R0.5 CCCCCOCCOCCC#N 7a_100011215259_100000184422 [2,0,0,0,0,0|2,0,0]=4 2828 B12R0.5 CCCCCOCCOCCCC 34a_100000210238_100000718602 [2,0,0,0,0,0|1,0,0]=3 2829 B12R0.5 CCCCCOCCOCCCC 34a_100000210253_100000743108 [2,0,0,0,0,0|1,0,0]=3 2830 B12R0.5 CCCCCOCCOCCCC 34a_100011215259_100000210210 [2,0,0,0,0,0|1,0,0]=3 2831 B12R0.5 CCCCCOCCOCCCC 7a_100000210238_100000210326 [2,0,0,0,0,0|1,0,0]=3 2832 B12R0.5 CCCCCOCCOCCCC 7a_100000210253_100000743108 [2,0,0,0,0,0|1,0,0]=3 2833 B12R0.5 CCCCCOCCOCCCC 7a_100011215259_100000210211 [2,0,0,0,0,0|1,0,0]=3 2834 B12R0.5 CCCCCOCCOCCCF 34a_100011215259_100011934791 [2,0,0,0,0,0|2,0,0]=4 2835 B12R0.5 CCCCCOCCOCCCF 7a_100011215259_100011934791 [2,0,0,0,0,0|2,0,0]=4 2836 B12R0.5 CCCCCOCCOCCCO 34a_100011215259_100000230001 [2,0,0,0,0,0|2,0,0]=4 2837 B12R0.5 CCCCCOCCOCCCO 7a_100011215259_100011215043 [2,0,0,0,0,0|2,0,0]=4 2838 B12R0.5 CCCCCOCCOCCNC 34a_100000228057_100000718602 [2,0,0,0,0,0|1,0,0]=3 2839 B12R0.5 CCCCCOCCOCCOC 34a_100000210253_100000695917 [2,0,0,0,0,0|0,0,0]=2 2840 B12R0.5 CCCCCOCCOCCOC 34a_100011215163_100000718602 [2,0,0,0,0,0|0,0,0]=2 2841 B12R0.5 CCCCCOCCOCCOC 34a_100011215259_100011201679 [2,0,0,0,0,0|0,0,0]=2 2842 B12R0.5 CCCCCOCCOCCOC 7a_100000210253_100000695917 [2,0,0,0,0,0|0,0,0]=2 2843 B12R0.5 CCCCCOCCOCCOC 7a_100011215163_100000210326 [2,0,0,0,0,0|0,0,0]=2 2844 B12R0.5 CCCCCOCCOCCOC 7a_100011215259_100000233755 [2,0,0,0,0,0|0,0,0]=2 2845 B12R0.5 CCCCCOCCOCCSC 34a_100011215259_100000212216 [2,0,0,0,0,0|0,1,0]=3 2846 B12R0.5 CCCCCOCCOCCSC 7a_100011215259_100000212216 [2,0,0,0,0,0|0,1,0]=3 2847 B12R0.5 CCCCCOCCSCCCC 34a_200000230436_100000718602 [2,0,0,0,0,0|1,1,0]=4 2848 B12R0.5 CCCCCOCCSCCCC 7a_200000230436_100000210326 [2,0,0,0,0,0|1,1,0]=4 2849 B12R0.5 CCCCCSCCOCCCC 62a_100000210326_100000743108 [2,0,0,0,0,0|1,1,0]=4 2850 B12R0.5 CCCCCSCCOCCCC 62a_100000743108_100000210326 [2,0,0,0,0,0|1,1,0]=4 2851 B12R0.5 CCCCCSCCOCCOC 62a_100000210326_100000695917 [2,0,0,0,0,0|0,1,0]=3 2852 B12R0.5 CCCCCSCCOCCOC 62a_100000695917_100000210326 [2,0,0,0,0,0|0,1,0]=3 2853 B12R0.5 CCCCNCCCCCCOC 2230a_100000102301_100011998445 [2,0,0,0,0,0|2,0,0]=4 2854 B12R0.5 CCCCNCCCCCCOC 7a_106832991798_100011998445 [2,0,0,0,0,0|2,0,0]=4 2855 B12R0.5 CCCCNCCCCOCCC 34a_200011216965_100000210303 [2,0,0,0,0,0|2,0,0]=4 2856 B12R0.5 CCCCNCCCCOCCO 34a_200011216965_100000211926 [2,0,0,0,0,0|2,0,0]=4 2857 B12R0.5 CCCCNCCCOCCOC 2230a_100000102301_100011216529 [2,0,0,0,0,0|2,0,0]=4 2858 B12R0.5 CCCCNCCCOCCOC 2230a_100000206027_100000210211 [2,0,0,0,0,0|2,0,0]=4 2859 B12R0.5 CCCCNCCCOCCOC 34a_100000206027_100000210210 [2,0,0,0,0,0|2,0,0]=4 2860 B12R0.5 CCCCNCCCOCCOC 7a_106832991798_100011216529 [2,0,0,0,0,0|2,0,0]=4 2861 B12R0.5 CCCCNCCOCCOCC 2230a_100000102301_100011211534 [2,0,0,0,0,0|2,0,0]=4 2862 B12R0.5 CCCCNCCOCCOCC 2230a_100102712874_100000210211 [2,0,0,0,0,0|2,0,0]=4 2863 B12R0.5 CCCCNCCOCCOCC 34a_100102712874_100000210210 [2,0,0,0,0,0|2,0,0]=4 2864 B12R0.5 CCCCNCCOCCOCC 7a_106832991798_100011211534 [2,0,0,0,0,0|2,0,0]=4 2865 B12R0.5 CCCCOCCCCCCCO 34a_100000210227_100000760002 [2,0,0,0,0,0|2,0,0]=4 2866 B12R0.5 CCCCOCCCCCCCO 7a_100000210227_100000760002 [2,0,0,0,0,0|2,0,0]=4 2867 B12R0.5 CCCCOCCCCCCOC 34a_100000210227_100011998445 [2,0,0,0,0,0|1,0,0]=3 2868 B12R0.5 CCCCOCCCCCCOC 34a_200012092642_100000210210 [2,0,0,0,0,0|1,0,0]=3 2869 B12R0.5 CCCCOCCCCCCOC 7a_100000210227_100011998445 [2,0,0,0,0,0|1,0,0]=3 2870 B12R0.5 CCCCOCCCCCCOC 7a_200012092642_100000210211 [2,0,0,0,0,0|1,0,0]=3 2871 B12R0.5 CCCCOCCCCOCCC 34a_200000760531_100000210303 [2,0,0,0,0,0|1,0,0]=3 2872 B12R0.5 CCCCOCCCCOCCC 7a_200000760531_100000210303 [2,0,0,0,0,0|1,0,0]=3 2873 B12R0.5 CCCCOCCCCOCCF 34a_200000760531_100011217306 [2,0,0,0,0,0|2,0,0]=4 2874 B12R0.5 CCCCOCCCCOCCF 7a_200000760531_100011217306 [2,0,0,0,0,0|2,0,0]=4 2875 B12R0.5 CCCCOCCCCOCCO 34a_200000760531_100000211926 [2,0,0,0,0,0|1,0,0]=3 2876 B12R0.5 CCCCOCCCCOCCO 7a_200000760531_100000211926 [2,0,0,0,0,0|1,0,0]=3 2877 B12R0.5 CCCCOCCCCOCSC 34a_200000760531_100011218213 [2,0,0,0,0,0|1,1,0]=4 2878 B12R0.5 CCCCOCCCNCCOC 2230a_200000211371_100011201679 [2,0,0,0,0,0|2,0,0]=4 2879 B12R0.5 CCCCOCCCNCCOC 34a_200000211371_100011201679 [2,0,0,0,0,0|2,0,0]=4 2880 B12R0.5 CCCCOCCCOCCCC 34a_200011215613_100000210210 [2,0,0,0,0,0|2,0,0]=4 2881 B12R0.5 CCCCOCCCOCCCC 7a_200011215613_100000210211 [2,0,0,0,0,0|2,0,0]=4 2882 B12R0.5 CCCCOCCCOCCOC 34a_100000210227_100011216529 [2,0,0,0,0,0|1,0,0]=3 2883 B12R0.5 CCCCOCCCOCCOC 34a_200011215613_100011201679 [2,0,0,0,0,0|1,0,0]=3 2884 B12R0.5 CCCCOCCCOCCOC 7a_100000210227_100011216529 [2,0,0,0,0,0|1,0,0]=3 2885 B12R0.5 CCCCOCCCOCCOC 7a_200011215613_100000233755 [2,0,0,0,0,0|1,0,0]=3 2886 B12R0.5 CCCCOCCCOCCSC 34a_200011215613_100000212216 [2,0,0,0,0,0|1,1,0]=4 2887 B12R0.5 CCCCOCCCOCCSC 7a_200011215613_100000212216 [2,0,0,0,0,0|1,1,0]=4 2888 B12R0.5 CCCCOCCNCCCCO 2230a_100000750430_100000743108 [2,0,0,0,0,0|2,0,0]=4 2889 B12R0.5 CCCCOCCNCCCCO 34a_100000750430_100000743108 [2,0,0,0,0,0|2,0,0]=4 2890 B12R0.5 CCCCOCCNCCCOC 34a_100150723488_100000743108 [2,0,0,0,0,0|2,0,0]=4 2891 B12R0.5 CCCCOCCNCCOCC 2230a_102516460346_100000743108 [2,0,0,0,0,0|2,0,0]=4 2892 B12R0.5 CCCCOCCNCCOCC 34a_102516460346_100000743108 [2,0,0,0,0,0|2,0,0]=4 2893 B12R0.5 CCCCOCCOCCCCBr 34a_100011216708_100000743108 [2,0,0,0,0,0|2,0,0]=4 2894 B12R0.5 CCCCOCCOCCCCCl 34a_100000210776_100000743108 [2,0,0,0,0,0|2,0,0]=4 2895 B12R0.5 CCCCOCCOCCCCCl 7a_100000210776_100000743108 [2,0,0,0,0,0|2,0,0]=4 2896 B12R0.5 CCCCOCCOCCCCF 34a_100000210238_100000729493 [2,0,0,0,0,0|2,0,0]=4 2897 B12R0.5 CCCCOCCOCCCCF 34a_100011995726_100000743108 [2,0,0,0,0,0|2,0,0]=4 2898 B12R0.5 CCCCOCCOCCCCF 7a_100000210238_100000729493 [2,0,0,0,0,0|2,0,0]=4 2899 B12R0.5 CCCCOCCOCCCCF 7a_100011995726_100000743108 [2,0,0,0,0,0|2,0,0]=4 2900 B12R0.5 CCCCOCCOCCCCI 34a_200012148704_100000743108 [2,0,0,0,0,0|2,0,0]=4 2901 B12R0.5 CCCCOCCOCCCCN 34a_100000750430_100000743108 [2,0,0,0,0,0|2,0,0]=4 2902 B12R0.5 CCCCOCCOCCCCO 34a_100000210238_100011216708 [2,0,0,0,0,0|1,0,0]=3 2903 B12R0.5 CCCCOCCOCCCCO 7a_100000210238_100000210776 [2,0,0,0,0,0|1,0,0]=3 2904 B12R0.5 CCCCOCCOCCCNC 34a_100000213112_100000743108 [2,0,0,0,0,0|2,0,0]=4 2905 B12R0.5 CCCCOCCOCCCOC 34a_100000210238_100000740836 [2,0,0,0,0,0|1,0,0]=3 2906 B12R0.5 CCCCOCCOCCCOC 34a_100000740835_100000743108 [2,0,0,0,0,0|1,0,0]=3 2907 B12R0.5 CCCCOCCOCCCOC 7a_100000210238_100000740836 [2,0,0,0,0,0|1,0,0]=3 2908 B12R0.5 CCCCOCCOCCCSC 34a_100000690336_100000743108 [2,0,0,0,0,0|1,1,0]=4 2909 B12R0.5 CCCCOCCOCCCSC 7a_100000690336_100000743108 [2,0,0,0,0,0|1,1,0]=4 2910 B12R0.5 CCCCOCCOCCOCC 34a_100000210136_100000743108 [2,0,0,0,0,0|1,0,0]=3 2911 B12R0.5 CCCCOCCOCCOCC 34a_100000210227_100011211534 [2,0,0,0,0,0|1,0,0]=3 2912 B12R0.5 CCCCOCCOCCOCC 34a_100000210238_100000210147 [2,0,0,0,0,0|1,0,0]=3 2913 B12R0.5 CCCCOCCOCCOCC 34a_100000210240_100000210210 [2,0,0,0,0,0|1,0,0]=3 2914 B12R0.5 CCCCOCCOCCOCC 34a_100011215186_100000210202 [2,0,0,0,0,0|1,0,0]=3 2915 B12R0.5 CCCCOCCOCCOCC 7a_100000210136_100000743108 [2,0,0,0,0,0|1,0,0]=3 2916 B12R0.5 CCCCOCCOCCOCC 7a_100000210227_100011211534 [2,0,0,0,0,0|1,0,0]=3 2917 B12R0.5 CCCCOCCOCCOCC 7a_100000210238_100011215890 [2,0,0,0,0,0|1,0,0]=3 2918 B12R0.5 CCCCOCCOCCOCC 7a_100000210240_100000210211 [2,0,0,0,0,0|1,0,0]=3 2919 B12R0.5 CCCCOCCOCCOCC 7a_100011215186_100000210202 [2,0,0,0,0,0|1,0,0]=3 2920 B12R0.5 CCCCOCCOCCOCF 34a_100011215186_100015361967 [2,0,0,0,0,0|2,0,0]=4 2921 B12R0.5 CCCCOCCOCCOCF 7a_100011215186_100015361967 [2,0,0,0,0,0|2,0,0]=4 2922 B12R0.5 CCCCOCCOCCSCC 34a_100000210238_100000757381 [2,0,0,0,0,0|1,1,0]=4 2923 B12R0.5 CCCCOCCOCCSCC 34a_100000212035_100000743108 [2,0,0,0,0,0|1,1,0]=4 2924 B12R0.5 CCCCOCCOCCSCC 7a_100000210238_100000757381 [2,0,0,0,0,0|1,1,0]=4 2925 B12R0.5 CCCCOCCOCCSCC 7a_100000212035_100000743108 [2,0,0,0,0,0|1,1,0]=4 2926 B12R0.5 CCCCOCCSCCCCO 62a_100000210776_100000743108 [2,0,0,0,0,0|1,1,0]=4 2927 B12R0.5 CCCCOCCSCCCCO 62a_100000743108_100000210776 [2,0,0,0,0,0|1,1,0]=4 2928 B12R0.5 CCCCOCCSCCCOC 62a_100000709357_100000743108 [2,0,0,0,0,0|1,1,0]=4 2929 B12R0.5 CCCCOCCSCCCOC 62a_100000743108_100000709357 [2,0,0,0,0,0|1,1,0]=4 2930 B12R0.5 CCCCOCCSCCOCC 62a_100000210147_100000743108 [2,0,0,0,0,0|1,1,0]=4 2931 B12R0.5 CCCCOCCSCCOCC 62a_100000743108_100011215890 [2,0,0,0,0,0|1,1,0]=4 2932 B12R0.5 CCCCOCNCCOCCC 2230a_100161115042_100011995733 [2,0,0,0,0,0|2,0,0]=4 2933 B12R0.5 CCCCOCNCCOCCC 34a_100161115042_100011995733 [2,0,0,0,0,0|2,0,0]=4 2934 B12R0.5 CCCCOCNCCOCCO 2230a_100000211614_100011995733 [2,0,0,0,0,0|2,0,0]=4 2935 B12R0.5 CCCCOCNCCOCCO 34a_100000211614_100011995733 [2,0,0,0,0,0|2,0,0]=4 2936 B12R0.5 CCCCOCOCCCCOC 34a_100000740925_100011995733 [2,0,0,0,0,0|1,0,0]=3 2937 B12R0.5 CCCCOCOCCCCSC 34a_100011217163_100011995733 [2,0,0,0,0,0|1,1,0]=4 2938 B12R0.5 CCCCOCOCCOCCBr 34a_100000692535_100011995733 [2,0,0,0,0,0|2,0,0]=4 2939 B12R0.5 CCCCOCOCCOCCC 34a_100000752267_100011995733 [2,0,0,0,0,0|1,0,0]=3 2940 B12R0.5 CCCCOCOCCOCCCl 34a_100011215305_100011995733 [2,0,0,0,0,0|2,0,0]=4 2941 B12R0.5 CCCCOCOCCOCCF 34a_200015357709_100011995733 [2,0,0,0,0,0|2,0,0]=4 2942 B12R0.5 CCCCOCOCCOCCI 34a_100012149058_100011995733 [2,0,0,0,0,0|2,0,0]=4 2943 B12R0.5 CCCCOCOCCOCCN 34a_100000211614_100011995733 [2,0,0,0,0,0|2,0,0]=4 2944 B12R0.5 CCCCOCOCCSCCC 34a_200000230433_100011995733 [2,0,0,0,0,0|1,1,0]=4 2945 B12R0.5 CCCCOCSCCCCOC 62a_100000730899_100011995733 [2,0,0,0,0,0|1,1,0]=4 2946 B12R0.5 CCCCOCSCCCCOC 62a_100011995733_100000730899 [2,0,0,0,0,0|1,1,0]=4 2947 B12R0.5 CCCCOCSCCOCCC 62a_100011215938_100011995733 [2,0,0,0,0,0|1,1,0]=4 2948 B12R0.5 CCCCOCSCCOCCC 62a_100011995733_100011215938 [2,0,0,0,0,0|1,1,0]=4 2949 B12R0.5 CCCCOCSCCOCCO 62a_100011215305_100011995733 [2,0,0,0,0,0|1,1,0]=4 2950 B12R0.5 CCCCOCSCCOCCO 62a_100011995733_100011215305 [2,0,0,0,0,0|1,1,0]=4 2951 B12R0.5 CCCCOCSCOCCOC 62a_100000231047_100011995733 [2,0,0,0,0,0|1,1,0]=4 2952 B12R0.5 CCCCOCSCOCCOC 62a_100011995733_100000231047 [2,0,0,0,0,0|1,1,0]=4 2953 B12R0.5 CCCCSCCCCCCOC 62a_100000210211_100011998445 [2,0,0,0,0,0|1,1,0]=4 2954 B12R0.5 CCCCSCCCCCCOC 62a_100011998445_100000210210 [2,0,0,0,0,0|1,1,0]=4 2955 B12R0.5 CCCCSCCCOCCOC 62a_100000210211_100011216529 [2,0,0,0,0,0|1,1,0]=4 2956 B12R0.5 CCCCSCCCOCCOC 62a_100011216529_100000210210 [2,0,0,0,0,0|1,1,0]=4 2957 B12R0.5 CCCCSCCOCCCCO 34a_200000230436_100011216708 [2,0,0,0,0,0|1,1,0]=4 2958 B12R0.5 CCCCSCCOCCCCO 7a_200000230436_100000210776 [2,0,0,0,0,0|1,1,0]=4 2959 B12R0.5 CCCCSCCOCCCOC 34a_200000230436_100000740836 [2,0,0,0,0,0|1,1,0]=4 2960 B12R0.5 CCCCSCCOCCCOC 7a_200000230436_100000740836 [2,0,0,0,0,0|1,1,0]=4 2961 B12R0.5 CCCCSCCOCCOCC 34a_200000230436_100000210147 [2,0,0,0,0,0|1,1,0]=4 2962 B12R0.5 CCCCSCCOCCOCC 62a_100000210211_100011211534 [2,0,0,0,0,0|1,1,0]=4 2963 B12R0.5 CCCCSCCOCCOCC 62a_100011211534_100000210210 [2,0,0,0,0,0|1,1,0]=4 2964 B12R0.5 CCCCSCCOCCOCC 7a_200000230436_100011215890 [2,0,0,0,0,0|1,1,0]=4 2965 B12R0.5 CCCNCCOCCOCCC 2230a_200011904461_100000210303 [2,0,0,0,0,0|1,0,0]=3 2966 B12R0.5 CCCNCCOCCOCCC 34a_200011904461_100000210303 [2,0,0,0,0,0|1,0,0]=3 2967 B12R0.5 CCCNCCOCCOCCO 2230a_100011998139_100000210303 [2,0,0,0,0,0|1,0,0]=3 2968 B12R0.5 CCCNCCOCCOCCO 34a_100011998139_100000210303 [2,0,0,0,0,0|1,0,0]=3 2969 B12R0.5 CCCOCCCCCCCCO 34a_100000210258_100000033203 [2,0,0,0,0,0|2,0,0]=4 2970 B12R0.5 CCCOCCCNCCCOC 2230a_100011217757_100000740836 [2,0,0,0,0,0|2,0,0]=4 2971 B12R0.5 CCCOCCCNCCCOC 34a_100011217757_100000740836 [2,0,0,0,0,0|2,0,0]=4 2972 B12R0.5 CCCOCCCOCCCOC 34a_200011215475_100000210303 [2,0,0,0,0,0|2,0,0]=4 2973 B12R0.5 CCCOCCCOCCCOC 7a_200011215475_100000210303 [2,0,0,0,0,0|2,0,0]=4 2974 B12R0.5 CCCOCCNCCCCCO 2230a_100000762737_100011215938 [2,0,0,0,0,0|2,0,0]=4 2975 B12R0.5 CCCOCCNCCCCCO 2230a_100161115042_100000746330 [2,0,0,0,0,0|2,0,0]=4 2976 B12R0.5 CCCOCCNCCCCCO 34a_100000762737_100011215938 [2,0,0,0,0,0|2,0,0]=4 2977 B12R0.5 CCCOCCNCCCCCO 34a_100161115042_100000746330 [2,0,0,0,0,0|2,0,0]=4 2978 B12R0.5 CCCOCCNCCCCOC 2230a_100161115042_100000730899 [2,0,0,0,0,0|1,0,0]=3 2979 B12R0.5 CCCOCCNCCCCOC 34a_100161115042_100000755781 [2,0,0,0,0,0|1,0,0]=3 2980 B12R0.5 CCCOCCNCCOCCC 2230a_100161115042_100011215938 [2,0,0,0,0,0|1,0,0]=3 2981 B12R0.5 CCCOCCNCCOCCC 34a_100161115042_100011215938 [2,0,0,0,0,0|1,0,0]=3 2982 B12R0.5 CCCOCCNCCOCCO 2230a_100000211614_100011215938 [2,0,0,0,0,0|1,0,0]=3 2983 B12R0.5 CCCOCCNCCOCCO 2230a_100161115042_100011215305 [2,0,0,0,0,0|1,0,0]=3 2984 B12R0.5 CCCOCCNCCOCCO 34a_100000211614_100011215938 [2,0,0,0,0,0|1,0,0]=3 2985 B12R0.5 CCCOCCNCCOCCO 34a_100161115042_100000692535 [2,0,0,0,0,0|1,0,0]=3 2986 B12R0.5 CCCOCCNCCSCCC 2230a_100020603323_100011215938 [2,0,0,0,0,0|1,1,0]=4 2987 B12R0.5 CCCOCCNCCSCCO 2230a_100011219999_100011215938 [2,0,0,0,0,0|1,1,0]=4 2988 B12R0.5 CCCOCCNCOCCOC 2230a_100161115042_100000231047 [2,0,0,0,0,0|1,0,0]=3 2989 B12R0.5 CCCOCCOCCCCC#N 7a_100000752267_100000211819 [2,0,0,0,0,0|2,0,0]=4 2990 B12R0.5 CCCOCCOCCCCC=O 7a_100000752267_100000139335 [2,0,0,0,0,0|2,0,0]=4 2991 B12R0.5 CCCOCCOCCCCCBr 34a_100000746331_100011215938 [2,0,0,0,0,0|2,0,0]=4 2992 B12R0.5 CCCOCCOCCCCCBr 7a_100000746331_100011215938 [2,0,0,0,0,0|2,0,0]=4 2993 B12R0.5 CCCOCCOCCCCCCl 34a_100000746330_100011215938 [2,0,0,0,0,0|2,0,0]=4 2994 B12R0.5 CCCOCCOCCCCCCl 7a_100000746330_100011215938 [2,0,0,0,0,0|2,0,0]=4 2995 B12R0.5 CCCOCCOCCCCCF 34a_100000752267_100000729378 [2,0,0,0,0,0|2,0,0]=4 2996 B12R0.5 CCCOCCOCCCCCF 7a_100000752267_100000729378 [2,0,0,0,0,0|2,0,0]=4 2997 B12R0.5 CCCOCCOCCCCCI 34a_200012148887_100011215938 [2,0,0,0,0,0|2,0,0]=4 2998 B12R0.5 CCCOCCOCCCCCI 7a_200012148887_100011215938 [2,0,0,0,0,0|2,0,0]=4 2999 B12R0.5 CCCOCCOCCCCCN 34a_100000762737_100011215938 [2,0,0,0,0,0|2,0,0]=4 3000 B12R0.5 CCCOCCOCCCCCO 34a_100000752267_100000746330 [2,0,0,0,0,0|1,0,0]=3 3001 B12R0.5 CCCOCCOCCCCCO 7a_100000752267_100000746330 [2,0,0,0,0,0|1,0,0]=3 3002 B12R0.5 CCCOCCOCCCCOC 34a_100000740925_100011215938 [2,0,0,0,0,0|0,0,0]=2 3003 B12R0.5 CCCOCCOCCCCOC 34a_100000752267_100000755781 [2,0,0,0,0,0|0,0,0]=2 3004 B12R0.5 CCCOCCOCCCCOC 7a_100000752267_100000730899 [2,0,0,0,0,0|0,0,0]=2 3005 B12R0.5 CCCOCCOCCCCSC 34a_100011217163_100011215938 [2,0,0,0,0,0|0,1,0]=3 3006 B12R0.5 CCCOCCOCCCCSC 7a_100011217163_100011215938 [2,0,0,0,0,0|0,1,0]=3 3007 B12R0.5 CCCOCCOCCCOCC 34a_100000752267_100012232248 [2,0,0,0,0,0|2,0,0]=4 3008 B12R0.5 CCCOCCOCCCOCC 34a_100000757476_100011215938 [2,0,0,0,0,0|2,0,0]=4 3009 B12R0.5 CCCOCCOCCCOCC 7a_100000752267_100012232248 [2,0,0,0,0,0|2,0,0]=4 3010 B12R0.5 CCCOCCOCCCOCC 7a_100000757476_100011215938 [2,0,0,0,0,0|2,0,0]=4 3011 B12R0.5 CCCOCCOCCCSCC 34a_100011216438_100011215938 [2,0,0,0,0,0|2,0,0]=4 3012 B12R0.5 CCCOCCOCCCSCC 7a_100011216438_100011215938 [2,0,0,0,0,0|2,0,0]=4 3013 B12R0.5 CCCOCCOCCNCCF 2230a_200011904461_100011217306 [2,0,0,0,0,0|2,0,0]=4 3014 B12R0.5 CCCOCCOCCNCCF 34a_200011904461_100011217306 [2,0,0,0,0,0|2,0,0]=4 3015 B12R0.5 CCCOCCOCCNCCO 2230a_200011904461_100000211926 [2,0,0,0,0,0|1,0,0]=3 3016 B12R0.5 CCCOCCOCCNCCO 34a_200011904461_100000211926 [2,0,0,0,0,0|1,0,0]=3 3017 B12R0.5 CCCOCCOCCNCOC 2230a_200011904461_100000766300 [2,0,0,0,0,0|1,0,0]=3 3018 B12R0.5 CCCOCCOCCNCSC 2230a_200011904461_100011218213 [2,0,0,0,0,0|1,1,0]=4 3019 B12R0.5 CCCOCCOCCNCSC 34a_200011904461_100011218213 [2,0,0,0,0,0|1,1,0]=4 3020 B12R0.5 CCCOCCOCCOCC#N 7a_100000752267_200000047693 [2,0,0,0,0,0|1,0,1]=4 3021 B12R0.5 CCCOCCOCCOCCBr 34a_100000692535_100011215938 [2,0,0,0,0,0|1,0,0]=3 3022 B12R0.5 CCCOCCOCCOCCBr 34a_100010132937_100000210303 [2,0,0,0,0,0|1,0,0]=3 3023 B12R0.5 CCCOCCOCCOCCBr 7a_100000692535_100011215938 [2,0,0,0,0,0|1,0,0]=3 3024 B12R0.5 CCCOCCOCCOCCBr 7a_100010132937_100000210303 [2,0,0,0,0,0|1,0,0]=3 3025 B12R0.5 CCCOCCOCCOCCC 34a_100000752267_100011215938 [2,0,0,0,0,0|0,0,0]=2 3026 B12R0.5 CCCOCCOCCOCCC 7a_100000752267_100011215938 [2,0,0,0,0,0|0,0,0]=2 3027 B12R0.5 CCCOCCOCCOCCCl 34a_100000032323_100000210303 [2,0,0,0,0,0|1,0,0]=3 3028 B12R0.5 CCCOCCOCCOCCCl 34a_100011215305_100011215938 [2,0,0,0,0,0|1,0,0]=3 3029 B12R0.5 CCCOCCOCCOCCCl 7a_100000032323_100000210303 [2,0,0,0,0,0|1,0,0]=3 3030 B12R0.5 CCCOCCOCCOCCCl 7a_100011215305_100011215938 [2,0,0,0,0,0|1,0,0]=3 3031 B12R0.5 CCCOCCOCCOCCF 34a_200015357709_100011215938 [2,0,0,0,0,0|1,0,0]=3 3032 B12R0.5 CCCOCCOCCOCCF 7a_200015357709_100011215938 [2,0,0,0,0,0|1,0,0]=3 3033 B12R0.5 CCCOCCOCCOCCI 34a_100012149058_100011215938 [2,0,0,0,0,0|1,0,0]=3 3034 B12R0.5 CCCOCCOCCOCCI 7a_100012149058_100011215938 [2,0,0,0,0,0|1,0,0]=3 3035 B12R0.5 CCCOCCOCCOCCN 34a_100000211614_100011215938 [2,0,0,0,0,0|1,0,0]=3 3036 B12R0.5 CCCOCCOCCOCCN 34a_100011998139_100000210303 [2,0,0,0,0,0|1,0,0]=3 3037 B12R0.5 CCCOCCOCCOCCO 34a_100000210258_100000032323 [2,0,0,0,0,0|0,0,0]=2 3038 B12R0.5 CCCOCCOCCOCCO 34a_100000752267_100000692535 [2,0,0,0,0,0|0,0,0]=2 3039 B12R0.5 CCCOCCOCCOCCO 7a_100000752267_100011215305 [2,0,0,0,0,0|0,0,0]=2 3040 B12R0.5 CCCOCCOCCSCCC 34a_200000230433_100011215938 [2,0,0,0,0,0|0,1,0]=3 3041 B12R0.5 CCCOCCOCCSCCC 7a_200000230433_100011215938 [2,0,0,0,0,0|0,1,0]=3 3042 B12R0.5 CCCOCCSCCCCCO 62a_100000746330_100011215938 [2,0,0,0,0,0|1,1,0]=4 3043 B12R0.5 CCCOCCSCCCCCO 62a_100011215938_100000746330 [2,0,0,0,0,0|1,1,0]=4 3044 B12R0.5 CCCOCCSCCCCOC 62a_100000730899_100011215938 [2,0,0,0,0,0|0,1,0]=3 3045 B12R0.5 CCCOCCSCCCCOC 62a_100011215938_100000730899 [2,0,0,0,0,0|0,1,0]=3 3046 B12R0.5 CCCOCCSCCOCCC 62a_100011215938_100011215938 [2,0,0,0,0,0|0,1,0]=3 3047 B12R0.5 CCCOCCSCCOCCO 62a_100011215305_100011215938 [2,0,0,0,0,0|0,1,0]=3 3048 B12R0.5 CCCOCCSCCOCCO 62a_100011215938_100011215305 [2,0,0,0,0,0|0,1,0]=3 3049 B12R0.5 CCCOCCSCOCCOC 62a_100000231047_100011215938 [2,0,0,0,0,0|0,1,0]=3 3050 B12R0.5 CCCOCCSCOCCOC 62a_100011215938_100000231047 [2,0,0,0,0,0|0,1,0]=3 3051 B12R0.5 CCCSCCNCCCCOC 2230a_100020603323_100000730899 [2,0,0,0,0,0|1,1,0]=4 3052 B12R0.5 CCCSCCNCCOCCO 2230a_100020603323_100011215305 [2,0,0,0,0,0|1,1,0]=4 3053 B12R0.5 CCCSCCNCOCCOC 2230a_100020603323_100000231047 [2,0,0,0,0,0|1,1,0]=4 3054 B12R0.5 CCCSCCOCCCCCO 34a_200000230433_100000746330 [2,0,0,0,0,0|1,1,0]=4 3055 B12R0.5 CCCSCCOCCCCCO 7a_200000230433_100000746330 [2,0,0,0,0,0|1,1,0]=4 3056 B12R0.5 CCCSCCOCCCCOC 34a_200000230433_100000755781 [2,0,0,0,0,0|0,1,0]=3 3057 B12R0.5 CCCSCCOCCCCOC 7a_200000230433_100000730899 [2,0,0,0,0,0|0,1,0]=3 3058 B12R0.5 CCCSCCOCCOCCO 34a_200000230433_100000692535 [2,0,0,0,0,0|0,1,0]=3 3059 B12R0.5 CCCSCCOCCOCCO 62a_100000032323_100000210303 [2,0,0,0,0,0|0,1,0]=3 3060 B12R0.5 CCCSCCOCCOCCO 62a_100000210303_100000032323 [2,0,0,0,0,0|0,1,0]=3 3061 B12R0.5 CCCSCCOCCOCCO 7a_200000230433_100011215305 [2,0,0,0,0,0|0,1,0]=3 3062 B12R0.5 CCNCCCOCCOCCO 2230a_100011996194_100000210202 [2,0,0,0,0,0|2,0,0]=4 3063 B12R0.5 CCNCCCOCCOCCO 34a_100011996194_100000210202 [2,0,0,0,0,0|2,0,0]=4 3064 B12R0.5 CCNCCOCCOCCOC 2230a_100012028300_100000210202 [2,0,0,0,0,0|1,0,0]=3 3065 B12R0.5 CCNCCOCCOCCOC 2230a_100015525214_100013367474 [2,0,0,0,0,0|1,0,0]=3 3066 B12R0.5 CCNCCOCCOCCOC 34a_100012028300_100000210202 [2,0,0,0,0,0|1,0,0]=3 3067 B12R0.5 CCOCCCNCOCCOC 2230a_100000210961_100000231047 [2,0,0,0,0,0|2,0,0]=4 3068 B12R0.5 CCOCCCOCCCCOC 34a_100000740925_100012232248 [2,0,0,0,0,0|2,0,0]=4 3069 B12R0.5 CCOCCCOCCCCOC 34a_100000757476_100000755781 [2,0,0,0,0,0|2,0,0]=4 3070 B12R0.5 CCOCCCOCCCCOC 7a_100000757476_100000730899 [2,0,0,0,0,0|2,0,0]=4 3071 B12R0.5 CCOCCCOCCOCCO 34a_100000757476_100000692535 [2,0,0,0,0,0|2,0,0]=4 3072 B12R0.5 CCOCCCOCCOCCO 7a_100000757476_100011215305 [2,0,0,0,0,0|2,0,0]=4 3073 B12R0.5 CCOCCCSCOCCOC 62a_100000231047_100012232248 [2,0,0,0,0,0|2,0,0]=4 3074 B12R0.5 CCOCCCSCOCCOC 62a_100012232248_100000231047 [2,0,0,0,0,0|2,0,0]=4 3075 B12R0.5 CCOCCNCCCCCOC 2230a_100000747528_100011215890 [2,0,0,0,0,0|2,0,0]=4 3076 B12R0.5 CCOCCNCCCCCOC 34a_100000747528_100000210147 [2,0,0,0,0,0|2,0,0]=4 3077 B12R0.5 CCOCCNCCOCCOC 2230a_100000745349_100011215890 [2,0,0,0,0,0|1,0,0]=3 3078 B12R0.5 CCOCCNCCOCCOC 2230a_102516460346_100000695917 [2,0,0,0,0,0|1,0,0]=3 3079 B12R0.5 CCOCCNCCOCCOC 34a_100000745349_100000210147 [2,0,0,0,0,0|1,0,0]=3 3080 B12R0.5 CCOCCNCCOCCOC 34a_102516460346_100000695917 [2,0,0,0,0,0|1,0,0]=3 3081 B12R0.5 CCOCCOCCCCCNC 34a_100000722520_100000210147 [2,0,0,0,0,0|2,0,0]=4 3082 B12R0.5 CCOCCOCCNCCOC 2230a_100000209980_100011211534 [2,0,0,0,0,0|1,0,0]=3 3083 B12R0.5 CCOCCOCCNCCOC 2230a_100102712874_100011201679 [2,0,0,0,0,0|1,0,0]=3 3084 B12R0.5 CCOCCOCCNCCOC 34a_100102712874_100011201679 [2,0,0,0,0,0|1,0,0]=3 3085 B12R0.5 CCOCCOCCNCCSC 2230a_100020590264_100011211534 [2,0,0,0,0,0|1,1,0]=4 3086 B12R0.5 CCOCCOCCNCCSC 2230a_100102712874_100000751147 [2,0,0,0,0,0|1,1,0]=4 3087 B12R0.5 CCOCCOCCNCCSC 34a_100102712874_100000212216 [2,0,0,0,0,0|1,1,0]=4 3088 B12R0.5 CCOCCOCCOCCC#N 7a_100000210240_100000184422 [2,0,0,0,0,0|2,0,0]=4 3089 B12R0.5 CCOCCOCCOCCCBr 34a_100011217188_100011211534 [2,0,0,0,0,0|2,0,0]=4 3090 B12R0.5 CCOCCOCCOCCCCl 34a_100000230001_100011211534 [2,0,0,0,0,0|2,0,0]=4 3091 B12R0.5 CCOCCOCCOCCCF 34a_100000210240_100011934791 [2,0,0,0,0,0|2,0,0]=4 3092 B12R0.5 CCOCCOCCOCCCF 34a_100000759539_100011211534 [2,0,0,0,0,0|2,0,0]=4 3093 B12R0.5 CCOCCOCCOCCCF 7a_100000210240_100011934791 [2,0,0,0,0,0|2,0,0]=4 3094 B12R0.5 CCOCCOCCOCCCN 34a_100000182051_100011211534 [2,0,0,0,0,0|2,0,0]=4 3095 B12R0.5 CCOCCOCCOCCCN 34a_100011996194_100000210202 [2,0,0,0,0,0|2,0,0]=4 3096 B12R0.5 CCOCCOCCOCCCO 34a_100000210240_100000230001 [2,0,0,0,0,0|2,0,0]=4 3097 B12R0.5 CCOCCOCCOCCCO 7a_100000210240_100011215043 [2,0,0,0,0,0|2,0,0]=4 3098 B12R0.5 CCOCCOCCOCCNC 2230a_100012282185_200000210301 [2,0,0,0,0,0|1,0,0]=3 3099 B12R0.5 CCOCCOCCOCCNC 34a_100000228057_100000210147 [2,0,0,0,0,0|1,0,0]=3 3100 B12R0.5 CCOCCOCCOCCNC 34a_100012282185_200000210301 [2,0,0,0,0,0|1,0,0]=3 3101 B12R0.5 CCOCCOCCOCCNC 34a_200014138305_100000210202 [2,0,0,0,0,0|1,0,0]=3 3102 B12R0.5 CCOCCOCCOCCN[13CH3] 2230a_100012282185_200025704644 [2,0,0,0,0,0|1,0,0]=3 3103 B12R0.5 CCOCCOCCOCCN[13CH3] 34a_100012282185_200025704644 [2,0,0,0,0,0|1,0,0]=3 3104 B12R0.5 CCOCCOCCOCCOC 34a_100000033264_200000210301 [2,0,0,0,0,0|0,0,0]=2 3105 B12R0.5 CCOCCOCCOCCOC 34a_100000210136_100000695917 [2,0,0,0,0,0|0,0,0]=2 3106 B12R0.5 CCOCCOCCOCCOC 34a_100000210237_100011211534 [2,0,0,0,0,0|0,0,0]=2 3107 B12R0.5 CCOCCOCCOCCOC 34a_100000210240_100011201679 [2,0,0,0,0,0|0,0,0]=2 3108 B12R0.5 CCOCCOCCOCCOC 34a_100000688194_100000210202 [2,0,0,0,0,0|0,0,0]=2 3109 B12R0.5 CCOCCOCCOCCOC 34a_100011215163_100000210147 [2,0,0,0,0,0|0,0,0]=2 3110 B12R0.5 CCOCCOCCOCCOC 34a_100121572206_100013367474 [2,0,0,0,0,0|0,0,0]=2 3111 B12R0.5 CCOCCOCCOCCOC 7a_100000033264_200000210301 [2,0,0,0,0,0|0,0,0]=2 3112 B12R0.5 CCOCCOCCOCCOC 7a_100000210136_100000695917 [2,0,0,0,0,0|0,0,0]=2 3113 B12R0.5 CCOCCOCCOCCOC 7a_100000210240_100000233755 [2,0,0,0,0,0|0,0,0]=2 3114 B12R0.5 CCOCCOCCOCCOC 7a_100000688194_100000210202 [2,0,0,0,0,0|0,0,0]=2 3115 B12R0.5 CCOCCOCCOCCOC 7a_100011215163_100011215890 [2,0,0,0,0,0|0,0,0]=2 3116 B12R0.5 CCOCCOCCOCCON 34a_100000700252_100011211534 [2,0,0,0,0,0|1,0,0]=3 3117 B12R0.5 CCOCCOCCOCCO[13CH3] 34a_100000033264_200025704644 [2,0,0,0,0,0|0,0,0]=2 3118 B12R0.5 CCOCCOCCOCCO[13CH3] 7a_100000033264_200025704644 [2,0,0,0,0,0|0,0,0]=2 3119 B12R0.5 CCOCCOCCOCCSC 34a_100000210240_100000212216 [2,0,0,0,0,0|0,1,0]=3 3120 B12R0.5 CCOCCOCCOCCSC 34a_100000230434_100011211534 [2,0,0,0,0,0|0,1,0]=3 3121 B12R0.5 CCOCCOCCOCCSC 7a_100000210240_100000212216 [2,0,0,0,0,0|0,1,0]=3 3122 B12R0.5 CCOCCOCCOCCSC 7a_100000230434_100011211534 [2,0,0,0,0,0|0,1,0]=3 3123 B12R0.5 CCOCCOCCSCCOC 62a_100000233755_100011211534 [2,0,0,0,0,0|0,1,0]=3 3124 B12R0.5 CCOCCOCCSCCOC 62a_100011211534_100000233755 [2,0,0,0,0,0|0,1,0]=3 3125 B12R0.5 CCOCCOCCSCCSC 62a_100000212216_100011211534 [2,0,0,0,0,0|0,2,0]=4 3126 B12R0.5 CCOCCOCCSCCSC 62a_100011211534_100000751147 [2,0,0,0,0,0|0,2,0]=4 3127 B12R0.5 CCOCCSCCOCCOC 62a_100000210147_100000695917 [2,0,0,0,0,0|0,1,0]=3 3128 B12R0.5 CCOCCSCCOCCOC 62a_100000695917_100011215890 [2,0,0,0,0,0|0,1,0]=3 3129 B12R0.5 CCOCSCCCOCCOC 62a_100000739092_100011216529 [2,0,0,0,0,0|2,0,0]=4 3130 B12R0.5 CCOCSCCCOCCOC 62a_100011216529_100000739092 [2,0,0,0,0,0|2,0,0]=4 3131 B12R0.5 CCSCCCOCCCCOC 34a_100011216438_100000755781 [2,0,0,0,0,0|2,0,0]=4 3132 B12R0.5 CCSCCCOCCCCOC 7a_100011216438_100000730899 [2,0,0,0,0,0|2,0,0]=4 3133 B12R0.5 CCSCCCOCCOCCO 34a_100011216438_100000692535 [2,0,0,0,0,0|2,0,0]=4 3134 B12R0.5 CCSCCCOCCOCCO 7a_100011216438_100011215305 [2,0,0,0,0,0|2,0,0]=4 3135 B12R0.5 CCSCCNCCOCCOC 2230a_100000106463_100000695917 [2,0,0,0,0,0|1,1,0]=4 3136 B12R0.5 CCSCCNCCOCCOC 2230a_100000745349_100000757381 [2,0,0,0,0,0|1,1,0]=4 3137 B12R0.5 CCSCCNCCOCCOC 34a_100000745349_100000757381 [2,0,0,0,0,0|1,1,0]=4 3138 B12R0.5 CCSCCOCCOCCNC 34a_100000228057_100000757381 [2,0,0,0,0,0|1,1,0]=4 3139 B12R0.5 CCSCCOCCOCCOC 34a_100000212035_100000695917 [2,0,0,0,0,0|0,1,0]=3 3140 B12R0.5 CCSCCOCCOCCOC 34a_100011215163_100000757381 [2,0,0,0,0,0|0,1,0]=3 3141 B12R0.5 CCSCCOCCOCCOC 62a_100000210202_100013367474 [2,0,0,0,0,0|0,1,0]=3 3142 B12R0.5 CCSCCOCCOCCOC 62a_100013367474_100000210202 [2,0,0,0,0,0|0,1,0]=3 3143 B12R0.5 CCSCCOCCOCCOC 7a_100000212035_100000695917 [2,0,0,0,0,0|0,1,0]=3 3144 B12R0.5 CCSCCOCCOCCOC 7a_100011215163_100000757381 [2,0,0,0,0,0|0,1,0]=3 3145 B12R0.5 CCSCCSCCOCCOC 62a_100000695917_100000757381 [2,0,0,0,0,0|0,2,0]=4 3146 B12R0.5 CCSCCSCCOCCOC 62a_100000757381_100000695917 [2,0,0,0,0,0|0,2,0]=4 3147 B12R0.5 CNCCCCCOCCCCO 34a_100000722520_100011216708 [2,0,0,0,0,0|2,0,0]=4 3148 B12R0.5 CNCCCCCOCCCOC 34a_100000722520_100000740836 [2,0,0,0,0,0|2,0,0]=4 3149 B12R0.5 CNCCCOCCOCCOC 34a_100000213112_100000695917 [2,0,0,0,0,0|1,0,0]=3 3150 B12R0.5 CNCCOCCOCCCCF 34a_100000228057_100000729493 [2,0,0,0,0,0|2,0,0]=4 3151 B12R0.5 CNCCOCCOCCCCO 34a_100000228057_100011216708 [2,0,0,0,0,0|1,0,0]=3 3152 B12R0.5 CNCCOCCOCCCOC 34a_100000228057_100000740836 [2,0,0,0,0,0|1,0,0]=3 3153 B12R0.5 CNCCOCCOCCOCF 34a_200014138305_100015361967 [2,0,0,0,0,0|2,0,0]=4 3154 B12R0.5 COCCCCCCCCCCO 34a_100138415774_100009813290 [2,0,0,0,0,0|2,0,0]=4 3155 B12R0.5 COCCCCCCNCCOC 2230a_100000209980_100011998445 [2,0,0,0,0,0|1,0,0]=3 3156 B12R0.5 COCCCCCCNCCSC 2230a_100020590264_100011998445 [2,0,0,0,0,0|1,1,0]=4 3157 B12R0.5 COCCCCCCOCCC#N 7a_200012092642_100000184422 [2,0,0,0,0,0|2,0,0]=4 3158 B12R0.5 COCCCCCCOCCCBr 34a_100011217188_100011998445 [2,0,0,0,0,0|2,0,0]=4 3159 B12R0.5 COCCCCCCOCCCCl 34a_100000230001_100011998445 [2,0,0,0,0,0|2,0,0]=4 3160 B12R0.5 COCCCCCCOCCCF 34a_100000759539_100011998445 [2,0,0,0,0,0|2,0,0]=4 3161 B12R0.5 COCCCCCCOCCCF 34a_200012092642_100011934791 [2,0,0,0,0,0|2,0,0]=4 3162 B12R0.5 COCCCCCCOCCCF 7a_200012092642_100011934791 [2,0,0,0,0,0|2,0,0]=4 3163 B12R0.5 COCCCCCCOCCCN 34a_100000182051_100011998445 [2,0,0,0,0,0|2,0,0]=4 3164 B12R0.5 COCCCCCCOCCCO 34a_200012092642_100000230001 [2,0,0,0,0,0|2,0,0]=4 3165 B12R0.5 COCCCCCCOCCCO 7a_200012092642_100011215043 [2,0,0,0,0,0|2,0,0]=4 3166 B12R0.5 COCCCCCCOCCOC 34a_100000210237_100011998445 [2,0,0,0,0,0|0,0,0]=2 3167 B12R0.5 COCCCCCCOCCOC 34a_200012092642_100011201679 [2,0,0,0,0,0|0,0,0]=2 3168 B12R0.5 COCCCCCCOCCOC 7a_200012092642_100000233755 [2,0,0,0,0,0|0,0,0]=2 3169 B12R0.5 COCCCCCCOCCON 34a_100000700252_100011998445 [2,0,0,0,0,0|1,0,0]=3 3170 B12R0.5 COCCCCCCOCCSC 34a_100000230434_100011998445 [2,0,0,0,0,0|0,1,0]=3 3171 B12R0.5 COCCCCCCOCCSC 34a_200012092642_100000212216 [2,0,0,0,0,0|0,1,0]=3 3172 B12R0.5 COCCCCCCOCCSC 7a_100000230434_100011998445 [2,0,0,0,0,0|0,1,0]=3 3173 B12R0.5 COCCCCCCOCCSC 7a_200012092642_100000212216 [2,0,0,0,0,0|0,1,0]=3 3174 B12R0.5 COCCCCCCSCCOC 62a_100000233755_100011998445 [2,0,0,0,0,0|0,1,0]=3 3175 B12R0.5 COCCCCCCSCCOC 62a_100011998445_100000233755 [2,0,0,0,0,0|0,1,0]=3 3176 B12R0.5 COCCCCCCSCCSC 62a_100000212216_100011998445 [2,0,0,0,0,0|0,2,0]=4 3177 B12R0.5 COCCCCCCSCCSC 62a_100011998445_100000751147 [2,0,0,0,0,0|0,2,0]=4 3178 B12R0.5 COCCCCCNCCCCO 2230a_100000747528_100000210776 [2,0,0,0,0,0|2,0,0]=4 3179 B12R0.5 COCCCCCNCCCCO 34a_100000747528_100011216708 [2,0,0,0,0,0|2,0,0]=4 3180 B12R0.5 COCCCCCNCCCOC 2230a_100000747528_100000740836 [2,0,0,0,0,0|2,0,0]=4 3181 B12R0.5 COCCCCCNCCCOC 34a_100000747528_100000740836 [2,0,0,0,0,0|2,0,0]=4 3182 B12R0.5 COCCCCNCCCCCO 2230a_100000762737_100000730899 [2,0,0,0,0,0|2,0,0]=4 3183 B12R0.5 COCCCCNCCCCCO 34a_100000762737_100000755781 [2,0,0,0,0,0|2,0,0]=4 3184 B12R0.5 COCCCCNCCOCCO 2230a_100000211614_100000730899 [2,0,0,0,0,0|1,0,0]=3 3185 B12R0.5 COCCCCNCCOCCO 34a_100000211614_100000755781 [2,0,0,0,0,0|1,0,0]=3 3186 B12R0.5 COCCCCNCCSCCO 2230a_100011219999_100000730899 [2,0,0,0,0,0|1,1,0]=4 3187 B12R0.5 COCCCCOCCCCCBr 34a_100000746331_100000755781 [2,0,0,0,0,0|2,0,0]=4 3188 B12R0.5 COCCCCOCCCCCBr 7a_100000746331_100000730899 [2,0,0,0,0,0|2,0,0]=4 3189 B12R0.5 COCCCCOCCCCCCl 34a_100000746330_100000755781 [2,0,0,0,0,0|2,0,0]=4 3190 B12R0.5 COCCCCOCCCCCCl 7a_100000746330_100000730899 [2,0,0,0,0,0|2,0,0]=4 3191 B12R0.5 COCCCCOCCCCCF 34a_100000740925_100000729378 [2,0,0,0,0,0|2,0,0]=4 3192 B12R0.5 COCCCCOCCCCCI 34a_200012148887_100000755781 [2,0,0,0,0,0|2,0,0]=4 3193 B12R0.5 COCCCCOCCCCCI 7a_200012148887_100000730899 [2,0,0,0,0,0|2,0,0]=4 3194 B12R0.5 COCCCCOCCCCCN 34a_100000762737_100000755781 [2,0,0,0,0,0|2,0,0]=4 3195 B12R0.5 COCCCCOCCCCCO 34a_100000740925_100000746330 [2,0,0,0,0,0|1,0,0]=3 3196 B12R0.5 COCCCCOCCCCOC 34a_100000740925_100000755781 [2,0,0,0,0,0|0,0,0]=2 3197 B12R0.5 COCCCCOCCCCSC 34a_100011217163_100000755781 [2,0,0,0,0,0|0,1,0]=3 3198 B12R0.5 COCCCCOCCCCSC 7a_100011217163_100000730899 [2,0,0,0,0,0|0,1,0]=3 3199 B12R0.5 COCCCCOCCOCCBr 34a_100000692535_100000755781 [2,0,0,0,0,0|1,0,0]=3 3200 B12R0.5 COCCCCOCCOCCBr 7a_100000692535_100000730899 [2,0,0,0,0,0|1,0,0]=3 3201 B12R0.5 COCCCCOCCOCCCl 34a_100011215305_100000755781 [2,0,0,0,0,0|1,0,0]=3 3202 B12R0.5 COCCCCOCCOCCCl 7a_100011215305_100000730899 [2,0,0,0,0,0|1,0,0]=3 3203 B12R0.5 COCCCCOCCOCCF 34a_200015357709_100000755781 [2,0,0,0,0,0|1,0,0]=3 3204 B12R0.5 COCCCCOCCOCCF 7a_200015357709_100000730899 [2,0,0,0,0,0|1,0,0]=3 3205 B12R0.5 COCCCCOCCOCCI 34a_100012149058_100000755781 [2,0,0,0,0,0|1,0,0]=3 3206 B12R0.5 COCCCCOCCOCCI 7a_100012149058_100000730899 [2,0,0,0,0,0|1,0,0]=3 3207 B12R0.5 COCCCCOCCOCCN 34a_100000211614_100000755781 [2,0,0,0,0,0|1,0,0]=3 3208 B12R0.5 COCCCCOCCOCCO 34a_100000740925_100000692535 [2,0,0,0,0,0|0,0,0]=2 3209 B12R0.5 COCCCCSCCCCCO 62a_100000730899_100000746330 [2,0,0,0,0,0|1,1,0]=4 3210 B12R0.5 COCCCCSCCCCCO 62a_100000746330_100000730899 [2,0,0,0,0,0|1,1,0]=4 3211 B12R0.5 COCCCCSCCCCOC 62a_100000730899_100000730899 [2,0,0,0,0,0|0,1,0]=3 3212 B12R0.5 COCCCCSCCOCCO 62a_100000730899_100011215305 [2,0,0,0,0,0|0,1,0]=3 3213 B12R0.5 COCCCCSCCOCCO 62a_100011215305_100000730899 [2,0,0,0,0,0|0,1,0]=3 3214 B12R0.5 COCCCCSCOCCOC 62a_100000231047_100000730899 [2,0,0,0,0,0|0,1,0]=3 3215 B12R0.5 COCCCCSCOCCOC 62a_100000730899_100000231047 [2,0,0,0,0,0|0,1,0]=3 3216 B12R0.5 COCCCNCCOCCOC 2230a_100000745349_100000740836 [2,0,0,0,0,0|1,0,0]=3 3217 B12R0.5 COCCCNCCOCCOC 34a_100000745349_100000740836 [2,0,0,0,0,0|1,0,0]=3 3218 B12R0.5 COCCCNCCOCCOC 34a_100150723488_100000695917 [2,0,0,0,0,0|1,0,0]=3 3219 B12R0.5 COCCCOCCCOCCO 34a_200011215475_100000211926 [2,0,0,0,0,0|2,0,0]=4 3220 B12R0.5 COCCCOCCCOCCO 7a_200011215475_100000211926 [2,0,0,0,0,0|2,0,0]=4 3221 B12R0.5 COCCCOCCOCCOC 34a_100000740835_100000695917 [2,0,0,0,0,0|0,0,0]=2 3222 B12R0.5 COCCCOCCOCCOC 34a_100011215163_100000740836 [2,0,0,0,0,0|0,0,0]=2 3223 B12R0.5 COCCCOCCOCCOC 7a_100011215163_100000740836 [2,0,0,0,0,0|0,0,0]=2 3224 B12R0.5 COCCCSCCOCCOC 62a_100000695917_100000709357 [2,0,0,0,0,0|0,1,0]=3 3225 B12R0.5 COCCCSCCOCCOC 62a_100000709357_100000695917 [2,0,0,0,0,0|0,1,0]=3 3226 B12R0.5 COCCNCCCCCCCO 2230a_100000209980_100000760002 [2,0,0,0,0,0|2,0,0]=4 3227 B12R0.5 COCCNCCCCCCCO 2230a_100011996573_100011201679 [2,0,0,0,0,0|2,0,0]=4 3228 B12R0.5 COCCNCCCCCCCO 34a_100011996573_100011201679 [2,0,0,0,0,0|2,0,0]=4 3229 B12R0.5 COCCNCCCOCCOC 2230a_100000206027_100011201679 [2,0,0,0,0,0|1,0,0]=3 3230 B12R0.5 COCCNCCCOCCOC 2230a_100000209980_100011216529 [2,0,0,0,0,0|1,0,0]=3 3231 B12R0.5 COCCNCCCOCCOC 34a_100000206027_100011201679 [2,0,0,0,0,0|1,0,0]=3 3232 B12R0.5 COCCOCCCCCCCBr 34a_100000760002_100011201679 [2,0,0,0,0,0|2,0,0]=4 3233 B12R0.5 COCCOCCCCCCCBr 7a_100000760002_100000233755 [2,0,0,0,0,0|2,0,0]=4 3234 B12R0.5 COCCOCCCCCCCN 34a_100011996573_100011201679 [2,0,0,0,0,0|2,0,0]=4 3235 B12R0.5 COCCOCCCCCCCO 34a_100000210237_100000760002 [2,0,0,0,0,0|1,0,0]=3 3236 B12R0.5 COCCOCCCNCCCO 2230a_100000206027_100000230001 [2,0,0,0,0,0|2,0,0]=4 3237 B12R0.5 COCCOCCCNCCCO 34a_100000206027_100000230001 [2,0,0,0,0,0|2,0,0]=4 3238 B12R0.5 COCCOCCCNCCSC 2230a_100000206027_100000751147 [2,0,0,0,0,0|1,1,0]=4 3239 B12R0.5 COCCOCCCNCCSC 2230a_100020590264_100011216529 [2,0,0,0,0,0|1,1,0]=4 3240 B12R0.5 COCCOCCCNCCSC 34a_100000206027_100000212216 [2,0,0,0,0,0|1,1,0]=4 3241 B12R0.5 COCCOCCCOCCCBr 34a_100011217188_100011216529 [2,0,0,0,0,0|2,0,0]=4 3242 B12R0.5 COCCOCCCOCCCCl 34a_100000230001_100011216529 [2,0,0,0,0,0|2,0,0]=4 3243 B12R0.5 COCCOCCCOCCCF 34a_100000759539_100011216529 [2,0,0,0,0,0|2,0,0]=4 3244 B12R0.5 COCCOCCCOCCCN 34a_100000182051_100011216529 [2,0,0,0,0,0|2,0,0]=4 3245 B12R0.5 COCCOCCCOCCCN 34a_100011310245_100011201679 [2,0,0,0,0,0|2,0,0]=4 3246 B12R0.5 COCCOCCCOCCOC 34a_100000210237_100011216529 [2,0,0,0,0,0|0,0,0]=2 3247 B12R0.5 COCCOCCCOCCON 34a_100000700252_100011216529 [2,0,0,0,0,0|1,0,0]=3 3248 B12R0.5 COCCOCCCOCCSC 34a_100000230434_100011216529 [2,0,0,0,0,0|0,1,0]=3 3249 B12R0.5 COCCOCCCOCCSC 7a_100000230434_100011216529 [2,0,0,0,0,0|0,1,0]=3 3250 B12R0.5 COCCOCCCSCCCO 62a_100011215043_100011216529 [2,0,0,0,0,0|2,0,0]=4 3251 B12R0.5 COCCOCCCSCCCO 62a_100011216529_100011215043 [2,0,0,0,0,0|2,0,0]=4 3252 B12R0.5 COCCOCCCSCCOC 62a_100000233755_100011216529 [2,0,0,0,0,0|0,1,0]=3 3253 B12R0.5 COCCOCCCSCCOC 62a_100011216529_100000233755 [2,0,0,0,0,0|0,1,0]=3 3254 B12R0.5 COCCOCCCSCCSC 62a_100000212216_100011216529 [2,0,0,0,0,0|0,2,0]=4 3255 B12R0.5 COCCOCCCSCCSC 62a_100011216529_100000751147 [2,0,0,0,0,0|0,2,0]=4 3256 B12R0.5 COCCOCCNCCCCF 2230a_100000745349_100000729493 [2,0,0,0,0,0|2,0,0]=4 3257 B12R0.5 COCCOCCNCCCCF 34a_100000745349_100000729493 [2,0,0,0,0,0|2,0,0]=4 3258 B12R0.5 COCCOCCNCCCCO 2230a_100000745349_100000210776 [2,0,0,0,0,0|1,0,0]=3 3259 B12R0.5 COCCOCCNCCCCO 2230a_100000750430_100000695917 [2,0,0,0,0,0|1,0,0]=3 3260 B12R0.5 COCCOCCNCCCCO 34a_100000745349_100011216708 [2,0,0,0,0,0|1,0,0]=3 3261 B12R0.5 COCCOCCNCCCCO 34a_100000750430_100000695917 [2,0,0,0,0,0|1,0,0]=3 3262 B12R0.5 COCCOCCNCCCSC 2230a_100000749238_100000695917 [2,0,0,0,0,0|1,1,0]=4 3263 B12R0.5 COCCOCCOCC#CCO 34a_100011215163_200000047223 [2,0,0,0,0,0|0,0,2]=4 3264 B12R0.5 COCCOCCOCC#CCO 7a_100011215163_200000047223 [2,0,0,0,0,0|0,0,2]=4 3265 B12R0.5 COCCOCCOCCCC#N 7a_100011215163_100000687738 [2,0,0,0,0,0|1,0,1]=4 3266 B12R0.5 COCCOCCOCCCC=O 7a_100011215163_200011292268 [2,0,0,0,0,0|0,0,2]=4 3267 B12R0.5 COCCOCCOCCCCBr 34a_100011216708_100000695917 [2,0,0,0,0,0|1,0,0]=3 3268 B12R0.5 COCCOCCOCCCCCl 34a_100000210776_100000695917 [2,0,0,0,0,0|1,0,0]=3 3269 B12R0.5 COCCOCCOCCCCCl 7a_100000210776_100000695917 [2,0,0,0,0,0|1,0,0]=3 3270 B12R0.5 COCCOCCOCCCCF 34a_100011215163_100000729493 [2,0,0,0,0,0|1,0,0]=3 3271 B12R0.5 COCCOCCOCCCCF 34a_100011995726_100000695917 [2,0,0,0,0,0|1,0,0]=3 3272 B12R0.5 COCCOCCOCCCCF 7a_100011215163_100000729493 [2,0,0,0,0,0|1,0,0]=3 3273 B12R0.5 COCCOCCOCCCCF 7a_100011995726_100000695917 [2,0,0,0,0,0|1,0,0]=3 3274 B12R0.5 COCCOCCOCCCCI 34a_200012148704_100000695917 [2,0,0,0,0,0|1,0,0]=3 3275 B12R0.5 COCCOCCOCCCCN 34a_100000750430_100000695917 [2,0,0,0,0,0|1,0,0]=3 3276 B12R0.5 COCCOCCOCCCCO 34a_100011215163_100011216708 [2,0,0,0,0,0|0,0,0]=2 3277 B12R0.5 COCCOCCOCCCCO 7a_100011215163_100000210776 [2,0,0,0,0,0|0,0,0]=2 3278 B12R0.5 COCCOCCOCCCSC 34a_100000690336_100000695917 [2,0,0,0,0,0|0,1,0]=3 3279 B12R0.5 COCCOCCOCCCSC 7a_100000690336_100000695917 [2,0,0,0,0,0|0,1,0]=3 3280 B12R0.5 COCCOCCOCCNCF 34a_100012028300_100015361967 [2,0,0,0,0,0|2,0,0]=4 3281 B12R0.5 COCCOCCOCCOCF 34a_100000688194_100015361967 [2,0,0,0,0,0|1,0,0]=3 3282 B12R0.5 COCCOCCOCCOCF 7a_100000688194_100015361967 [2,0,0,0,0,0|1,0,0]=3 3283 B12R0.5 COCCOCCOCCSCF 62a_100013367474_100015361967 [2,0,0,0,0,0|1,1,0]=4 3284 B12R0.5 COCCOCCOCCSCF 62a_100015361967_100013367474 [2,0,0,0,0,0|1,1,0]=4 3285 B12R0.5 COCCOCCSCCCCF 62a_100000695917_100000729493 [2,0,0,0,0,0|1,1,0]=4 3286 B12R0.5 COCCOCCSCCCCF 62a_100000729493_100000695917 [2,0,0,0,0,0|1,1,0]=4 3287 B12R0.5 COCCOCCSCCCCO 62a_100000210776_100000695917 [2,0,0,0,0,0|0,1,0]=3 3288 B12R0.5 COCCOCCSCCCCO 62a_100000695917_100000210776 [2,0,0,0,0,0|0,1,0]=3 3289 B12R0.5 COCCOCNCCCCCO 2230a_100000762737_100000231047 [2,0,0,0,0,0|2,0,0]=4 3290 B12R0.5 COCCOCNCCOCCO 2230a_100000211614_100000231047 [2,0,0,0,0,0|1,0,0]=3 3291 B12R0.5 COCCOCNCCSCCO 2230a_100011219999_100000231047 [2,0,0,0,0,0|1,1,0]=4 3292 B12R0.5 COCCOCSCCCCCO 62a_100000231047_100000746330 [2,0,0,0,0,0|1,1,0]=4 3293 B12R0.5 COCCOCSCCCCCO 62a_100000746330_100000231047 [2,0,0,0,0,0|1,1,0]=4 3294 B12R0.5 COCCOCSCCOCCO 62a_100000231047_100011215305 [2,0,0,0,0,0|0,1,0]=3 3295 B12R0.5 COCCOCSCCOCCO 62a_100011215305_100000231047 [2,0,0,0,0,0|0,1,0]=3 3296 B12R0.5 COCCOCSCOCCOC 62a_100000231047_100000231047 [2,0,0,0,0,0|0,1,0]=3 3297 B12R0.5 COCCSCCCCCCCO 62a_100000233755_100000760002 [2,0,0,0,0,0|1,1,0]=4 3298 B12R0.5 COCCSCCCCCCCO 62a_100000760002_100000233755 [2,0,0,0,0,0|1,1,0]=4 3299 B12R0.5 COCNCCOCCOCCO 2230a_100011998139_100000766300 [2,0,0,0,0,0|1,0,0]=3 3300 B12R0.5 COCSCCOCCOCCO 62a_100000032323_100000766300 [2,0,0,0,0,0|0,1,0]=3 3301 B12R0.5 COCSCCOCCOCCO 62a_100000766300_100000032323 [2,0,0,0,0,0|0,1,0]=3 3302 B12R0.5 CSCCCCOCCCCCO 34a_100011217163_100000746330 [2,0,0,0,0,0|1,1,0]=4 3303 B12R0.5 CSCCCCOCCCCCO 7a_100011217163_100000746330 [2,0,0,0,0,0|1,1,0]=4 3304 B12R0.5 CSCCCCOCCOCCO 34a_100011217163_100000692535 [2,0,0,0,0,0|0,1,0]=3 3305 B12R0.5 CSCCCCOCCOCCO 7a_100011217163_100011215305 [2,0,0,0,0,0|0,1,0]=3 3306 B12R0.5 CSCCOCCCCCCCO 34a_100000230434_100000760002 [2,0,0,0,0,0|1,1,0]=4 3307 B12R0.5 CSCCOCCCCCCCO 7a_100000230434_100000760002 [2,0,0,0,0,0|1,1,0]=4 3308 B12R0.5 CSCNCCOCCOCCO 2230a_100011998139_100011218213 [2,0,0,0,0,0|1,1,0]=4 3309 B12R0.5 CSCNCCOCCOCCO 34a_100011998139_100011218213 [2,0,0,0,0,0|1,1,0]=4 3310 B12R0.5 CSCOCCOCCOCCBr 34a_100010132937_100011218213 [2,0,0,0,0,0|1,1,0]=4 3311 B12R0.5 CSCOCCOCCOCCCl 34a_100000032323_100011218213 [2,0,0,0,0,0|1,1,0]=4 3312 B12R0.5 CSCOCCOCCOCCN 34a_100011998139_100011218213 [2,0,0,0,0,0|1,1,0]=4 3313 B12R0.5 CSCSCCOCCOCCO 62a_100000032323_100011218213 [2,0,0,0,0,0|0,2,0]=4 3314 B12R0.5 CSCSCCOCCOCCO 62a_100011218213_100000032323 [2,0,0,0,0,0|0,2,0]=4 3315 B12R0.5 FCCOCCOCCOCCBr 34a_100010132937_100011217306 [2,0,0,0,0,0|2,0,0]=4 3316 B12R0.5 FCCOCCOCCOCCBr 7a_100010132937_100011217306 [2,0,0,0,0,0|2,0,0]=4 3317 B12R0.5 FCCOCCOCCOCCCl 34a_100000032323_100011217306 [2,0,0,0,0,0|2,0,0]=4 3318 B12R0.5 FCCOCCOCCOCCCl 7a_100000032323_100011217306 [2,0,0,0,0,0|2,0,0]=4 3319 B12R0.5 NCCCCCOCCOCCO 34a_100000762737_100000692535 [2,0,0,0,0,0|2,0,0]=4 3320 B12R0.5 NCCOCCOCCCCCO 34a_100000211614_100000746330 [2,0,0,0,0,0|2,0,0]=4 3321 B12R0.5 NCCOCCOCCOCCF 34a_100011998139_100011217306 [2,0,0,0,0,0|2,0,0]=4 3322 B12R0.5 NCCOCCOCCOCCO 34a_100000210304_100000032323 [2,0,0,0,0,0|1,0,0]=3 3323 B12R0.5 NCCOCCOCCOCCO 34a_100000211614_100000692535 [2,0,0,0,0,0|1,0,0]=3 3324 B12R0.5 NCCOCCOCCOCCO 34a_100011998139_100000211926 [2,0,0,0,0,0|1,0,0]=3 3325 B12R0.5 NOCCOCCCCCCCO 34a_100000700252_100000760002 [2,0,0,0,0,0|2,0,0]=4 3326 B12R0.5 OCCCCCNCCOCCO 2230a_100000211614_100000746330 [2,0,0,0,0,0|2,0,0]=4 3327 B12R0.5 OCCCCCNCCOCCO 2230a_100000762737_100011215305 [2,0,0,0,0,0|2,0,0]=4 3328 B12R0.5 OCCCCCNCCOCCO 34a_100000211614_100000746330 [2,0,0,0,0,0|2,0,0]=4 3329 B12R0.5 OCCCCCNCCOCCO 34a_100000762737_100000692535 [2,0,0,0,0,0|2,0,0]=4 3330 B12R0.5 OCCCCCOCCOCCBr 34a_100000692535_100000746330 [2,0,0,0,0,0|2,0,0]=4 3331 B12R0.5 OCCCCCOCCOCCBr 7a_100000692535_100000746330 [2,0,0,0,0,0|2,0,0]=4 3332 B12R0.5 OCCCCCOCCOCCCl 34a_100011215305_100000746330 [2,0,0,0,0,0|2,0,0]=4 3333 B12R0.5 OCCCCCOCCOCCCl 7a_100011215305_100000746330 [2,0,0,0,0,0|2,0,0]=4 3334 B12R0.5 OCCCCCOCCOCCF 34a_200015357709_100000746330 [2,0,0,0,0,0|2,0,0]=4 3335 B12R0.5 OCCCCCOCCOCCF 7a_200015357709_100000746330 [2,0,0,0,0,0|2,0,0]=4 3336 B12R0.5 OCCCCCOCCOCCI 34a_100012149058_100000746330 [2,0,0,0,0,0|2,0,0]=4 3337 B12R0.5 OCCCCCOCCOCCI 7a_100012149058_100000746330 [2,0,0,0,0,0|2,0,0]=4 3338 B12R0.5 OCCCCCSCCOCCO 62a_100000746330_100011215305 [2,0,0,0,0,0|1,1,0]=4 3339 B12R0.5 OCCCCCSCCOCCO 62a_100011215305_100000746330 [2,0,0,0,0,0|1,1,0]=4 3340 B12R0.5 OCCNCCOCCOCCO 2230a_100011998139_100000211926 [2,0,0,0,0,0|1,0,0]=3 3341 B12R0.5 OCCNCCOCCOCCO 2230a_100016997473_100000032323 [2,0,0,0,0,0|1,0,0]=3 3342 B12R0.5 OCCNCCOCCOCCO 34a_100011998139_100000211926 [2,0,0,0,0,0|1,0,0]=3 3343 B12R0.5 OCCNCCOCCOCCO 34a_100016990907_100000032323 [2,0,0,0,0,0|1,0,0]=3 3344 B12R0.5 OCCOCCNCCOCCO 2230a_100000211614_100011215305 [2,0,0,0,0,0|1,0,0]=3 3345 B12R0.5 OCCOCCNCCOCCO 34a_100000211614_100000692535 [2,0,0,0,0,0|1,0,0]=3 3346 B12R0.5 OCCOCCNCCSCCO 2230a_100011219999_100011215305 [2,0,0,0,0,0|1,1,0]=4 3347 B12R0.5 OCCOCCOCCCCCBr 34a_100000746331_100000692535 [2,0,0,0,0,0|2,0,0]=4 3348 B12R0.5 OCCOCCOCCCCCBr 7a_100000746331_100011215305 [2,0,0,0,0,0|2,0,0]=4 3349 B12R0.5 OCCOCCOCCCCCCl 34a_100000746330_100000692535 [2,0,0,0,0,0|2,0,0]=4 3350 B12R0.5 OCCOCCOCCCCCCl 7a_100000746330_100011215305 [2,0,0,0,0,0|2,0,0]=4 3351 B12R0.5 OCCOCCOCCCCCI 34a_200012148887_100000692535 [2,0,0,0,0,0|2,0,0]=4 3352 B12R0.5 OCCOCCOCCCCCI 7a_200012148887_100011215305 [2,0,0,0,0,0|2,0,0]=4 3353 B12R0.5 OCCOCCOCCNCCF 2230a_100011998139_100011217306 [2,0,0,0,0,0|2,0,0]=4 3354 B12R0.5 OCCOCCOCCNCCF 34a_100000724931_100000032323 [2,0,0,0,0,0|2,0,0]=4 3355 B12R0.5 OCCOCCOCCNCCF 34a_100011998139_100011217306 [2,0,0,0,0,0|2,0,0]=4 3356 B12R0.5 OCCOCCOCCOCCBr 34a_100000211926_100000032323 [2,0,0,0,0,0|1,0,0]=3 3357 B12R0.5 OCCOCCOCCOCCBr 34a_100000692535_100000692535 [2,0,0,0,0,0|1,0,0]=3 3358 B12R0.5 OCCOCCOCCOCCBr 34a_100010132937_100000211926 [2,0,0,0,0,0|1,0,0]=3 3359 B12R0.5 OCCOCCOCCOCCBr 7a_100000692535_100011215305 [2,0,0,0,0,0|1,0,0]=3 3360 B12R0.5 OCCOCCOCCOCCBr 7a_100010132937_100000211926 [2,0,0,0,0,0|1,0,0]=3 3361 B12R0.5 OCCOCCOCCOCCCl 34a_100000032323_100000211926 [2,0,0,0,0,0|1,0,0]=3 3362 B12R0.5 OCCOCCOCCOCCCl 34a_100011215305_100000692535 [2,0,0,0,0,0|1,0,0]=3 3363 B12R0.5 OCCOCCOCCOCCCl 7a_100000032323_100000211926 [2,0,0,0,0,0|1,0,0]=3 3364 B12R0.5 OCCOCCOCCOCCCl 7a_100011215305_100011215305 [2,0,0,0,0,0|1,0,0]=3 3365 B12R0.5 OCCOCCOCCOCCF 34a_200015357709_100000692535 [2,0,0,0,0,0|1,0,0]=3 3366 B12R0.5 OCCOCCOCCOCCF 7a_200015357709_100011215305 [2,0,0,0,0,0|1,0,0]=3 3367 B12R0.5 OCCOCCOCCOCCI 34a_100012149058_100000692535 [2,0,0,0,0,0|1,0,0]=3 3368 B12R0.5 OCCOCCOCCOCCI 7a_100012149058_100011215305 [2,0,0,0,0,0|1,0,0]=3 3369 B12R0.5 OCCOCCOCCSCCF 62a_100000032323_100011217306 [2,0,0,0,0,0|1,1,0]=4 3370 B12R0.5 OCCOCCOCCSCCF 62a_100011217306_100000032323 [2,0,0,0,0,0|1,1,0]=4 3371 B12R0.5 OCCOCCOCCSCCO 62a_100000032323_100000211926 [2,0,0,0,0,0|0,1,0]=3 3372 B12R0.5 OCCOCCOCCSCCO 62a_100000211926_100000032323 [2,0,0,0,0,0|0,1,0]=3 3373 B12R0.5 OCCOCCSCCOCCO 62a_100011215305_100011215305 [2,0,0,0,0,0|0,1,0]=3 3374 B14R0.145 CCCCCCC(=O)CCOCCOC 1458a_100000745395_100000210757 [1,1,0,0,0,0|2,0,0]=4 3375 B14R0.145 CCCCCCC(=O)CCOCCOC 1458a_100102632555_100000695917 [1,1,0,0,0,0|2,0,0]=4 3376 B14R0.145 CCCCCCC(C)CCOCCOC 34a_200011024964_100011201679 [1,1,0,0,0,0|2,0,0]=4 3377 B14R0.145 CCCCCCC(C)CCOCCOC 7a_200011024964_100000233755 [1,1,0,0,0,0|2,0,0]=4 3378 B14R0.145 CCCCCCC(C)OCCCCOC 34a_100000210265_100000755781 [1,1,0,0,0,0|2,0,0]=4 3379 B14R0.145 CCCCCCC(C)OCCCCOC 34a_100000740925_100011215978 [1,1,0,0,0,0|2,0,0]=4 3380 B14R0.145 CCCCCCC(C)OCCCCOC 7a_100000210265_100000730899 [1,1,0,0,0,0|2,0,0]=4 3381 B14R0.145 CCCCCCC(C)OCCOCCC 34a_100000210265_100011215938 [1,1,0,0,0,0|2,0,0]=4 3382 B14R0.145 CCCCCCC(C)OCCOCCC 34a_100000752267_100011215978 [1,1,0,0,0,0|2,0,0]=4 3383 B14R0.145 CCCCCCC(C)OCCOCCC 7a_100000210265_100011215938 [1,1,0,0,0,0|2,0,0]=4 3384 B14R0.145 CCCCCCC(C)OCCOCCC 7a_100000752267_100011215978 [1,1,0,0,0,0|2,0,0]=4 3385 B14R0.145 CCCCCCC(C)OCCOCCO 34a_100000210265_100000692535 [1,1,0,0,0,0|2,0,0]=4 3386 B14R0.145 CCCCCCC(C)OCCOCCO 7a_100000210265_100011215305 [1,1,0,0,0,0|2,0,0]=4 3387 B14R0.145 CCCCCCN(C)CCOCCOC 2230a_106256046315_100000695917 [1,1,0,0,0,0|2,0,0]=4 3388 B14R0.145 CCCCCCN(C)CCOCCOC 269982a_106256046315_100000695917 [1,1,0,0,0,0|2,0,0]=4 3389 B14R0.145 CCCCCCOC(C)COCCCC 34a_100011217071_100000210314 [1,1,0,0,0,0|2,0,0]=4 3390 B14R0.145 CCCCCCOC(C)COCCCC 7a_100011217071_100000210314 [1,1,0,0,0,0|2,0,0]=4 3391 B14R0.145 CCCCOCC(=O)CCOCCOC 1458a_100000745395_100011995733 [1,1,0,0,0,0|1,0,1]=4 3392 B14R0.145 CCCCOCC(=O)CCOCCOC 1458a_100000757543_100000695917 [1,1,0,0,0,0|1,0,1]=4 3393 B14R0.145 CCCCOCC(C)OCCCCCO 34a_100011217071_100000746330 [1,1,0,0,0,0|2,0,0]=4 3394 B14R0.145 CCCCOCC(C)OCCCCCO 7a_100011217071_100000746330 [1,1,0,0,0,0|2,0,0]=4 3395 B14R0.145 CCCCOCC(C)OCCCCOC 34a_100011217071_100000755781 [1,1,0,0,0,0|1,0,0]=3 3396 B14R0.145 CCCCOCC(C)OCCCCOC 7a_100011217071_100000730899 [1,1,0,0,0,0|1,0,0]=3 3397 B14R0.145 CCCCOCC(C)OCCOCCC 34a_100011217071_100011215938 [1,1,0,0,0,0|1,0,0]=3 3398 B14R0.145 CCCCOCC(C)OCCOCCC 7a_100011217071_100011215938 [1,1,0,0,0,0|1,0,0]=3 3399 B14R0.145 CCCCOCC(C)OCCOCCO 34a_100011217071_100000692535 [1,1,0,0,0,0|1,0,0]=3 3400 B14R0.145 CCCCOCC(C)OCCOCCO 7a_100011217071_100011215305 [1,1,0,0,0,0|1,0,0]=3 3401 B14R0.145 CCCCOCCC(=O)CCOCCO 1458a_100011229844_100000743108 [1,1,0,0,0,0|2,0,0]=4 3402 B14R0.145 CCCCOCCC(=O)COCCOC 1458a_100000211095_100000743108 [1,1,0,0,0,0|1,0,1]=4 3403 B14R0.145 CCCCOCCN(C)CCOCCO 2230a_100000228057_100000743108 [1,1,0,0,0,0|2,0,0]=4 3404 B14R0.145 CCCCOCCN(C)CCOCCO 269982a_100000228057_100000743108 [1,1,0,0,0,0|2,0,0]=4 3405 B14R0.145 CCCCOCOC(C)COCCCC 34a_100011217071_100011995733 [1,1,0,0,0,0|2,0,0]=4 3406 B14R0.145 CCCOCCC(=O)CCCCCOC 1458a_100011935119_100011215938 [1,1,0,0,0,0|2,0,0]=4 3407 B14R0.145 CCCOCCC(=O)CCOCCOC 1458a_100000745395_100011215938 [1,1,0,0,0,0|1,0,0]=3 3408 B14R0.145 CCCOCCNC(=O)COCCOC 1626a_100161115042_100000211095 [1,1,0,0,0,0|1,0,1]=4 3409 B14R0.145 CCCOCCNC(=O)COCCOC 240690a_100161115042_100000211095 [1,1,0,0,0,0|1,0,1]=4 3410 B14R0.145 CCCOCCNC(=O)COCCOC 527a_100161115042_100000211095 [1,1,0,0,0,0|1,0,1]=4 3411 B14R0.145 COCCCCC(=O)CCOCCOC 1458a_100000745395_100000755781 [1,1,0,0,0,0|1,0,0]=3 3412 B14R0.145 COCCCCCC(=O)CCCCOC 1458a_100011935119_100000755781 [1,1,0,0,0,0|2,0,0]=4 3413 B14R0.145 COCCCCCC(=O)CCOCCO 1458a_100011935119_100011215305 [1,1,0,0,0,0|2,0,0]=4 3414 B14R0.145 COCCCNC(=O)CCOCCOC 1626a_100150723488_100000745395 [1,1,0,0,0,0|2,0,0]=4 3415 B14R0.145 COCCCNC(=O)CCOCCOC 240690a_100150723488_100000745395 [1,1,0,0,0,0|2,0,0]=4 3416 B14R0.145 COCCCNC(=O)CCOCCOC 527a_100150723488_100000745395 [1,1,0,0,0,0|2,0,0]=4 3417 B14R0.145 COCCOCC(=O)NCCOCCO 240690a_100000211614_100000211095 [1,1,0,0,0,0|1,0,1]=4 3418 B14R0.145 COCCOCCC(=O)CCCCCO 1458a_100000745395_100000746330 [1,1,0,0,0,0|2,0,0]=4 3419 B14R0.145 COCCOCCC(=O)CCCCCO 1458a_100102619762_100000695917 [1,1,0,0,0,0|2,0,0]=4 3420 B14R0.145 COCCOCCC(=O)CCOCCO 1458a_100000745395_100011215305 [1,1,0,0,0,0|1,0,0]=3 3421 B14R0.145 COCCOCCC(=O)CCOCCO 1458a_100011229844_100000695917 [1,1,0,0,0,0|1,0,0]=3 3422 B14R0.145 COCCOCCC(=O)COCCOC 1458a_100000211095_100000695917 [1,1,0,0,0,0|0,0,1]=3 3423 B14R0.145 COCCOCCN(C)CCCCCO 2230a_100000722520_100000695917 [1,1,0,0,0,0|2,0,0]=4 3424 B14R0.145 COCCOCCN(C)CCCCCO 269982a_100000722520_100000695917 [1,1,0,0,0,0|2,0,0]=4 3425 B14R0.145 COCCOCCN(C)CCOCCO 2230a_100000228057_100000695917 [1,1,0,0,0,0|1,0,0]=3 3426 B14R0.145 COCCOCCN(C)CCOCCO 269982a_100000228057_100000695917 [1,1,0,0,0,0|1,0,0]=3 3427 B14R0.179 C#CCOCC(C)OCCOCCOC 34a_100011025554_100000695917 [1,1,0,0,0,0|0,0,2]=4 3428 B14R0.179 C#CCOCC(C)OCCOCCOC 7a_100011025554_100000695917 [1,1,0,0,0,0|0,0,2]=4 3429 B14R0.179 CCC#CCC(C)OCCOCCOC 34a_200000035118_100000695917 [1,1,0,0,0,0|1,0,1]=4 3430 B14R0.179 CCC#CCC(C)OCCOCCOC 7a_200000035118_100000695917 [1,1,0,0,0,0|1,0,1]=4 3431 B14R0.179 CCCCCC(C)NCCOCCOC 2230a_100000211957_100000695917 [1,1,0,0,0,0|2,0,0]=4 3432 B14R0.179 CCCCCC(C)NCCOCCOC 2230a_100000745349_200011218191 [1,1,0,0,0,0|2,0,0]=4 3433 B14R0.179 CCCCCC(C)NCCOCCOC 270004a_100000745349_100000211708 [1,1,0,0,0,0|2,0,0]=4 3434 B14R0.179 CCCCCC(C)NCCOCCOC 34a_100000745349_200011218191 [1,1,0,0,0,0|2,0,0]=4 3435 B14R0.179 CCCCCC(C)OCCOCCCC 34a_100000210238_200011218191 [1,1,0,0,0,0|2,0,0]=4 3436 B14R0.179 CCCCCC(C)OCCOCCCC 34a_100011215632_100000743108 [1,1,0,0,0,0|2,0,0]=4 3437 B14R0.179 CCCCCC(C)OCCOCCCC 7a_100000210238_200011218191 [1,1,0,0,0,0|2,0,0]=4 3438 B14R0.179 CCCCCC(C)OCCOCCCC 7a_100011215632_100000743108 [1,1,0,0,0,0|2,0,0]=4 3439 B14R0.179 CCCCCC(C)OCCOCCNC 34a_100000228057_200011218191 [1,1,0,0,0,0|2,0,0]=4 3440 B14R0.179 CCCCCC(C)OCCOCCOC 34a_100011215163_200011218191 [1,1,0,0,0,0|1,0,0]=3 3441 B14R0.179 CCCCCC(C)OCCOCCOC 34a_100011215632_100000695917 [1,1,0,0,0,0|1,0,0]=3 3442 B14R0.179 CCCCCC(C)OCCOCCOC 7a_100011215163_200011218191 [1,1,0,0,0,0|1,0,0]=3 3443 B14R0.179 CCCCCC(C)OCCOCCOC 7a_100011215632_100000695917 [1,1,0,0,0,0|1,0,0]=3 3444 B14R0.179 CCCCCC(C)SCCOCCOC 62a_100000695917_200011218191 [1,1,0,0,0,0|1,1,0]=4 3445 B14R0.179 CCCCCC(C)SCCOCCOC 62a_200011218191_100000695917 [1,1,0,0,0,0|1,1,0]=4 3446 B14R0.179 CCCCCCCCC(C)OCCOC 34a_100000210740_100011201679 [1,1,0,0,0,0|2,0,0]=4 3447 B14R0.179 CCCCCCCCC(C)OCCOC 7a_100000210740_100000233755 [1,1,0,0,0,0|2,0,0]=4 3448 B14R0.179 CCCCCCCOC(C)CCCOC 34a_200011539412_100000210614 [1,1,0,0,0,0|2,0,0]=4 3449 B14R0.179 CCCCCCCOC(C)CCCOC 7a_200011539412_100000210614 [1,1,0,0,0,0|2,0,0]=4 3450 B14R0.179 CCCCCCOCC(=O)OCCOC 34a_100000210259_200000040189 [1,1,0,0,0,0|1,0,1]=4 3451 B14R0.179 CCCCCCOCC(=O)OCCOC 7a_100000210259_200000040189 [1,1,0,0,0,0|1,0,1]=4 3452 B14R0.179 CCCCOC(=O)COCCCCOC 34a_100000740925_100000211628 [1,1,0,0,0,0|1,0,1]=4 3453 B14R0.179 CCCCOC(=O)COCCOCCC 34a_100000752267_100000211628 [1,1,0,0,0,0|1,0,1]=4 3454 B14R0.179 CCCCOC(=O)COCCOCCC 7a_100000752267_100000211628 [1,1,0,0,0,0|1,0,1]=4 3455 B14R0.179 CCCCOCCOC(C)CCCOC 34a_200011539412_100000743108 [1,1,0,0,0,0|1,0,0]=3 3456 B14R0.179 CCCCOCCOC(C)CCCOC 7a_200011539412_100000743108 [1,1,0,0,0,0|1,0,0]=3 3457 B14R0.179 CCCOCC(=O)CCCOCCOC 1458a_100000745993_100011216529 [1,1,0,0,0,0|1,0,1]=4 3458 B14R0.179 CCCOCC(=O)NCCOCCOC 11a_100000745349_100000745993 [1,1,0,0,0,0|1,0,1]=4 3459 B14R0.179 CCCOCC(=O)NCCOCCOC 1626a_100000745349_100000745993 [1,1,0,0,0,0|1,0,1]=4 3460 B14R0.179 CCCOCC(=O)NCCOCCOC 240690a_100000745349_100000745993 [1,1,0,0,0,0|1,0,1]=4 3461 B14R0.179 CCCOCC(=O)NCCOCCOC 527a_100000745349_100000745993 [1,1,0,0,0,0|1,0,1]=4 3462 B14R0.179 CCCOCCNCC(=O)OCCOC 2230a_100161115042_200000040189 [1,1,0,0,0,0|1,0,1]=4 3463 B14R0.179 CCCOCCNCC(=O)OCCOC 34a_100161115042_200000040189 [1,1,0,0,0,0|1,0,1]=4 3464 B14R0.179 CCCOCCOCC(=O)NCCOC 34a_100000752267_100000183275 [1,1,0,0,0,0|1,0,1]=4 3465 B14R0.179 CCCOCCOCC(=O)NCCOC 7a_100000752267_100000183275 [1,1,0,0,0,0|1,0,1]=4 3466 B14R0.179 CCCOCCOCC(=O)OCCOC 34a_100000752267_200000040189 [1,1,0,0,0,0|0,0,1]=3 3467 B14R0.179 CCCOCCOCC(=O)OCCOC 7a_100000752267_200000040189 [1,1,0,0,0,0|0,0,1]=3 3468 B14R0.179 CCCOCCSCC(=O)OCCOC 62a_100011215938_200000040189 [1,1,0,0,0,0|0,1,1]=4 3469 B14R0.179 CCCOCCSCC(=O)OCCOC 62a_200000040189_100011215938 [1,1,0,0,0,0|0,1,1]=4 3470 B14R0.179 CCCSCC(C)NCCOCCOC 270004a_100000745349_100011343953 [1,1,0,0,0,0|1,1,0]=4 3471 B14R0.179 CCCSCCOCC(=O)OCCOC 34a_200000230433_200000040189 [1,1,0,0,0,0|0,1,1]=4 3472 B14R0.179 CCCSCCOCC(=O)OCCOC 7a_200000230433_200000040189 [1,1,0,0,0,0|0,1,1]=4 3473 B14R0.179 COCCCC(=O)CCCOCCOC 1458a_100000741012_100011216529 [1,1,0,0,0,0|1,0,1]=4 3474 B14R0.179 COCCCC(=O)COCCOCCO 1458a_106645077154_100000740836 [1,1,0,0,0,0|1,0,1]=4 3475 B14R0.179 COCCCC(=O)NCCOCCOC 11a_100000745349_100000741012 [1,1,0,0,0,0|1,0,1]=4 3476 B14R0.179 COCCCC(=O)NCCOCCOC 1626a_100000745349_100000741012 [1,1,0,0,0,0|1,0,1]=4 3477 B14R0.179 COCCCC(=O)NCCOCCOC 240690a_100000745349_100000741012 [1,1,0,0,0,0|1,0,1]=4 3478 B14R0.179 COCCCC(=O)NCCOCCOC 527a_100000745349_100000741012 [1,1,0,0,0,0|1,0,1]=4 3479 B14R0.179 COCCCC(C)OCCOCCOC 34a_200011539412_100000695917 [1,1,0,0,0,0|0,0,0]=2 3480 B14R0.179 COCCCC(C)OCCOCCOC 7a_200011539412_100000695917 [1,1,0,0,0,0|0,0,0]=2 3481 B14R0.179 COCCCCOCC(=O)NCCOC 34a_100000740925_100000183275 [1,1,0,0,0,0|1,0,1]=4 3482 B14R0.179 COCCCCOCC(=O)OCCOC 34a_100000740925_200000040189 [1,1,0,0,0,0|0,0,1]=3 3483 B14R0.179 COCCCCSCC(=O)OCCOC 62a_100000730899_200000040189 [1,1,0,0,0,0|0,1,1]=4 3484 B14R0.179 COCCCCSCC(=O)OCCOC 62a_200000040189_100000730899 [1,1,0,0,0,0|0,1,1]=4 3485 B14R0.179 COCCCN(C)CCCOCCOC 2230a_100000224831_100011216529 [1,1,0,0,0,0|2,0,0]=4 3486 B14R0.179 COCCCN(C)CCCOCCOC 269982a_100000224831_100011216529 [1,1,0,0,0,0|2,0,0]=4 3487 B14R0.179 COCCNC(=O)COCCOCCO 1626a_100000209980_106645077154 [1,1,0,0,0,0|1,0,1]=4 3488 B14R0.179 COCCNC(=O)COCCOCCO 240690a_100000209980_106645077154 [1,1,0,0,0,0|1,0,1]=4 3489 B14R0.179 COCCOC(=O)CNCCOCCO 2230a_100000211614_200000040189 [1,1,0,0,0,0|1,0,1]=4 3490 B14R0.179 COCCOC(=O)CNCCOCCO 34a_100000211614_200000040189 [1,1,0,0,0,0|1,0,1]=4 3491 B14R0.179 COCCOC(=O)COCCCCSC 34a_100011217163_200000040189 [1,1,0,0,0,0|0,1,1]=4 3492 B14R0.179 COCCOC(=O)COCCCCSC 7a_100011217163_200000040189 [1,1,0,0,0,0|0,1,1]=4 3493 B14R0.179 COCCOC(=O)COCCOCCBr 34a_100000692535_200000040189 [1,1,0,0,0,0|1,0,1]=4 3494 B14R0.179 COCCOC(=O)COCCOCCBr 7a_100000692535_200000040189 [1,1,0,0,0,0|1,0,1]=4 3495 B14R0.179 COCCOC(=O)COCCOCCCl 34a_100011215305_200000040189 [1,1,0,0,0,0|1,0,1]=4 3496 B14R0.179 COCCOC(=O)COCCOCCCl 7a_100011215305_200000040189 [1,1,0,0,0,0|1,0,1]=4 3497 B14R0.179 COCCOC(=O)COCCOCCF 34a_200015357709_200000040189 [1,1,0,0,0,0|1,0,1]=4 3498 B14R0.179 COCCOC(=O)COCCOCCF 7a_200015357709_200000040189 [1,1,0,0,0,0|1,0,1]=4 3499 B14R0.179 COCCOC(=O)COCCOCCI 34a_100012149058_200000040189 [1,1,0,0,0,0|1,0,1]=4 3500 B14R0.179 COCCOC(=O)COCCOCCI 7a_100012149058_200000040189 [1,1,0,0,0,0|1,0,1]=4 3501 B14R0.179 COCCOC(=O)COCCOCCN 34a_100000211614_200000040189 [1,1,0,0,0,0|1,0,1]=4 3502 B14R0.179 COCCOC(=O)CSCCOCCO 62a_100011215305_200000040189 [1,1,0,0,0,0|0,1,1]=4 3503 B14R0.179 COCCOC(=O)CSCCOCCO 62a_200000040189_100011215305 [1,1,0,0,0,0|0,1,1]=4 3504 B14R0.179 COCCOCCCC(=O)COCCO 1458a_100000708028_100011216529 [1,1,0,0,0,0|1,0,1]=4 3505 B14R0.179 COCCOCCNC(=O)COCCO 1626a_100000745349_100000708028 [1,1,0,0,0,0|1,0,1]=4 3506 B14R0.179 COCCOCCNC(=O)COCCO 240690a_100000745349_100000708028 [1,1,0,0,0,0|1,0,1]=4 3507 B14R0.179 COCCOCCNC(C)CCCSC 270004a_100000745349_100011399439 [1,1,0,0,0,0|1,1,0]=4 3508 B14R0.179 COCCOCSCC(=O)OCCOC 62a_100000231047_200000040189 [1,1,0,0,0,0|0,1,1]=4 3509 B14R0.179 COCCOCSCC(=O)OCCOC 62a_200000040189_100000231047 [1,1,0,0,0,0|0,1,1]=4 3510 B14R0.337 C#CC(C)OCCOCCOCCOC 34a_100000688194_200000035995 [1,1,0,0,0,0|0,0,2]=4 3511 B14R0.337 C#CCOCCOCCOCC(C)OC 34a_100000690652_100010408581 [1,1,0,0,0,0|0,0,2]=4 3512 B14R0.337 C#C[C@@H](C)OCCOCCOCCOC 34a_100009815206_100013367474 [1,1,0,0,0,0|0,0,2]=4 3513 B14R0.337 C#C[C@@H](C)OCCOCCOCCOC 7a_100009815206_100013367474 [1,1,0,0,0,0|0,0,2]=4 3514 B14R0.337 C=CC(C)COCCOCCOCCO 34a_100011215527_100000032323 [1,1,0,0,0,0|1,0,1]=4 3515 B14R0.337 C=CC(C)COCCOCCOCCO 7a_100011215527_100000032323 [1,1,0,0,0,0|1,0,1]=4 3516 B14R0.337 C=CC(C)OCCOCCOCCOC 34a_100000695699_100013367474 [1,1,0,0,0,0|0,0,2]=4 3517 B14R0.337 C=C[C@H](N)COCCOCCOCCO 34a_100016989147_100000032323 [1,1,0,0,0,0|1,0,1]=4 3518 B14R0.337 CC(CN)COCCOCCOCCO 34a_100000744482_100000032323 [1,1,0,0,0,0|2,0,0]=4 3519 B14R0.337 CC(CO)OCCOCCOCCCN 34a_100011996194_100012180447 [1,1,0,0,0,0|2,0,0]=4 3520 B14R0.337 CCC(=O)COCCOCCOCCO 1458a_100010423381_100000210202 [1,1,0,0,0,0|1,0,1]=4 3521 B14R0.337 CCC(=O)COCCOCCOCCO 34a_100000725409_100000032323 [1,1,0,0,0,0|1,0,1]=4 3522 B14R0.337 CCC(=O)NCCOCCOCCOC 1626a_100012028300_100000210414 [1,1,0,0,0,0|1,0,1]=4 3523 B14R0.337 CCC(=O)NCCOCCOCCOC 240690a_100012028300_100000210414 [1,1,0,0,0,0|1,0,1]=4 3524 B14R0.337 CCC(=O)NCCOCCOCCOC 34a_200000158885_100000695917 [1,1,0,0,0,0|1,0,1]=4 3525 B14R0.337 CCC(=O)NCCOCCOCCOC 7a_200000158885_100000695917 [1,1,0,0,0,0|1,0,1]=4 3526 B14R0.337 CCC(=O)OCCOCCOCCOC 7a_200000031056_100000695917 [1,1,0,0,0,0|0,0,1]=3 3527 B14R0.337 CCC(C)CCCOCCOCCOC 7a_100011216074_100000695917 [1,1,0,0,0,0|1,0,0]=3 3528 B14R0.337 CCC(C)CNCCOCCOCCO 2230a_100011998139_100000748023 [1,1,0,0,0,0|2,0,0]=4 3529 B14R0.337 CCC(C)CNCCOCCOCCO 2230a_100020588543_100000032323 [1,1,0,0,0,0|2,0,0]=4 3530 B14R0.337 CCC(C)CNCCOCCOCCO 270004a_100011998139_100000243153 [1,1,0,0,0,0|2,0,0]=4 3531 B14R0.337 CCC(C)CNCCOCCOCCO 34a_100011998139_100000748023 [1,1,0,0,0,0|2,0,0]=4 3532 B14R0.337 CCC(C)COCCOCCOCCBr 34a_100010132937_100000748023 [1,1,0,0,0,0|2,0,0]=4 3533 B14R0.337 CCC(C)COCCOCCOCCBr 7a_100010132937_100000748023 [1,1,0,0,0,0|2,0,0]=4 3534 B14R0.337 CCC(C)COCCOCCOCCCl 34a_100000032323_100000748023 [1,1,0,0,0,0|2,0,0]=4 3535 B14R0.337 CCC(C)COCCOCCOCCCl 7a_100000032323_100000748023 [1,1,0,0,0,0|2,0,0]=4 3536 B14R0.337 CCC(C)COCCOCCOCCN 34a_100011998139_100000748023 [1,1,0,0,0,0|2,0,0]=4 3537 B14R0.337 CCC(C)CSCCOCCOCCO 62a_100000032323_100000748023 [1,1,0,0,0,0|1,1,0]=4 3538 B14R0.337 CCC(C)CSCCOCCOCCO 62a_100000748023_100000032323 [1,1,0,0,0,0|1,1,0]=4 3539 B14R0.337 CCC(C)NCCOCCOCCOC 2230a_100000209981_100013367474 [1,1,0,0,0,0|1,0,0]=3 3540 B14R0.337 CCC(C)NCCOCCOCCOC 2230a_100012028300_100000758301 [1,1,0,0,0,0|1,0,0]=3 3541 B14R0.337 CCC(C)NCCOCCOCCOC 34a_100012028300_100011215416 [1,1,0,0,0,0|1,0,0]=3 3542 B14R0.337 CCC(C)OCCOCCOCCCN 34a_100011996194_100011215416 [1,1,0,0,0,0|2,0,0]=4 3543 B14R0.337 CCC(C)OCCOCCOCCNC 34a_200014138305_100011215416 [1,1,0,0,0,0|1,0,0]=3 3544 B14R0.337 CCC(C)OCCOCCOCCOC 34a_100000688194_100011215416 [1,1,0,0,0,0|0,0,0]=2 3545 B14R0.337 CCC(C)OCCOCCOCCOC 7a_100000210228_100013367474 [1,1,0,0,0,0|0,0,0]=2 3546 B14R0.337 CCC(C)OCCOCCOCCOC 7a_100000688194_100000758301 [1,1,0,0,0,0|0,0,0]=2 3547 B14R0.337 CCC(C)SCCOCCOCCOC 62a_100000758301_100013367474 [1,1,0,0,0,0|0,1,0]=3 3548 B14R0.337 CCC(C)SCCOCCOCCOC 62a_100013367474_100000758301 [1,1,0,0,0,0|0,1,0]=3 3549 B14R0.337 CCC(O)CNCCOCCOCCO 2230a_100011218483_100000032323 [1,1,0,0,0,0|2,0,0]=4 3550 B14R0.337 CCC(O)CNCCOCCOCCO 2230a_100011998139_100011218378 [1,1,0,0,0,0|2,0,0]=4 3551 B14R0.337 CCC(O)CNCCOCCOCCO 34a_100011998139_100011218378 [1,1,0,0,0,0|2,0,0]=4 3552 B14R0.337 CCC(O)COCCOCCOCCBr 34a_100010132937_100011218378 [1,1,0,0,0,0|2,0,0]=4 3553 B14R0.337 CCC(O)COCCOCCOCCBr 7a_100010132937_100011218378 [1,1,0,0,0,0|2,0,0]=4 3554 B14R0.337 CCC(O)COCCOCCOCCCl 34a_100000032323_100011218378 [1,1,0,0,0,0|2,0,0]=4 3555 B14R0.337 CCC(O)COCCOCCOCCCl 7a_100000032323_100011218378 [1,1,0,0,0,0|2,0,0]=4 3556 B14R0.337 CCC(O)COCCOCCOCCN 34a_100011998139_100011218378 [1,1,0,0,0,0|2,0,0]=4 3557 B14R0.337 CCC(O)CSCCOCCOCCO 62a_100000032323_100011218378 [1,1,0,0,0,0|1,1,0]=4 3558 B14R0.337 CCC(O)CSCCOCCOCCO 62a_100011218378_100000032323 [1,1,0,0,0,0|1,1,0]=4 3559 B14R0.337 CCCCCCCCCOCC(C)OC 34a_100000690652_100011214924 [1,1,0,0,0,0|2,0,0]=4 3560 B14R0.337 CCCCCCOCCOCC(=O)OC 34a_100000210259_100000090808 [1,1,0,0,0,0|1,0,1]=4 3561 B14R0.337 CCCCCCOCCOCC(=O)OC 34a_100000691444_100000747449 [1,1,0,0,0,0|1,0,1]=4 3562 B14R0.337 CCCCCCOCCOCC(=O)OC 7a_100000210259_100000090808 [1,1,0,0,0,0|1,0,1]=4 3563 B14R0.337 CCCCCCOCCOCC(=O)OC 7a_100000691444_100000747449 [1,1,0,0,0,0|1,0,1]=4 3564 B14R0.337 CCCCCCOCCOCC(C)CC 34a_100000691444_100000748023 [1,1,0,0,0,0|2,0,0]=4 3565 B14R0.337 CCCCCCOCCOCC(C)CC 7a_100000691444_100000748023 [1,1,0,0,0,0|2,0,0]=4 3566 B14R0.337 CCCCCCOCCOCC(O)CC 34a_100000691444_100011218378 [1,1,0,0,0,0|2,0,0]=4 3567 B14R0.337 CCCCCCOCCOCC(O)CC 7a_100000691444_100011218378 [1,1,0,0,0,0|2,0,0]=4 3568 B14R0.337 CCCCCCOCCOC[C@@H](C)CC 34a_100000691444_100009816398 [1,1,0,0,0,0|2,0,0]=4 3569 B14R0.337 CCCCCCOCCOC[C@@H](C)CC 7a_100000691444_100009816398 [1,1,0,0,0,0|2,0,0]=4 3570 B14R0.337 CCCCOCCCCOCC(=O)OC 34a_200000760531_100000747449 [1,1,0,0,0,0|1,0,1]=4 3571 B14R0.337 CCCCOCCCCOCC(=O)OC 7a_200000760531_100000747449 [1,1,0,0,0,0|1,0,1]=4 3572 B14R0.337 CCCCOCCCCOCC(C)CC 34a_200000760531_100000748023 [1,1,0,0,0,0|2,0,0]=4 3573 B14R0.337 CCCCOCCCCOCC(C)CC 7a_200000760531_100000748023 [1,1,0,0,0,0|2,0,0]=4 3574 B14R0.337 CCCCOCCCCOCC(O)CC 34a_200000760531_100011218378 [1,1,0,0,0,0|2,0,0]=4 3575 B14R0.337 CCCCOCCCCOCC(O)CC 7a_200000760531_100011218378 [1,1,0,0,0,0|2,0,0]=4 3576 B14R0.337 CCCCOCCCCOC[C@@H](C)CC 34a_200000760531_100009816398 [1,1,0,0,0,0|2,0,0]=4 3577 B14R0.337 CCCCOCCCCOC[C@@H](C)CC 7a_200000760531_100009816398 [1,1,0,0,0,0|2,0,0]=4 3578 B14R0.337 CCCCOCCOCCCC(=O)OC 34a_100000210238_100000742333 [1,1,0,0,0,0|1,0,1]=4 3579 B14R0.337 CCCCOCCOCCCC(=O)OC 7a_100000210238_100011218270 [1,1,0,0,0,0|1,0,1]=4 3580 B14R0.337 CCCCOCCOCCCC(C)CC 7a_100011216074_100000743108 [1,1,0,0,0,0|2,0,0]=4 3581 B14R0.337 CCCCOCCOCCOC(=O)CC 7a_200000031056_100000743108 [1,1,0,0,0,0|1,0,1]=4 3582 B14R0.337 CCCCOCCOCCOC(=O)OC 34a_100010262106_100000743108 [1,1,0,0,0,0|1,0,1]=4 3583 B14R0.337 CCCCOCCOCCOC(C)CC 34a_100011215186_100011215416 [1,1,0,0,0,0|1,0,0]=3 3584 B14R0.337 CCCCOCCOCCOC(C)CC 7a_100011215186_100000758301 [1,1,0,0,0,0|1,0,0]=3 3585 B14R0.337 CCCCOCCOCCOC(C)CO 34a_100011215186_100012180447 [1,1,0,0,0,0|1,0,0]=3 3586 B14R0.337 CCCCOCCOCCOC(C)CO 7a_100011215186_100012180447 [1,1,0,0,0,0|1,0,0]=3 3587 B14R0.337 CCCOCCNCCOCC(=O)OC 2230a_100161115042_100000090808 [1,1,0,0,0,0|1,0,1]=4 3588 B14R0.337 CCCOCCNCCOCC(=O)OC 34a_100161115042_100000090808 [1,1,0,0,0,0|1,0,1]=4 3589 B14R0.337 CCCOCCOCCCCC(=O)OC 34a_100000059025_100011215938 [1,1,0,0,0,0|1,0,1]=4 3590 B14R0.337 CCCOCCOCCCCC(=O)OC 34a_100000752267_100000204269 [1,1,0,0,0,0|1,0,1]=4 3591 B14R0.337 CCCOCCOCCCCC(=O)OC 7a_100000059025_100011215938 [1,1,0,0,0,0|1,0,1]=4 3592 B14R0.337 CCCOCCOCCCCC(=O)OC 7a_100000752267_100000204269 [1,1,0,0,0,0|1,0,1]=4 3593 B14R0.337 CCCOCCOCCNCC(=O)OC 2230a_200011904461_100000747449 [1,1,0,0,0,0|1,0,1]=4 3594 B14R0.337 CCCOCCOCCNCC(=O)OC 34a_200011904461_100000747449 [1,1,0,0,0,0|1,0,1]=4 3595 B14R0.337 CCCOCCOCCNCC(C)CC 2230a_200011904461_100000748023 [1,1,0,0,0,0|2,0,0]=4 3596 B14R0.337 CCCOCCOCCNCC(C)CC 270004a_200011904461_100000243153 [1,1,0,0,0,0|2,0,0]=4 3597 B14R0.337 CCCOCCOCCNCC(C)CC 34a_200011904461_100000748023 [1,1,0,0,0,0|2,0,0]=4 3598 B14R0.337 CCCOCCOCCNCC(O)CC 2230a_200011904461_100011218378 [1,1,0,0,0,0|2,0,0]=4 3599 B14R0.337 CCCOCCOCCNCC(O)CC 34a_200011904461_100011218378 [1,1,0,0,0,0|2,0,0]=4 3600 B14R0.337 CCCOCCOCCNC[C@@H](C)CC 2230a_200011904461_100009816398 [1,1,0,0,0,0|2,0,0]=4 3601 B14R0.337 CCCOCCOCCNC[C@@H](C)CC 34a_200011904461_100009816398 [1,1,0,0,0,0|2,0,0]=4 3602 B14R0.337 CCCOCCOCCOCC(=O)OC 34a_100000752267_100000090808 [1,1,0,0,0,0|0,0,1]=3 3603 B14R0.337 CCCOCCOCCOCC(=O)OC 34a_100011023656_100000210303 [1,1,0,0,0,0|0,0,1]=3 3604 B14R0.337 CCCOCCOCCOCC(=O)OC 7a_100000752267_100000090808 [1,1,0,0,0,0|0,0,1]=3 3605 B14R0.337 CCCOCCOCCOCC(=O)OC 7a_100011023656_100000210303 [1,1,0,0,0,0|0,0,1]=3 3606 B14R0.337 CCCOCCSCCOCC(=O)OC 62a_100000090808_100011215938 [1,1,0,0,0,0|0,1,1]=4 3607 B14R0.337 CCCOCCSCCOCC(=O)OC 62a_100011215938_100000090808 [1,1,0,0,0,0|0,1,1]=4 3608 B14R0.337 CCCSCCOCCOCC(=O)OC 34a_200000230433_100000090808 [1,1,0,0,0,0|0,1,1]=4 3609 B14R0.337 CCCSCCOCCOCC(=O)OC 7a_200000230433_100000090808 [1,1,0,0,0,0|0,1,1]=4 3610 B14R0.337 CCN(C)CCCOCCOCCOC 7a_100011215163_100015186262 [1,1,0,0,0,0|2,0,0]=4 3611 B14R0.337 CC[C@H](C)CNCCOCCOCCO 2230a_100011998139_100009816398 [1,1,0,0,0,0|2,0,0]=4 3612 B14R0.337 CC[C@H](C)CNCCOCCOCCO 34a_100011998139_100009816398 [1,1,0,0,0,0|2,0,0]=4 3613 B14R0.337 CC[C@H](C)COCCOCCOCCBr 34a_100010132937_100009816398 [1,1,0,0,0,0|2,0,0]=4 3614 B14R0.337 CC[C@H](C)COCCOCCOCCBr 7a_100010132937_100009816398 [1,1,0,0,0,0|2,0,0]=4 3615 B14R0.337 CC[C@H](C)COCCOCCOCCCl 34a_100000032323_100009816398 [1,1,0,0,0,0|2,0,0]=4 3616 B14R0.337 CC[C@H](C)COCCOCCOCCCl 7a_100000032323_100009816398 [1,1,0,0,0,0|2,0,0]=4 3617 B14R0.337 CC[C@H](C)COCCOCCOCCN 34a_100011998139_100009816398 [1,1,0,0,0,0|2,0,0]=4 3618 B14R0.337 CC[C@H](C)COCCOCCOCCO 7a_100009816381_100000032323 [1,1,0,0,0,0|1,0,0]=3 3619 B14R0.337 CC[C@H](C)CSCCOCCOCCO 62a_100000032323_100009816398 [1,1,0,0,0,0|1,1,0]=4 3620 B14R0.337 CC[C@H](C)CSCCOCCOCCO 62a_100009816398_100000032323 [1,1,0,0,0,0|1,1,0]=4 3621 B14R0.337 CNC(=O)CCCOCCOCCOC 34a_100011215163_100000741757 [1,1,0,0,0,0|1,0,1]=4 3622 B14R0.337 CNC(=O)CCCOCCOCCOC 7a_100011215163_100000741757 [1,1,0,0,0,0|1,0,1]=4 3623 B14R0.337 CNC(=O)COCCOCCOCCO 1626a_100102657272_100010423381 [1,1,0,0,0,0|1,0,1]=4 3624 B14R0.337 CNC(=O)COCCOCCOCCO 240690a_100102657272_100010423381 [1,1,0,0,0,0|1,0,1]=4 3625 B14R0.337 CNC(=O)COCCOCCOCCO 34a_100000750040_100000032323 [1,1,0,0,0,0|1,0,1]=4 3626 B14R0.337 CNC(=O)OCCOCCOCCOC 34a_100011215163_200011997002 [1,1,0,0,0,0|1,0,1]=4 3627 B14R0.337 CNC(=O)OCCOCCOCCOC 7a_100011215163_200011997002 [1,1,0,0,0,0|1,0,1]=4 3628 B14R0.337 CNCCOCCOCCCC(=O)OC 34a_100000228057_100000742333 [1,1,0,0,0,0|1,0,1]=4 3629 B14R0.337 CNCCOCCOCCOC(C)CO 34a_200014138305_100012180447 [1,1,0,0,0,0|1,0,0]=3 3630 B14R0.337 COC(=O)CCCCOCCOCCO 34a_100000059025_100000692535 [1,1,0,0,0,0|1,0,1]=4 3631 B14R0.337 COC(=O)CCCCOCCOCCO 7a_100000059025_100011215305 [1,1,0,0,0,0|1,0,1]=4 3632 B14R0.337 COC(=O)CNCCOCCOCCO 2230a_100011998139_100000747449 [1,1,0,0,0,0|1,0,1]=4 3633 B14R0.337 COC(=O)CNCCOCCOCCO 34a_100011998139_100000747449 [1,1,0,0,0,0|1,0,1]=4 3634 B14R0.337 COC(=O)COCCNCCOCCO 2230a_100000211614_100000090808 [1,1,0,0,0,0|1,0,1]=4 3635 B14R0.337 COC(=O)COCCNCCOCCO 34a_100000211614_100000090808 [1,1,0,0,0,0|1,0,1]=4 3636 B14R0.337 COC(=O)COCCOCCCCSC 34a_100011217163_100000090808 [1,1,0,0,0,0|0,1,1]=4 3637 B14R0.337 COC(=O)COCCOCCCCSC 7a_100011217163_100000090808 [1,1,0,0,0,0|0,1,1]=4 3638 B14R0.337 COC(=O)COCCOCCOCCBr 34a_100000692535_100000090808 [1,1,0,0,0,0|1,0,1]=4 3639 B14R0.337 COC(=O)COCCOCCOCCBr 34a_100010132937_100000747449 [1,1,0,0,0,0|1,0,1]=4 3640 B14R0.337 COC(=O)COCCOCCOCCBr 7a_100000692535_100000090808 [1,1,0,0,0,0|1,0,1]=4 3641 B14R0.337 COC(=O)COCCOCCOCCBr 7a_100010132937_100000747449 [1,1,0,0,0,0|1,0,1]=4 3642 B14R0.337 COC(=O)COCCOCCOCCCl 34a_100000032323_100000747449 [1,1,0,0,0,0|1,0,1]=4 3643 B14R0.337 COC(=O)COCCOCCOCCCl 34a_100011215305_100000090808 [1,1,0,0,0,0|1,0,1]=4 3644 B14R0.337 COC(=O)COCCOCCOCCCl 7a_100000032323_100000747449 [1,1,0,0,0,0|1,0,1]=4 3645 B14R0.337 COC(=O)COCCOCCOCCCl 7a_100011215305_100000090808 [1,1,0,0,0,0|1,0,1]=4 3646 B14R0.337 COC(=O)COCCOCCOCCF 34a_100011023656_100011217306 [1,1,0,0,0,0|1,0,1]=4 3647 B14R0.337 COC(=O)COCCOCCOCCF 34a_200015357709_100000090808 [1,1,0,0,0,0|1,0,1]=4 3648 B14R0.337 COC(=O)COCCOCCOCCF 7a_100011023656_100011217306 [1,1,0,0,0,0|1,0,1]=4 3649 B14R0.337 COC(=O)COCCOCCOCCF 7a_200015357709_100000090808 [1,1,0,0,0,0|1,0,1]=4 3650 B14R0.337 COC(=O)COCCOCCOCCI 34a_100012149058_100000090808 [1,1,0,0,0,0|1,0,1]=4 3651 B14R0.337 COC(=O)COCCOCCOCCI 7a_100012149058_100000090808 [1,1,0,0,0,0|1,0,1]=4 3652 B14R0.337 COC(=O)COCCOCCOCCN 34a_100000211614_100000090808 [1,1,0,0,0,0|1,0,1]=4 3653 B14R0.337 COC(=O)COCCOCCOCCN 34a_100011998139_100000747449 [1,1,0,0,0,0|1,0,1]=4 3654 B14R0.337 COC(=O)COCCOCCOCCO 34a_100011023656_100000211926 [1,1,0,0,0,0|0,0,1]=3 3655 B14R0.337 COC(=O)COCCOCCOCCO 7a_100011023656_100000211926 [1,1,0,0,0,0|0,0,1]=3 3656 B14R0.337 COC(=O)COCCOCCOCSC 34a_100011023656_100011218213 [1,1,0,0,0,0|0,1,1]=4 3657 B14R0.337 COC(=O)COCCSCCOCCO 62a_100000090808_100011215305 [1,1,0,0,0,0|0,1,1]=4 3658 B14R0.337 COC(=O)COCCSCCOCCO 62a_100011215305_100000090808 [1,1,0,0,0,0|0,1,1]=4 3659 B14R0.337 COC(=O)CSCCOCCOCCO 62a_100000032323_100000747449 [1,1,0,0,0,0|0,1,1]=4 3660 B14R0.337 COC(=O)CSCCOCCOCCO 62a_100000747449_100000032323 [1,1,0,0,0,0|0,1,1]=4 3661 B14R0.337 COC(C)COCCCCCCCCO 34a_100000690652_100000033203 [1,1,0,0,0,0|2,0,0]=4 3662 B14R0.337 COC(C)COCCOCCOCCO 34a_100000690652_100000032323 [1,1,0,0,0,0|0,0,0]=2 3663 B14R0.337 COCCCCOCCCCC(=O)OC 34a_100000059025_100000755781 [1,1,0,0,0,0|1,0,1]=4 3664 B14R0.337 COCCCCOCCCCC(=O)OC 34a_100000740925_100000204269 [1,1,0,0,0,0|1,0,1]=4 3665 B14R0.337 COCCCCOCCCCC(=O)OC 7a_100000059025_100000730899 [1,1,0,0,0,0|1,0,1]=4 3666 B14R0.337 COCCCCOCCOCC(=O)OC 34a_100000740925_100000090808 [1,1,0,0,0,0|0,0,1]=3 3667 B14R0.337 COCCCCSCCOCC(=O)OC 62a_100000090808_100000730899 [1,1,0,0,0,0|0,1,1]=4 3668 B14R0.337 COCCCCSCCOCC(=O)OC 62a_100000730899_100000090808 [1,1,0,0,0,0|0,1,1]=4 3669 B14R0.337 COCCOCCCCCCC(=O)OC 34a_100000210237_100009815986 [1,1,0,0,0,0|1,0,1]=4 3670 B14R0.337 COCCOCCCCCCC(=O)OC 34a_100009863599_100011201679 [1,1,0,0,0,0|1,0,1]=4 3671 B14R0.337 COCCOCCCCCCC(=O)OC 7a_100009863599_100000233755 [1,1,0,0,0,0|1,0,1]=4 3672 B14R0.337 COCCOCCCOCCC(C)OC 7a_100000764861_100011216529 [1,1,0,0,0,0|2,0,0]=4 3673 B14R0.337 COCCOCCNCCCC(=O)OC 2230a_100000745349_100011218270 [1,1,0,0,0,0|1,0,1]=4 3674 B14R0.337 COCCOCCNCCCC(=O)OC 34a_100000745349_100000742333 [1,1,0,0,0,0|1,0,1]=4 3675 B14R0.337 COCCOCCOCCCC(=O)OC 34a_100011215163_100000742333 [1,1,0,0,0,0|0,0,1]=3 3676 B14R0.337 COCCOCCOCCCC(=O)OC 7a_100011215163_100011218270 [1,1,0,0,0,0|0,0,1]=3 3677 B14R0.337 COCCOCCOCCC[C@@H](C)CN 34a_100160569302_100000695917 [1,1,0,0,0,0|2,0,0]=4 3678 B14R0.337 COCCOCCOCCNC(=O)CO 240690a_100012028300_100000210174 [1,1,0,0,0,0|1,0,1]=4 3679 B14R0.337 COCCOCCOCCNC(=O)OC 34a_100000757965_100000695917 [1,1,0,0,0,0|1,0,1]=4 3680 B14R0.337 COCCOCCOCCNC(C)CO 2230a_100012028300_100012180447 [1,1,0,0,0,0|1,0,0]=3 3681 B14R0.337 COCCOCCOCCNC(C)CO 34a_100012028300_100012180447 [1,1,0,0,0,0|1,0,0]=3 3682 B14R0.337 COCCOCCOCCN[C@H](C)CO 2230a_100000737577_100013367474 [1,1,0,0,0,0|1,0,0]=3 3683 B14R0.337 COCCOCCOCCOC(=O)OC 34a_100010262106_100000695917 [1,1,0,0,0,0|0,0,1]=3 3684 B14R0.337 COCCOCCOCCOC(C)C#N 34a_100011218135_100013367474 [1,1,0,0,0,0|1,0,1]=4 3685 B14R0.337 COCCOCCOCCOC(C)C#N 7a_100000688194_100000703298 [1,1,0,0,0,0|1,0,1]=4 3686 B14R0.337 COCCOCCOCCOC(C)CF 34a_100016041109_100013367474 [1,1,0,0,0,0|1,0,0]=3 3687 B14R0.337 COCCOCCOCCOC(C)CF 7a_100016041109_100013367474 [1,1,0,0,0,0|1,0,0]=3 3688 B14R0.337 COCCOCCOCCOC(C)CN 34a_100000210904_100013367474 [1,1,0,0,0,0|1,0,0]=3 3689 B14R0.337 COCCOCCOCCOC(C)CO 34a_100000688194_100012180447 [1,1,0,0,0,0|0,0,0]=2 3690 B14R0.337 COCCOCCOCCOC(C)CO 7a_100000688194_100012180447 [1,1,0,0,0,0|0,0,0]=2 3691 B14R0.337 COCCOCCOCCSC(C)CO 62a_100012180447_100013367474 [1,1,0,0,0,0|0,1,0]=3 3692 B14R0.337 COCCOCCOCCSC(C)OC 62a_100009879195_100013367474 [1,1,0,0,0,0|0,1,0]=3 3693 B14R0.337 COCCOCCOCCSC(C)OC 62a_100013367474_100009879195 [1,1,0,0,0,0|0,1,0]=3 3694 B14R0.337 COCCOCCOCCS[C@H](C)CO 62a_100013367474_100016084084 [1,1,0,0,0,0|0,1,0]=3 3695 B14R0.337 COCCOCCOCCS[C@H](C)CO 62a_100016084084_100013367474 [1,1,0,0,0,0|0,1,0]=3 3696 B14R0.337 COCCOCCSCCCC(=O)OC 62a_100000695917_100011218270 [1,1,0,0,0,0|0,1,1]=4 3697 B14R0.337 COCCOCCSCCCC(=O)OC 62a_100011218270_100000695917 [1,1,0,0,0,0|0,1,1]=4 3698 B14R0.337 COCCOCSCCOCC(=O)OC 62a_100000090808_100000231047 [1,1,0,0,0,0|0,1,1]=4 3699 B14R0.337 COCCOCSCCOCC(=O)OC 62a_100000231047_100000090808 [1,1,0,0,0,0|0,1,1]=4 3700 B14R0.337 CO[C@H](C)CNCCOCCOCCO 2230a_100020591295_100000032323 [1,1,0,0,0,0|1,0,0]=3 3701 B14R0.337 NC[C@@H](F)COCCOCCOCCO 34a_100015665980_100000032323 [1,1,0,0,0,0|2,0,0]=4 3702 B14R0.337 OCCOCCOCCOCC(Cl)CCl 34a_100000033668_100000032323 [1,1,0,0,0,0|2,0,0]=4 3703 B14R0.393 C#CCC(C)OCCOCCOCCO 34a_100000685586_100000032323 [1,1,0,0,0,0|1,0,1]=4 3704 B14R0.393 C#CCC(C)OCCOCCOCCO 7a_100000685586_100000032323 [1,1,0,0,0,0|1,0,1]=4 3705 B14R0.393 C#CCOCCOCCOC(C)COC 34a_100000041007_100000765312 [1,1,0,0,0,0|0,0,2]=4 3706 B14R0.393 C#CCOCCOCCOC(C)COC 7a_100000041007_100000765312 [1,1,0,0,0,0|0,0,2]=4 3707 B14R0.393 C#CCOCCOCCO[C@H](C)COC 34a_100011934205_100010408581 [1,1,0,0,0,0|0,0,2]=4 3708 B14R0.393 C/C=C/C(C)OCCOCCOCCO 34a_200102604097_100000032323 [1,1,0,0,0,0|1,0,1]=4 3709 B14R0.393 C=CCOCCOCCOC(C)COC 34a_100000065479_100000765312 [1,1,0,0,0,0|0,0,2]=4 3710 B14R0.393 C=CCOCCOCCOC(C)COC 7a_100000065479_100000765312 [1,1,0,0,0,0|0,0,2]=4 3711 B14R0.393 C=CC[C@@H](C)OCCOCCOCCO 34a_100000731007_100000032323 [1,1,0,0,0,0|1,0,1]=4 3712 B14R0.393 C=CC[C@@H](C)OCCOCCOCCO 7a_100000731007_100000032323 [1,1,0,0,0,0|1,0,1]=4 3713 B14R0.393 CC#CC(C)OCCOCCOCCO 34a_100011216543_100000032323 [1,1,0,0,0,0|1,0,1]=4 3714 B14R0.393 CC(CCBr)OCCOCCOCCO 34a_100012276601_100000032323 [1,1,0,0,0,0|2,0,0]=4 3715 B14R0.393 CCCC(=O)CCOCCOCCOC 1458a_100000211992_100013367474 [1,1,0,0,0,0|1,0,0]=3 3716 B14R0.393 CCCC(=O)CCOCCOCCOC 1458a_100012278103_100000210303 [1,1,0,0,0,0|1,0,0]=3 3717 B14R0.393 CCCC(=O)OCOCCOCCOC 34a_100011215163_100000034017 [1,1,0,0,0,0|1,0,1]=4 3718 B14R0.393 CCCC(C)CCCOCCCCOC 34a_100011713154_100000755781 [1,1,0,0,0,0|2,0,0]=4 3719 B14R0.393 CCCC(C)CCCOCCCCOC 7a_100011713154_100000730899 [1,1,0,0,0,0|2,0,0]=4 3720 B14R0.393 CCCC(C)CCCOCCOCCO 34a_100011713154_100000692535 [1,1,0,0,0,0|2,0,0]=4 3721 B14R0.393 CCCC(C)CCCOCCOCCO 7a_100011713154_100011215305 [1,1,0,0,0,0|2,0,0]=4 3722 B14R0.393 CCCC(C)CCOCCOCCOC 34a_100011217855_100000695917 [1,1,0,0,0,0|1,0,0]=3 3723 B14R0.393 CCCC(C)CCOCCOCCOC 7a_100011217855_100000695917 [1,1,0,0,0,0|1,0,0]=3 3724 B14R0.393 CCCC(C)NCCOCCOCCO 2230a_100000741246_100000032323 [1,1,0,0,0,0|2,0,0]=4 3725 B14R0.393 CCCC(C)NCCOCCOCCO 2230a_100011998139_100000766640 [1,1,0,0,0,0|2,0,0]=4 3726 B14R0.393 CCCC(C)NCCOCCOCCO 270004a_100011998139_100000211909 [1,1,0,0,0,0|2,0,0]=4 3727 B14R0.393 CCCC(C)NCCOCCOCCO 34a_100011998139_100000766640 [1,1,0,0,0,0|2,0,0]=4 3728 B14R0.393 CCCC(C)OCCOCCOCCBr 34a_100010132937_100000766640 [1,1,0,0,0,0|2,0,0]=4 3729 B14R0.393 CCCC(C)OCCOCCOCCBr 7a_100010132937_100000766640 [1,1,0,0,0,0|2,0,0]=4 3730 B14R0.393 CCCC(C)OCCOCCOCCCl 34a_100000032323_100000766640 [1,1,0,0,0,0|2,0,0]=4 3731 B14R0.393 CCCC(C)OCCOCCOCCCl 7a_100000032323_100000766640 [1,1,0,0,0,0|2,0,0]=4 3732 B14R0.393 CCCC(C)OCCOCCOCCN 34a_100011998139_100000766640 [1,1,0,0,0,0|2,0,0]=4 3733 B14R0.393 CCCC(C)OCCOCCOCCO 34a_100000764384_100000032323 [1,1,0,0,0,0|1,0,0]=3 3734 B14R0.393 CCCC(C)OCCOCCOCCO 7a_100000764384_100000032323 [1,1,0,0,0,0|1,0,0]=3 3735 B14R0.393 CCCC(C)SCCOCCOCCO 62a_100000032323_100000766640 [1,1,0,0,0,0|1,1,0]=4 3736 B14R0.393 CCCC(C)SCCOCCOCCO 62a_100000766640_100000032323 [1,1,0,0,0,0|1,1,0]=4 3737 B14R0.393 CCCCCCCCCOC(C)COC 34a_100000210712_100000765312 [1,1,0,0,0,0|2,0,0]=4 3738 B14R0.393 CCCCCCCCCOC(C)COC 7a_100000210712_100000765312 [1,1,0,0,0,0|2,0,0]=4 3739 B14R0.393 CCCCCCCCCO[C@H](C)COC 34a_100011934205_100011214924 [1,1,0,0,0,0|2,0,0]=4 3740 B14R0.393 CCCCCCOCCOC(C)CCC 34a_100000691444_100000766640 [1,1,0,0,0,0|2,0,0]=4 3741 B14R0.393 CCCCCCOCCOC(C)CCC 7a_100000691444_100000766640 [1,1,0,0,0,0|2,0,0]=4 3742 B14R0.393 CCCCCCOCCOC(C)COC 34a_100000691444_100000765312 [1,1,0,0,0,0|1,0,0]=3 3743 B14R0.393 CCCCCCOCCOC(C)COC 7a_100000691444_100000765312 [1,1,0,0,0,0|1,0,0]=3 3744 B14R0.393 CCCCNCCCCOC(C)COC 34a_200011216965_100000765312 [1,1,0,0,0,0|2,0,0]=4 3745 B14R0.393 CCCCOCCCCOC(C)CCC 34a_200000760531_100000766640 [1,1,0,0,0,0|2,0,0]=4 3746 B14R0.393 CCCCOCCCCOC(C)CCC 7a_200000760531_100000766640 [1,1,0,0,0,0|2,0,0]=4 3747 B14R0.393 CCCCOCCCCOC(C)COC 34a_200000760531_100000765312 [1,1,0,0,0,0|1,0,0]=3 3748 B14R0.393 CCCCOCCCCOC(C)COC 7a_200000760531_100000765312 [1,1,0,0,0,0|1,0,0]=3 3749 B14R0.393 CCCCOCCOCCC(C)CCC 34a_100011217855_100000743108 [1,1,0,0,0,0|2,0,0]=4 3750 B14R0.393 CCCCOCCOCCC(C)CCC 7a_100011217855_100000743108 [1,1,0,0,0,0|2,0,0]=4 3751 B14R0.393 CCCCOCCOCC[C@@H](N)CCC 34a_100015193777_100000743108 [1,1,0,0,0,0|2,0,0]=4 3752 B14R0.393 CCCN(C)CCOCCOCCOC 2230a_100000747261_100013367474 [1,1,0,0,0,0|1,0,0]=3 3753 B14R0.393 CCCN(C)CCOCCOCCOC 2230a_200000716983_100000210303 [1,1,0,0,0,0|1,0,0]=3 3754 B14R0.393 CCCN(C)CCOCCOCCOC 269982a_100000747261_100013367474 [1,1,0,0,0,0|1,0,0]=3 3755 B14R0.393 CCCN(C)CCOCCOCCOC 269982a_200000716983_100000210303 [1,1,0,0,0,0|1,0,0]=3 3756 B14R0.393 CCCN(C)CCOCCOCCOC 34a_200000716983_100000210303 [1,1,0,0,0,0|1,0,0]=3 3757 B14R0.393 CCCOCCOCCCC(C)CCC 34a_100011713154_100011215938 [1,1,0,0,0,0|2,0,0]=4 3758 B14R0.393 CCCOCCOCCCC(C)CCC 7a_100011713154_100011215938 [1,1,0,0,0,0|2,0,0]=4 3759 B14R0.393 CCCOCCOCCNC(=O)COC 11a_200011904461_100000210968 [1,1,0,0,0,0|1,0,1]=4 3760 B14R0.393 CCCOCCOCCNC(=O)COC 1626a_200011904461_100000210968 [1,1,0,0,0,0|1,0,1]=4 3761 B14R0.393 CCCOCCOCCNC(=O)COC 240690a_200011904461_100000210968 [1,1,0,0,0,0|1,0,1]=4 3762 B14R0.393 CCCOCCOCCNC(C)CCC 2230a_200011904461_100000766640 [1,1,0,0,0,0|2,0,0]=4 3763 B14R0.393 CCCOCCOCCNC(C)CCC 270004a_200011904461_100000211909 [1,1,0,0,0,0|2,0,0]=4 3764 B14R0.393 CCCOCCOCCNC(C)CCC 34a_200011904461_100000766640 [1,1,0,0,0,0|2,0,0]=4 3765 B14R0.393 CCCOCCOCCNC(C)COC 2230a_200011904461_100000765312 [1,1,0,0,0,0|1,0,0]=3 3766 B14R0.393 CCCOCCOCCNC(C)COC 270004a_200011904461_100000749346 [1,1,0,0,0,0|1,0,0]=3 3767 B14R0.393 CCCOCCOCCNC(C)COC 34a_200011904461_100000765312 [1,1,0,0,0,0|1,0,0]=3 3768 B14R0.393 CCCOCCOCCNC(C)CSC 270004a_200011904461_100011216314 [1,1,0,0,0,0|1,1,0]=4 3769 B14R0.393 CCC[C@H](N)CCOCCOCCOC 34a_100015193777_100000695917 [1,1,0,0,0,0|1,0,0]=3 3770 B14R0.393 CCNC(=O)CCOCCOCCOC 11a_100015525214_100012278103 [1,1,0,0,0,0|2,0,0]=4 3771 B14R0.393 CCNC(=O)CCOCCOCCOC 240690a_100015525214_100012278103 [1,1,0,0,0,0|2,0,0]=4 3772 B14R0.393 CCNC(=O)CCOCCOCCOC 527a_100015525214_100012278103 [1,1,0,0,0,0|2,0,0]=4 3773 B14R0.393 CCNC(=O)CCOCCOCCOC 7a_100011215163_100000737597 [1,1,0,0,0,0|2,0,0]=4 3774 B14R0.393 CCOC(=O)CCOCCOCCOC 34a_100010737887_200000210301 [1,1,0,0,0,0|2,0,0]=4 3775 B14R0.393 CCOC(=O)CCOCCOCCOC 34a_100011215163_100000765890 [1,1,0,0,0,0|2,0,0]=4 3776 B14R0.393 CCOC(=O)CCOCCOCCOC 7a_100010737887_200000210301 [1,1,0,0,0,0|2,0,0]=4 3777 B14R0.393 CCOC(=O)CCOCCOCCOC 7a_100011215163_100011206558 [1,1,0,0,0,0|2,0,0]=4 3778 B14R0.393 CCOC(=O)CCOCCOCCO[13CH3] 34a_100010737887_200025704644 [1,1,0,0,0,0|2,0,0]=4 3779 B14R0.393 CCOC(=O)CCOCCOCCO[13CH3] 7a_100010737887_200025704644 [1,1,0,0,0,0|2,0,0]=4 3780 B14R0.393 COCC(=O)NCCOCCOCCO 240690a_100011998139_100000210968 [1,1,0,0,0,0|1,0,1]=4 3781 B14R0.393 COCC(C)NCCOCCOCCO 2230a_100011998139_100000765312 [1,1,0,0,0,0|1,0,0]=3 3782 B14R0.393 COCC(C)NCCOCCOCCO 270004a_100011998139_100000749346 [1,1,0,0,0,0|1,0,0]=3 3783 B14R0.393 COCC(C)NCCOCCOCCO 34a_100011998139_100000765312 [1,1,0,0,0,0|1,0,0]=3 3784 B14R0.393 COCC(C)OCCOCCOCCBr 34a_100010132937_100000765312 [1,1,0,0,0,0|1,0,0]=3 3785 B14R0.393 COCC(C)OCCOCCOCCBr 7a_100010132937_100000765312 [1,1,0,0,0,0|1,0,0]=3 3786 B14R0.393 COCC(C)OCCOCCOCCCl 34a_100000032323_100000765312 [1,1,0,0,0,0|1,0,0]=3 3787 B14R0.393 COCC(C)OCCOCCOCCCl 7a_100000032323_100000765312 [1,1,0,0,0,0|1,0,0]=3 3788 B14R0.393 COCC(C)OCCOCCOCCN 34a_100011998139_100000765312 [1,1,0,0,0,0|1,0,0]=3 3789 B14R0.393 COCC(C)SCCOCCOCCO 62a_100000032323_100000765312 [1,1,0,0,0,0|0,1,0]=3 3790 B14R0.393 COCC(C)SCCOCCOCCO 62a_100000765312_100000032323 [1,1,0,0,0,0|0,1,0]=3 3791 B14R0.393 COCCCOCCCOC(C)COC 34a_200011215475_100000765312 [1,1,0,0,0,0|2,0,0]=4 3792 B14R0.393 COCCCOCCCOC(C)COC 7a_200011215475_100000765312 [1,1,0,0,0,0|2,0,0]=4 3793 B14R0.393 COCCOCCCNCC(O)COC 2230a_100000756049_100011216529 [1,1,0,0,0,0|2,0,0]=4 3794 B14R0.393 COCCOCCCNCC(O)COC 34a_100000206027_100011215053 [1,1,0,0,0,0|2,0,0]=4 3795 B14R0.393 COCCOCCCNCC(O)COC 34a_100000756049_100011216529 [1,1,0,0,0,0|2,0,0]=4 3796 B14R0.393 COCCOCCCOCC(N)COC 34a_100000724102_100011216529 [1,1,0,0,0,0|2,0,0]=4 3797 B14R0.393 COCCOCCCSCC(O)COC 62a_100011215053_100011216529 [1,1,0,0,0,0|2,0,0]=4 3798 B14R0.393 COCCOCCCSCC(O)COC 62a_100011216529_100011215053 [1,1,0,0,0,0|2,0,0]=4 3799 B14R0.393 COCCOCCOCCC(=O)CCF 1458a_100012278103_100011217306 [1,1,0,0,0,0|2,0,0]=4 3800 B14R0.393 COCCOCCOCCC(=O)CCO 1458a_100011216618_100013367474 [1,1,0,0,0,0|1,0,0]=3 3801 B14R0.393 COCCOCCOCCC(=O)CCO 1458a_100012278103_100000211926 [1,1,0,0,0,0|1,0,0]=3 3802 B14R0.393 COCCOCCOCCC(=O)COC 1458a_100000210968_100013367474 [1,1,0,0,0,0|0,0,1]=3 3803 B14R0.393 COCCOCCOCCC(=O)CSC 1458a_100000184570_100013367474 [1,1,0,0,0,0|0,1,1]=4 3804 B14R0.393 COCCOCCOCCN(C)CCF 2230a_200000716983_100011217306 [1,1,0,0,0,0|2,0,0]=4 3805 B14R0.393 COCCOCCOCCN(C)CCF 269982a_200000716983_100011217306 [1,1,0,0,0,0|2,0,0]=4 3806 B14R0.393 COCCOCCOCCN(C)CCF 34a_200000716983_100011217306 [1,1,0,0,0,0|2,0,0]=4 3807 B14R0.393 COCCOCCOCCN(C)CCO 2230a_100000210263_100013367474 [1,1,0,0,0,0|1,0,0]=3 3808 B14R0.393 COCCOCCOCCN(C)CCO 2230a_200000716983_100000211926 [1,1,0,0,0,0|1,0,0]=3 3809 B14R0.393 COCCOCCOCCN(C)CCO 269982a_100000210263_100013367474 [1,1,0,0,0,0|1,0,0]=3 3810 B14R0.393 COCCOCCOCCN(C)CCO 269982a_200000716983_100000211926 [1,1,0,0,0,0|1,0,0]=3 3811 B14R0.393 COCCOCCOCCN(C)CCO 34a_200000716983_100000211926 [1,1,0,0,0,0|1,0,0]=3 3812 B14R0.393 COCCOCCOCCN(C)COC 2230a_200000716983_100000766300 [1,1,0,0,0,0|1,0,0]=3 3813 B14R0.393 COCCOCCOCCN(C)COC 269982a_200000716983_100000766300 [1,1,0,0,0,0|1,0,0]=3 3814 B14R0.393 COCCOCCOCCN(C)CSC 2230a_200000716983_100011218213 [1,1,0,0,0,0|1,1,0]=4 3815 B14R0.393 COCCOCCOCCN(C)CSC 269982a_200000716983_100011218213 [1,1,0,0,0,0|1,1,0]=4 3816 B14R0.393 COCCOCCOCCN(C)CSC 34a_200000716983_100011218213 [1,1,0,0,0,0|1,1,0]=4 3817 B14R0.393 COC[C@@H](C)NCCOCCOCCO 2230a_100000764878_100000032323 [1,1,0,0,0,0|1,0,0]=3 3818 B14R0.393 COC[C@@H](C)OCCCCCCCCO 34a_100011934205_100000033203 [1,1,0,0,0,0|2,0,0]=4 3819 B14R0.393 COC[C@@H](C)OCCOCCOCCO 34a_100011934205_100000032323 [1,1,0,0,0,0|0,0,0]=2 3820 B14R0.393 CSCC(C)NCCOCCOCCO 270004a_100011998139_100011216314 [1,1,0,0,0,0|1,1,0]=4 3821 B14R0.394 C=C(Br)CCOCCOCCOCCO 34a_100009813270_100000032323 [1,1,0,0,0,0|1,0,1]=4 3822 B14R0.394 C=C(C)CCNCCOCCOCCC 2230a_200011904461_100000730704 [1,1,0,0,0,0|2,0,0]=4 3823 B14R0.394 C=C(C)CCNCCOCCOCCC 34a_200011904461_100000730704 [1,1,0,0,0,0|2,0,0]=4 3824 B14R0.394 C=C(C)CCNCCOCCOCCO 2230a_100011998139_100000730704 [1,1,0,0,0,0|2,0,0]=4 3825 B14R0.394 C=C(C)CCNCCOCCOCCO 34a_100011998139_100000730704 [1,1,0,0,0,0|2,0,0]=4 3826 B14R0.394 C=C(C)CCOCCCCOCCCC 34a_200000760531_100000730704 [1,1,0,0,0,0|2,0,0]=4 3827 B14R0.394 C=C(C)CCOCCCCOCCCC 7a_200000760531_100000730704 [1,1,0,0,0,0|2,0,0]=4 3828 B14R0.394 C=C(C)CCOCCOCCCCCC 34a_100000691444_100000730704 [1,1,0,0,0,0|2,0,0]=4 3829 B14R0.394 C=C(C)CCOCCOCCCCCC 7a_100000691444_100000730704 [1,1,0,0,0,0|2,0,0]=4 3830 B14R0.394 C=C(C)CCOCCOCCOCCBr 34a_100010132937_100000730704 [1,1,0,0,0,0|2,0,0]=4 3831 B14R0.394 C=C(C)CCOCCOCCOCCBr 7a_100010132937_100000730704 [1,1,0,0,0,0|2,0,0]=4 3832 B14R0.394 C=C(C)CCOCCOCCOCCCl 34a_100000032323_100000730704 [1,1,0,0,0,0|2,0,0]=4 3833 B14R0.394 C=C(C)CCOCCOCCOCCCl 7a_100000032323_100000730704 [1,1,0,0,0,0|2,0,0]=4 3834 B14R0.394 C=C(C)CCOCCOCCOCCN 34a_100011998139_100000730704 [1,1,0,0,0,0|2,0,0]=4 3835 B14R0.394 C=C(C)CCOCCOCCOCCO 34a_100000764851_100000032323 [1,1,0,0,0,0|1,0,0]=3 3836 B14R0.394 C=C(C)CCSCCOCCOCCO 62a_100000032323_100000730704 [1,1,0,0,0,0|1,1,0]=4 3837 B14R0.394 C=C(C)CCSCCOCCOCCO 62a_100000730704_100000032323 [1,1,0,0,0,0|1,1,0]=4 3838 B14R0.394 C=C(C)CNCCOCCOCCOC 2230a_100012028300_100000748629 [1,1,0,0,0,0|1,0,1]=4 3839 B14R0.394 C=C(C)CNCCOCCOCCOC 34a_100012028300_100000748629 [1,1,0,0,0,0|1,0,1]=4 3840 B14R0.394 C=C(C)COCCOCCOCCCC 34a_100011215186_100000748629 [1,1,0,0,0,0|1,0,1]=4 3841 B14R0.394 C=C(C)COCCOCCOCCCC 7a_100011215186_100000748629 [1,1,0,0,0,0|1,0,1]=4 3842 B14R0.394 C=C(C)COCCOCCOCCNC 34a_200014138305_100000748629 [1,1,0,0,0,0|1,0,1]=4 3843 B14R0.394 C=C(C)COCCOCCOCCOC 34a_100000210245_100013367474 [1,1,0,0,0,0|0,0,1]=3 3844 B14R0.394 C=C(C)COCCOCCOCCOC 34a_100000688194_100000748629 [1,1,0,0,0,0|0,0,1]=3 3845 B14R0.394 C=C(C)COCCOCCOCCOC 7a_100000688194_100000748629 [1,1,0,0,0,0|0,0,1]=3 3846 B14R0.394 C=C(C)CSCCOCCOCCOC 62a_100000748629_100013367474 [1,1,0,0,0,0|0,1,1]=4 3847 B14R0.394 C=C(C)CSCCOCCOCCOC 62a_100013367474_100000211660 [1,1,0,0,0,0|0,1,1]=4 3848 B14R0.394 C=C(F)COCCOCCOCCOC 34a_100000688194_100009893438 [1,1,0,0,0,0|0,0,2]=4 3849 B14R0.394 C=C(F)COCCOCCOCCOC 34a_200010262243_100013367474 [1,1,0,0,0,0|0,0,2]=4 3850 B14R0.394 C=C(F)COCCOCCOCCOC 7a_100000688194_100000042424 [1,1,0,0,0,0|0,0,2]=4 3851 B14R0.394 CC(=CCOCCOCCOCCO)C 34a_100000753907_100000032323 [1,1,0,0,0,0|1,0,1]=4 3852 B14R0.394 CC(=O)CCOCCOCCOCCBr 7a_100010132937_100000053229 [1,1,0,0,0,0|2,0,0]=4 3853 B14R0.394 CC(=O)CCOCCOCCOCCCl 7a_100000032323_100000053229 [1,1,0,0,0,0|2,0,0]=4 3854 B14R0.394 CC(=O)CCOCCOCCOCCO 1458a_100000070787_100010166562 [1,1,0,0,0,0|1,0,0]=3 3855 B14R0.394 CC(=O)CCOCCOCCOCCO 1458a_100010977405_200000210301 [1,1,0,0,0,0|1,0,0]=3 3856 B14R0.394 CC(=O)CCOCCOCCOCCO 34a_100000759926_100000032323 [1,1,0,0,0,0|1,0,0]=3 3857 B14R0.394 CC(=O)CCOCCOCCOCCO 7a_100000759926_100000032323 [1,1,0,0,0,0|1,0,0]=3 3858 B14R0.394 CC(=O)CCSCCOCCOCCO 62a_100000032323_100000053229 [1,1,0,0,0,0|1,1,0]=4 3859 B14R0.394 CC(=O)CCSCCOCCOCCO 62a_100000053229_100000032323 [1,1,0,0,0,0|1,1,0]=4 3860 B14R0.394 CC(Br)CCOCCOCCOCCO 34a_100009893172_100000032323 [1,1,0,0,0,0|1,0,0]=3 3861 B14R0.394 CC(C)CCCCCOCCOCCO 34a_100011995859_100000692535 [1,1,0,0,0,0|2,0,0]=4 3862 B14R0.394 CC(C)CCCCCOCCOCCO 7a_100011995859_100011215305 [1,1,0,0,0,0|2,0,0]=4 3863 B14R0.394 CC(C)CCNCCOCCOCCO 2230a_100011998139_100000210312 [1,1,0,0,0,0|2,0,0]=4 3864 B14R0.394 CC(C)CCNCCOCCOCCO 269862a_100011998139_100000185833 [1,1,0,0,0,0|2,0,0]=4 3865 B14R0.394 CC(C)CCNCCOCCOCCO 34a_100011998139_100000210312 [1,1,0,0,0,0|2,0,0]=4 3866 B14R0.394 CC(C)CCOCCOCCOCCBr 34a_100010132937_100000210312 [1,1,0,0,0,0|2,0,0]=4 3867 B14R0.394 CC(C)CCOCCOCCOCCBr 7a_100010132937_100000210626 [1,1,0,0,0,0|2,0,0]=4 3868 B14R0.394 CC(C)CCOCCOCCOCCCl 34a_100000032323_100000210312 [1,1,0,0,0,0|2,0,0]=4 3869 B14R0.394 CC(C)CCOCCOCCOCCCl 7a_100000032323_100000210626 [1,1,0,0,0,0|2,0,0]=4 3870 B14R0.394 CC(C)CCOCCOCCOCCN 34a_100011998139_100000210312 [1,1,0,0,0,0|2,0,0]=4 3871 B14R0.394 CC(C)CCOCCOCCOCCO 34a_100000210254_100000032323 [1,1,0,0,0,0|1,0,0]=3 3872 B14R0.394 CC(C)CCOCCOCCOCCO 7a_100000210254_100000032323 [1,1,0,0,0,0|1,0,0]=3 3873 B14R0.394 CC(C)CCSCCOCCOCCO 62a_100000032323_100000210312 [1,1,0,0,0,0|1,1,0]=4 3874 B14R0.394 CC(C)CCSCCOCCOCCO 62a_100000210312_100000032323 [1,1,0,0,0,0|1,1,0]=4 3875 B14R0.394 CC(C)COCCOCCOCCCN 34a_100011996194_100000210624 [1,1,0,0,0,0|2,0,0]=4 3876 B14R0.394 CC(O)CCNCCOCCOCCO 2230a_100011998139_100012276601 [1,1,0,0,0,0|2,0,0]=4 3877 B14R0.394 CC(O)CCNCCOCCOCCO 2230a_200000755665_100000032323 [1,1,0,0,0,0|2,0,0]=4 3878 B14R0.394 CC(O)CCNCCOCCOCCO 34a_100011998139_100012276601 [1,1,0,0,0,0|2,0,0]=4 3879 B14R0.394 CC(O)CCOCCOCCOCCBr 34a_100010132937_100012276601 [1,1,0,0,0,0|2,0,0]=4 3880 B14R0.394 CC(O)CCOCCOCCOCCBr 7a_100010132937_100012276601 [1,1,0,0,0,0|2,0,0]=4 3881 B14R0.394 CC(O)CCOCCOCCOCCCl 34a_100000032323_100012276601 [1,1,0,0,0,0|2,0,0]=4 3882 B14R0.394 CC(O)CCOCCOCCOCCCl 7a_100000032323_100012276601 [1,1,0,0,0,0|2,0,0]=4 3883 B14R0.394 CC(O)CCOCCOCCOCCN 34a_100011998139_100012276601 [1,1,0,0,0,0|2,0,0]=4 3884 B14R0.394 CC(O)CCSCCOCCOCCO 62a_100000032323_100012276601 [1,1,0,0,0,0|1,1,0]=4 3885 B14R0.394 CC(O)CCSCCOCCOCCO 62a_100012276601_100000032323 [1,1,0,0,0,0|1,1,0]=4 3886 B14R0.394 CC(O)COCCOCCOCCCN 34a_100011996194_100011218427 [1,1,0,0,0,0|2,0,0]=4 3887 B14R0.394 CCCCCCCOCCOCC(C)C 34a_100000703358_100000210614 [1,1,0,0,0,0|2,0,0]=4 3888 B14R0.394 CCCCCCCOCCOCC(C)C 7a_100000703358_100000210614 [1,1,0,0,0,0|2,0,0]=4 3889 B14R0.394 CCCCCCOCCOCCC(=O)C 7a_100000691444_100000053229 [1,1,0,0,0,0|2,0,0]=4 3890 B14R0.394 CCCCCCOCCOCCC(C)C 34a_100000691444_100000210312 [1,1,0,0,0,0|2,0,0]=4 3891 B14R0.394 CCCCCCOCCOCCC(C)C 7a_100000691444_100000210626 [1,1,0,0,0,0|2,0,0]=4 3892 B14R0.394 CCCCCCOCCOCCC(C)O 34a_100000691444_100012276601 [1,1,0,0,0,0|2,0,0]=4 3893 B14R0.394 CCCCCCOCCOCCC(C)O 7a_100000691444_100012276601 [1,1,0,0,0,0|2,0,0]=4 3894 B14R0.394 CCCCCCOCCOCCN(C)C 7a_100000691444_100000755713 [1,1,0,0,0,0|2,0,0]=4 3895 B14R0.394 CCCCOCCCCOCCC(=O)C 7a_200000760531_100000053229 [1,1,0,0,0,0|2,0,0]=4 3896 B14R0.394 CCCCOCCCCOCCC(C)C 34a_200000760531_100000210312 [1,1,0,0,0,0|2,0,0]=4 3897 B14R0.394 CCCCOCCCCOCCC(C)C 7a_200000760531_100000210626 [1,1,0,0,0,0|2,0,0]=4 3898 B14R0.394 CCCCOCCCCOCCC(C)O 34a_200000760531_100012276601 [1,1,0,0,0,0|2,0,0]=4 3899 B14R0.394 CCCCOCCCCOCCC(C)O 7a_200000760531_100012276601 [1,1,0,0,0,0|2,0,0]=4 3900 B14R0.394 CCCCOCCCCOCCN(C)C 7a_200000760531_100000755713 [1,1,0,0,0,0|2,0,0]=4 3901 B14R0.394 CCCCOCCOCCCCC(=O)C 34a_100000210238_100009817362 [1,1,0,0,0,0|2,0,0]=4 3902 B14R0.394 CCCCOCCOCCCCC(=O)C 7a_100000210238_100000735457 [1,1,0,0,0,0|2,0,0]=4 3903 B14R0.394 CCCCOCCOCCCCC(C)C 34a_100000210238_100011216152 [1,1,0,0,0,0|2,0,0]=4 3904 B14R0.394 CCCCOCCOCCCCC(C)C 34a_100011214890_100000743108 [1,1,0,0,0,0|2,0,0]=4 3905 B14R0.394 CCCCOCCOCCCCC(C)C 7a_100000210238_100011216152 [1,1,0,0,0,0|2,0,0]=4 3906 B14R0.394 CCCCOCCOCCCCC(C)C 7a_100011214890_100000743108 [1,1,0,0,0,0|2,0,0]=4 3907 B14R0.394 CCCCOCCOCCNCC(C)C 34a_100015185251_100000743108 [1,1,0,0,0,0|2,0,0]=4 3908 B14R0.394 CCCCOCCOCCOCC(C)C 34a_100000703358_100000743108 [1,1,0,0,0,0|1,0,0]=3 3909 B14R0.394 CCCCOCCOCCOCC(C)C 34a_100011215186_100000210624 [1,1,0,0,0,0|1,0,0]=3 3910 B14R0.394 CCCCOCCOCCOCC(C)C 7a_100000703358_100000743108 [1,1,0,0,0,0|1,0,0]=3 3911 B14R0.394 CCCCOCCOCCOCC(C)C 7a_100011215186_100000210760 [1,1,0,0,0,0|1,0,0]=3 3912 B14R0.394 CCCCOCCOCCOCC(C)O 34a_100011215186_100011218427 [1,1,0,0,0,0|1,0,0]=3 3913 B14R0.394 CCCCOCCOCCOCC(C)O 7a_100011215186_100011218427 [1,1,0,0,0,0|1,0,0]=3 3914 B14R0.394 CCCCOCCOCCOCC(F)F 34a_100000210238_200012177212 [1,1,0,0,0,0|2,0,0]=4 3915 B14R0.394 CCCCOCCOCCOCC(F)F 34a_100000704375_100000743108 [1,1,0,0,0,0|2,0,0]=4 3916 B14R0.394 CCCCOCCOCCOCC(F)F 34a_100010782186_100000210210 [1,1,0,0,0,0|2,0,0]=4 3917 B14R0.394 CCCCOCCOCCOCC(F)F 34a_100011215186_100011934356 [1,1,0,0,0,0|2,0,0]=4 3918 B14R0.394 CCCCOCCOCCOCC(F)F 7a_100000210238_200012177212 [1,1,0,0,0,0|2,0,0]=4 3919 B14R0.394 CCCCOCCOCCOCC(F)F 7a_100000704375_100000743108 [1,1,0,0,0,0|2,0,0]=4 3920 B14R0.394 CCCCOCCOCCOCC(F)F 7a_100010782186_100000210211 [1,1,0,0,0,0|2,0,0]=4 3921 B14R0.394 CCCCOCCOCCOCC(F)F 7a_100011215186_100011934356 [1,1,0,0,0,0|2,0,0]=4 3922 B14R0.394 CCCCOCCOCCOC[C@@H](C)O 34a_100011215186_100009817552 [1,1,0,0,0,0|1,0,0]=3 3923 B14R0.394 CCCCOCCOCCOC[C@@H](C)O 7a_100011215186_100009817552 [1,1,0,0,0,0|1,0,0]=3 3924 B14R0.394 CCCCOCCOCCSCC(C)C 34a_200000230437_100000743108 [1,1,0,0,0,0|1,1,0]=4 3925 B14R0.394 CCCCOCCOCCSCC(C)C 7a_200000230437_100000743108 [1,1,0,0,0,0|1,1,0]=4 3926 B14R0.394 CCCOCCOCCCCCC(C)C 34a_100000752267_100000210682 [1,1,0,0,0,0|2,0,0]=4 3927 B14R0.394 CCCOCCOCCCCCC(C)C 34a_100011995859_100011215938 [1,1,0,0,0,0|2,0,0]=4 3928 B14R0.394 CCCOCCOCCCCCC(C)C 7a_100000752267_100000210682 [1,1,0,0,0,0|2,0,0]=4 3929 B14R0.394 CCCOCCOCCCCCC(C)C 7a_100011995859_100011215938 [1,1,0,0,0,0|2,0,0]=4 3930 B14R0.394 CCCOCCOCCNCCC(C)C 2230a_200011904461_100000210312 [1,1,0,0,0,0|2,0,0]=4 3931 B14R0.394 CCCOCCOCCNCCC(C)C 269862a_200011904461_100000185833 [1,1,0,0,0,0|2,0,0]=4 3932 B14R0.394 CCCOCCOCCNCCC(C)C 34a_200011904461_100000210312 [1,1,0,0,0,0|2,0,0]=4 3933 B14R0.394 CCCOCCOCCNCCC(C)O 2230a_200011904461_100012276601 [1,1,0,0,0,0|2,0,0]=4 3934 B14R0.394 CCCOCCOCCNCCC(C)O 34a_200011904461_100012276601 [1,1,0,0,0,0|2,0,0]=4 3935 B14R0.394 CN(C)CCOCCOCCOCCBr 7a_100010132937_100000755713 [1,1,0,0,0,0|2,0,0]=4 3936 B14R0.394 CN(C)CCOCCOCCOCCCl 7a_100000032323_100000755713 [1,1,0,0,0,0|2,0,0]=4 3937 B14R0.394 CN(C)CCOCCOCCOCCO 2230a_100036875364_200000210301 [1,1,0,0,0,0|1,0,0]=3 3938 B14R0.394 CN(C)CCOCCOCCOCCO 2230a_100102631434_100010166562 [1,1,0,0,0,0|1,0,0]=3 3939 B14R0.394 CN(C)CCOCCOCCOCCO 269982a_100036875364_200000210301 [1,1,0,0,0,0|1,0,0]=3 3940 B14R0.394 CN(C)CCOCCOCCOCCO 269982a_100102631434_100010166562 [1,1,0,0,0,0|1,0,0]=3 3941 B14R0.394 CN(C)CCOCCOCCOCCO 34a_100036875364_200000210301 [1,1,0,0,0,0|1,0,0]=3 3942 B14R0.394 CN(C)CCSCCOCCOCCO 62a_100000032323_100000755713 [1,1,0,0,0,0|1,1,0]=4 3943 B14R0.394 CN([13CH3])CCOCCOCCOCCO 2230a_100036875364_200025704644 [1,1,0,0,0,0|1,0,0]=3 3944 B14R0.394 CN([13CH3])CCOCCOCCOCCO 269982a_100036875364_200025704644 [1,1,0,0,0,0|1,0,0]=3 3945 B14R0.394 CN([13CH3])CCOCCOCCOCCO 34a_100036875364_200025704644 [1,1,0,0,0,0|1,0,0]=3 3946 B14R0.394 CNCCOCCOCCCCC(=O)C 34a_100000228057_100009817362 [1,1,0,0,0,0|2,0,0]=4 3947 B14R0.394 CNCCOCCOCCCCC(C)C 34a_100000228057_100011216152 [1,1,0,0,0,0|2,0,0]=4 3948 B14R0.394 CNCCOCCOCCOCC(=O)O 269956a_100010423269_200000210301 [1,1,0,0,0,0|1,0,1]=4 3949 B14R0.394 CNCCOCCOCCOCC(C)C 34a_200014138305_100000210624 [1,1,0,0,0,0|1,0,0]=3 3950 B14R0.394 CNCCOCCOCCOCC(C)O 34a_200014138305_100011218427 [1,1,0,0,0,0|1,0,0]=3 3951 B14R0.394 CNCCOCCOCCOCC(F)F 34a_100000228057_200012177212 [1,1,0,0,0,0|2,0,0]=4 3952 B14R0.394 CNCCOCCOCCOCC(F)F 34a_200014138305_100011934356 [1,1,0,0,0,0|2,0,0]=4 3953 B14R0.394 CNCCOCCOCCOC[C@@H](C)O 34a_200014138305_100009817552 [1,1,0,0,0,0|1,0,0]=3 3954 B14R0.394 COCCCCOCCCCCC(C)C 34a_100000740925_100000210682 [1,1,0,0,0,0|2,0,0]=4 3955 B14R0.394 COCCCCOCCCCCC(C)C 34a_100011995859_100000755781 [1,1,0,0,0,0|2,0,0]=4 3956 B14R0.394 COCCCCOCCCCCC(C)C 7a_100011995859_100000730899 [1,1,0,0,0,0|2,0,0]=4 3957 B14R0.394 COCCNCCOCCOCC(=O)O 269956a_100009854275_100000233755 [1,1,0,0,0,0|1,0,1]=4 3958 B14R0.394 COCCOCCCCCCCC(C)C 34a_200000210741_100011201679 [1,1,0,0,0,0|2,0,0]=4 3959 B14R0.394 COCCOCCCCCCCC(C)C 7a_200000210741_100000233755 [1,1,0,0,0,0|2,0,0]=4 3960 B14R0.394 COCCOCCNCCCCC(=O)C 34a_100000745349_100009817362 [1,1,0,0,0,0|2,0,0]=4 3961 B14R0.394 COCCOCCNCCCCC(C)C 2230a_100000745349_100011216152 [1,1,0,0,0,0|2,0,0]=4 3962 B14R0.394 COCCOCCNCCCCC(C)C 34a_100000745349_100011216152 [1,1,0,0,0,0|2,0,0]=4 3963 B14R0.394 COCCOCCNCCOCC(=O)O 269956a_100000700818_100000695917 [1,1,0,0,0,0|1,0,1]=4 3964 B14R0.394 COCCOCCNCCOCC(F)F 2230a_100000745349_200012177212 [1,1,0,0,0,0|2,0,0]=4 3965 B14R0.394 COCCOCCNCCOCC(F)F 34a_100000745349_200012177212 [1,1,0,0,0,0|2,0,0]=4 3966 B14R0.394 COCCOCCOCCCCB(O)O 34a_100011215163_200009817182 [1,1,0,0,0,0|2,0,0]=4 3967 B14R0.394 COCCOCCOCCCCB(O)O 7a_100011215163_200009817182 [1,1,0,0,0,0|2,0,0]=4 3968 B14R0.394 COCCOCCOCCCCC(=O)C 34a_100011215163_100009817362 [1,1,0,0,0,0|1,0,0]=3 3969 B14R0.394 COCCOCCOCCCCC(=O)C 7a_100011215163_100000735457 [1,1,0,0,0,0|1,0,0]=3 3970 B14R0.394 COCCOCCOCCCCC(=O)N 34a_100012022536_100000695917 [1,1,0,0,0,0|2,0,0]=4 3971 B14R0.394 COCCOCCOCCCCC(=O)N 7a_100012022536_100000695917 [1,1,0,0,0,0|2,0,0]=4 3972 B14R0.394 COCCOCCOCCCCC(C)C 34a_100011214890_100000695917 [1,1,0,0,0,0|1,0,0]=3 3973 B14R0.394 COCCOCCOCCCCC(C)C 34a_100011215163_100011216152 [1,1,0,0,0,0|1,0,0]=3 3974 B14R0.394 COCCOCCOCCCCC(C)C 7a_100011214890_100000695917 [1,1,0,0,0,0|1,0,0]=3 3975 B14R0.394 COCCOCCOCCCCC(C)C 7a_100011215163_100011216152 [1,1,0,0,0,0|1,0,0]=3 3976 B14R0.394 COCCOCCOCCCC[N+](=O)[O-] 34a_200015379883_100000695917 [1,1,0,0,0,0|2,0,0]=4 3977 B14R0.394 COCCOCCOCCCC[N+](=O)[O-] 7a_200015379883_100000695917 [1,1,0,0,0,0|2,0,0]=4 3978 B14R0.394 COCCOCCOCCCNC(=O)C 34a_100000752032_100000695917 [1,1,0,0,0,0|2,0,0]=4 3979 B14R0.394 COCCOCCOCCCNC(C)C 34a_100000182298_100000695917 [1,1,0,0,0,0|2,0,0]=4 3980 B14R0.394 COCCOCCOCCCOC(=O)C 34a_100011215163_100000042594 [1,1,0,0,0,0|2,0,0]=4 3981 B14R0.394 COCCOCCOCCCOC(=O)C 7a_100011215163_100000042594 [1,1,0,0,0,0|2,0,0]=4 3982 B14R0.394 COCCOCCOCCCOC(=S)C 34a_100011215163_200135323944 [1,1,0,0,0,0|2,0,0]=4 3983 B14R0.394 COCCOCCOCCCOC(=S)C 7a_100011215163_200135323944 [1,1,0,0,0,0|2,0,0]=4 3984 B14R0.394 COCCOCCOCCCSC(=O)C 34a_100011215163_100000038929 [1,1,0,0,0,0|2,0,0]=4 3985 B14R0.394 COCCOCCOCCCSC(=O)C 7a_100011215163_100000038929 [1,1,0,0,0,0|2,0,0]=4 3986 B14R0.394 COCCOCCOCCNCC(=O)O 269956a_100016091260_100013367474 [1,1,0,0,0,0|1,0,1]=4 3987 B14R0.394 COCCOCCOCCNCC(C)C 2230a_100000210953_100013367474 [1,1,0,0,0,0|1,0,0]=3 3988 B14R0.394 COCCOCCOCCNCC(C)C 2230a_100012028300_100000210760 [1,1,0,0,0,0|1,0,0]=3 3989 B14R0.394 COCCOCCOCCNCC(C)C 270004a_100012028300_100000210432 [1,1,0,0,0,0|1,0,0]=3 3990 B14R0.394 COCCOCCOCCNCC(C)C 34a_100000210953_100013367474 [1,1,0,0,0,0|1,0,0]=3 3991 B14R0.394 COCCOCCOCCNCC(C)C 34a_100012028300_100000210624 [1,1,0,0,0,0|1,0,0]=3 3992 B14R0.394 COCCOCCOCCNCC(C)C 34a_100015185251_100000695917 [1,1,0,0,0,0|1,0,0]=3 3993 B14R0.394 COCCOCCOCCNCC(C)O 2230a_100000210904_100013367474 [1,1,0,0,0,0|1,0,0]=3 3994 B14R0.394 COCCOCCOCCNCC(C)O 2230a_100012028300_100011218427 [1,1,0,0,0,0|1,0,0]=3 3995 B14R0.394 COCCOCCOCCNCC(C)O 34a_100000210904_100013367474 [1,1,0,0,0,0|1,0,0]=3 3996 B14R0.394 COCCOCCOCCNCC(C)O 34a_100012028300_100011218427 [1,1,0,0,0,0|1,0,0]=3 3997 B14R0.394 COCCOCCOCCNCC(F)F 2230a_100012028300_100011934356 [1,1,0,0,0,0|2,0,0]=4 3998 B14R0.394 COCCOCCOCCNCC(F)F 34a_100000765723_100013367474 [1,1,0,0,0,0|2,0,0]=4 3999 B14R0.394 COCCOCCOCCNCC(F)F 34a_100012028300_100011934356 [1,1,0,0,0,0|2,0,0]=4 4000 B14R0.394 COCCOCCOCCNC[C@@H](C)O 2230a_100012028300_100009817552 [1,1,0,0,0,0|1,0,0]=3 4001 B14R0.394 COCCOCCOCCNC[C@@H](C)O 34a_100012028300_100009817552 [1,1,0,0,0,0|1,0,0]=3 4002 B14R0.394 COCCOCCOCCOCC(=O)C 1458a_100012826494_200000210301 [1,1,0,0,0,0|0,0,1]=3 4003 B14R0.394 COCCOCCOCCOCC(=O)C 34a_100000211253_100013367474 [1,1,0,0,0,0|0,0,1]=3 4004 B14R0.394 COCCOCCOCCOCC(=O)N 34a_100000688194_100000187820 [1,1,0,0,0,0|0,0,2]=4 4005 B14R0.394 COCCOCCOCCOCC(=O)N 34a_100011215163_100000076697 [1,1,0,0,0,0|0,0,2]=4 4006 B14R0.394 COCCOCCOCCOCC(=O)N 7a_100000688194_100000187820 [1,1,0,0,0,0|0,0,2]=4 4007 B14R0.394 COCCOCCOCCOCC(=O)N 7a_100011215163_100000076697 [1,1,0,0,0,0|0,0,2]=4 4008 B14R0.394 COCCOCCOCCOCC(=O)[13CH3] 1458a_100012826494_200025704644 [1,1,0,0,0,0|0,0,1]=3 4009 B14R0.394 COCCOCCOCCOCC(=O)[O-] 34a_100000688194_100020667443 [1,1,0,0,0,0|0,0,2]=4 4010 B14R0.394 COCCOCCOCCOCC(C)Br 34a_100012180447_100013367474 [1,1,0,0,0,0|0,0,0]=2 4011 B14R0.394 COCCOCCOCCOCC(C)C 34a_100000210257_100013367474 [1,1,0,0,0,0|0,0,0]=2 4012 B14R0.394 COCCOCCOCCOCC(C)C 34a_100000688194_100000210624 [1,1,0,0,0,0|0,0,0]=2 4013 B14R0.394 COCCOCCOCCOCC(C)C 34a_100000703358_100000695917 [1,1,0,0,0,0|0,0,0]=2 4014 B14R0.394 COCCOCCOCCOCC(C)C 7a_100000688194_100000210760 [1,1,0,0,0,0|0,0,0]=2 4015 B14R0.394 COCCOCCOCCOCC(C)C 7a_100000703358_100000695917 [1,1,0,0,0,0|0,0,0]=2 4016 B14R0.394 COCCOCCOCCOCC(C)F 34a_100015925927_100013367474 [1,1,0,0,0,0|0,0,0]=2 4017 B14R0.394 COCCOCCOCCOCC(C)O 34a_100000688194_100011218427 [1,1,0,0,0,0|0,0,0]=2 4018 B14R0.394 COCCOCCOCCOCC(C)O 7a_100000688194_100011218427 [1,1,0,0,0,0|0,0,0]=2 4019 B14R0.394 COCCOCCOCCOCC(F)F 34a_100000688194_100011934356 [1,1,0,0,0,0|1,0,0]=3 4020 B14R0.394 COCCOCCOCCOCC(F)F 34a_100000704375_100000695917 [1,1,0,0,0,0|1,0,0]=3 4021 B14R0.394 COCCOCCOCCOCC(F)F 34a_100000743014_100013367474 [1,1,0,0,0,0|1,0,0]=3 4022 B14R0.394 COCCOCCOCCOCC(F)F 34a_100010782186_100011201679 [1,1,0,0,0,0|1,0,0]=3 4023 B14R0.394 COCCOCCOCCOCC(F)F 34a_100011215163_200012177212 [1,1,0,0,0,0|1,0,0]=3 4024 B14R0.394 COCCOCCOCCOCC(F)F 7a_100000688194_100011934356 [1,1,0,0,0,0|1,0,0]=3 4025 B14R0.394 COCCOCCOCCOCC(F)F 7a_100000704375_100000695917 [1,1,0,0,0,0|1,0,0]=3 4026 B14R0.394 COCCOCCOCCOCC(F)F 7a_100010782186_100000233755 [1,1,0,0,0,0|1,0,0]=3 4027 B14R0.394 COCCOCCOCCOCC(F)F 7a_100011215163_200012177212 [1,1,0,0,0,0|1,0,0]=3 4028 B14R0.394 COCCOCCOCCOC[C@@H](C)Cl 34a_100016084084_100013367474 [1,1,0,0,0,0|0,0,0]=2 4029 B14R0.394 COCCOCCOCCOC[C@@H](C)N 34a_100000737577_100013367474 [1,1,0,0,0,0|0,0,0]=2 4030 B14R0.394 COCCOCCOCCOC[C@@H](C)O 34a_100000688194_100009817552 [1,1,0,0,0,0|0,0,0]=2 4031 B14R0.394 COCCOCCOCCOC[C@@H](C)O 7a_100000688194_100009817552 [1,1,0,0,0,0|0,0,0]=2 4032 B14R0.394 COCCOCCOCCOC[N+](=O)[O-] 34a_100000688194_100000761209 [1,1,0,0,0,0|1,0,1]=4 4033 B14R0.394 COCCOCCOCCSCC(C)C 34a_200000230437_100000695917 [1,1,0,0,0,0|0,1,0]=3 4034 B14R0.394 COCCOCCOCCSCC(C)C 62a_100000210624_100013367474 [1,1,0,0,0,0|0,1,0]=3 4035 B14R0.394 COCCOCCOCCSCC(C)C 62a_100013367474_100000210760 [1,1,0,0,0,0|0,1,0]=3 4036 B14R0.394 COCCOCCOCCSCC(C)C 7a_200000230437_100000695917 [1,1,0,0,0,0|0,1,0]=3 4037 B14R0.394 COCCOCCOCCSCC(C)O 62a_100011218427_100013367474 [1,1,0,0,0,0|0,1,0]=3 4038 B14R0.394 COCCOCCOCCSCC(C)O 62a_100013367474_100011218427 [1,1,0,0,0,0|0,1,0]=3 4039 B14R0.394 COCCOCCOCCSCC(F)F 62a_100011934356_100013367474 [1,1,0,0,0,0|1,1,0]=4 4040 B14R0.394 COCCOCCOCCSCC(F)F 62a_100013367474_100011934356 [1,1,0,0,0,0|1,1,0]=4 4041 B14R0.394 COCCOCCOCCSC[C@@H](C)O 62a_100009817552_100013367474 [1,1,0,0,0,0|0,1,0]=3 4042 B14R0.394 COCCOCCOCCSC[C@@H](C)O 62a_100013367474_100009817552 [1,1,0,0,0,0|0,1,0]=3 4043 B14R0.394 COCCOCCSCCCCC(=O)C 62a_100000695917_100000735457 [1,1,0,0,0,0|1,1,0]=4 4044 B14R0.394 COCCOCCSCCCCC(=O)C 62a_100000735457_100000695917 [1,1,0,0,0,0|1,1,0]=4 4045 B14R0.394 COCCOCCSCCCCC(C)C 62a_100000695917_100011216152 [1,1,0,0,0,0|1,1,0]=4 4046 B14R0.394 COCCOCCSCCCCC(C)C 62a_100011216152_100000695917 [1,1,0,0,0,0|1,1,0]=4 4047 B14R0.394 COCCOCCSCCCCN(C)C 62a_100000695917_100000690147 [1,1,0,0,0,0|1,1,0]=4 4048 B14R0.394 COCCOCCSCCOCC(F)F 62a_100000695917_200012177212 [1,1,0,0,0,0|1,1,0]=4 4049 B14R0.394 COCCOCCSCCOCC(F)F 62a_200012177212_100000695917 [1,1,0,0,0,0|1,1,0]=4 4050 B14R0.394 COCCOCNCCCOCC(C)C 2230a_100000205972_100000231047 [1,1,0,0,0,0|2,0,0]=4 4051 B14R0.394 CSCCOCCOCCOCC(F)F 34a_100010782186_100000212216 [1,1,0,0,0,0|1,1,0]=4 4052 B14R0.394 CSCCOCCOCCOCC(F)F 7a_100010782186_100000212216 [1,1,0,0,0,0|1,1,0]=4 4053 B14R0.394 C[C@@H](N)CCOCCOCCOCCO 34a_100000706166_100000032323 [1,1,0,0,0,0|1,0,0]=3 4054 B14R0.394 C[C@@H](O)COCCOCCOCCCN 34a_100011996194_100009817552 [1,1,0,0,0,0|2,0,0]=4 4055 B14R0.394 NC(=O)CCOCCOCCOCCO 34a_100000757172_100000032323 [1,1,0,0,0,0|2,0,0]=4 4056 B14R0.394 NC(=O)CCOCCOCCOCCO 7a_100000757172_100000032323 [1,1,0,0,0,0|2,0,0]=4 4057 B14R0.394 OCCOCCOCCOCCC(F)F 34a_100103093639_100000032323 [1,1,0,0,0,0|2,0,0]=4 4058 B14R0.394 [13CH3]C(=O)CCOCCOCCOCCO 1458a_100010977405_200025704644 [1,1,0,0,0,0|1,0,0]=3 4059 B14R0.394 [13CH3]NCCOCCOCCOCC(=O)O 269956a_100010423269_200025704644 [1,1,0,0,0,0|1,0,1]=4 4060 B14R0.493 C#CCOC(C)COCCOCCOC 34a_200000093152_100000695917 [1,1,0,0,0,0|0,0,2]=4 4061 B14R0.493 C#CCOC(C)COCCOCCOC 7a_200000093152_100000695917 [1,1,0,0,0,0|0,0,2]=4 4062 B14R0.493 C=C(CNCCOCCOC)OCOC 34a_100000745349_100000042856 [1,1,0,0,0,0|1,0,1]=4 4063 B14R0.493 C=C(COCCOCCCC)OCOC 34a_100000210238_100000042856 [1,1,0,0,0,0|1,0,1]=4 4064 B14R0.493 C=C(COCCOCCNC)OCOC 34a_100000228057_100000042856 [1,1,0,0,0,0|1,0,1]=4 4065 B14R0.493 C=C(COCCOCCOC)OCOC 34a_100011215163_100000042856 [1,1,0,0,0,0|0,0,1]=3 4066 B14R0.493 C=C(CSCCOCCOC)OCOC 62a_100000042856_100000695917 [1,1,0,0,0,0|0,1,1]=4 4067 B14R0.493 C=C(CSCCOCCOC)OCOC 62a_100000695917_100000042856 [1,1,0,0,0,0|0,1,1]=4 4068 B14R0.493 CCCCC(=O)CCOCCOCCO 1458a_100000210183_100000032323 [1,1,0,0,0,0|2,0,0]=4 4069 B14R0.493 CCCCC(=O)CCOCCOCCO 1458a_100009915118_100000210211 [1,1,0,0,0,0|2,0,0]=4 4070 B14R0.493 CCCCC(=O)COCCOCCOC 1458a_100011214951_100000210211 [1,1,0,0,0,0|1,0,1]=4 4071 B14R0.493 CCCCC(C)CCCCOCCOC 34a_200011021034_100011201679 [1,1,0,0,0,0|2,0,0]=4 4072 B14R0.493 CCCCC(C)CCCCOCCOC 7a_200011021034_100000233755 [1,1,0,0,0,0|2,0,0]=4 4073 B14R0.493 CCCCC(C)COCCOCCOC 34a_100011995851_100000695917 [1,1,0,0,0,0|1,0,0]=3 4074 B14R0.493 CCCCC(C)COCCOCCOC 7a_100011995851_100000695917 [1,1,0,0,0,0|1,0,0]=3 4075 B14R0.493 CCCCCCCOC[C@@H](C)OCOC 34a_100016172286_100000210614 [1,1,0,0,0,0|2,0,0]=4 4076 B14R0.493 CCCCCCCOC[C@@H](C)OCOC 7a_100016172286_100000210614 [1,1,0,0,0,0|2,0,0]=4 4077 B14R0.493 CCCCN(C)CCOCCOCCO 2230a_100000207549_100000032323 [1,1,0,0,0,0|2,0,0]=4 4078 B14R0.493 CCCCN(C)CCOCCOCCO 2230a_200014138305_100000210211 [1,1,0,0,0,0|2,0,0]=4 4079 B14R0.493 CCCCN(C)CCOCCOCCO 269982a_100000207549_100000032323 [1,1,0,0,0,0|2,0,0]=4 4080 B14R0.493 CCCCN(C)CCOCCOCCO 269982a_200014138305_100000210211 [1,1,0,0,0,0|2,0,0]=4 4081 B14R0.493 CCCCN(C)CCOCCOCCO 34a_200014138305_100000210210 [1,1,0,0,0,0|2,0,0]=4 4082 B14R0.493 CCCCOCCNCC(C)OCCC 2230a_100015185124_100000743108 [1,1,0,0,0,0|2,0,0]=4 4083 B14R0.493 CCCCOCCNCC(C)OCCC 34a_100015185124_100000743108 [1,1,0,0,0,0|2,0,0]=4 4084 B14R0.493 CCCCOCCOCC(=O)CCOC 1458a_100011216887_100000233755 [1,1,0,0,0,0|1,0,1]=4 4085 B14R0.493 CCCCOCCOCC(=O)OCCC 34a_100000210238_200011215008 [1,1,0,0,0,0|1,0,1]=4 4086 B14R0.493 CCCCOCCOCC(=O)OCCC 7a_100000210238_200011215008 [1,1,0,0,0,0|1,0,1]=4 4087 B14R0.493 CCCCOCCOCC(C)CCCC 34a_100011995851_100000743108 [1,1,0,0,0,0|2,0,0]=4 4088 B14R0.493 CCCCOCCOCC(C)CCCC 7a_100011995851_100000743108 [1,1,0,0,0,0|2,0,0]=4 4089 B14R0.493 CCCCOCCOC[C@@H](C)OCOC 34a_100016172286_100000743108 [1,1,0,0,0,0|1,0,0]=3 4090 B14R0.493 CCCCOCCOC[C@@H](C)OCOC 7a_100016172286_100000743108 [1,1,0,0,0,0|1,0,0]=3 4091 B14R0.493 CCCCOCCOC[C@@H](N)CCCC 34a_100011934283_100000743108 [1,1,0,0,0,0|2,0,0]=4 4092 B14R0.493 CCCCOCCOC[C@@H](N)CCSC 34a_100011827619_100000743108 [1,1,0,0,0,0|1,1,0]=4 4093 B14R0.493 CCCC[C@H](N)COCCOCCOC 34a_100011934283_100000695917 [1,1,0,0,0,0|1,0,0]=3 4094 B14R0.493 CCCNC(=O)COCCOCCOC 11a_100020643023_100011214951 [1,1,0,0,0,0|1,0,1]=4 4095 B14R0.493 CCCNC(=O)COCCOCCOC 1626a_100020643023_100011214951 [1,1,0,0,0,0|1,0,1]=4 4096 B14R0.493 CCCNC(=O)COCCOCCOC 240690a_100020643023_100011214951 [1,1,0,0,0,0|1,0,1]=4 4097 B14R0.493 CCCNC(=O)COCCOCCOC 34a_100011215163_100000183358 [1,1,0,0,0,0|1,0,1]=4 4098 B14R0.493 CCCNC(=O)COCCOCCOC 527a_100020643023_100011214951 [1,1,0,0,0,0|1,0,1]=4 4099 B14R0.493 CCCNC(=O)COCCOCCOC 7a_100011215163_100000183358 [1,1,0,0,0,0|1,0,1]=4 4100 B14R0.493 CCCOC(=O)CNCCOCCOC 2230a_100000745349_200011215008 [1,1,0,0,0,0|1,0,1]=4 4101 B14R0.493 CCCOC(=O)CNCCOCCOC 34a_100000745349_200011215008 [1,1,0,0,0,0|1,0,1]=4 4102 B14R0.493 CCCOC(=O)COCCOCCNC 34a_100000228057_200011215008 [1,1,0,0,0,0|1,0,1]=4 4103 B14R0.493 CCCOC(=O)COCCOCCOC 34a_100011215163_200011215008 [1,1,0,0,0,0|0,0,1]=3 4104 B14R0.493 CCCOC(=O)COCCOCCOC 7a_100011215163_200011215008 [1,1,0,0,0,0|0,0,1]=3 4105 B14R0.493 CCCOC(=O)CSCCOCCOC 62a_100000695917_200011215008 [1,1,0,0,0,0|0,1,1]=4 4106 B14R0.493 CCCOC(=O)CSCCOCCOC 62a_200011215008_100000695917 [1,1,0,0,0,0|0,1,1]=4 4107 B14R0.493 CCCOC(C)CNCCOCCOC 2230a_100015185124_100000695917 [1,1,0,0,0,0|1,0,0]=3 4108 B14R0.493 CCCOC(C)CNCCOCCOC 34a_100015185124_100000695917 [1,1,0,0,0,0|1,0,0]=3 4109 B14R0.493 COCCC(=O)CCOCCOCCO 1458a_100000749529_100000032323 [1,1,0,0,0,0|1,0,0]=3 4110 B14R0.493 COCCC(=O)CCOCCOCCO 1458a_100009915118_100000233755 [1,1,0,0,0,0|1,0,0]=3 4111 B14R0.493 COCCN(C)CCOCCOCCO 2230a_100000743101_100000032323 [1,1,0,0,0,0|1,0,0]=3 4112 B14R0.493 COCCN(C)CCOCCOCCO 2230a_200014138305_100011201679 [1,1,0,0,0,0|1,0,0]=3 4113 B14R0.493 COCCN(C)CCOCCOCCO 269982a_100000743101_100000032323 [1,1,0,0,0,0|1,0,0]=3 4114 B14R0.493 COCCN(C)CCOCCOCCO 269982a_200014138305_100000233755 [1,1,0,0,0,0|1,0,0]=3 4115 B14R0.493 COCCN(C)CCOCCOCCO 34a_200014138305_100011201679 [1,1,0,0,0,0|1,0,0]=3 4116 B14R0.493 COCCOCCCNC(=O)CCOC 1626a_100000206027_100000749529 [1,1,0,0,0,0|2,0,0]=4 4117 B14R0.493 COCCOCCCNC(=O)CCOC 240690a_100000206027_100000749529 [1,1,0,0,0,0|2,0,0]=4 4118 B14R0.493 COCCOCCCNC(C)CCOC 270004a_100000206027_100000742357 [1,1,0,0,0,0|2,0,0]=4 4119 B14R0.493 COCCOCCNC[C@H](C)CCCO 2230a_100160569302_100000695917 [1,1,0,0,0,0|2,0,0]=4 4120 B14R0.493 COCCOCCNC[C@H](C)CCCO 34a_100160569302_100000695917 [1,1,0,0,0,0|2,0,0]=4 4121 B14R0.493 COCCOCCOCC(=O)CCCO 1458a_100011214951_100011215043 [1,1,0,0,0,0|1,0,1]=4 4122 B14R0.493 COCCOCCOCC(=O)CCOC 1458a_100011214951_100000233755 [1,1,0,0,0,0|0,0,1]=3 4123 B14R0.493 COCCOCCOCC(=O)CCSC 1458a_100011214951_100000751147 [1,1,0,0,0,0|0,1,1]=4 4124 B14R0.493 COCCOCCOCC(=O)NCCO 240690a_100000210304_100011214951 [1,1,0,0,0,0|1,0,1]=4 4125 B14R0.493 COCCOCCOCC(=O)NCCO 527a_100000210304_100011214951 [1,1,0,0,0,0|1,0,1]=4 4126 B14R0.493 COCCOCCOC[C@@H](C)OCOC 34a_100016172286_100000695917 [1,1,0,0,0,0|0,0,0]=2 4127 B14R0.493 COCCOCCOC[C@@H](C)OCOC 7a_100016172286_100000695917 [1,1,0,0,0,0|0,0,0]=2 4128 B14R0.493 COCCOCCOC[C@@H](N)CCSC 34a_100011827619_100000695917 [1,1,0,0,0,0|0,1,0]=3 4129 B14R0.493 CSCCC(=O)CCOCCOCCO 1458a_100000174002_100000032323 [1,1,0,0,0,0|1,1,0]=4 4130 B14R0.493 CSCCC(=O)CCOCCOCCO 1458a_100009915118_100000751147 [1,1,0,0,0,0|1,1,0]=4 4131 B14R0.493 CSCCN(C)CCOCCOCCO 2230a_100000686725_100000032323 [1,1,0,0,0,0|1,1,0]=4 4132 B14R0.493 CSCCN(C)CCOCCOCCO 2230a_200014138305_100000751147 [1,1,0,0,0,0|1,1,0]=4 4133 B14R0.493 CSCCN(C)CCOCCOCCO 269982a_100000686725_100000032323 [1,1,0,0,0,0|1,1,0]=4 4134 B14R0.493 CSCCN(C)CCOCCOCCO 269982a_200014138305_100000212216 [1,1,0,0,0,0|1,1,0]=4 4135 B14R0.493 CSCCN(C)CCOCCOCCO 34a_200014138305_100000212216 [1,1,0,0,0,0|1,1,0]=4 4136 B16R0.61 C#CCC(=O)COCCOCCOCCOC 1458a_100012826494_100000184674 [0,2,0,0,0,0|1,0,1]=4 4137 B16R0.61 C=CCC(=O)COCCOCCOCCOC 1458a_100012826494_100000210623 [0,2,0,0,0,0|1,0,1]=4 4138 B16R0.61 C=CCC(C)COCCOCCOCCOC 34a_100009832082_100013367474 [0,2,0,0,0,0|1,0,1]=4 4139 B16R0.61 C=CCC(C)COCCOCCOCCOC 7a_100009832082_100013367474 [0,2,0,0,0,0|1,0,1]=4 4140 B16R0.61 C=CC[C@@H](N)COCCOCCOCCOC 34a_100020615467_100013367474 [0,2,0,0,0,0|1,0,1]=4 4141 B16R0.61 C=COC(=O)COCCOCCOCCOC 34a_100000688194_100000036128 [0,2,0,0,0,0|0,0,2]=4 4142 B16R0.61 CCCC(=O)CNCCOCCOCCOC 2230a_100012028300_100000747444 [0,2,0,0,0,0|2,0,0]=4 4143 B16R0.61 CCCC(=O)COCCOCCOCCOC 1458a_100012826494_100000210303 [0,2,0,0,0,0|1,0,0]=3 4144 B16R0.61 CCCC(=O)COCCOCCOCCOC 7a_100000688194_100000747444 [0,2,0,0,0,0|1,0,0]=3 4145 B16R0.61 CCCC(=O)CSCCOCCOCCOC 62a_100000747444_100013367474 [0,2,0,0,0,0|1,1,0]=4 4146 B16R0.61 CCCC(=O)CSCCOCCOCCOC 62a_100013367474_100000747444 [0,2,0,0,0,0|1,1,0]=4 4147 B16R0.61 CCCC(C)CCCOCCCOCCOC 34a_100011713154_100011216529 [0,2,0,0,0,0|2,0,0]=4 4148 B16R0.61 CCCC(C)CCCOCCCOCCOC 7a_100011713154_100011216529 [0,2,0,0,0,0|2,0,0]=4 4149 B16R0.61 CCCC(C)CCCOCCOCCOCC 34a_100011713154_100011211534 [0,2,0,0,0,0|2,0,0]=4 4150 B16R0.61 CCCC(C)CCCOCCOCCOCC 7a_100011713154_100011211534 [0,2,0,0,0,0|2,0,0]=4 4151 B16R0.61 CCCC(C)CNCCOCCOCCOC 2230a_100012028300_100011216630 [0,2,0,0,0,0|2,0,0]=4 4152 B16R0.61 CCCC(C)CNCCOCCOCCOC 270004a_100012028300_100000243154 [0,2,0,0,0,0|2,0,0]=4 4153 B16R0.61 CCCC(C)CNCCOCCOCCOC 34a_100012028300_100011216630 [0,2,0,0,0,0|2,0,0]=4 4154 B16R0.61 CCCC(C)COCCOCCOCCNC 34a_200014138305_100011216630 [0,2,0,0,0,0|2,0,0]=4 4155 B16R0.61 CCCC(C)COCCOCCOCCOC 34a_100000688023_100013367474 [0,2,0,0,0,0|1,0,0]=3 4156 B16R0.61 CCCC(C)COCCOCCOCCOC 34a_100000688194_100011216630 [0,2,0,0,0,0|1,0,0]=3 4157 B16R0.61 CCCC(C)COCCOCCOCCOC 7a_100000688023_100013367474 [0,2,0,0,0,0|1,0,0]=3 4158 B16R0.61 CCCC(C)COCCOCCOCCOC 7a_100000688194_100011216630 [0,2,0,0,0,0|1,0,0]=3 4159 B16R0.61 CCCC(C)CSCCOCCOCCOC 62a_100011216630_100013367474 [0,2,0,0,0,0|1,1,0]=4 4160 B16R0.61 CCCC(C)CSCCOCCOCCOC 62a_100013367474_100011216630 [0,2,0,0,0,0|1,1,0]=4 4161 B16R0.61 CCCC(C)NCCOCCOCCOCC 2230a_100012282185_100000766640 [0,2,0,0,0,0|2,0,0]=4 4162 B16R0.61 CCCC(C)NCCOCCOCCOCC 270004a_100012282185_100000211909 [0,2,0,0,0,0|2,0,0]=4 4163 B16R0.61 CCCC(C)NCCOCCOCCOCC 34a_100012282185_100000766640 [0,2,0,0,0,0|2,0,0]=4 4164 B16R0.61 CCCC(C)OCCOCCOCCOCC 34a_100000033264_100000766640 [0,2,0,0,0,0|1,0,0]=3 4165 B16R0.61 CCCC(C)OCCOCCOCCOCC 7a_100000033264_100000766640 [0,2,0,0,0,0|1,0,0]=3 4166 B16R0.61 CCCCOCCOCCOCC(=O)CCC 7a_100011215186_100000747444 [0,2,0,0,0,0|2,0,0]=4 4167 B16R0.61 CCCCOCCOCCOCC(=O)OCC 34a_100000210238_100000088970 [0,2,0,0,0,0|1,0,1]=4 4168 B16R0.61 CCCCOCCOCCOCC(=O)OCC 34a_100011215186_100000188475 [0,2,0,0,0,0|1,0,1]=4 4169 B16R0.61 CCCCOCCOCCOCC(=O)OCC 7a_100000210238_100000088970 [0,2,0,0,0,0|1,0,1]=4 4170 B16R0.61 CCCCOCCOCCOCC(=O)OCC 7a_100011215186_100000188475 [0,2,0,0,0,0|1,0,1]=4 4171 B16R0.61 CCCCOCCOCCOCC(C)CCC 34a_100011215186_100011216630 [0,2,0,0,0,0|2,0,0]=4 4172 B16R0.61 CCCCOCCOCCOCC(C)CCC 7a_100011215186_100011216630 [0,2,0,0,0,0|2,0,0]=4 4173 B16R0.61 CCCCOCCOCCOCC(O)COC 34a_100011215186_100011215053 [0,2,0,0,0,0|1,0,0]=3 4174 B16R0.61 CCCCOCCOCCOCC(O)COC 7a_100011215186_100011215053 [0,2,0,0,0,0|1,0,0]=3 4175 B16R0.61 CCC[C@H](N)COCCOCCOCCOC 34a_100000732646_100013367474 [0,2,0,0,0,0|1,0,0]=3 4176 B16R0.61 CCNC(=O)COCCOCCOCCOC 11a_100015525214_100012826494 [0,2,0,0,0,0|1,0,1]=4 4177 B16R0.61 CCNC(=O)COCCOCCOCCOC 240690a_100015525214_100012826494 [0,2,0,0,0,0|1,0,1]=4 4178 B16R0.61 CCNC(=O)COCCOCCOCCOC 34a_100000688194_100000183381 [0,2,0,0,0,0|1,0,1]=4 4179 B16R0.61 CCNC(=O)COCCOCCOCCOC 527a_100015525214_100012826494 [0,2,0,0,0,0|1,0,1]=4 4180 B16R0.61 CCNC(=O)COCCOCCOCCOC 7a_100000688194_100000183381 [0,2,0,0,0,0|1,0,1]=4 4181 B16R0.61 CCOC(=O)CCCCOCCOCCOC 34a_100011215163_100000750268 [0,2,0,0,0,0|1,0,1]=4 4182 B16R0.61 CCOC(=O)CCCCOCCOCCOC 7a_100011215163_100000750268 [0,2,0,0,0,0|1,0,1]=4 4183 B16R0.61 CCOC(=O)CNCCOCCOCCOC 2230a_100012028300_100000188475 [0,2,0,0,0,0|1,0,1]=4 4184 B16R0.61 CCOC(=O)CNCCOCCOCCOC 34a_100012028300_100000188475 [0,2,0,0,0,0|1,0,1]=4 4185 B16R0.61 CCOC(=O)COCCNCCOCCOC 2230a_100000745349_100000088970 [0,2,0,0,0,0|1,0,1]=4 4186 B16R0.61 CCOC(=O)COCCNCCOCCOC 34a_100000745349_100000088970 [0,2,0,0,0,0|1,0,1]=4 4187 B16R0.61 CCOC(=O)COCCOCCOCCNC 34a_100000228057_100000088970 [0,2,0,0,0,0|1,0,1]=4 4188 B16R0.61 CCOC(=O)COCCOCCOCCNC 34a_200014138305_100000188475 [0,2,0,0,0,0|1,0,1]=4 4189 B16R0.61 CCOC(=O)COCCOCCOCCOC 34a_100000688194_100000188475 [0,2,0,0,0,0|0,0,1]=3 4190 B16R0.61 CCOC(=O)COCCOCCOCCOC 34a_100011215163_100000088970 [0,2,0,0,0,0|0,0,1]=3 4191 B16R0.61 CCOC(=O)COCCOCCOCCOC 7a_100000688194_100000188475 [0,2,0,0,0,0|0,0,1]=3 4192 B16R0.61 CCOC(=O)COCCOCCOCCOC 7a_100011215163_100000088970 [0,2,0,0,0,0|0,0,1]=3 4193 B16R0.61 CCOC(=O)COCCSCCOCCOC 62a_100000088970_100000695917 [0,2,0,0,0,0|0,1,1]=4 4194 B16R0.61 CCOC(=O)COCCSCCOCCOC 62a_100000695917_100000088970 [0,2,0,0,0,0|0,1,1]=4 4195 B16R0.61 CCOC(=O)CSCCOCCOCCOC 62a_100000188475_100013367474 [0,2,0,0,0,0|0,1,1]=4 4196 B16R0.61 CCOC(=O)CSCCOCCOCCOC 62a_100013367474_100000188475 [0,2,0,0,0,0|0,1,1]=4 4197 B16R0.61 CCOC(=O)CSCCOCCOCCOC 7a_200000230590_100000695917 [0,2,0,0,0,0|0,1,1]=4 4198 B16R0.61 CCOCCOCCOCCNC(=O)COC 1626a_100012282185_100000210968 [0,2,0,0,0,0|1,0,1]=4 4199 B16R0.61 CCOCCOCCOCCNC(=O)COC 240690a_100012282185_100000210968 [0,2,0,0,0,0|1,0,1]=4 4200 B16R0.61 CCOCCOCCOCCNC(C)COC 2230a_100012282185_100000765312 [0,2,0,0,0,0|1,0,0]=3 4201 B16R0.61 CCOCCOCCOCCNC(C)COC 270004a_100012282185_100000749346 [0,2,0,0,0,0|1,0,0]=3 4202 B16R0.61 CCOCCOCCOCCNC(C)COC 34a_100012282185_100000765312 [0,2,0,0,0,0|1,0,0]=3 4203 B16R0.61 CCOCCOCCOCCNC(C)CSC 270004a_100012282185_100011216314 [0,2,0,0,0,0|1,1,0]=4 4204 B16R0.61 CCOCCOCCOCCOC(C)CC#N 7a_100000033264_100009813641 [0,2,0,0,0,0|2,0,0]=4 4205 B16R0.61 CCOCCOCCOCCOC(C)CCO 34a_100000033264_100009893172 [0,2,0,0,0,0|2,0,0]=4 4206 B16R0.61 CCOCCOCCOCCOC(C)CCO 7a_100000033264_100009893172 [0,2,0,0,0,0|2,0,0]=4 4207 B16R0.61 CCOCCOCCOCCOC(C)COC 34a_100000033264_100000765312 [0,2,0,0,0,0|0,0,0]=2 4208 B16R0.61 CCOCCOCCOCCOC(C)COC 7a_100000033264_100000765312 [0,2,0,0,0,0|0,0,0]=2 4209 B16R0.61 CNCCOCCOCCOCC(O)COC 34a_200014138305_100011215053 [0,2,0,0,0,0|1,0,0]=3 4210 B16R0.61 CNNC(=O)COCCOCCOCCOC 22a_100016993582_100012826494 [0,2,0,0,0,0|1,0,1]=4 4211 B16R0.61 COCC(O)COCCOCCOCCCN 34a_100011996194_100011215053 [0,2,0,0,0,0|2,0,0]=4 4212 B16R0.61 COCCOCCOCCNCC(O)COC 2230a_100000756049_100013367474 [0,2,0,0,0,0|1,0,0]=3 4213 B16R0.61 COCCOCCOCCNCC(O)COC 34a_100000756049_100013367474 [0,2,0,0,0,0|1,0,0]=3 4214 B16R0.61 COCCOCCOCCNCC(O)COC 34a_100012028300_100011215053 [0,2,0,0,0,0|1,0,0]=3 4215 B16R0.61 COCCOCCOCCOCC(=O)CC#N 1458a_100012826494_100011214920 [0,2,0,0,0,0|2,0,0]=4 4216 B16R0.61 COCCOCCOCCOCC(=O)CCF 1458a_100012826494_100011217306 [0,2,0,0,0,0|1,0,1]=4 4217 B16R0.61 COCCOCCOCCOCC(=O)CCO 1458a_100012826494_100000211926 [0,2,0,0,0,0|1,0,1]=4 4218 B16R0.61 COCCOCCOCCOCC(=O)NCO 34a_100000688194_100000185155 [0,2,0,0,0,0|1,0,1]=4 4219 B16R0.61 COCCOCCOCCOCC(=O)NCO 7a_100000688194_100000185155 [0,2,0,0,0,0|1,0,1]=4 4220 B16R0.61 COCCOCCOCCOCC(C)CCN 34a_106354213184_100013367474 [0,2,0,0,0,0|1,0,0]=3 4221 B16R0.61 COCCOCCOCCOCC(N)COC 34a_100000724102_100013367474 [0,2,0,0,0,0|0,0,0]=2 4222 B16R0.61 COCCOCCOCCOCC(O)COC 34a_100000688194_100011215053 [0,2,0,0,0,0|0,0,0]=2 4223 B16R0.61 COCCOCCOCCOCC(O)COC 7a_100000688194_100011215053 [0,2,0,0,0,0|0,0,0]=2 4224 B16R0.61 COCCOCCOCCOC[C@@H](O)CC#N 7a_100000688194_100000001066 [0,2,0,0,0,0|1,0,1]=4 4225 B16R0.61 COCCOCCOCCSCC(O)COC 62a_100011215053_100013367474 [0,2,0,0,0,0|0,1,0]=3 4226 B16R0.61 COCCOCCOCCSCC(O)COC 62a_100013367474_100011215053 [0,2,0,0,0,0|0,1,0]=3 4227 B16R0.61 COC[C@@H](C)OCCOCCOCCN=[N+]=[N-] 34a_100011934205_100010820720 [0,2,0,0,0,0|2,0,0]=4 4228 B16R0.68 C=COCCC(=O)CCOCCOCCOC 1458a_100012278103_100000039644 [0,2,0,0,0,0|1,0,1]=4 4229 B16R0.68 C=COCCN(C)CCOCCOCCOC 2230a_200000716983_100000039644 [0,2,0,0,0,0|1,0,1]=4 4230 B16R0.68 C=COCCN(C)CCOCCOCCOC 269982a_200000716983_100000039644 [0,2,0,0,0,0|1,0,1]=4 4231 B16R0.68 C=COCCN(C)CCOCCOCCOC 34a_200000716983_100000039644 [0,2,0,0,0,0|1,0,1]=4 4232 B16R0.68 C=COCCOCCOCC(=O)OCCOC 34a_100000039918_200000040189 [0,2,0,0,0,0|0,0,2]=4 4233 B16R0.68 C=COCCOCCOCC(=O)OCCOC 7a_100000039918_200000040189 [0,2,0,0,0,0|0,0,2]=4 4234 B16R0.68 CCCCCC(=O)CCOCCOCCOC 1458a_100000212188_100013367474 [0,2,0,0,0,0|2,0,0]=4 4235 B16R0.68 CCCCCC(=O)CCOCCOCCOC 1458a_100012278103_100000210326 [0,2,0,0,0,0|2,0,0]=4 4236 B16R0.68 CCCCCN(C)CCOCCOCCOC 2230a_100000223495_100013367474 [0,2,0,0,0,0|2,0,0]=4 4237 B16R0.68 CCCCCN(C)CCOCCOCCOC 2230a_200000716983_100000210326 [0,2,0,0,0,0|2,0,0]=4 4238 B16R0.68 CCCCCN(C)CCOCCOCCOC 269982a_100000223495_100013367474 [0,2,0,0,0,0|2,0,0]=4 4239 B16R0.68 CCCCCN(C)CCOCCOCCOC 269982a_200000716983_100000210215 [0,2,0,0,0,0|2,0,0]=4 4240 B16R0.68 CCCCCN(C)CCOCCOCCOC 34a_200000716983_100000718602 [0,2,0,0,0,0|2,0,0]=4 4241 B16R0.68 CCCCCOCCOCC(=O)OCCOC 34a_100011215259_200000040189 [0,2,0,0,0,0|1,0,1]=4 4242 B16R0.68 CCCCCOCCOCC(=O)OCCOC 7a_100011215259_200000040189 [0,2,0,0,0,0|1,0,1]=4 4243 B16R0.68 CCCCNC(=O)CCOCCOCCOC 11a_100000102301_100012278103 [0,2,0,0,0,0|2,0,0]=4 4244 B16R0.68 CCCCNC(=O)CCOCCOCCOC 1626a_100000102301_100012278103 [0,2,0,0,0,0|2,0,0]=4 4245 B16R0.68 CCCCNC(=O)CCOCCOCCOC 240690a_100000102301_100012278103 [0,2,0,0,0,0|2,0,0]=4 4246 B16R0.68 CCCCNC(=O)CCOCCOCCOC 527a_100000102301_100012278103 [0,2,0,0,0,0|2,0,0]=4 4247 B16R0.68 CCCCOC(=O)COCCOCCOCC 34a_100000210240_100000211628 [0,2,0,0,0,0|1,0,1]=4 4248 B16R0.68 CCCCOC(=O)COCCOCCOCC 7a_100000210240_100000211628 [0,2,0,0,0,0|1,0,1]=4 4249 B16R0.68 CCCCOCCCOCC(=O)OCCOC 34a_200011215613_200000040189 [0,2,0,0,0,0|1,0,1]=4 4250 B16R0.68 CCCCOCCCOCC(=O)OCCOC 7a_200011215613_200000040189 [0,2,0,0,0,0|1,0,1]=4 4251 B16R0.68 CCCOCC(=O)CCOCCOCCOC 1458a_100000745993_100013367474 [0,2,0,0,0,0|2,0,0]=4 4252 B16R0.68 CCCSCC(=O)CCOCCOCCOC 1458a_100000217233_100013367474 [0,2,0,0,0,0|2,0,0]=4 4253 B16R0.68 CCOCCC(=O)CCOCCOCCOC 1458a_100000749530_100013367474 [0,2,0,0,0,0|1,0,0]=3 4254 B16R0.68 CCOCCC(=O)CCOCCOCCOC 1458a_100012278103_100011215890 [0,2,0,0,0,0|1,0,0]=3 4255 B16R0.68 CCOCCN(C)CCOCCOCCOC 2230a_200000716983_100011215890 [0,2,0,0,0,0|1,0,0]=3 4256 B16R0.68 CCOCCN(C)CCOCCOCCOC 269982a_200000716983_100011215890 [0,2,0,0,0,0|1,0,0]=3 4257 B16R0.68 CCOCCN(C)CCOCCOCCOC 34a_200000716983_100000210147 [0,2,0,0,0,0|1,0,0]=3 4258 B16R0.68 CCOCCOCCNCC(=O)OCCOC 2230a_100102712874_200000040189 [0,2,0,0,0,0|1,0,1]=4 4259 B16R0.68 CCOCCOCCNCC(=O)OCCOC 34a_100102712874_200000040189 [0,2,0,0,0,0|1,0,1]=4 4260 B16R0.68 CCOCCOCCOCC(=O)NCCOC 34a_100000210240_100000183275 [0,2,0,0,0,0|1,0,1]=4 4261 B16R0.68 CCOCCOCCOCC(=O)NCCOC 7a_100000210240_100000183275 [0,2,0,0,0,0|1,0,1]=4 4262 B16R0.68 CCOCCOCCOCC(=O)OCCOC 34a_100000210240_200000040189 [0,2,0,0,0,0|0,0,1]=3 4263 B16R0.68 CCOCCOCCOCC(=O)OCCOC 7a_100000210240_200000040189 [0,2,0,0,0,0|0,0,1]=3 4264 B16R0.68 CCOCCOCCSCC(=O)OCCOC 62a_100011211534_200000040189 [0,2,0,0,0,0|0,1,1]=4 4265 B16R0.68 CCOCCOCCSCC(=O)OCCOC 62a_200000040189_100011211534 [0,2,0,0,0,0|0,1,1]=4 4266 B16R0.68 CCSCCC(=O)CCOCCOCCOC 1458a_100000230768_100013367474 [0,2,0,0,0,0|1,1,0]=4 4267 B16R0.68 CCSCCC(=O)CCOCCOCCOC 1458a_100012278103_100000757381 [0,2,0,0,0,0|1,1,0]=4 4268 B16R0.68 CCSCCN(C)CCOCCOCCOC 2230a_200000716983_100000757381 [0,2,0,0,0,0|1,1,0]=4 4269 B16R0.68 CCSCCN(C)CCOCCOCCOC 269982a_200000716983_100000757381 [0,2,0,0,0,0|1,1,0]=4 4270 B16R0.68 CCSCCN(C)CCOCCOCCOC 34a_200000716983_100000757381 [0,2,0,0,0,0|1,1,0]=4 4271 B16R0.68 COCC=CC(=O)CCOCCOCCOC 1458a_100016285016_100013367474 [0,2,0,0,0,0|1,0,1]=4 4272 B16R0.68 COCCCC(=O)CCOCCOCCOC 1458a_100000741012_100013367474 [0,2,0,0,0,0|1,0,0]=3 4273 B16R0.68 COCCCC(=O)CCOCCOCCOC 1458a_100012278103_100000740836 [0,2,0,0,0,0|1,0,0]=3 4274 B16R0.68 COCCCCCCOCC(=O)OCCOC 34a_200012092642_200000040189 [0,2,0,0,0,0|1,0,1]=4 4275 B16R0.68 COCCCCCCOCC(=O)OCCOC 7a_200012092642_200000040189 [0,2,0,0,0,0|1,0,1]=4 4276 B16R0.68 COCCCN(C)CCOCCOCCOC 2230a_100000224831_100013367474 [0,2,0,0,0,0|1,0,0]=3 4277 B16R0.68 COCCCN(C)CCOCCOCCOC 2230a_200000716983_100000740836 [0,2,0,0,0,0|1,0,0]=3 4278 B16R0.68 COCCCN(C)CCOCCOCCOC 269982a_100000224831_100013367474 [0,2,0,0,0,0|1,0,0]=3 4279 B16R0.68 COCCCN(C)CCOCCOCCOC 269982a_200000716983_100000740836 [0,2,0,0,0,0|1,0,0]=3 4280 B16R0.68 COCCCN(C)CCOCCOCCOC 34a_200000716983_100000740836 [0,2,0,0,0,0|1,0,0]=3 4281 B16R0.68 COCCNC(=O)CCOCCOCCOC 1626a_100000209980_100012278103 [0,2,0,0,0,0|1,0,0]=3 4282 B16R0.68 COCCNC(=O)CCOCCOCCOC 240690a_100000209980_100012278103 [0,2,0,0,0,0|1,0,0]=3 4283 B16R0.68 COCCNC(=O)CCOCCOCCOC 527a_100000209980_100012278103 [0,2,0,0,0,0|1,0,0]=3 4284 B16R0.68 COCCOCCCNCC(=O)OCCOC 2230a_100000206027_200000040189 [0,2,0,0,0,0|1,0,1]=4 4285 B16R0.68 COCCOCCCNCC(=O)OCCOC 34a_100000206027_200000040189 [0,2,0,0,0,0|1,0,1]=4 4286 B16R0.68 COCCOCCCSCC(=O)OCCOC 62a_100011216529_200000040189 [0,2,0,0,0,0|0,1,1]=4 4287 B16R0.68 COCCOCCCSCC(=O)OCCOC 62a_200000040189_100011216529 [0,2,0,0,0,0|0,1,1]=4 4288 B16R0.68 COCCOCCOCCC(=O)CCCCF 1458a_100012278103_100000729493 [0,2,0,0,0,0|2,0,0]=4 4289 B16R0.68 COCCOCCOCCC(=O)CCCCO 1458a_100000695505_100013367474 [0,2,0,0,0,0|2,0,0]=4 4290 B16R0.68 COCCOCCOCCC(=O)CCCCO 1458a_100012278103_100000210776 [0,2,0,0,0,0|2,0,0]=4 4291 B16R0.68 COCCOCCOCCC(=O)CCCSC 1458a_100000173376_100013367474 [0,2,0,0,0,0|1,1,0]=4 4292 B16R0.68 COCCOCCOCCC(=O)NCCSC 11a_100020590264_100012278103 [0,2,0,0,0,0|1,1,0]=4 4293 B16R0.68 COCCOCCOCCC(=O)NCCSC 1626a_100020590264_100012278103 [0,2,0,0,0,0|1,1,0]=4 4294 B16R0.68 COCCOCCOCCC(=O)NCCSC 240690a_100020590264_100012278103 [0,2,0,0,0,0|1,1,0]=4 4295 B16R0.68 COCCOCCOCCC(=O)NCCSC 527a_100020590264_100012278103 [0,2,0,0,0,0|1,1,0]=4 4296 B16R0.68 COCCOCCOCCN(C)CCCCF 2230a_200000716983_100000729493 [0,2,0,0,0,0|2,0,0]=4 4297 B16R0.68 COCCOCCOCCN(C)CCCCF 269982a_200000716983_100000729493 [0,2,0,0,0,0|2,0,0]=4 4298 B16R0.68 COCCOCCOCCN(C)CCCCF 34a_200000716983_100000729493 [0,2,0,0,0,0|2,0,0]=4 4299 B16R0.68 COCCOCCOCCN(C)CCCCO 2230a_100000717598_100013367474 [0,2,0,0,0,0|2,0,0]=4 4300 B16R0.68 COCCOCCOCCN(C)CCCCO 2230a_200000716983_100000210776 [0,2,0,0,0,0|2,0,0]=4 4301 B16R0.68 COCCOCCOCCN(C)CCCCO 269982a_100000717598_100013367474 [0,2,0,0,0,0|2,0,0]=4 4302 B16R0.68 COCCOCCOCCN(C)CCCCO 269982a_200000716983_100000210776 [0,2,0,0,0,0|2,0,0]=4 4303 B16R0.68 COCCOCCOCCN(C)CCCCO 34a_200000716983_100011216708 [0,2,0,0,0,0|2,0,0]=4 4304 B16R0.136 CCCCCCCC(C)OCCOCCOC 34a_100011215163_200011218727 [0,2,0,0,0,0|2,0,0]=4 4305 B16R0.136 CCCCCCCC(C)OCCOCCOC 34a_200011215852_100000695917 [0,2,0,0,0,0|2,0,0]=4 4306 B16R0.136 CCCCCCCC(C)OCCOCCOC 7a_100011215163_200011218727 [0,2,0,0,0,0|2,0,0]=4 4307 B16R0.136 CCCCCCCC(C)OCCOCCOC 7a_200011215852_100000695917 [0,2,0,0,0,0|2,0,0]=4 4308 B16R0.136 CCOCCOCCC(=O)CCCCCOC 1458a_100011935119_100011211534 [0,2,0,0,0,0|2,0,0]=4 4309 B16R0.136 CCOCCOCCC(=O)CCOCCOC 1458a_100000745395_100011211534 [0,2,0,0,0,0|1,0,0]=3 4310 B16R0.136 COCCCCCC(=O)CCCOCCOC 1458a_100011935119_100011216529 [0,2,0,0,0,0|2,0,0]=4 4311 B16R0.136 COCCCCCC(=O)NCCOCCOC 11a_100000745349_100011935119 [0,2,0,0,0,0|2,0,0]=4 4312 B16R0.136 COCCCCCC(=O)NCCOCCOC 1626a_100000745349_100011935119 [0,2,0,0,0,0|2,0,0]=4 4313 B16R0.136 COCCCCCC(=O)NCCOCCOC 240690a_100000745349_100011935119 [0,2,0,0,0,0|2,0,0]=4 4314 B16R0.136 COCCCCCC(=O)NCCOCCOC 527a_100000745349_100011935119 [0,2,0,0,0,0|2,0,0]=4 4315 B16R0.136 COCCCCCCC(=O)CCOCCOC 1458a_100000745395_100011998445 [0,2,0,0,0,0|2,0,0]=4 4316 B16R0.136 COCCCCCNC(=O)CCOCCOC 11a_100000747528_100000745395 [0,2,0,0,0,0|2,0,0]=4 4317 B16R0.136 COCCCCCNC(=O)CCOCCOC 1626a_100000747528_100000745395 [0,2,0,0,0,0|2,0,0]=4 4318 B16R0.136 COCCCCCNC(=O)CCOCCOC 240690a_100000747528_100000745395 [0,2,0,0,0,0|2,0,0]=4 4319 B16R0.136 COCCCCCNC(=O)CCOCCOC 527a_100000747528_100000745395 [0,2,0,0,0,0|2,0,0]=4 4320 B16R0.136 COCCOCCCC(=O)CCOCCOC 1458a_100000745395_100011216529 [0,2,0,0,0,0|1,0,0]=3 4321 B16R0.136 COCCOCCNC(=O)CCOCCOC 11a_100000745349_100000745395 [0,2,0,0,0,0|1,0,0]=3 4322 B16R0.136 COCCOCCNC(=O)CCOCCOC 1626a_100000745349_100000745395 [0,2,0,0,0,0|1,0,0]=3 4323 B16R0.136 COCCOCCNC(=O)CCOCCOC 240690a_100000745349_100000745395 [0,2,0,0,0,0|1,0,0]=3 4324 B16R0.136 COCCOCCNC(=O)CCOCCOC 527a_100000745349_100000745395 [0,2,0,0,0,0|1,0,0]=3 4325 B16R0.221 C#C/C(=C\COCCOCCOCCOC)/C 34a_100016990848_100013367474 [0,2,0,0,0,0|1,0,1]=4 4326 B16R0.221 C#CC(=O)CCOCCOCCOCCOC 1458a_100000211873_100012349117 [0,2,0,0,0,0|1,0,1]=4 4327 B16R0.221 C#CCCOCCOCCOCCC(=O)OC 34a_100010982084_100000688953 [0,2,0,0,0,0|1,0,1]=4 4328 B16R0.221 C#CCCOCCOCCOCCC(=O)OC 7a_100010982084_100000688953 [0,2,0,0,0,0|1,0,1]=4 4329 B16R0.221 C/C=C/COCCOCCOCCC(=O)OC 34a_100010982084_100102629194 [0,2,0,0,0,0|1,0,1]=4 4330 B16R0.221 C/C=C/COCCOCCOCCC(=O)OC 7a_100010982084_100102629194 [0,2,0,0,0,0|1,0,1]=4 4331 B16R0.221 C=CC(=O)CCOCCOCCOCCOC 1458a_100000185746_100012349117 [0,2,0,0,0,0|1,0,1]=4 4332 B16R0.221 C=CC(O)COCCOCCOCCOCC 34a_100000033264_100000730141 [0,2,0,0,0,0|1,0,1]=4 4333 B16R0.221 C=CC(O)COCCOCCOCCOCC 7a_100000033264_100000730141 [0,2,0,0,0,0|1,0,1]=4 4334 B16R0.221 C=CCCOCCOCCOCCC(=O)OC 34a_100010982084_100000754431 [0,2,0,0,0,0|1,0,1]=4 4335 B16R0.221 C=CCCOCCOCCOCCC(=O)OC 7a_100010982084_100000754431 [0,2,0,0,0,0|1,0,1]=4 4336 B16R0.221 C=COCCOCCOCCOCC(=O)OC 34a_100000039918_100000090808 [0,2,0,0,0,0|0,0,2]=4 4337 B16R0.221 C=COCCOCCOCCOCC(=O)OC 34a_100011023656_100000039644 [0,2,0,0,0,0|0,0,2]=4 4338 B16R0.221 C=COCCOCCOCCOCC(=O)OC 7a_100000039918_100000090808 [0,2,0,0,0,0|0,0,2]=4 4339 B16R0.221 C=COCCOCCOCCOCC(=O)OC 7a_100011023656_100000039644 [0,2,0,0,0,0|0,0,2]=4 4340 B16R0.221 CC#CCOCCOCCOCCC(=O)OC 34a_100010982084_100000748600 [0,2,0,0,0,0|1,0,1]=4 4341 B16R0.221 CC#CCOCCOCCOCCC(=O)OC 7a_100010982084_100000748600 [0,2,0,0,0,0|1,0,1]=4 4342 B16R0.221 CC=CCOCCOCCOCCC(=O)OC 34a_100010982084_100000070051 [0,2,0,0,0,0|1,0,1]=4 4343 B16R0.221 CC=CCOCCOCCOCCC(=O)OC 7a_100010982084_100000070051 [0,2,0,0,0,0|1,0,1]=4 4344 B16R0.221 CCC(=O)CCOCCOCCOCCOC 1458a_100000210414_100012349117 [0,2,0,0,0,0|1,0,0]=3 4345 B16R0.221 CCC(=O)CCOCCOCCOCCOC 1458a_100012359594_100000210202 [0,2,0,0,0,0|1,0,0]=3 4346 B16R0.221 CCC(C)CCCCCOCCOCCOC 7a_200000035636_100000695917 [0,2,0,0,0,0|2,0,0]=4 4347 B16R0.221 CCC(C)CCNCCOCCOCCOC 2230a_100020591266_100013367474 [0,2,0,0,0,0|2,0,0]=4 4348 B16R0.221 CCC(C)CCOCCOCCOCCOC 7a_100011215188_100013367474 [0,2,0,0,0,0|1,0,0]=3 4349 B16R0.221 CCCCCOCCOCCOCC(=O)OC 34a_100011023656_100000718602 [0,2,0,0,0,0|1,0,1]=4 4350 B16R0.221 CCCCCOCCOCCOCC(=O)OC 34a_100011215259_100000090808 [0,2,0,0,0,0|1,0,1]=4 4351 B16R0.221 CCCCCOCCOCCOCC(=O)OC 7a_100011023656_100000210326 [0,2,0,0,0,0|1,0,1]=4 4352 B16R0.221 CCCCCOCCOCCOCC(=O)OC 7a_100011215259_100000090808 [0,2,0,0,0,0|1,0,1]=4 4353 B16R0.221 CCCCOCCCOCCOCC(=O)OC 34a_200011215613_100000090808 [0,2,0,0,0,0|1,0,1]=4 4354 B16R0.221 CCCCOCCCOCCOCC(=O)OC 7a_200011215613_100000090808 [0,2,0,0,0,0|1,0,1]=4 4355 B16R0.221 CCCCOCCOCCCCCC(=O)OC 34a_100000074720_100000743108 [0,2,0,0,0,0|2,0,0]=4 4356 B16R0.221 CCCCOCCOCCCCCC(=O)OC 34a_100000210238_100009816466 [0,2,0,0,0,0|2,0,0]=4 4357 B16R0.221 CCCCOCCOCCCCCC(=O)OC 7a_100000074720_100000743108 [0,2,0,0,0,0|2,0,0]=4 4358 B16R0.221 CCCCOCCOCCCCCC(=O)OC 7a_100000210238_100009816466 [0,2,0,0,0,0|2,0,0]=4 4359 B16R0.221 CCCCOCCOCCOCCC(=O)NC 34a_100011215186_100012179268 [0,2,0,0,0,0|2,0,0]=4 4360 B16R0.221 CCCCOCCOCCOCCC(=O)NC 7a_100011215186_100000737683 [0,2,0,0,0,0|2,0,0]=4 4361 B16R0.221 CCCCOCCOCCOCCC(=O)OC 34a_100010982084_100000210210 [0,2,0,0,0,0|1,0,0]=3 4362 B16R0.221 CCCCOCCOCCOCCC(=O)OC 34a_100011215186_100000742370 [0,2,0,0,0,0|1,0,0]=3 4363 B16R0.221 CCCCOCCOCCOCCC(=O)OC 7a_100010982084_100000210211 [0,2,0,0,0,0|1,0,0]=3 4364 B16R0.221 CCCCOCCOCCOCCC(=O)OC 7a_100011215186_100000204255 [0,2,0,0,0,0|1,0,0]=3 4365 B16R0.221 CCN(C)CCOCCOCCOCCOC 2230a_100000225621_100012349117 [0,2,0,0,0,0|1,0,0]=3 4366 B16R0.221 CCN(C)CCOCCOCCOCCOC 269982a_100000225621_100012349117 [0,2,0,0,0,0|1,0,0]=3 4367 B16R0.221 CCOCCOCCNCCOCC(=O)OC 2230a_100102712874_100000090808 [0,2,0,0,0,0|1,0,1]=4 4368 B16R0.221 CCOCCOCCNCCOCC(=O)OC 34a_100102712874_100000090808 [0,2,0,0,0,0|1,0,1]=4 4369 B16R0.221 CCOCCOCCOCCCCC(=O)OC 34a_100000059025_100011211534 [0,2,0,0,0,0|1,0,1]=4 4370 B16R0.221 CCOCCOCCOCCCCC(=O)OC 34a_100000210240_100000204269 [0,2,0,0,0,0|1,0,1]=4 4371 B16R0.221 CCOCCOCCOCCCCC(=O)OC 7a_100000059025_100011211534 [0,2,0,0,0,0|1,0,1]=4 4372 B16R0.221 CCOCCOCCOCCCCC(=O)OC 7a_100000210240_100000204269 [0,2,0,0,0,0|1,0,1]=4 4373 B16R0.221 CCOCCOCCOCCNCC(=O)OC 2230a_100012282185_100000747449 [0,2,0,0,0,0|1,0,1]=4 4374 B16R0.221 CCOCCOCCOCCNCC(=O)OC 34a_100012282185_100000747449 [0,2,0,0,0,0|1,0,1]=4 4375 B16R0.221 CCOCCOCCOCCNCC(C)CC 2230a_100012282185_100000748023 [0,2,0,0,0,0|2,0,0]=4 4376 B16R0.221 CCOCCOCCOCCNCC(C)CC 270004a_100012282185_100000243153 [0,2,0,0,0,0|2,0,0]=4 4377 B16R0.221 CCOCCOCCOCCNCC(C)CC 34a_100012282185_100000748023 [0,2,0,0,0,0|2,0,0]=4 4378 B16R0.221 CCOCCOCCOCCNCC(O)CC 2230a_100012282185_100011218378 [0,2,0,0,0,0|2,0,0]=4 4379 B16R0.221 CCOCCOCCOCCNCC(O)CC 34a_100012282185_100011218378 [0,2,0,0,0,0|2,0,0]=4 4380 B16R0.221 CCOCCOCCOCCNC[C@@H](C)CC 2230a_100012282185_100009816398 [0,2,0,0,0,0|2,0,0]=4 4381 B16R0.221 CCOCCOCCOCCNC[C@@H](C)CC 34a_100012282185_100009816398 [0,2,0,0,0,0|2,0,0]=4 4382 B16R0.221 CCOCCOCCOCCOCC(=O)CC 7a_100000033264_100000747405 [0,2,0,0,0,0|1,0,1]=4 4383 B16R0.221 CCOCCOCCOCCOCC(=O)NC 34a_100000033264_100000183359 [0,2,0,0,0,0|1,0,1]=4 4384 B16R0.221 CCOCCOCCOCCOCC(=O)NC 7a_100000033264_100000183359 [0,2,0,0,0,0|1,0,1]=4 4385 B16R0.221 CCOCCOCCOCCOCC(=O)OC 34a_100000033264_100000747449 [0,2,0,0,0,0|0,0,1]=3 4386 B16R0.221 CCOCCOCCOCCOCC(=O)OC 34a_100000210240_100000090808 [0,2,0,0,0,0|0,0,1]=3 4387 B16R0.221 CCOCCOCCOCCOCC(=O)OC 34a_100011023656_100000210147 [0,2,0,0,0,0|0,0,1]=3 4388 B16R0.221 CCOCCOCCOCCOCC(=O)OC 7a_100000033264_100000747449 [0,2,0,0,0,0|0,0,1]=3 4389 B16R0.221 CCOCCOCCOCCOCC(=O)OC 7a_100000210240_100000090808 [0,2,0,0,0,0|0,0,1]=3 4390 B16R0.221 CCOCCOCCOCCOCC(=O)OC 7a_100011023656_100011215890 [0,2,0,0,0,0|0,0,1]=3 4391 B16R0.221 CCOCCOCCOCCOCC(C)CC 34a_100000033264_100000748023 [0,2,0,0,0,0|1,0,0]=3 4392 B16R0.221 CCOCCOCCOCCOCC(C)CC 7a_100000033264_100000748023 [0,2,0,0,0,0|1,0,0]=3 4393 B16R0.221 CCOCCOCCOCCOCC(O)CC 34a_100000033264_100011218378 [0,2,0,0,0,0|1,0,0]=3 4394 B16R0.221 CCOCCOCCOCCOCC(O)CC 7a_100000033264_100011218378 [0,2,0,0,0,0|1,0,0]=3 4395 B16R0.221 CCOCCOCCOCCOCC(O)CO 34a_100000033264_100011219619 [0,2,0,0,0,0|2,0,0]=4 4396 B16R0.221 CCOCCOCCOCCOCC(O)CO 7a_100000033264_100011219619 [0,2,0,0,0,0|2,0,0]=4 4397 B16R0.221 CCOCCOCCOCCOC[C@@H](C)CC 34a_100000033264_100009816398 [0,2,0,0,0,0|1,0,0]=3 4398 B16R0.221 CCOCCOCCOCCOC[C@@H](C)CC 7a_100000033264_100009816398 [0,2,0,0,0,0|1,0,0]=3 4399 B16R0.221 CCOCCOCCOCCOC[C@@H](C)CO 34a_100000033264_100000059175 [0,2,0,0,0,0|2,0,0]=4 4400 B16R0.221 CCOCCOCCOCCOC[C@@H](C)CO 7a_100000033264_100000059175 [0,2,0,0,0,0|2,0,0]=4 4401 B16R0.221 CCOCCOCCOCCOC[C@@H](O)CF 34a_100000033264_100015614560 [0,2,0,0,0,0|2,0,0]=4 4402 B16R0.221 CCOCCOCCOCCOC[C@@H](O)CF 7a_100000033264_100015614560 [0,2,0,0,0,0|2,0,0]=4 4403 B16R0.221 CCOCCOCCOCCOC[C@@H](O)CO 34a_100000033264_100009815848 [0,2,0,0,0,0|2,0,0]=4 4404 B16R0.221 CCOCCOCCOCCOC[C@@H](O)CO 7a_100000033264_100009815848 [0,2,0,0,0,0|2,0,0]=4 4405 B16R0.221 CCOCCOCCSCCOCC(=O)OC 62a_100000090808_100011211534 [0,2,0,0,0,0|0,1,1]=4 4406 B16R0.221 CCOCCOCCSCCOCC(=O)OC 62a_100011211534_100000090808 [0,2,0,0,0,0|0,1,1]=4 4407 B16R0.221 CCSCCOCCOCCOCC(=O)OC 34a_100011023656_100000757381 [0,2,0,0,0,0|0,1,1]=4 4408 B16R0.221 CCSCCOCCOCCOCC(=O)OC 7a_100011023656_100000757381 [0,2,0,0,0,0|0,1,1]=4 4409 B16R0.221 CNC(=O)CCNCCOCCOCCOC 2230a_100000738227_100013367474 [0,2,0,0,0,0|2,0,0]=4 4410 B16R0.221 CNC(=O)CCNCCOCCOCCOC 2230a_100012028300_100000737683 [0,2,0,0,0,0|2,0,0]=4 4411 B16R0.221 CNC(=O)CCNCCOCCOCCOC 34a_100000738227_100013367474 [0,2,0,0,0,0|2,0,0]=4 4412 B16R0.221 CNC(=O)CCNCCOCCOCCOC 34a_100012028300_100012179268 [0,2,0,0,0,0|2,0,0]=4 4413 B16R0.221 CNC(=O)CCOCCOCCOCCOC 11a_106832991635_100012359594 [0,2,0,0,0,0|1,0,0]=3 4414 B16R0.221 CNC(=O)CCOCCOCCOCCOC 1626a_100102657272_100012359594 [0,2,0,0,0,0|1,0,0]=3 4415 B16R0.221 CNC(=O)CCOCCOCCOCCOC 240690a_100102657272_100012359594 [0,2,0,0,0,0|1,0,0]=3 4416 B16R0.221 CNC(=O)CCOCCOCCOCCOC 34a_100000688194_100012179268 [0,2,0,0,0,0|1,0,0]=3 4417 B16R0.221 CNC(=O)CCOCCOCCOCCOC 34a_100000754576_100013367474 [0,2,0,0,0,0|1,0,0]=3 4418 B16R0.221 CNC(=O)CCOCCOCCOCCOC 527a_100102657272_100012359594 [0,2,0,0,0,0|1,0,0]=3 4419 B16R0.221 CNC(=O)CCOCCOCCOCCOC 7a_100000688194_100000737683 [0,2,0,0,0,0|1,0,0]=3 4420 B16R0.221 CNC(=O)CCSCCOCCOCCOC 62a_100000737683_100013367474 [0,2,0,0,0,0|1,1,0]=4 4421 B16R0.221 CNC(=O)CCSCCOCCOCCOC 62a_100013367474_100000737683 [0,2,0,0,0,0|1,1,0]=4 4422 B16R0.221 CNCCOCCOCCCCCC(=O)OC 34a_100000228057_100009816466 [0,2,0,0,0,0|2,0,0]=4 4423 B16R0.221 CNCCOCCOCCOCCC(=O)NC 34a_200014138305_100012179268 [0,2,0,0,0,0|2,0,0]=4 4424 B16R0.221 CNCCOCCOCCOCCC(=O)OC 34a_200014138305_100000742370 [0,2,0,0,0,0|1,0,0]=3 4425 B16R0.221 COC(=O)CCOCCOCCOCCC#N 7a_100010982084_100000184422 [0,2,0,0,0,0|2,0,0]=4 4426 B16R0.221 COC(=O)CCOCCOCCOCCCF 34a_100010982084_100011934791 [0,2,0,0,0,0|2,0,0]=4 4427 B16R0.221 COC(=O)CCOCCOCCOCCCF 7a_100010982084_100011934791 [0,2,0,0,0,0|2,0,0]=4 4428 B16R0.221 COC(=O)CCOCCOCCOCCCN 34a_100011996194_100000742370 [0,2,0,0,0,0|2,0,0]=4 4429 B16R0.221 COC(=O)CCOCCOCCOCCCO 34a_100010982084_100000230001 [0,2,0,0,0,0|2,0,0]=4 4430 B16R0.221 COC(=O)CCOCCOCCOCCCO 7a_100010982084_100011215043 [0,2,0,0,0,0|2,0,0]=4 4431 B16R0.221 COC(=O)CCOCCOCCOCCSC 34a_100010982084_100000212216 [0,2,0,0,0,0|0,1,0]=3 4432 B16R0.221 COC(=O)CCOCCOCCOCCSC 7a_100010982084_100000212216 [0,2,0,0,0,0|0,1,0]=3 4433 B16R0.221 COC(=O)COCCOCCOCCCCF 34a_100011023656_100000729493 [0,2,0,0,0,0|1,0,1]=4 4434 B16R0.221 COC(=O)COCCOCCOCCCCF 7a_100011023656_100000729493 [0,2,0,0,0,0|1,0,1]=4 4435 B16R0.221 COC(=O)COCCOCCOCCCCO 34a_100011023656_100011216708 [0,2,0,0,0,0|1,0,1]=4 4436 B16R0.221 COC(=O)COCCOCCOCCCCO 7a_100011023656_100000210776 [0,2,0,0,0,0|1,0,1]=4 4437 B16R0.221 COC(C)COCCOCCOCCN=[N+]=[N-] 34a_100000690652_100010820720 [0,2,0,0,0,0|2,0,0]=4 4438 B16R0.221 COCCCCCCOCCOCC(=O)OC 34a_200012092642_100000090808 [0,2,0,0,0,0|1,0,1]=4 4439 B16R0.221 COCCCCCCOCCOCC(=O)OC 7a_200012092642_100000090808 [0,2,0,0,0,0|1,0,1]=4 4440 B16R0.221 COCCCOCCOCCOCC(=O)OC 34a_100011023656_100000740836 [0,2,0,0,0,0|0,0,1]=3 4441 B16R0.221 COCCCOCCOCCOCC(=O)OC 7a_100011023656_100000740836 [0,2,0,0,0,0|0,0,1]=3 4442 B16R0.221 COCCOCCCCCCCCC(=O)OC 34a_100000035544_100011201679 [0,2,0,0,0,0|2,0,0]=4 4443 B16R0.221 COCCOCCCCCCCCC(=O)OC 34a_100000210237_100010282707 [0,2,0,0,0,0|2,0,0]=4 4444 B16R0.221 COCCOCCCCCCCCC(=O)OC 7a_100000035544_100000233755 [0,2,0,0,0,0|2,0,0]=4 4445 B16R0.221 COCCOCCCNCCOCC(=O)OC 2230a_100000206027_100000090808 [0,2,0,0,0,0|1,0,1]=4 4446 B16R0.221 COCCOCCCNCCOCC(=O)OC 34a_100000206027_100000090808 [0,2,0,0,0,0|1,0,1]=4 4447 B16R0.221 COCCOCCCOCCCCC(=O)OC 34a_100000059025_100011216529 [0,2,0,0,0,0|1,0,1]=4 4448 B16R0.221 COCCOCCCOCCCCC(=O)OC 7a_100000059025_100011216529 [0,2,0,0,0,0|1,0,1]=4 4449 B16R0.221 COCCOCCCSCCOCC(=O)OC 62a_100000090808_100011216529 [0,2,0,0,0,0|0,1,1]=4 4450 B16R0.221 COCCOCCCSCCOCC(=O)OC 62a_100011216529_100000090808 [0,2,0,0,0,0|0,1,1]=4 4451 B16R0.221 COCCOCCNCCCCCC(=O)OC 2230a_100000745349_100009816466 [0,2,0,0,0,0|2,0,0]=4 4452 B16R0.221 COCCOCCNCCCCCC(=O)OC 34a_100000745349_100009816466 [0,2,0,0,0,0|2,0,0]=4 4453 B16R0.221 COCCOCCOCCCCCC(=O)OC 34a_100000074720_100000695917 [0,2,0,0,0,0|1,0,0]=3 4454 B16R0.221 COCCOCCOCCCCCC(=O)OC 34a_100011215163_100009816466 [0,2,0,0,0,0|1,0,0]=3 4455 B16R0.221 COCCOCCOCCCCCC(=O)OC 7a_100000074720_100000695917 [0,2,0,0,0,0|1,0,0]=3 4456 B16R0.221 COCCOCCOCCCCCC(=O)OC 7a_100011215163_100009816466 [0,2,0,0,0,0|1,0,0]=3 4457 B16R0.221 COCCOCCOCCNCCC(=O)OC 2230a_100012028300_100000204255 [0,2,0,0,0,0|1,0,0]=3 4458 B16R0.221 COCCOCCOCCNCCC(=O)OC 34a_100012028300_100000742370 [0,2,0,0,0,0|1,0,0]=3 4459 B16R0.221 COCCOCCOCCNCCC(C)CO 2230a_106354213184_100013367474 [0,2,0,0,0,0|2,0,0]=4 4460 B16R0.221 COCCOCCOCCNCCC(C)CO 34a_106354213184_100013367474 [0,2,0,0,0,0|2,0,0]=4 4461 B16R0.221 COCCOCCOCCOCCC(=NO)N 34a_100000749954_100013367474 [0,2,0,0,0,0|2,0,0]=4 4462 B16R0.221 COCCOCCOCCOCCC(=O)CF 1458a_100012359594_100015361967 [0,2,0,0,0,0|1,0,0]=3 4463 B16R0.221 COCCOCCOCCOCCC(=O)CO 1458a_100000210174_100012349117 [0,2,0,0,0,0|1,0,0]=3 4464 B16R0.221 COCCOCCOCCOCCC(=O)OC 34a_100000688194_100000742370 [0,2,0,0,0,0|0,0,0]=2 4465 B16R0.221 COCCOCCOCCOCCC(=O)OC 34a_100010982084_100011201679 [0,2,0,0,0,0|0,0,0]=2 4466 B16R0.221 COCCOCCOCCOCCC(=O)OC 7a_100000688194_100000204255 [0,2,0,0,0,0|0,0,0]=2 4467 B16R0.221 COCCOCCOCCOCCC(=O)OC 7a_100010982084_100000233755 [0,2,0,0,0,0|0,0,0]=2 4468 B16R0.221 COCCOCCOCCOCCC(C)OC 7a_100000764861_100013367474 [0,2,0,0,0,0|0,0,0]=2 4469 B16R0.221 COCCOCCOCCSCCC(=O)OC 62a_100000204255_100013367474 [0,2,0,0,0,0|0,1,0]=3 4470 B16R0.221 COCCOCCOCCSCCC(=O)OC 62a_100013367474_100000204255 [0,2,0,0,0,0|0,1,0]=3 4471 B16R0.221 COCCOCCOCCSCOC(=O)OC 62a_100013367474_100000139417 [0,2,0,0,0,0|0,1,1]=4 4472 B16R0.221 COCCOCCSCCCCCC(=O)OC 62a_100000695917_100009816466 [0,2,0,0,0,0|1,1,0]=4 4473 B16R0.221 COCCOCCSCCCCCC(=O)OC 62a_100009816466_100000695917 [0,2,0,0,0,0|1,1,0]=4 4474 B16R0.274 C#CCCOCCOCCOCCOC(C)C 34a_200000035644_100000688953 [0,2,0,0,0,0|1,0,1]=4 4475 B16R0.274 C#CCCOCCOCCOCCOC(C)C 7a_200000035644_100000688953 [0,2,0,0,0,0|1,0,1]=4 4476 B16R0.274 C/C=C/COCCOCCOCCOC(C)C 34a_200000035644_100102629194 [0,2,0,0,0,0|1,0,1]=4 4477 B16R0.274 C/C=C/COCCOCCOCCOC(C)C 7a_200000035644_100102629194 [0,2,0,0,0,0|1,0,1]=4 4478 B16R0.274 C=C(C)CCNCCOCCOCCOCC 2230a_100012282185_100000730704 [0,2,0,0,0,0|2,0,0]=4 4479 B16R0.274 C=C(C)CCNCCOCCOCCOCC 34a_100012282185_100000730704 [0,2,0,0,0,0|2,0,0]=4 4480 B16R0.274 C=C(C)CCOCCOCCOCCOCC 34a_100000033264_100000730704 [0,2,0,0,0,0|1,0,0]=3 4481 B16R0.274 C=C(C)CCOCCOCCOCCOCC 7a_100000033264_100000730704 [0,2,0,0,0,0|1,0,0]=3 4482 B16R0.274 C=CCCOCCOCCOCCOC(C)C 34a_200000035644_100000754431 [0,2,0,0,0,0|1,0,1]=4 4483 B16R0.274 C=CCCOCCOCCOCCOC(C)C 7a_200000035644_100000754431 [0,2,0,0,0,0|1,0,1]=4 4484 B16R0.274 CC#CCOCCOCCOCCOC(C)C 34a_200000035644_100000748600 [0,2,0,0,0,0|1,0,1]=4 4485 B16R0.274 CC#CCOCCOCCOCCOC(C)C 7a_200000035644_100000748600 [0,2,0,0,0,0|1,0,1]=4 4486 B16R0.274 CC(=O)OCCOCCOCCOCCCN 34a_100011996194_100009814007 [0,2,0,0,0,0|2,0,0]=4 4487 B16R0.274 CC(=O)SCCOCCOCCOCCO[13CH3] 34a_100010172677_200025704644 [0,2,0,0,0,0|0,1,0]=3 4488 B16R0.274 CC(=O)SCCOCCOCCOCCO[13CH3] 7a_100010172677_200025704644 [0,2,0,0,0,0|0,1,0]=3 4489 B16R0.274 CC(C)OCCOCCOCCOCCC#N 7a_200000035644_100000184422 [0,2,0,0,0,0|2,0,0]=4 4490 B16R0.274 CC(C)OCCOCCOCCOCCCF 34a_200000035644_100011934791 [0,2,0,0,0,0|2,0,0]=4 4491 B16R0.274 CC(C)OCCOCCOCCOCCCF 7a_200000035644_100011934791 [0,2,0,0,0,0|2,0,0]=4 4492 B16R0.274 CC(C)OCCOCCOCCOCCCN 34a_100011996194_100000211751 [0,2,0,0,0,0|2,0,0]=4 4493 B16R0.274 CC(C)OCCOCCOCCOCCCO 34a_200000035644_100000230001 [0,2,0,0,0,0|2,0,0]=4 4494 B16R0.274 CC(C)OCCOCCOCCOCCCO 7a_200000035644_100011215043 [0,2,0,0,0,0|2,0,0]=4 4495 B16R0.274 CC(C)OCCOCCOCCOCCON 34a_200121571635_100000210206 [0,2,0,0,0,0|1,0,0]=3 4496 B16R0.274 CC=CCOCCOCCOCCOC(C)C 34a_200000035644_100000070051 [0,2,0,0,0,0|1,0,1]=4 4497 B16R0.274 CC=CCOCCOCCOCCOC(C)C 7a_200000035644_100000070051 [0,2,0,0,0,0|1,0,1]=4 4498 B16R0.274 CCCCCCCOCCOCCOC(=O)C 34a_100000210272_200000083610 [0,2,0,0,0,0|2,0,0]=4 4499 B16R0.274 CCCCCCCOCCOCCOC(=O)C 7a_100000210272_200000083610 [0,2,0,0,0,0|2,0,0]=4 4500 B16R0.274 CCCCOCCOCCCCCOC(=O)C 34a_100000210238_100000033007 [0,2,0,0,0,0|2,0,0]=4 4501 B16R0.274 CCCCOCCOCCCCCOC(=O)C 7a_100000210238_100000033007 [0,2,0,0,0,0|2,0,0]=4 4502 B16R0.274 CCCCOCCOCCOCCC=C(C)C 34a_100011215186_100011217483 [0,2,0,0,0,0|2,0,0]=4 4503 B16R0.274 CCCCOCCOCCOCCC=C(C)C 7a_100011215186_100011217483 [0,2,0,0,0,0|2,0,0]=4 4504 B16R0.274 CCCCOCCOCCOCCCC(=O)C 34a_100011215186_100000685027 [0,2,0,0,0,0|2,0,0]=4 4505 B16R0.274 CCCCOCCOCCOCCCC(=O)C 7a_100011215186_100011215641 [0,2,0,0,0,0|2,0,0]=4 4506 B16R0.274 CCCCOCCOCCOCCCC(C)C 34a_100011215186_100011214892 [0,2,0,0,0,0|2,0,0]=4 4507 B16R0.274 CCCCOCCOCCOCCCC(C)C 7a_100011215186_100011214892 [0,2,0,0,0,0|2,0,0]=4 4508 B16R0.274 CCCCOCCOCCOCCCC(C)O 34a_100011215186_200000718107 [0,2,0,0,0,0|2,0,0]=4 4509 B16R0.274 CCCCOCCOCCOCCCC(C)O 7a_100011215186_200000718107 [0,2,0,0,0,0|2,0,0]=4 4510 B16R0.274 CCCCOCCOCCOCCCN(C)C 7a_100011215186_100000757444 [0,2,0,0,0,0|2,0,0]=4 4511 B16R0.274 CCCCOCCOCCOCCNC(=O)C 7a_100011215186_100000189650 [0,2,0,0,0,0|2,0,0]=4 4512 B16R0.274 CCCCOCCOCCOCCOC(=O)C 34a_100000210238_200000083610 [0,2,0,0,0,0|1,0,0]=3 4513 B16R0.274 CCCCOCCOCCOCCOC(=O)C 34a_100011215186_100009814007 [0,2,0,0,0,0|1,0,0]=3 4514 B16R0.274 CCCCOCCOCCOCCOC(=O)C 7a_100000210238_200000083610 [0,2,0,0,0,0|1,0,0]=3 4515 B16R0.274 CCCCOCCOCCOCCOC(=O)C 7a_100011215186_100009814007 [0,2,0,0,0,0|1,0,0]=3 4516 B16R0.274 CCCCOCCOCCOCCOC(=O)N 34a_100011215186_200011214921 [0,2,0,0,0,0|1,0,1]=4 4517 B16R0.274 CCCCOCCOCCOCCOC(=O)N 7a_100011215186_200011214921 [0,2,0,0,0,0|1,0,1]=4 4518 B16R0.274 CCCCOCCOCCOCCOC(C)C 34a_100000700218_100000210206 [0,2,0,0,0,0|1,0,0]=3 4519 B16R0.274 CCCCOCCOCCOCCOC(C)C 34a_100011215186_100000211751 [0,2,0,0,0,0|1,0,0]=3 4520 B16R0.274 CCCCOCCOCCOCCOC(C)C 34a_200000035644_100000210210 [0,2,0,0,0,0|1,0,0]=3 4521 B16R0.274 CCCCOCCOCCOCCOC(C)C 7a_100000700218_100000210206 [0,2,0,0,0,0|1,0,0]=3 4522 B16R0.274 CCCCOCCOCCOCCOC(C)C 7a_100011215186_100000211751 [0,2,0,0,0,0|1,0,0]=3 4523 B16R0.274 CCCCOCCOCCOCCOC(C)C 7a_200000035644_100000210211 [0,2,0,0,0,0|1,0,0]=3 4524 B16R0.274 CCCCOCCOCCOCCSC(C)C 34a_100011215186_100000730970 [0,2,0,0,0,0|1,1,0]=4 4525 B16R0.274 CCCCOCCOCCOCCSC(C)C 7a_100011215186_100000730970 [0,2,0,0,0,0|1,1,0]=4 4526 B16R0.274 CCCCOCCSCCOCCOC(=O)C 62a_100000743108_200000083610 [0,2,0,0,0,0|1,1,0]=4 4527 B16R0.274 CCCCOCCSCCOCCOC(=O)C 62a_200000083610_100000743108 [0,2,0,0,0,0|1,1,0]=4 4528 B16R0.274 CCCCSCCOCCOCCOC(=O)C 34a_200000230436_200000083610 [0,2,0,0,0,0|1,1,0]=4 4529 B16R0.274 CCCCSCCOCCOCCOC(=O)C 7a_200000230436_200000083610 [0,2,0,0,0,0|1,1,0]=4 4530 B16R0.274 CCOCCOCCOCCCCCC(C)C 34a_100000210240_100000210682 [0,2,0,0,0,0|2,0,0]=4 4531 B16R0.274 CCOCCOCCOCCCCCC(C)C 34a_100011995859_100011211534 [0,2,0,0,0,0|2,0,0]=4 4532 B16R0.274 CCOCCOCCOCCCCCC(C)C 7a_100000210240_100000210682 [0,2,0,0,0,0|2,0,0]=4 4533 B16R0.274 CCOCCOCCOCCCCCC(C)C 7a_100011995859_100011211534 [0,2,0,0,0,0|2,0,0]=4 4534 B16R0.274 CCOCCOCCOCCNCCC(C)C 2230a_100012282185_100000210312 [0,2,0,0,0,0|2,0,0]=4 4535 B16R0.274 CCOCCOCCOCCNCCC(C)C 269862a_100012282185_100000185833 [0,2,0,0,0,0|2,0,0]=4 4536 B16R0.274 CCOCCOCCOCCNCCC(C)C 34a_100012282185_100000210312 [0,2,0,0,0,0|2,0,0]=4 4537 B16R0.274 CCOCCOCCOCCNCCC(C)O 2230a_100012282185_100012276601 [0,2,0,0,0,0|2,0,0]=4 4538 B16R0.274 CCOCCOCCOCCNCCC(C)O 34a_100012282185_100012276601 [0,2,0,0,0,0|2,0,0]=4 4539 B16R0.274 CCOCCOCCOCCOCC=C(C)C 34a_100000033264_100000761012 [0,2,0,0,0,0|1,0,1]=4 4540 B16R0.274 CCOCCOCCOCCOCC=C(C)C 7a_100000033264_100000761012 [0,2,0,0,0,0|1,0,1]=4 4541 B16R0.274 CCOCCOCCOCCOCCC(=O)C 7a_100000033264_100000053229 [0,2,0,0,0,0|1,0,0]=3 4542 B16R0.274 CCOCCOCCOCCOCCC(=O)N 34a_100000033264_100000731001 [0,2,0,0,0,0|2,0,0]=4 4543 B16R0.274 CCOCCOCCOCCOCCC(=O)N 7a_100000033264_100000744528 [0,2,0,0,0,0|2,0,0]=4 4544 B16R0.274 CCOCCOCCOCCOCCC(C)C 34a_100000033264_100000210312 [0,2,0,0,0,0|1,0,0]=3 4545 B16R0.274 CCOCCOCCOCCOCCC(C)C 7a_100000033264_100000210626 [0,2,0,0,0,0|1,0,0]=3 4546 B16R0.274 CCOCCOCCOCCOCCC(C)O 34a_100000033264_100012276601 [0,2,0,0,0,0|1,0,0]=3 4547 B16R0.274 CCOCCOCCOCCOCCC(C)O 7a_100000033264_100012276601 [0,2,0,0,0,0|1,0,0]=3 4548 B16R0.274 CCOCCOCCOCCOCCN(C)C 7a_100000033264_100000755713 [0,2,0,0,0,0|1,0,0]=3 4549 B16R0.274 CCOCCOCCOCCOCOC(=O)C 34a_100000033264_100009813279 [0,2,0,0,0,0|2,0,0]=4 4550 B16R0.274 CCOCCOCCOCCOCOC(C)C 34a_100000033264_100000709892 [0,2,0,0,0,0|2,0,0]=4 4551 B16R0.274 CNCCCCCOCCOCCOC(=O)C 34a_100000722520_200000083610 [0,2,0,0,0,0|2,0,0]=4 4552 B16R0.274 CNCCOCCOCCCCCOC(=O)C 34a_100000228057_100000033007 [0,2,0,0,0,0|2,0,0]=4 4553 B16R0.274 CNCCOCCOCCOCCC=C(C)C 34a_200014138305_100011217483 [0,2,0,0,0,0|2,0,0]=4 4554 B16R0.274 CNCCOCCOCCOCCCC(=O)C 34a_200014138305_100000685027 [0,2,0,0,0,0|2,0,0]=4 4555 B16R0.274 CNCCOCCOCCOCCCC(C)C 34a_200014138305_100011214892 [0,2,0,0,0,0|2,0,0]=4 4556 B16R0.274 CNCCOCCOCCOCCCC(C)O 34a_200014138305_200000718107 [0,2,0,0,0,0|2,0,0]=4 4557 B16R0.274 CNCCOCCOCCOCCOC(=O)C 34a_100000228057_200000083610 [0,2,0,0,0,0|1,0,0]=3 4558 B16R0.274 CNCCOCCOCCOCCOC(=O)C 34a_200014138305_100009814007 [0,2,0,0,0,0|1,0,0]=3 4559 B16R0.274 CNCCOCCOCCOCCOC(=O)N 34a_200014138305_200011214921 [0,2,0,0,0,0|1,0,1]=4 4560 B16R0.274 CNCCOCCOCCOCCOC(C)C 34a_100036875364_100000210206 [0,2,0,0,0,0|1,0,0]=3 4561 B16R0.274 CNCCOCCOCCOCCOC(C)C 34a_200014138305_100000211751 [0,2,0,0,0,0|1,0,0]=3 4562 B16R0.274 CNCCOCCOCCOCCSC(C)C 34a_200014138305_100000730970 [0,2,0,0,0,0|1,1,0]=4 4563 B16R0.274 COCCCCCNCCOCCOC(=O)C 2230a_100000747528_200000083610 [0,2,0,0,0,0|2,0,0]=4 4564 B16R0.274 COCCCCCNCCOCCOC(=O)C 34a_100000747528_200000083610 [0,2,0,0,0,0|2,0,0]=4 4565 B16R0.274 COCCOCCCNCOCCOC(=O)C 34a_100000206027_100000076355 [0,2,0,0,0,0|2,0,0]=4 4566 B16R0.274 COCCOCCCOCCCCCC(C)C 34a_100011995859_100011216529 [0,2,0,0,0,0|2,0,0]=4 4567 B16R0.274 COCCOCCCOCCCCCC(C)C 7a_100011995859_100011216529 [0,2,0,0,0,0|2,0,0]=4 4568 B16R0.274 COCCOCCCSCOCCOC(=O)C 62a_100000076355_100011216529 [0,2,0,0,0,0|2,0,0]=4 4569 B16R0.274 COCCOCCCSCOCCOC(=O)C 62a_100011216529_100000076355 [0,2,0,0,0,0|2,0,0]=4 4570 B16R0.274 COCCOCCNCCCCCOC(=O)C 2230a_100000745349_100009813381 [0,2,0,0,0,0|2,0,0]=4 4571 B16R0.274 COCCOCCNCCCCCOC(=O)C 34a_100000745349_100000033007 [0,2,0,0,0,0|2,0,0]=4 4572 B16R0.274 COCCOCCNCCOCCOC(=O)C 2230a_100000745349_200000083610 [0,2,0,0,0,0|1,0,0]=3 4573 B16R0.274 COCCOCCNCCOCCOC(=O)C 34a_100000745349_200000083610 [0,2,0,0,0,0|1,0,0]=3 4574 B16R0.274 COCCOCCOCCCCCNC(C)C 34a_100011629493_100000695917 [0,2,0,0,0,0|2,0,0]=4 4575 B16R0.274 COCCOCCOCCCCCOC(=O)C 34a_100011215163_100000033007 [0,2,0,0,0,0|1,0,0]=3 4576 B16R0.274 COCCOCCOCCCCCOC(=O)C 7a_100011215163_100000033007 [0,2,0,0,0,0|1,0,0]=3 4577 B16R0.274 COCCOCCOCCNCCC=C(C)C 2230a_100012028300_100011217483 [0,2,0,0,0,0|2,0,0]=4 4578 B16R0.274 COCCOCCOCCNCCC=C(C)C 34a_100012028300_100011217483 [0,2,0,0,0,0|2,0,0]=4 4579 B16R0.274 COCCOCCOCCNCCCC(=O)C 34a_100012028300_100000685027 [0,2,0,0,0,0|2,0,0]=4 4580 B16R0.274 COCCOCCOCCNCCCC(C)C 2230a_100012028300_100011214892 [0,2,0,0,0,0|2,0,0]=4 4581 B16R0.274 COCCOCCOCCNCCCC(C)C 2230a_200000737386_100013367474 [0,2,0,0,0,0|2,0,0]=4 4582 B16R0.274 COCCOCCOCCNCCCC(C)C 34a_100012028300_100011214892 [0,2,0,0,0,0|2,0,0]=4 4583 B16R0.274 COCCOCCOCCNCCCC(C)C 34a_200000737386_100013367474 [0,2,0,0,0,0|2,0,0]=4 4584 B16R0.274 COCCOCCOCCNCCCC(C)O 2230a_100012028300_200000718107 [0,2,0,0,0,0|2,0,0]=4 4585 B16R0.274 COCCOCCOCCNCCCC(C)O 34a_100012028300_200000718107 [0,2,0,0,0,0|2,0,0]=4 4586 B16R0.274 COCCOCCOCCNCCCS(=O)C 2230a_200000753449_100013367474 [0,2,0,0,0,0|1,1,0]=4 4587 B16R0.274 COCCOCCOCCNCCNC(=O)C 2230a_100000209853_100013367474 [0,2,0,0,0,0|2,0,0]=4 4588 B16R0.274 COCCOCCOCCNCCNC(=O)C 2230a_100012028300_100000189650 [0,2,0,0,0,0|2,0,0]=4 4589 B16R0.274 COCCOCCOCCNCCOC(=O)C 34a_100012028300_100009814007 [0,2,0,0,0,0|1,0,0]=3 4590 B16R0.274 COCCOCCOCCNCCOC(=O)N 34a_100012028300_200011214921 [0,2,0,0,0,0|1,0,1]=4 4591 B16R0.274 COCCOCCOCCNCCOC(C)C 2230a_100000701111_100013367474 [0,2,0,0,0,0|1,0,0]=3 4592 B16R0.274 COCCOCCOCCNCCOC(C)C 2230a_100012028300_100000211751 [0,2,0,0,0,0|1,0,0]=3 4593 B16R0.274 COCCOCCOCCNCCOC(C)C 34a_100000701111_100013367474 [0,2,0,0,0,0|1,0,0]=3 4594 B16R0.274 COCCOCCOCCNCCOC(C)C 34a_100012028300_100000211751 [0,2,0,0,0,0|1,0,0]=3 4595 B16R0.274 COCCOCCOCCNCCSC(C)C 2230a_100000731138_100013367474 [0,2,0,0,0,0|1,1,0]=4 4596 B16R0.274 COCCOCCOCCNCCSC(C)C 2230a_100012028300_100000730970 [0,2,0,0,0,0|1,1,0]=4 4597 B16R0.274 COCCOCCOCCNCCSC(C)C 34a_100000731138_100013367474 [0,2,0,0,0,0|1,1,0]=4 4598 B16R0.274 COCCOCCOCCNCCSC(C)C 34a_100012028300_100000730970 [0,2,0,0,0,0|1,1,0]=4 4599 B16R0.274 COCCOCCOCCOCCC=C(C)C 34a_100000688194_100011217483 [0,2,0,0,0,0|1,0,0]=3 4600 B16R0.274 COCCOCCOCCOCCC=C(C)C 7a_100000688194_100011217483 [0,2,0,0,0,0|1,0,0]=3 4601 B16R0.274 COCCOCCOCCOCCC=C(F)F 34a_100000688194_200009816681 [0,2,0,0,0,0|1,0,1]=4 4602 B16R0.274 COCCOCCOCCOCCC=C(F)F 7a_100000688194_200009816681 [0,2,0,0,0,0|1,0,1]=4 4603 B16R0.274 COCCOCCOCCOCCCC(=O)C 34a_100000688194_100000685027 [0,2,0,0,0,0|1,0,0]=3 4604 B16R0.274 COCCOCCOCCOCCCC(=O)C 34a_100000759063_100013367474 [0,2,0,0,0,0|1,0,0]=3 4605 B16R0.274 COCCOCCOCCOCCCC(=O)C 7a_100000688194_100011215641 [0,2,0,0,0,0|1,0,0]=3 4606 B16R0.274 COCCOCCOCCOCCCC(=O)C 7a_100000759063_100013367474 [0,2,0,0,0,0|1,0,0]=3 4607 B16R0.274 COCCOCCOCCOCCCC(=O)N 34a_100000688194_100102525003 [0,2,0,0,0,0|1,0,1]=4 4608 B16R0.274 COCCOCCOCCOCCCC(=O)N 7a_100000688194_100102525003 [0,2,0,0,0,0|1,0,1]=4 4609 B16R0.274 COCCOCCOCCOCCCC(C)C 34a_100000210774_100013367474 [0,2,0,0,0,0|1,0,0]=3 4610 B16R0.274 COCCOCCOCCOCCCC(C)C 34a_100000688194_100011214892 [0,2,0,0,0,0|1,0,0]=3 4611 B16R0.274 COCCOCCOCCOCCCC(C)C 7a_100000210774_100013367474 [0,2,0,0,0,0|1,0,0]=3 4612 B16R0.274 COCCOCCOCCOCCCC(C)C 7a_100000688194_100011214892 [0,2,0,0,0,0|1,0,0]=3 4613 B16R0.274 COCCOCCOCCOCCCC(C)O 34a_100000688194_200000718107 [0,2,0,0,0,0|1,0,0]=3 4614 B16R0.274 COCCOCCOCCOCCCC(C)O 7a_100000688194_200000718107 [0,2,0,0,0,0|1,0,0]=3 4615 B16R0.274 COCCOCCOCCOCCCN(C)C 7a_100000688194_100000757444 [0,2,0,0,0,0|1,0,0]=3 4616 B16R0.274 COCCOCCOCCOCCC[N+](=O)[O-] 34a_200000037920_100013367474 [0,2,0,0,0,0|2,0,0]=4 4617 B16R0.274 COCCOCCOCCOCCNC(=O)C 1626a_100012359593_100015343762 [0,2,0,0,0,0|1,0,0]=3 4618 B16R0.274 COCCOCCOCCOCCNC(=O)C 240690a_100012359593_100015343762 [0,2,0,0,0,0|1,0,0]=3 4619 B16R0.274 COCCOCCOCCOCCNC(=O)C 34a_100000158858_100013367474 [0,2,0,0,0,0|1,0,0]=3 4620 B16R0.274 COCCOCCOCCOCCNC(=O)C 7a_100000688194_100000189650 [0,2,0,0,0,0|1,0,0]=3 4621 B16R0.274 COCCOCCOCCOCCNC(=O)N 34a_100000181757_100013367474 [0,2,0,0,0,0|1,0,1]=4 4622 B16R0.274 COCCOCCOCCOCCNC(=O)N 7a_100000688194_200000034859 [0,2,0,0,0,0|1,0,1]=4 4623 B16R0.274 COCCOCCOCCOCCNC(C)C 2230a_100012359593_100000210206 [0,2,0,0,0,0|1,0,0]=3 4624 B16R0.274 COCCOCCOCCOCCNC(C)C 2230a_100138425928_100012349117 [0,2,0,0,0,0|1,0,0]=3 4625 B16R0.274 COCCOCCOCCOCCNC(C)C 34a_100000224655_100013367474 [0,2,0,0,0,0|1,0,0]=3 4626 B16R0.274 COCCOCCOCCOCCNC(C)C 34a_100012359593_100000210206 [0,2,0,0,0,0|1,0,0]=3 4627 B16R0.274 COCCOCCOCCOCCNC(C)C 34a_100138425928_100012349117 [0,2,0,0,0,0|1,0,0]=3 4628 B16R0.274 COCCOCCOCCOCCOC(=O)C 34a_100000688194_100009814007 [0,2,0,0,0,0|0,0,0]=2 4629 B16R0.274 COCCOCCOCCOCCOC(=O)C 34a_100011215163_200000083610 [0,2,0,0,0,0|0,0,0]=2 4630 B16R0.274 COCCOCCOCCOCCOC(=O)C 7a_100000688194_100009814007 [0,2,0,0,0,0|0,0,0]=2 4631 B16R0.274 COCCOCCOCCOCCOC(=O)C 7a_100011215163_200000083610 [0,2,0,0,0,0|0,0,0]=2 4632 B16R0.274 COCCOCCOCCOCCOC(=O)N 34a_100000688194_200011214921 [0,2,0,0,0,0|0,0,1]=3 4633 B16R0.274 COCCOCCOCCOCCOC(=O)N 7a_100000688194_200011214921 [0,2,0,0,0,0|0,0,1]=3 4634 B16R0.274 COCCOCCOCCOCCOC(=O)N 7a_100000766696_100013367474 [0,2,0,0,0,0|0,0,1]=3 4635 B16R0.274 COCCOCCOCCOCCOC(C)C 34a_100000211219_100013367474 [0,2,0,0,0,0|0,0,0]=2 4636 B16R0.274 COCCOCCOCCOCCOC(C)C 34a_100000212225_100012349117 [0,2,0,0,0,0|0,0,0]=2 4637 B16R0.274 COCCOCCOCCOCCOC(C)C 34a_100000688194_100000211751 [0,2,0,0,0,0|0,0,0]=2 4638 B16R0.274 COCCOCCOCCOCCOC(C)C 34a_100011218579_100000210206 [0,2,0,0,0,0|0,0,0]=2 4639 B16R0.274 COCCOCCOCCOCCOC(C)C 34a_200000035644_100011201679 [0,2,0,0,0,0|0,0,0]=2 4640 B16R0.274 COCCOCCOCCOCCOC(C)C 7a_100000211219_100013367474 [0,2,0,0,0,0|0,0,0]=2 4641 B16R0.274 COCCOCCOCCOCCOC(C)C 7a_100000688194_100000211751 [0,2,0,0,0,0|0,0,0]=2 4642 B16R0.274 COCCOCCOCCOCCOC(C)C 7a_100011218579_100000210206 [0,2,0,0,0,0|0,0,0]=2 4643 B16R0.274 COCCOCCOCCOCCOC(C)C 7a_200000035644_100000233755 [0,2,0,0,0,0|0,0,0]=2 4644 B16R0.274 COCCOCCOCCOCCSC(=O)C 34a_100010172677_200000210301 [0,2,0,0,0,0|0,1,0]=3 4645 B16R0.274 COCCOCCOCCOCCSC(=O)C 7a_100010172677_200000210301 [0,2,0,0,0,0|0,1,0]=3 4646 B16R0.274 COCCOCCOCCOCCSC(C)C 34a_100000688194_100000730970 [0,2,0,0,0,0|0,1,0]=3 4647 B16R0.274 COCCOCCOCCOCCSC(C)C 34a_200011212901_100013367474 [0,2,0,0,0,0|0,1,0]=3 4648 B16R0.274 COCCOCCOCCOCCSC(C)C 62a_100000210206_100012349117 [0,2,0,0,0,0|0,1,0]=3 4649 B16R0.274 COCCOCCOCCOCCSC(C)C 62a_100012349117_100000210206 [0,2,0,0,0,0|0,1,0]=3 4650 B16R0.274 COCCOCCOCCOCCSC(C)C 7a_100000688194_100000730970 [0,2,0,0,0,0|0,1,0]=3 4651 B16R0.274 COCCOCCOCCOCCSC(C)C 7a_200011212901_100013367474 [0,2,0,0,0,0|0,1,0]=3 4652 B16R0.274 COCCOCCOCCSCCC=C(C)C 62a_100011217483_100013367474 [0,2,0,0,0,0|1,1,0]=4 4653 B16R0.274 COCCOCCOCCSCCC=C(C)C 62a_100013367474_100011217483 [0,2,0,0,0,0|1,1,0]=4 4654 B16R0.274 COCCOCCOCCSCCCC(=O)C 62a_100011215641_100013367474 [0,2,0,0,0,0|1,1,0]=4 4655 B16R0.274 COCCOCCOCCSCCCC(=O)C 62a_100013367474_100011215641 [0,2,0,0,0,0|1,1,0]=4 4656 B16R0.274 COCCOCCOCCSCCCC(C)C 62a_100011214892_100013367474 [0,2,0,0,0,0|1,1,0]=4 4657 B16R0.274 COCCOCCOCCSCCCC(C)C 62a_100013367474_100011214892 [0,2,0,0,0,0|1,1,0]=4 4658 B16R0.274 COCCOCCOCCSCCCC(C)O 62a_100013367474_200000718107 [0,2,0,0,0,0|1,1,0]=4 4659 B16R0.274 COCCOCCOCCSCCCC(C)O 62a_200000718107_100013367474 [0,2,0,0,0,0|1,1,0]=4 4660 B16R0.274 COCCOCCOCCSCCCN(C)C 62a_100013367474_100000757444 [0,2,0,0,0,0|1,1,0]=4 4661 B16R0.274 COCCOCCOCCSCCNC(=O)C 62a_100000189650_100013367474 [0,2,0,0,0,0|1,1,0]=4 4662 B16R0.274 COCCOCCOCCSCCNC(=O)C 62a_100013367474_100000189650 [0,2,0,0,0,0|1,1,0]=4 4663 B16R0.274 COCCOCCOCCSCCOC(=O)C 62a_100009814007_100013367474 [0,2,0,0,0,0|0,1,0]=3 4664 B16R0.274 COCCOCCOCCSCCOC(=O)C 62a_100013367474_100009814007 [0,2,0,0,0,0|0,1,0]=3 4665 B16R0.274 COCCOCCOCCSCCOC(=O)N 62a_100013367474_200011214921 [0,2,0,0,0,0|0,1,1]=4 4666 B16R0.274 COCCOCCOCCSCCOC(=O)N 62a_200011214921_100013367474 [0,2,0,0,0,0|0,1,1]=4 4667 B16R0.274 COCCOCCOCCSCCOC(C)C 62a_100000211751_100013367474 [0,2,0,0,0,0|0,1,0]=3 4668 B16R0.274 COCCOCCOCCSCCOC(C)C 62a_100013367474_100000211751 [0,2,0,0,0,0|0,1,0]=3 4669 B16R0.274 COCCOCCOCCSCCSC(C)C 62a_100000730970_100013367474 [0,2,0,0,0,0|0,2,0]=4 4670 B16R0.274 COCCOCCOCCSCCSC(C)C 62a_100013367474_100000730970 [0,2,0,0,0,0|0,2,0]=4 4671 B16R0.274 COCCOCCSCCCCCOC(=O)C 62a_100000033007_100000695917 [0,2,0,0,0,0|1,1,0]=4 4672 B16R0.274 COCCOCCSCCCCCOC(=O)C 62a_100000695917_100000033007 [0,2,0,0,0,0|1,1,0]=4 4673 B16R0.274 COCCOCCSCCOCCOC(=O)C 62a_100000695917_200000083610 [0,2,0,0,0,0|0,1,0]=3 4674 B16R0.274 COCCOCCSCCOCCOC(=O)C 62a_200000083610_100000695917 [0,2,0,0,0,0|0,1,0]=3 4675 B16R0.274 CSCCOCCOCCOCCOC(C)C 34a_200000035644_100000212216 [0,2,0,0,0,0|0,1,0]=3 4676 B16R0.274 CSCCOCCOCCOCCOC(C)C 7a_200000035644_100000212216 [0,2,0,0,0,0|0,1,0]=3 4677 B16R0.303 C#CCCCCCCCOCCOCCOC 34a_100000054614_100000695917 [0,2,0,0,0,0|2,0,0]=4 4678 B16R0.303 C#CCCCCCCCOCCOCCOC 34a_100011215163_100153394163 [0,2,0,0,0,0|2,0,0]=4 4679 B16R0.303 C#CCCCCCCCOCCOCCOC 7a_100000054614_100000695917 [0,2,0,0,0,0|2,0,0]=4 4680 B16R0.303 C#CCCCCCCCOCCOCCOC 7a_100011215163_100153394163 [0,2,0,0,0,0|2,0,0]=4 4681 B16R0.303 C#CCCCCNCCOCCOCCOC 2230a_100000706060_100013367474 [0,2,0,0,0,0|2,0,0]=4 4682 B16R0.303 C#CCCCCNCCOCCOCCOC 2230a_100012028300_100010269958 [0,2,0,0,0,0|2,0,0]=4 4683 B16R0.303 C#CCCCCNCCOCCOCCOC 34a_100000706060_100013367474 [0,2,0,0,0,0|2,0,0]=4 4684 B16R0.303 C#CCCCCNCCOCCOCCOC 34a_100012028300_100010269958 [0,2,0,0,0,0|2,0,0]=4 4685 B16R0.303 C#CCCCCOCCOCCOCCCC 34a_100011215186_100010269958 [0,2,0,0,0,0|2,0,0]=4 4686 B16R0.303 C#CCCCCOCCOCCOCCCC 7a_100011215186_100010269958 [0,2,0,0,0,0|2,0,0]=4 4687 B16R0.303 C#CCCCCOCCOCCOCCNC 34a_200014138305_100010269958 [0,2,0,0,0,0|2,0,0]=4 4688 B16R0.303 C#CCCCCOCCOCCOCCOC 34a_100000688194_100010269958 [0,2,0,0,0,0|1,0,0]=3 4689 B16R0.303 C#CCCCCOCCOCCOCCOC 34a_100000766709_100013367474 [0,2,0,0,0,0|1,0,0]=3 4690 B16R0.303 C#CCCCCOCCOCCOCCOC 7a_100000688194_100010269958 [0,2,0,0,0,0|1,0,0]=3 4691 B16R0.303 C#CCCCCOCCOCCOCCOC 7a_100000766709_100013367474 [0,2,0,0,0,0|1,0,0]=3 4692 B16R0.303 C#CCCCCSCCOCCOCCOC 62a_100010269958_100013367474 [0,2,0,0,0,0|1,1,0]=4 4693 B16R0.303 C#CCCCCSCCOCCOCCOC 62a_100013367474_100010269958 [0,2,0,0,0,0|1,1,0]=4 4694 B16R0.303 C#CCCCOCCOCCOCCOCC 34a_100000033264_100000695029 [0,2,0,0,0,0|1,0,1]=4 4695 B16R0.303 C#CCCCOCCOCCOCCOCC 7a_100000033264_100011215417 [0,2,0,0,0,0|1,0,1]=4 4696 B16R0.303 C#CCCOCCOCCOCCOCC#C 34a_100009872019_100000688953 [0,2,0,0,0,0|1,0,1]=4 4697 B16R0.303 C#CCCOCCOCCOCCOCC#C 34a_100011215631_100020624644 [0,2,0,0,0,0|1,0,1]=4 4698 B16R0.303 C#CCCOCCOCCOCCOCC#C 7a_100009872019_100000688953 [0,2,0,0,0,0|1,0,1]=4 4699 B16R0.303 C#CCCOCCOCCOCCOCCBr 34a_100010132935_100000688953 [0,2,0,0,0,0|1,0,1]=4 4700 B16R0.303 C#CCCOCCOCCOCCOCCBr 7a_100010132935_100000688953 [0,2,0,0,0,0|1,0,1]=4 4701 B16R0.303 C#CCCOCCOCCOCCOCCCl 34a_100010166562_100000688953 [0,2,0,0,0,0|1,0,1]=4 4702 B16R0.303 C#CCCOCCOCCOCCOCCCl 7a_100010166562_100000688953 [0,2,0,0,0,0|1,0,1]=4 4703 B16R0.303 C#CCCOCCOCCOCCOCCN 34a_103437854208_100000688953 [0,2,0,0,0,0|1,0,1]=4 4704 B16R0.303 C#CCCOCCOCCOCCOCCO 34a_100011215631_100010166562 [0,2,0,0,0,0|1,0,1]=4 4705 B16R0.303 C#CCNCCOCCOCCOCCOC 2230a_100012359593_100000038162 [0,2,0,0,0,0|1,0,0]=3 4706 B16R0.303 C#CCNCCOCCOCCOCCOC 34a_100000212058_100012349117 [0,2,0,0,0,0|1,0,0]=3 4707 B16R0.303 C#CCNCCOCCOCCOCCOC 34a_100012359593_100000184674 [0,2,0,0,0,0|1,0,0]=3 4708 B16R0.303 C#CCOCCNCCOCCOCCOC 2230a_100000700922_100013367474 [0,2,0,0,0,0|1,0,0]=3 4709 B16R0.303 C#CCOCCNCCOCCOCCOC 2230a_100012028300_100010402529 [0,2,0,0,0,0|1,0,0]=3 4710 B16R0.303 C#CCOCCNCCOCCOCCOC 34a_100000700922_100013367474 [0,2,0,0,0,0|1,0,0]=3 4711 B16R0.303 C#CCOCCNCCOCCOCCOC 34a_100012028300_100010402529 [0,2,0,0,0,0|1,0,0]=3 4712 B16R0.303 C#CCOCCOCCNCCCCCOC 2230a_100000747528_100010408581 [0,2,0,0,0,0|2,0,0]=4 4713 B16R0.303 C#CCOCCOCCNCCCCCOC 34a_100000747528_100010408581 [0,2,0,0,0,0|2,0,0]=4 4714 B16R0.303 C#CCOCCOCCNCCOCCCC 2230a_100000056377_100000743108 [0,2,0,0,0,0|2,0,0]=4 4715 B16R0.303 C#CCOCCOCCNCCOCCCC 34a_100000056377_100000743108 [0,2,0,0,0,0|2,0,0]=4 4716 B16R0.303 C#CCOCCOCCNCCOCCOC 2230a_100000056377_100000695917 [0,2,0,0,0,0|1,0,0]=3 4717 B16R0.303 C#CCOCCOCCNCCOCCOC 2230a_100000745349_100010408581 [0,2,0,0,0,0|1,0,0]=3 4718 B16R0.303 C#CCOCCOCCNCCOCCOC 34a_100000056377_100000695917 [0,2,0,0,0,0|1,0,0]=3 4719 B16R0.303 C#CCOCCOCCNCCOCCOC 34a_100000745349_100010408581 [0,2,0,0,0,0|1,0,0]=3 4720 B16R0.303 C#CCOCCOCCOCCCCCCC 34a_100000041007_100000210614 [0,2,0,0,0,0|2,0,0]=4 4721 B16R0.303 C#CCOCCOCCOCCCCCCC 34a_100000210272_100010408581 [0,2,0,0,0,0|2,0,0]=4 4722 B16R0.303 C#CCOCCOCCOCCCCCCC 7a_100000041007_100000210614 [0,2,0,0,0,0|2,0,0]=4 4723 B16R0.303 C#CCOCCOCCOCCCCCCC 7a_100000210272_100010408581 [0,2,0,0,0,0|2,0,0]=4 4724 B16R0.303 C#CCOCCOCCOCCCCCNC 34a_100000722520_100010408581 [0,2,0,0,0,0|2,0,0]=4 4725 B16R0.303 C#CCOCCOCCOCCNCCCC 2230a_100000102301_100020624644 [0,2,0,0,0,0|2,0,0]=4 4726 B16R0.303 C#CCOCCOCCOCCNCCCC 2230a_100009980927_100000210211 [0,2,0,0,0,0|2,0,0]=4 4727 B16R0.303 C#CCOCCOCCOCCNCCCC 34a_100009980927_100000210210 [0,2,0,0,0,0|2,0,0]=4 4728 B16R0.303 C#CCOCCOCCOCCNCCCC 7a_106832991798_100020624644 [0,2,0,0,0,0|2,0,0]=4 4729 B16R0.303 C#CCOCCOCCOCCNCCOC 2230a_100000209980_100020624644 [0,2,0,0,0,0|1,0,0]=3 4730 B16R0.303 C#CCOCCOCCOCCNCCOC 2230a_100009980927_100011201679 [0,2,0,0,0,0|1,0,0]=3 4731 B16R0.303 C#CCOCCOCCOCCNCCOC 34a_100009980927_100011201679 [0,2,0,0,0,0|1,0,0]=3 4732 B16R0.303 C#CCOCCOCCOCCNCCSC 2230a_100009980927_100000751147 [0,2,0,0,0,0|1,1,0]=4 4733 B16R0.303 C#CCOCCOCCOCCNCCSC 2230a_100020590264_100020624644 [0,2,0,0,0,0|1,1,0]=4 4734 B16R0.303 C#CCOCCOCCOCCNCCSC 34a_100009980927_100000212216 [0,2,0,0,0,0|1,1,0]=4 4735 B16R0.303 C#CCOCCOCCOCCOC/C=C/C 34a_100009872019_100102629194 [0,2,0,0,0,0|1,0,1]=4 4736 B16R0.303 C#CCOCCOCCOCCOC/C=C/C 34a_100016270725_100020624644 [0,2,0,0,0,0|1,0,1]=4 4737 B16R0.303 C#CCOCCOCCOCCOC/C=C/C 7a_100009872019_100102629194 [0,2,0,0,0,0|1,0,1]=4 4738 B16R0.303 C#CCOCCOCCOCCOCC#CC 34a_100000761923_100020624644 [0,2,0,0,0,0|1,0,1]=4 4739 B16R0.303 C#CCOCCOCCOCCOCC#CC 34a_100009872019_100000748600 [0,2,0,0,0,0|1,0,1]=4 4740 B16R0.303 C#CCOCCOCCOCCOCC#CC 7a_100009872019_100000748600 [0,2,0,0,0,0|1,0,1]=4 4741 B16R0.303 C#CCOCCOCCOCCOCC=CC 34a_100009872019_100000070051 [0,2,0,0,0,0|1,0,1]=4 4742 B16R0.303 C#CCOCCOCCOCCOCC=CC 7a_100009872019_100000070051 [0,2,0,0,0,0|1,0,1]=4 4743 B16R0.303 C#CCOCCOCCOCCOCCC#N 7a_100009872019_100000184422 [0,2,0,0,0,0|2,0,0]=4 4744 B16R0.303 C#CCOCCOCCOCCOCCC=C 34a_100009872019_100000754431 [0,2,0,0,0,0|1,0,1]=4 4745 B16R0.303 C#CCOCCOCCOCCOCCC=C 34a_100011205117_100020624644 [0,2,0,0,0,0|1,0,1]=4 4746 B16R0.303 C#CCOCCOCCOCCOCCC=C 7a_100009872019_100000754431 [0,2,0,0,0,0|1,0,1]=4 4747 B16R0.303 C#CCOCCOCCOCCOCCCBr 34a_100011217188_100020624644 [0,2,0,0,0,0|2,0,0]=4 4748 B16R0.303 C#CCOCCOCCOCCOCCCC 34a_100000041007_100000743108 [0,2,0,0,0,0|1,0,0]=3 4749 B16R0.303 C#CCOCCOCCOCCOCCCC 34a_100000210227_100020624644 [0,2,0,0,0,0|1,0,0]=3 4750 B16R0.303 C#CCOCCOCCOCCOCCCC 34a_100000210238_100010408581 [0,2,0,0,0,0|1,0,0]=3 4751 B16R0.303 C#CCOCCOCCOCCOCCCC 34a_100000700218_100000184674 [0,2,0,0,0,0|1,0,0]=3 4752 B16R0.303 C#CCOCCOCCOCCOCCCC 34a_100009872019_100000210210 [0,2,0,0,0,0|1,0,0]=3 4753 B16R0.303 C#CCOCCOCCOCCOCCCC 34a_100011215186_100010402529 [0,2,0,0,0,0|1,0,0]=3 4754 B16R0.303 C#CCOCCOCCOCCOCCCC 7a_100000041007_100000743108 [0,2,0,0,0,0|1,0,0]=3 4755 B16R0.303 C#CCOCCOCCOCCOCCCC 7a_100000210227_100020624644 [0,2,0,0,0,0|1,0,0]=3 4756 B16R0.303 C#CCOCCOCCOCCOCCCC 7a_100000210238_100010408581 [0,2,0,0,0,0|1,0,0]=3 4757 B16R0.303 C#CCOCCOCCOCCOCCCC 7a_100000700218_100000038162 [0,2,0,0,0,0|1,0,0]=3 4758 B16R0.303 C#CCOCCOCCOCCOCCCC 7a_100009872019_100000210211 [0,2,0,0,0,0|1,0,0]=3 4759 B16R0.303 C#CCOCCOCCOCCOCCCC 7a_100011215186_100010402529 [0,2,0,0,0,0|1,0,0]=3 4760 B16R0.303 C#CCOCCOCCOCCOCCCCl 34a_100000230001_100020624644 [0,2,0,0,0,0|2,0,0]=4 4761 B16R0.303 C#CCOCCOCCOCCOCCCF 34a_100000759539_100020624644 [0,2,0,0,0,0|2,0,0]=4 4762 B16R0.303 C#CCOCCOCCOCCOCCCF 34a_100009872019_100011934791 [0,2,0,0,0,0|2,0,0]=4 4763 B16R0.303 C#CCOCCOCCOCCOCCCF 7a_100009872019_100011934791 [0,2,0,0,0,0|2,0,0]=4 4764 B16R0.303 C#CCOCCOCCOCCOCCCN 34a_100000182051_100020624644 [0,2,0,0,0,0|2,0,0]=4 4765 B16R0.303 C#CCOCCOCCOCCOCCCN 34a_100011996194_100010402529 [0,2,0,0,0,0|2,0,0]=4 4766 B16R0.303 C#CCOCCOCCOCCOCCCO 34a_100009872019_100000230001 [0,2,0,0,0,0|2,0,0]=4 4767 B16R0.303 C#CCOCCOCCOCCOCCCO 7a_100009872019_100011215043 [0,2,0,0,0,0|2,0,0]=4 4768 B16R0.303 C#CCOCCOCCOCCOCCNC 2230a_100010371074_200000210301 [0,2,0,0,0,0|1,0,0]=3 4769 B16R0.303 C#CCOCCOCCOCCOCCNC 2230a_106832991635_100020624645 [0,2,0,0,0,0|1,0,0]=3 4770 B16R0.303 C#CCOCCOCCOCCOCCNC 34a_100000228057_100010408581 [0,2,0,0,0,0|1,0,0]=3 4771 B16R0.303 C#CCOCCOCCOCCOCCNC 34a_100010371074_200000210301 [0,2,0,0,0,0|1,0,0]=3 4772 B16R0.303 C#CCOCCOCCOCCOCCNC 34a_100036875364_100000184674 [0,2,0,0,0,0|1,0,0]=3 4773 B16R0.303 C#CCOCCOCCOCCOCCNC 34a_100102657272_100020624645 [0,2,0,0,0,0|1,0,0]=3 4774 B16R0.303 C#CCOCCOCCOCCOCCNC 34a_200014138305_100010402529 [0,2,0,0,0,0|1,0,0]=3 4775 B16R0.303 C#CCOCCOCCOCCOCCNC 7a_106832991635_100020624645 [0,2,0,0,0,0|1,0,0]=3 4776 B16R0.303 C#CCOCCOCCOCCOCCN[13CH3] 2230a_100010371074_200025704644 [0,2,0,0,0,0|1,0,0]=3 4777 B16R0.303 C#CCOCCOCCOCCOCCN[13CH3] 34a_100010371074_200025704644 [0,2,0,0,0,0|1,0,0]=3 4778 B16R0.303 C#CCOCCOCCOCCOCCOC 34a_100000041007_100000695917 [0,2,0,0,0,0|0,0,0]=2 4779 B16R0.303 C#CCOCCOCCOCCOCCOC 34a_100000054580_100013367474 [0,2,0,0,0,0|0,0,0]=2 4780 B16R0.303 C#CCOCCOCCOCCOCCOC 34a_100000210237_100020624644 [0,2,0,0,0,0|0,0,0]=2 4781 B16R0.303 C#CCOCCOCCOCCOCCOC 34a_100000210247_100012349117 [0,2,0,0,0,0|0,0,0]=2 4782 B16R0.303 C#CCOCCOCCOCCOCCOC 34a_100000688194_100010402529 [0,2,0,0,0,0|0,0,0]=2 4783 B16R0.303 C#CCOCCOCCOCCOCCOC 34a_100009872019_100011201679 [0,2,0,0,0,0|0,0,0]=2 4784 B16R0.303 C#CCOCCOCCOCCOCCOC 34a_100010365481_200000210301 [0,2,0,0,0,0|0,0,0]=2 4785 B16R0.303 C#CCOCCOCCOCCOCCOC 34a_100011215163_100010408581 [0,2,0,0,0,0|0,0,0]=2 4786 B16R0.303 C#CCOCCOCCOCCOCCOC 34a_100011218579_100000184674 [0,2,0,0,0,0|0,0,0]=2 4787 B16R0.303 C#CCOCCOCCOCCOCCOC 34a_100138415774_100020624645 [0,2,0,0,0,0|0,0,0]=2 4788 B16R0.303 C#CCOCCOCCOCCOCCOC 7a_100000041007_100000695917 [0,2,0,0,0,0|0,0,0]=2 4789 B16R0.303 C#CCOCCOCCOCCOCCOC 7a_100000054580_100013367474 [0,2,0,0,0,0|0,0,0]=2 4790 B16R0.303 C#CCOCCOCCOCCOCCOC 7a_100000688194_100010402529 [0,2,0,0,0,0|0,0,0]=2 4791 B16R0.303 C#CCOCCOCCOCCOCCOC 7a_100009872019_100000233755 [0,2,0,0,0,0|0,0,0]=2 4792 B16R0.303 C#CCOCCOCCOCCOCCOC 7a_100010365481_200000210301 [0,2,0,0,0,0|0,0,0]=2 4793 B16R0.303 C#CCOCCOCCOCCOCCOC 7a_100011215163_100010408581 [0,2,0,0,0,0|0,0,0]=2 4794 B16R0.303 C#CCOCCOCCOCCOCCOC 7a_100011218579_100000038162 [0,2,0,0,0,0|0,0,0]=2 4795 B16R0.303 C#CCOCCOCCOCCOCCON 34a_100000700252_100020624644 [0,2,0,0,0,0|1,0,0]=3 4796 B16R0.303 C#CCOCCOCCOCCOCCON 34a_200121571635_100000184674 [0,2,0,0,0,0|1,0,0]=3 4797 B16R0.303 C#CCOCCOCCOCCOCCO[13CH3] 34a_100010365481_200025704644 [0,2,0,0,0,0|0,0,0]=2 4798 B16R0.303 C#CCOCCOCCOCCOCCO[13CH3] 7a_100010365481_200025704644 [0,2,0,0,0,0|0,0,0]=2 4799 B16R0.303 C#CCOCCOCCOCCOCCSC 34a_100000230434_100020624644 [0,2,0,0,0,0|0,1,0]=3 4800 B16R0.303 C#CCOCCOCCOCCOCCSC 34a_100009872019_100000212216 [0,2,0,0,0,0|0,1,0]=3 4801 B16R0.303 C#CCOCCOCCOCCOCCSC 62a_100020624645_200000210301 [0,2,0,0,0,0|0,1,0]=3 4802 B16R0.303 C#CCOCCOCCOCCOCCSC 62a_200000210301_100020624645 [0,2,0,0,0,0|0,1,0]=3 4803 B16R0.303 C#CCOCCOCCOCCOCCSC 7a_100000230434_100020624644 [0,2,0,0,0,0|0,1,0]=3 4804 B16R0.303 C#CCOCCOCCOCCOCCSC 7a_100009872019_100000212216 [0,2,0,0,0,0|0,1,0]=3 4805 B16R0.303 C#CCOCCOCCOCCOCCS[13CH3] 62a_100020624645_200025704644 [0,2,0,0,0,0|0,1,0]=3 4806 B16R0.303 C#CCOCCOCCOCCOCCS[13CH3] 62a_200025704644_100020624645 [0,2,0,0,0,0|0,1,0]=3 4807 B16R0.303 C#CCOCCOCCOCCSCCCC 34a_200000230436_100010408581 [0,2,0,0,0,0|1,1,0]=4 4808 B16R0.303 C#CCOCCOCCOCCSCCCC 62a_100000210211_100020624644 [0,2,0,0,0,0|1,1,0]=4 4809 B16R0.303 C#CCOCCOCCOCCSCCCC 62a_100020624644_100000210210 [0,2,0,0,0,0|1,1,0]=4 4810 B16R0.303 C#CCOCCOCCOCCSCCCC 7a_200000230436_100010408581 [0,2,0,0,0,0|1,1,0]=4 4811 B16R0.303 C#CCOCCOCCOCCSCCOC 62a_100000233755_100020624644 [0,2,0,0,0,0|0,1,0]=3 4812 B16R0.303 C#CCOCCOCCOCCSCCOC 62a_100020624644_100000233755 [0,2,0,0,0,0|0,1,0]=3 4813 B16R0.303 C#CCOCCOCCOCCSCCSC 62a_100000212216_100020624644 [0,2,0,0,0,0|0,2,0]=4 4814 B16R0.303 C#CCOCCOCCOCCSCCSC 62a_100020624644_100000751147 [0,2,0,0,0,0|0,2,0]=4 4815 B16R0.303 C#CCOCCOCCSCCOCCCC 62a_100000743108_100010408581 [0,2,0,0,0,0|1,1,0]=4 4816 B16R0.303 C#CCOCCOCCSCCOCCCC 62a_100010408581_100000743108 [0,2,0,0,0,0|1,1,0]=4 4817 B16R0.303 C#CCOCCOCCSCCOCCOC 62a_100000695917_100010408581 [0,2,0,0,0,0|0,1,0]=3 4818 B16R0.303 C#CCOCCOCCSCCOCCOC 62a_100010408581_100000695917 [0,2,0,0,0,0|0,1,0]=3 4819 B16R0.303 C#CCOCCSCCOCCOCCOC 62a_100010402529_100013367474 [0,2,0,0,0,0|0,1,0]=3 4820 B16R0.303 C#CCOCCSCCOCCOCCOC 62a_100013367474_100010402529 [0,2,0,0,0,0|0,1,0]=3 4821 B16R0.303 C#CCSCCOCCOCCOCCOC 62a_100000038162_100012349117 [0,2,0,0,0,0|0,1,0]=3 4822 B16R0.303 C/C=C/C=C/COCCOCCOCCOC 34a_100016283227_100013367474 [0,2,0,0,0,0|1,0,1]=4 4823 B16R0.303 C/C=C/COCCOCCOCCOCCBr 34a_100010132935_100102629194 [0,2,0,0,0,0|1,0,1]=4 4824 B16R0.303 C/C=C/COCCOCCOCCOCCBr 7a_100010132935_100102629194 [0,2,0,0,0,0|1,0,1]=4 4825 B16R0.303 C/C=C/COCCOCCOCCOCCCl 34a_100010166562_100102629194 [0,2,0,0,0,0|1,0,1]=4 4826 B16R0.303 C/C=C/COCCOCCOCCOCCCl 7a_100010166562_100102629194 [0,2,0,0,0,0|1,0,1]=4 4827 B16R0.303 C/C=C/COCCOCCOCCOCCN 34a_103437854208_100102629194 [0,2,0,0,0,0|1,0,1]=4 4828 B16R0.303 C/C=C/COCCOCCOCCOCCO 34a_100016270725_100010166562 [0,2,0,0,0,0|1,0,1]=4 4829 B16R0.303 C=CCCCCCCCOCCOCCOC 34a_100000730831_100000695917 [0,2,0,0,0,0|2,0,0]=4 4830 B16R0.303 C=CCCCCCCCOCCOCCOC 34a_100011215163_100012355270 [0,2,0,0,0,0|2,0,0]=4 4831 B16R0.303 C=CCCCCCCCOCCOCCOC 7a_100000730831_100000695917 [0,2,0,0,0,0|2,0,0]=4 4832 B16R0.303 C=CCCCCCCCOCCOCCOC 7a_100011215163_100012355270 [0,2,0,0,0,0|2,0,0]=4 4833 B16R0.303 C=CCCCCNCCOCCOCCOC 2230a_100000703577_100013367474 [0,2,0,0,0,0|2,0,0]=4 4834 B16R0.303 C=CCCCCNCCOCCOCCOC 2230a_100012028300_100011215482 [0,2,0,0,0,0|2,0,0]=4 4835 B16R0.303 C=CCCCCNCCOCCOCCOC 34a_100000703577_100013367474 [0,2,0,0,0,0|2,0,0]=4 4836 B16R0.303 C=CCCCCNCCOCCOCCOC 34a_100012028300_100011215482 [0,2,0,0,0,0|2,0,0]=4 4837 B16R0.303 C=CCCCCOCCOCCOCCCC 34a_100011215186_100011215482 [0,2,0,0,0,0|2,0,0]=4 4838 B16R0.303 C=CCCCCOCCOCCOCCCC 7a_100011215186_100011215482 [0,2,0,0,0,0|2,0,0]=4 4839 B16R0.303 C=CCCCCOCCOCCOCCNC 34a_200014138305_100011215482 [0,2,0,0,0,0|2,0,0]=4 4840 B16R0.303 C=CCCCCOCCOCCOCCOC 34a_100000688194_100011215482 [0,2,0,0,0,0|1,0,0]=3 4841 B16R0.303 C=CCCCCOCCOCCOCCOC 34a_100000766645_100013367474 [0,2,0,0,0,0|1,0,0]=3 4842 B16R0.303 C=CCCCCOCCOCCOCCOC 7a_100000688194_100011215482 [0,2,0,0,0,0|1,0,0]=3 4843 B16R0.303 C=CCCCCOCCOCCOCCOC 7a_100000766645_100013367474 [0,2,0,0,0,0|1,0,0]=3 4844 B16R0.303 C=CCCCCSCCOCCOCCOC 62a_100011215482_100013367474 [0,2,0,0,0,0|1,1,0]=4 4845 B16R0.303 C=CCCCCSCCOCCOCCOC 62a_100013367474_100011215482 [0,2,0,0,0,0|1,1,0]=4 4846 B16R0.303 C=CCCCOCCOCCOCCOCC 34a_100000033264_100000757094 [0,2,0,0,0,0|1,0,1]=4 4847 B16R0.303 C=CCCCOCCOCCOCCOCC 7a_100000033264_100000757094 [0,2,0,0,0,0|1,0,1]=4 4848 B16R0.303 C=CCCOCCOCCOCCOCCBr 34a_100010132935_100000754431 [0,2,0,0,0,0|1,0,1]=4 4849 B16R0.303 C=CCCOCCOCCOCCOCCBr 7a_100010132935_100000754431 [0,2,0,0,0,0|1,0,1]=4 4850 B16R0.303 C=CCCOCCOCCOCCOCCCl 34a_100010166562_100000754431 [0,2,0,0,0,0|1,0,1]=4 4851 B16R0.303 C=CCCOCCOCCOCCOCCCl 7a_100010166562_100000754431 [0,2,0,0,0,0|1,0,1]=4 4852 B16R0.303 C=CCCOCCOCCOCCOCCN 34a_103437854208_100000754431 [0,2,0,0,0,0|1,0,1]=4 4853 B16R0.303 C=CCCOCCOCCOCCOCCO 34a_100011205117_100010166562 [0,2,0,0,0,0|1,0,1]=4 4854 B16R0.303 C=CCNCCOCCOCCOCCOC 2230a_100012359593_100000210623 [0,2,0,0,0,0|1,0,0]=3 4855 B16R0.303 C=CCNCCOCCOCCOCCOC 2230a_100020586998_100012349117 [0,2,0,0,0,0|1,0,0]=3 4856 B16R0.303 C=CCNCCOCCOCCOCCOC 34a_100012359593_100015514636 [0,2,0,0,0,0|1,0,0]=3 4857 B16R0.303 C=CCOCCOCCOCCCCCCC 34a_100000065479_100000210614 [0,2,0,0,0,0|2,0,0]=4 4858 B16R0.303 C=CCOCCOCCOCCCCCCC 7a_100000065479_100000210614 [0,2,0,0,0,0|2,0,0]=4 4859 B16R0.303 C=CCOCCOCCOCCOCCCC 34a_100000065479_100000743108 [0,2,0,0,0,0|1,0,0]=3 4860 B16R0.303 C=CCOCCOCCOCCOCCCC 34a_100000700218_100015514636 [0,2,0,0,0,0|1,0,0]=3 4861 B16R0.303 C=CCOCCOCCOCCOCCCC 7a_100000065479_100000743108 [0,2,0,0,0,0|1,0,0]=3 4862 B16R0.303 C=CCOCCOCCOCCOCCCC 7a_100000700218_100015514636 [0,2,0,0,0,0|1,0,0]=3 4863 B16R0.303 C=CCOCCOCCOCCOCCNC 34a_100036875364_100015514636 [0,2,0,0,0,0|1,0,0]=3 4864 B16R0.303 C=CCOCCOCCOCCOCCOC 34a_100000037705_100013367474 [0,2,0,0,0,0|0,0,0]=2 4865 B16R0.303 C=CCOCCOCCOCCOCCOC 34a_100000065479_100000695917 [0,2,0,0,0,0|0,0,0]=2 4866 B16R0.303 C=CCOCCOCCOCCOCCOC 34a_100011218579_100015514636 [0,2,0,0,0,0|0,0,0]=2 4867 B16R0.303 C=CCOCCOCCOCCOCCOC 34a_200000210373_100012349117 [0,2,0,0,0,0|0,0,0]=2 4868 B16R0.303 C=CCOCCOCCOCCOCCOC 7a_100000037705_100013367474 [0,2,0,0,0,0|0,0,0]=2 4869 B16R0.303 C=CCOCCOCCOCCOCCOC 7a_100000065479_100000695917 [0,2,0,0,0,0|0,0,0]=2 4870 B16R0.303 C=CCOCCOCCOCCOCCOC 7a_100011218579_100015514636 [0,2,0,0,0,0|0,0,0]=2 4871 B16R0.303 C=CCOCCOCCOCCOCCON 34a_200121571635_100015514636 [0,2,0,0,0,0|1,0,0]=3 4872 B16R0.303 C=CCSCCOCCOCCOCCOC 62a_100000210623_100012349117 [0,2,0,0,0,0|0,1,0]=3 4873 B16R0.303 C=CCSCCOCCOCCOCCOC 62a_100012349117_100000210623 [0,2,0,0,0,0|0,1,0]=3 4874 B16R0.303 C=COCCCNCCOCCOCCOC 2230a_100000210767_100013367474 [0,2,0,0,0,0|1,0,1]=4 4875 B16R0.303 C=COCCCNCCOCCOCCOC 34a_100000210767_100013367474 [0,2,0,0,0,0|1,0,1]=4 4876 B16R0.303 C=COCCNCCOCCOCCOCC 2230a_100012282185_100000039644 [0,2,0,0,0,0|1,0,1]=4 4877 B16R0.303 C=COCCNCCOCCOCCOCC 34a_100012282185_100000039644 [0,2,0,0,0,0|1,0,1]=4 4878 B16R0.303 C=COCCOCCOCCCCCCOC 34a_100000039918_100011998445 [0,2,0,0,0,0|1,0,1]=4 4879 B16R0.303 C=COCCOCCOCCCCCCOC 7a_100000039918_100011998445 [0,2,0,0,0,0|1,0,1]=4 4880 B16R0.303 C=COCCOCCOCCCOCCOC 34a_100000039918_100011216529 [0,2,0,0,0,0|0,0,1]=3 4881 B16R0.303 C=COCCOCCOCCCOCCOC 7a_100000039918_100011216529 [0,2,0,0,0,0|0,0,1]=3 4882 B16R0.303 C=COCCOCCOCCOCCOCC 34a_100000033264_100000039644 [0,2,0,0,0,0|0,0,1]=3 4883 B16R0.303 C=COCCOCCOCCOCCOCC 34a_100000039918_100011211534 [0,2,0,0,0,0|0,0,1]=3 4884 B16R0.303 C=COCCOCCOCCOCCOCC 7a_100000033264_100000039644 [0,2,0,0,0,0|0,0,1]=3 4885 B16R0.303 C=COCCOCCOCCOCCOCC 7a_100000039918_100011211534 [0,2,0,0,0,0|0,0,1]=3 4886 B16R0.303 CC#CCOCCOCCOCCOCCBr 34a_100010132935_100000748600 [0,2,0,0,0,0|1,0,1]=4 4887 B16R0.303 CC#CCOCCOCCOCCOCCBr 7a_100010132935_100000748600 [0,2,0,0,0,0|1,0,1]=4 4888 B16R0.303 CC#CCOCCOCCOCCOCCCl 34a_100010166562_100000748600 [0,2,0,0,0,0|1,0,1]=4 4889 B16R0.303 CC#CCOCCOCCOCCOCCCl 7a_100010166562_100000748600 [0,2,0,0,0,0|1,0,1]=4 4890 B16R0.303 CC#CCOCCOCCOCCOCCN 34a_103437854208_100000748600 [0,2,0,0,0,0|1,0,1]=4 4891 B16R0.303 CC#CCOCCOCCOCCOCCO 34a_100000761923_100010166562 [0,2,0,0,0,0|1,0,1]=4 4892 B16R0.303 CC/C=C\CCCCCOCCOCCOC 34a_100016268722_100000695917 [0,2,0,0,0,0|2,0,0]=4 4893 B16R0.303 CC/C=C\CCCCCOCCOCCOC 7a_100016268722_100000695917 [0,2,0,0,0,0|2,0,0]=4 4894 B16R0.303 CC/C=C\CCNCCOCCOCCOC 2230a_100012028300_100015370543 [0,2,0,0,0,0|2,0,0]=4 4895 B16R0.303 CC/C=C\CCNCCOCCOCCOC 34a_100012028300_100015370543 [0,2,0,0,0,0|2,0,0]=4 4896 B16R0.303 CC/C=C\CCOCCOCCOCCCC 34a_100011215186_100015370543 [0,2,0,0,0,0|2,0,0]=4 4897 B16R0.303 CC/C=C\CCOCCOCCOCCCC 7a_100011215186_100015370543 [0,2,0,0,0,0|2,0,0]=4 4898 B16R0.303 CC/C=C\CCOCCOCCOCCNC 34a_200014138305_100015370543 [0,2,0,0,0,0|2,0,0]=4 4899 B16R0.303 CC/C=C\CCOCCOCCOCCOC 34a_100000688194_100015370543 [0,2,0,0,0,0|1,0,0]=3 4900 B16R0.303 CC/C=C\CCOCCOCCOCCOC 34a_100016288707_100013367474 [0,2,0,0,0,0|1,0,0]=3 4901 B16R0.303 CC/C=C\CCOCCOCCOCCOC 7a_100000688194_100015370543 [0,2,0,0,0,0|1,0,0]=3 4902 B16R0.303 CC/C=C\CCOCCOCCOCCOC 7a_100016288707_100013367474 [0,2,0,0,0,0|1,0,0]=3 4903 B16R0.303 CC/C=C\CCSCCOCCOCCOC 62a_100013367474_100015370543 [0,2,0,0,0,0|1,1,0]=4 4904 B16R0.303 CC/C=C\CCSCCOCCOCCOC 62a_100015370543_100013367474 [0,2,0,0,0,0|1,1,0]=4 4905 B16R0.303 CC/C=C\COCCOCCOCCOCC 34a_100000033264_100103147603 [0,2,0,0,0,0|1,0,1]=4 4906 B16R0.303 CC/C=C\COCCOCCOCCOCC 7a_100000033264_100103147603 [0,2,0,0,0,0|1,0,1]=4 4907 B16R0.303 CC=C=CCCOCCOCCOCCOC 34a_100011020354_100013367474 [0,2,0,0,0,0|1,0,0]=3 4908 B16R0.303 CC=CCCCOCCOCCOCCOC 34a_100020645299_100013367474 [0,2,0,0,0,0|1,0,0]=3 4909 B16R0.303 CC=CCOCCOCCOCCOCCBr 34a_100010132935_100000070051 [0,2,0,0,0,0|1,0,1]=4 4910 B16R0.303 CC=CCOCCOCCOCCOCCBr 7a_100010132935_100000070051 [0,2,0,0,0,0|1,0,1]=4 4911 B16R0.303 CC=CCOCCOCCOCCOCCCl 34a_100010166562_100000070051 [0,2,0,0,0,0|1,0,1]=4 4912 B16R0.303 CC=CCOCCOCCOCCOCCCl 7a_100010166562_100000070051 [0,2,0,0,0,0|1,0,1]=4 4913 B16R0.303 CC=CCOCCOCCOCCOCCN 34a_103437854208_100000070051 [0,2,0,0,0,0|1,0,1]=4 4914 B16R0.303 CCC#CCCOCCOCCOCCOC 34a_100000036655_100013367474 [0,2,0,0,0,0|1,0,0]=3 4915 B16R0.303 CCC#CCCOCCOCCOCCOC 7a_100000036655_100013367474 [0,2,0,0,0,0|1,0,0]=3 4916 B16R0.303 CCC#CCOCCOCCOCCOCC 34a_100000033264_100009813939 [0,2,0,0,0,0|1,0,1]=4 4917 B16R0.303 CCC#CCOCCOCCOCCOCC 7a_100000033264_100009813939 [0,2,0,0,0,0|1,0,1]=4 4918 B16R0.303 CCC/C=C/COCCOCCOCCOC 34a_100016278788_100013367474 [0,2,0,0,0,0|1,0,0]=3 4919 B16R0.303 CCC/C=C/COCCOCCOCCOC 7a_100016278788_100013367474 [0,2,0,0,0,0|1,0,0]=3 4920 B16R0.303 CCCC#CCOCCOCCOCCOC 34a_100000034806_100013367474 [0,2,0,0,0,0|1,0,0]=3 4921 B16R0.303 CCCC#CCOCCOCCOCCOC 7a_100000034806_100013367474 [0,2,0,0,0,0|1,0,0]=3 4922 B16R0.303 CCCC/C=C\CCOCCCOCCOC 34a_200016286491_100011216529 [0,2,0,0,0,0|2,0,0]=4 4923 B16R0.303 CCCC/C=C\CCOCCCOCCOC 7a_200016286491_100011216529 [0,2,0,0,0,0|2,0,0]=4 4924 B16R0.303 CCCC/C=C\CCOCCOCCOCC 34a_200016286491_100011211534 [0,2,0,0,0,0|2,0,0]=4 4925 B16R0.303 CCCC/C=C\CCOCCOCCOCC 7a_200016286491_100011211534 [0,2,0,0,0,0|2,0,0]=4 4926 B16R0.303 CCCCC#CCCCOCCOCCOC 34a_100011215163_200000047210 [0,2,0,0,0,0|2,0,0]=4 4927 B16R0.303 CCCCC#CCCCOCCOCCOC 7a_100011215163_200000047210 [0,2,0,0,0,0|2,0,0]=4 4928 B16R0.303 CCCCC#CCCOCCCOCCOC 34a_100000037610_100011216529 [0,2,0,0,0,0|2,0,0]=4 4929 B16R0.303 CCCCC#CCCOCCCOCCOC 7a_100000037610_100011216529 [0,2,0,0,0,0|2,0,0]=4 4930 B16R0.303 CCCCC#CCCOCCOCCOCC 34a_100000037610_100011211534 [0,2,0,0,0,0|2,0,0]=4 4931 B16R0.303 CCCCC#CCCOCCOCCOCC 7a_100000037610_100011211534 [0,2,0,0,0,0|2,0,0]=4 4932 B16R0.303 CCCCC/C=C\CCOCCOCCOC 34a_100016277358_100000695917 [0,2,0,0,0,0|2,0,0]=4 4933 B16R0.303 CCCCC/C=C\CCOCCOCCOC 7a_100016277358_100000695917 [0,2,0,0,0,0|2,0,0]=4 4934 B16R0.303 CCCCCC#CCCOCCOCCOC 34a_200000042877_100000695917 [0,2,0,0,0,0|2,0,0]=4 4935 B16R0.303 CCCCCC#CCCOCCOCCOC 7a_200000042877_100000695917 [0,2,0,0,0,0|2,0,0]=4 4936 B16R0.303 CCCCCC/C=C/COCCOCCOC 34a_200016276170_100000695917 [0,2,0,0,0,0|2,0,0]=4 4937 B16R0.303 CCCCCC/C=C/COCCOCCOC 7a_200016276170_100000695917 [0,2,0,0,0,0|2,0,0]=4 4938 B16R0.303 CCCCCCC#CCOCCOCCOC 34a_200000037284_100000695917 [0,2,0,0,0,0|2,0,0]=4 4939 B16R0.303 CCCCCCC#CCOCCOCCOC 7a_200000037284_100000695917 [0,2,0,0,0,0|2,0,0]=4 4940 B16R0.303 CCCCCCCCCOCCOCCOC 34a_100000210712_100000695917 [0,2,0,0,0,0|2,0,0]=4 4941 B16R0.303 CCCCCCCCCOCCOCCOC 34a_100011215163_100011214924 [0,2,0,0,0,0|2,0,0]=4 4942 B16R0.303 CCCCCCCCCOCCOCCOC 7a_100000210712_100000695917 [0,2,0,0,0,0|2,0,0]=4 4943 B16R0.303 CCCCCCCCCOCCOCCOC 7a_100011215163_100000210328 [0,2,0,0,0,0|2,0,0]=4 4944 B16R0.303 CCCCCCCCOCCCOCCOC 34a_100000210232_100011216529 [0,2,0,0,0,0|2,0,0]=4 4945 B16R0.303 CCCCCCCCOCCCOCCOC 7a_100000210232_100011216529 [0,2,0,0,0,0|2,0,0]=4 4946 B16R0.303 CCCCCCCCOCCOCCOCC 34a_100000210232_100011211534 [0,2,0,0,0,0|2,0,0]=4 4947 B16R0.303 CCCCCCCCOCCOCCOCC 34a_100000210240_100000210759 [0,2,0,0,0,0|2,0,0]=4 4948 B16R0.303 CCCCCCCCOCCOCCOCC 7a_100000210232_100011211534 [0,2,0,0,0,0|2,0,0]=4 4949 B16R0.303 CCCCCCCCOCCOCCOCC 7a_100000210240_100000210759 [0,2,0,0,0,0|2,0,0]=4 4950 B16R0.303 CCCCCCCOCCCOCCCOC 34a_200011215475_100000210614 [0,2,0,0,0,0|2,0,0]=4 4951 B16R0.303 CCCCCCCOCCCOCCCOC 7a_200011215475_100000210614 [0,2,0,0,0,0|2,0,0]=4 4952 B16R0.303 CCCCCCCOCCOCCOCCBr 34a_100010132937_100000210614 [0,2,0,0,0,0|2,0,0]=4 4953 B16R0.303 CCCCCCCOCCOCCOCCBr 7a_100010132937_100000210614 [0,2,0,0,0,0|2,0,0]=4 4954 B16R0.303 CCCCCCCOCCOCCOCCCl 34a_100000032323_100000210614 [0,2,0,0,0,0|2,0,0]=4 4955 B16R0.303 CCCCCCCOCCOCCOCCCl 7a_100000032323_100000210614 [0,2,0,0,0,0|2,0,0]=4 4956 B16R0.303 CCCCCCCOCCOCCOCCN 34a_100011998139_100000210614 [0,2,0,0,0,0|2,0,0]=4 4957 B16R0.303 CCCCCCCOCCOCCOCCO 34a_100000210272_100000032323 [0,2,0,0,0,0|2,0,0]=4 4958 B16R0.303 CCCCCCCOCCOCCOCCO 7a_100000210272_100000032323 [0,2,0,0,0,0|2,0,0]=4 4959 B16R0.303 CCCCCCNCCOCCOCCOC 2230a_100000210581_100013367474 [0,2,0,0,0,0|2,0,0]=4 4960 B16R0.303 CCCCCCNCCOCCOCCOC 2230a_100012028300_100000210314 [0,2,0,0,0,0|2,0,0]=4 4961 B16R0.303 CCCCCCNCCOCCOCCOC 34a_100012028300_100000210314 [0,2,0,0,0,0|2,0,0]=4 4962 B16R0.303 CCCCCCOCCOCCOCCCC 34a_100000032842_100000210210 [0,2,0,0,0,0|2,0,0]=4 4963 B16R0.303 CCCCCCOCCOCCOCCCC 34a_100000691444_100000743108 [0,2,0,0,0,0|2,0,0]=4 4964 B16R0.303 CCCCCCOCCOCCOCCCC 34a_100011215186_100000210314 [0,2,0,0,0,0|2,0,0]=4 4965 B16R0.303 CCCCCCOCCOCCOCCCC 7a_100000032842_100000210211 [0,2,0,0,0,0|2,0,0]=4 4966 B16R0.303 CCCCCCOCCOCCOCCCC 7a_100000691444_100000743108 [0,2,0,0,0,0|2,0,0]=4 4967 B16R0.303 CCCCCCOCCOCCOCCCC 7a_100011215186_100000210314 [0,2,0,0,0,0|2,0,0]=4 4968 B16R0.303 CCCCCCOCCOCCOCCNC 34a_200014138305_100000210314 [0,2,0,0,0,0|2,0,0]=4 4969 B16R0.303 CCCCCCOCCOCCOCCOC 34a_100000032842_100011201679 [0,2,0,0,0,0|1,0,0]=3 4970 B16R0.303 CCCCCCOCCOCCOCCOC 34a_100000210259_100013367474 [0,2,0,0,0,0|1,0,0]=3 4971 B16R0.303 CCCCCCOCCOCCOCCOC 34a_100000688194_100000210314 [0,2,0,0,0,0|1,0,0]=3 4972 B16R0.303 CCCCCCOCCOCCOCCOC 34a_100000691444_100000695917 [0,2,0,0,0,0|1,0,0]=3 4973 B16R0.303 CCCCCCOCCOCCOCCOC 7a_100000032842_100000233755 [0,2,0,0,0,0|1,0,0]=3 4974 B16R0.303 CCCCCCOCCOCCOCCOC 7a_100000210259_100013367474 [0,2,0,0,0,0|1,0,0]=3 4975 B16R0.303 CCCCCCOCCOCCOCCOC 7a_100000688194_100000210314 [0,2,0,0,0,0|1,0,0]=3 4976 B16R0.303 CCCCCCOCCOCCOCCOC 7a_100000691444_100000695917 [0,2,0,0,0,0|1,0,0]=3 4977 B16R0.303 CCCCCCOCCOCCOCCSC 34a_100000032842_100000212216 [0,2,0,0,0,0|1,1,0]=4 4978 B16R0.303 CCCCCCOCCOCCOCCSC 7a_100000032842_100000212216 [0,2,0,0,0,0|1,1,0]=4 4979 B16R0.303 CCCCCCSCCOCCOCCOC 62a_100000210314_100013367474 [0,2,0,0,0,0|1,1,0]=4 4980 B16R0.303 CCCCCCSCCOCCOCCOC 62a_100013367474_100000210757 [0,2,0,0,0,0|1,1,0]=4 4981 B16R0.303 CCCCCNCCOCCCOCCOC 34a_100000224656_100011216529 [0,2,0,0,0,0|2,0,0]=4 4982 B16R0.303 CCCCCNCCOCCOCCOCC 2230a_100012282185_100000210326 [0,2,0,0,0,0|2,0,0]=4 4983 B16R0.303 CCCCCNCCOCCOCCOCC 34a_100000224656_100011211534 [0,2,0,0,0,0|2,0,0]=4 4984 B16R0.303 CCCCCNCCOCCOCCOCC 34a_100012282185_100000718602 [0,2,0,0,0,0|2,0,0]=4 4985 B16R0.303 CCCCCOCCOCCCCCCOC 34a_100011215259_100011998445 [0,2,0,0,0,0|2,0,0]=4 4986 B16R0.303 CCCCCOCCOCCCCCCOC 7a_100011215259_100011998445 [0,2,0,0,0,0|2,0,0]=4 4987 B16R0.303 CCCCCOCCOCCCOCCOC 34a_100011215259_100011216529 [0,2,0,0,0,0|1,0,0]=3 4988 B16R0.303 CCCCCOCCOCCCOCCOC 7a_100011215259_100011216529 [0,2,0,0,0,0|1,0,0]=3 4989 B16R0.303 CCCCCOCCOCCOCCOCC 34a_100000033264_100000718602 [0,2,0,0,0,0|1,0,0]=3 4990 B16R0.303 CCCCCOCCOCCOCCOCC 34a_100011215259_100011211534 [0,2,0,0,0,0|1,0,0]=3 4991 B16R0.303 CCCCCOCCOCCOCCOCC 7a_100000033264_100000210326 [0,2,0,0,0,0|1,0,0]=3 4992 B16R0.303 CCCCCOCCOCCOCCOCC 7a_100011215259_100011211534 [0,2,0,0,0,0|1,0,0]=3 4993 B16R0.303 CCCCNCCCCOCCOCCOC 34a_200011216965_100000695917 [0,2,0,0,0,0|2,0,0]=4 4994 B16R0.303 CCCCNCCOCCOCCOCCO 2230a_100000102301_100010166562 [0,2,0,0,0,0|2,0,0]=4 4995 B16R0.303 CCCCNCCOCCOCCOCCO 2230a_103437854208_100000210211 [0,2,0,0,0,0|2,0,0]=4 4996 B16R0.303 CCCCNCCOCCOCCOCCO 34a_103437854208_100000210210 [0,2,0,0,0,0|2,0,0]=4 4997 B16R0.303 CCCCNCCOCCOCCOCCO 7a_106832991798_100010166562 [0,2,0,0,0,0|2,0,0]=4 4998 B16R0.303 CCCCOCCCCOCCOCCCC 34a_200000760531_100000743108 [0,2,0,0,0,0|2,0,0]=4 4999 B16R0.303 CCCCOCCCCOCCOCCCC 7a_200000760531_100000743108 [0,2,0,0,0,0|2,0,0]=4 5000 B16R0.303 CCCCOCCCCOCCOCCOC 34a_200000760531_100000695917 [0,2,0,0,0,0|1,0,0]=3 5001 B16R0.303 CCCCOCCCCOCCOCCOC 7a_200000760531_100000695917 [0,2,0,0,0,0|1,0,0]=3 5002 B16R0.303 CCCCOCCCNCCCOCCOC 2230a_200000211371_100011216529 [0,2,0,0,0,0|2,0,0]=4 5003 B16R0.303 CCCCOCCCNCCCOCCOC 34a_200000211371_100011216529 [0,2,0,0,0,0|2,0,0]=4 5004 B16R0.303 CCCCOCCCNCCOCCOCC 2230a_200000211371_100011211534 [0,2,0,0,0,0|2,0,0]=4 5005 B16R0.303 CCCCOCCCNCCOCCOCC 34a_200000211371_100011211534 [0,2,0,0,0,0|2,0,0]=4 5006 B16R0.303 CCCCOCCCOCCCCCCOC 34a_200011215613_100011998445 [0,2,0,0,0,0|2,0,0]=4 5007 B16R0.303 CCCCOCCCOCCCCCCOC 7a_200011215613_100011998445 [0,2,0,0,0,0|2,0,0]=4 5008 B16R0.303 CCCCOCCCOCCCOCCOC 34a_200011215613_100011216529 [0,2,0,0,0,0|1,0,0]=3 5009 B16R0.303 CCCCOCCCOCCCOCCOC 7a_200011215613_100011216529 [0,2,0,0,0,0|1,0,0]=3 5010 B16R0.303 CCCCOCCCOCCOCCOCC 34a_200011215613_100011211534 [0,2,0,0,0,0|1,0,0]=3 5011 B16R0.303 CCCCOCCCOCCOCCOCC 7a_200011215613_100011211534 [0,2,0,0,0,0|1,0,0]=3 5012 B16R0.303 CCCCOCCNCCOCCOCCC 2230a_200011904461_100000743108 [0,2,0,0,0,0|2,0,0]=4 5013 B16R0.303 CCCCOCCNCCOCCOCCC 34a_200011904461_100000743108 [0,2,0,0,0,0|2,0,0]=4 5014 B16R0.303 CCCCOCCNCCOCCOCCO 2230a_100011998139_100000743108 [0,2,0,0,0,0|2,0,0]=4 5015 B16R0.303 CCCCOCCNCCOCCOCCO 34a_100011998139_100000743108 [0,2,0,0,0,0|2,0,0]=4 5016 B16R0.303 CCCCOCCOCCCOCCCOC 34a_200011215475_100000743108 [0,2,0,0,0,0|1,0,0]=3 5017 B16R0.303 CCCCOCCOCCCOCCCOC 7a_200011215475_100000743108 [0,2,0,0,0,0|1,0,0]=3 5018 B16R0.303 CCCCOCCOCCOCCCCC#N 7a_100011215186_100000211819 [0,2,0,0,0,0|2,0,0]=4 5019 B16R0.303 CCCCOCCOCCOCCCCC=O 7a_100011215186_100000139335 [0,2,0,0,0,0|2,0,0]=4 5020 B16R0.303 CCCCOCCOCCOCCCCCF 34a_100011215186_100000729378 [0,2,0,0,0,0|2,0,0]=4 5021 B16R0.303 CCCCOCCOCCOCCCCCF 7a_100011215186_100000729378 [0,2,0,0,0,0|2,0,0]=4 5022 B16R0.303 CCCCOCCOCCOCCCCCO 34a_100011215186_100000746330 [0,2,0,0,0,0|2,0,0]=4 5023 B16R0.303 CCCCOCCOCCOCCCCCO 7a_100011215186_100000746330 [0,2,0,0,0,0|2,0,0]=4 5024 B16R0.303 CCCCOCCOCCOCCCCOC 34a_100011215186_100000755781 [0,2,0,0,0,0|1,0,0]=3 5025 B16R0.303 CCCCOCCOCCOCCCCOC 7a_100011215186_100000730899 [0,2,0,0,0,0|1,0,0]=3 5026 B16R0.303 CCCCOCCOCCOCCCOCC 34a_100011215186_100012232248 [0,2,0,0,0,0|1,0,0]=3 5027 B16R0.303 CCCCOCCOCCOCCCOCC 7a_100011215186_100012232248 [0,2,0,0,0,0|1,0,0]=3 5028 B16R0.303 CCCCOCCOCCOCCOCC#N 7a_100000700218_100011215382 [0,2,0,0,0,0|1,0,0]=3 5029 B16R0.303 CCCCOCCOCCOCCOCC#N 7a_100011215186_200000047693 [0,2,0,0,0,0|1,0,0]=3 5030 B16R0.303 CCCCOCCOCCOCCOCC=O 34a_100000700218_200009817547 [0,2,0,0,0,0|1,0,0]=3 5031 B16R0.303 CCCCOCCOCCOCCOCC=O 7a_100000700218_200015260668 [0,2,0,0,0,0|1,0,0]=3 5032 B16R0.303 CCCCOCCOCCOCCOCCBr 34a_100010132935_100000210210 [0,2,0,0,0,0|1,0,0]=3 5033 B16R0.303 CCCCOCCOCCOCCOCCBr 34a_100010132937_100000743108 [0,2,0,0,0,0|1,0,0]=3 5034 B16R0.303 CCCCOCCOCCOCCOCCBr 7a_100010132935_100000210211 [0,2,0,0,0,0|1,0,0]=3 5035 B16R0.303 CCCCOCCOCCOCCOCCBr 7a_100010132937_100000743108 [0,2,0,0,0,0|1,0,0]=3 5036 B16R0.303 CCCCOCCOCCOCCOCCC 34a_100000700218_100000210303 [0,2,0,0,0,0|1,0,0]=3 5037 B16R0.303 CCCCOCCOCCOCCOCCC 34a_100011215186_100011215938 [0,2,0,0,0,0|1,0,0]=3 5038 B16R0.303 CCCCOCCOCCOCCOCCC 7a_100000700218_100000210303 [0,2,0,0,0,0|1,0,0]=3 5039 B16R0.303 CCCCOCCOCCOCCOCCC 7a_100011215186_100011215938 [0,2,0,0,0,0|1,0,0]=3 5040 B16R0.303 CCCCOCCOCCOCCOCCCl 34a_100000032323_100000743108 [0,2,0,0,0,0|1,0,0]=3 5041 B16R0.303 CCCCOCCOCCOCCOCCCl 34a_100010166562_100000210210 [0,2,0,0,0,0|1,0,0]=3 5042 B16R0.303 CCCCOCCOCCOCCOCCCl 7a_100000032323_100000743108 [0,2,0,0,0,0|1,0,0]=3 5043 B16R0.303 CCCCOCCOCCOCCOCCCl 7a_100010166562_100000210211 [0,2,0,0,0,0|1,0,0]=3 5044 B16R0.303 CCCCOCCOCCOCCOCCF 34a_100000700218_100011217306 [0,2,0,0,0,0|1,0,0]=3 5045 B16R0.303 CCCCOCCOCCOCCOCCF 7a_100000700218_100011217306 [0,2,0,0,0,0|1,0,0]=3 5046 B16R0.303 CCCCOCCOCCOCCOCCN 34a_100011998139_100000743108 [0,2,0,0,0,0|1,0,0]=3 5047 B16R0.303 CCCCOCCOCCOCCOCCN 34a_103437854208_100000210210 [0,2,0,0,0,0|1,0,0]=3 5048 B16R0.303 CCCCOCCOCCOCCOCCO 34a_100000210227_100010166562 [0,2,0,0,0,0|1,0,0]=3 5049 B16R0.303 CCCCOCCOCCOCCOCCO 34a_100000210238_100000032323 [0,2,0,0,0,0|1,0,0]=3 5050 B16R0.303 CCCCOCCOCCOCCOCCO 34a_100000700218_100000211926 [0,2,0,0,0,0|1,0,0]=3 5051 B16R0.303 CCCCOCCOCCOCCOCCO 34a_100011215186_100000692535 [0,2,0,0,0,0|1,0,0]=3 5052 B16R0.303 CCCCOCCOCCOCCOCCO 7a_100000210227_100010166562 [0,2,0,0,0,0|1,0,0]=3 5053 B16R0.303 CCCCOCCOCCOCCOCCO 7a_100000210238_100000032323 [0,2,0,0,0,0|1,0,0]=3 5054 B16R0.303 CCCCOCCOCCOCCOCCO 7a_100000700218_100000211926 [0,2,0,0,0,0|1,0,0]=3 5055 B16R0.303 CCCCOCCOCCOCCOCCO 7a_100011215186_100011215305 [0,2,0,0,0,0|1,0,0]=3 5056 B16R0.303 CCCCOCCOCCOCCOCSC 34a_100000700218_100011218213 [0,2,0,0,0,0|1,0,0]=3 5057 B16R0.303 CCCCOCCOCCOCOCCCC 34a_100011215186_100011995733 [0,2,0,0,0,0|2,0,0]=4 5058 B16R0.303 CCCCOCCSCCOCCOCCO 62a_100000032323_100000743108 [0,2,0,0,0,0|1,1,0]=4 5059 B16R0.303 CCCCOCCSCCOCCOCCO 62a_100000743108_100000032323 [0,2,0,0,0,0|1,1,0]=4 5060 B16R0.303 CCCCOCNCCOCCOCCOC 2230a_100012028300_100011995733 [0,2,0,0,0,0|1,0,0]=3 5061 B16R0.303 CCCCOCNCCOCCOCCOC 34a_100012028300_100011995733 [0,2,0,0,0,0|1,0,0]=3 5062 B16R0.303 CCCCOCOCCOCCOCCNC 34a_200014138305_100011995733 [0,2,0,0,0,0|2,0,0]=4 5063 B16R0.303 CCCCOCOCCOCCOCCOC 34a_100000688194_100011995733 [0,2,0,0,0,0|1,0,0]=3 5064 B16R0.303 CCCCOCSCCOCCOCCOC 62a_100011995733_100013367474 [0,2,0,0,0,0|1,0,0]=3 5065 B16R0.303 CCCCOCSCCOCCOCCOC 62a_100013367474_100011995733 [0,2,0,0,0,0|1,0,0]=3 5066 B16R0.303 CCCCSCCOCCOCCOCCO 34a_200000230436_100000032323 [0,2,0,0,0,0|1,1,0]=4 5067 B16R0.303 CCCCSCCOCCOCCOCCO 62a_100000210211_100010166562 [0,2,0,0,0,0|1,1,0]=4 5068 B16R0.303 CCCCSCCOCCOCCOCCO 62a_100010166562_100000210210 [0,2,0,0,0,0|1,1,0]=4 5069 B16R0.303 CCCCSCCOCCOCCOCCO 7a_200000230436_100000032323 [0,2,0,0,0,0|1,1,0]=4 5070 B16R0.303 CCCNCCOCCOCCOCCOC 2230a_100012359593_100000210303 [0,2,0,0,0,0|1,0,0]=3 5071 B16R0.303 CCCNCCOCCOCCOCCOC 34a_100012359593_100000210303 [0,2,0,0,0,0|1,0,0]=3 5072 B16R0.303 CCCOCCNCCOCCOCCOC 2230a_100012028300_100011215938 [0,2,0,0,0,0|1,0,0]=3 5073 B16R0.303 CCCOCCNCCOCCOCCOC 2230a_100161115042_100013367474 [0,2,0,0,0,0|1,0,0]=3 5074 B16R0.303 CCCOCCNCCOCCOCCOC 34a_100012028300_100011215938 [0,2,0,0,0,0|1,0,0]=3 5075 B16R0.303 CCCOCCNCCOCCOCCOC 34a_100161115042_100013367474 [0,2,0,0,0,0|1,0,0]=3 5076 B16R0.303 CCCOCCOCCNCCOCCOC 2230a_200011904461_100000695917 [0,2,0,0,0,0|1,0,0]=3 5077 B16R0.303 CCCOCCOCCNCCOCCOC 34a_200011904461_100000695917 [0,2,0,0,0,0|1,0,0]=3 5078 B16R0.303 CCCOCCOCCOCCOCCCN 34a_100011996194_100011215938 [0,2,0,0,0,0|2,0,0]=4 5079 B16R0.303 CCCOCCOCCOCCOCCNC 34a_100036875364_100000210303 [0,2,0,0,0,0|1,0,0]=3 5080 B16R0.303 CCCOCCOCCOCCOCCNC 34a_200014138305_100011215938 [0,2,0,0,0,0|1,0,0]=3 5081 B16R0.303 CCCOCCOCCOCCOCCOC 34a_100000210258_100012349117 [0,2,0,0,0,0|0,0,0]=2 5082 B16R0.303 CCCOCCOCCOCCOCCOC 34a_100000688194_100011215938 [0,2,0,0,0,0|0,0,0]=2 5083 B16R0.303 CCCOCCOCCOCCOCCOC 34a_100000752267_100013367474 [0,2,0,0,0,0|0,0,0]=2 5084 B16R0.303 CCCOCCOCCOCCOCCOC 34a_100011218579_100000210303 [0,2,0,0,0,0|0,0,0]=2 5085 B16R0.303 CCCOCCOCCOCCOCCOC 7a_100000688194_100011215938 [0,2,0,0,0,0|0,0,0]=2 5086 B16R0.303 CCCOCCOCCOCCOCCOC 7a_100000752267_100013367474 [0,2,0,0,0,0|0,0,0]=2 5087 B16R0.303 CCCOCCOCCOCCOCCOC 7a_100011218579_100000210303 [0,2,0,0,0,0|0,0,0]=2 5088 B16R0.303 CCCOCCOCCOCCOCCON 34a_200121571635_100000210303 [0,2,0,0,0,0|1,0,0]=3 5089 B16R0.303 CCCOCCSCCOCCOCCOC 62a_100011215938_100013367474 [0,2,0,0,0,0|0,1,0]=3 5090 B16R0.303 CCCOCCSCCOCCOCCOC 62a_100013367474_100011215938 [0,2,0,0,0,0|0,1,0]=3 5091 B16R0.303 CCCSCCNCCOCCOCCOC 2230a_100020603323_100013367474 [0,2,0,0,0,0|1,1,0]=4 5092 B16R0.303 CCCSCCOCCOCCOCCOC 34a_200000230433_100013367474 [0,2,0,0,0,0|0,1,0]=3 5093 B16R0.303 CCCSCCOCCOCCOCCOC 62a_100000210303_100012349117 [0,2,0,0,0,0|0,1,0]=3 5094 B16R0.303 CCCSCCOCCOCCOCCOC 62a_100012349117_100000210303 [0,2,0,0,0,0|0,1,0]=3 5095 B16R0.303 CCCSCCOCCOCCOCCOC 7a_200000230433_100013367474 [0,2,0,0,0,0|0,1,0]=3 5096 B16R0.303 CCOCCCCCCCCCOCCOC 34a_100009875440_100011201679 [0,2,0,0,0,0|2,0,0]=4 5097 B16R0.303 CCOCCCCCCCCCOCCOC 7a_100009875440_100000233755 [0,2,0,0,0,0|2,0,0]=4 5098 B16R0.303 CCOCCCNCCOCCOCCOC 2230a_100000210961_100013367474 [0,2,0,0,0,0|1,0,0]=3 5099 B16R0.303 CCOCCCNCCOCCOCCOC 2230a_100012028300_100012232248 [0,2,0,0,0,0|1,0,0]=3 5100 B16R0.303 CCOCCCNCCOCCOCCOC 34a_100000210961_100013367474 [0,2,0,0,0,0|1,0,0]=3 5101 B16R0.303 CCOCCCNCCOCCOCCOC 34a_100012028300_100012232248 [0,2,0,0,0,0|1,0,0]=3 5102 B16R0.303 CCOCCCOCCOCCOCCCN 34a_100011996194_100012232248 [0,2,0,0,0,0|2,0,0]=4 5103 B16R0.303 CCOCCCOCCOCCOCCNC 34a_200014138305_100012232248 [0,2,0,0,0,0|1,0,0]=3 5104 B16R0.303 CCOCCCOCCOCCOCCOC 34a_100000688194_100012232248 [0,2,0,0,0,0|0,0,0]=2 5105 B16R0.303 CCOCCCOCCOCCOCCOC 34a_100000757476_100013367474 [0,2,0,0,0,0|0,0,0]=2 5106 B16R0.303 CCOCCCOCCOCCOCCOC 7a_100000688194_100012232248 [0,2,0,0,0,0|0,0,0]=2 5107 B16R0.303 CCOCCCOCCOCCOCCOC 7a_100000757476_100013367474 [0,2,0,0,0,0|0,0,0]=2 5108 B16R0.303 CCOCCCSCCOCCOCCOC 62a_100012232248_100013367474 [0,2,0,0,0,0|0,1,0]=3 5109 B16R0.303 CCOCCCSCCOCCOCCOC 62a_100013367474_100012232248 [0,2,0,0,0,0|0,1,0]=3 5110 B16R0.303 CCOCCNCCOCCOCCOCC 2230a_100012282185_100011215890 [0,2,0,0,0,0|1,0,0]=3 5111 B16R0.303 CCOCCNCCOCCOCCOCC 34a_100012282185_100000210147 [0,2,0,0,0,0|1,0,0]=3 5112 B16R0.303 CCOCCOCCNCCCCCCOC 2230a_100102712874_100011998445 [0,2,0,0,0,0|2,0,0]=4 5113 B16R0.303 CCOCCOCCNCCCCCCOC 34a_100102712874_100011998445 [0,2,0,0,0,0|2,0,0]=4 5114 B16R0.303 CCOCCOCCNCCCOCCOC 2230a_100000206027_100011211534 [0,2,0,0,0,0|1,0,0]=3 5115 B16R0.303 CCOCCOCCNCCCOCCOC 2230a_100102712874_100011216529 [0,2,0,0,0,0|1,0,0]=3 5116 B16R0.303 CCOCCOCCNCCCOCCOC 34a_100000206027_100011211534 [0,2,0,0,0,0|1,0,0]=3 5117 B16R0.303 CCOCCOCCNCCCOCCOC 34a_100102712874_100011216529 [0,2,0,0,0,0|1,0,0]=3 5118 B16R0.303 CCOCCOCCNCCOCCOCC 2230a_100102712874_100011211534 [0,2,0,0,0,0|1,0,0]=3 5119 B16R0.303 CCOCCOCCNCCOCCOCC 34a_100102712874_100011211534 [0,2,0,0,0,0|1,0,0]=3 5120 B16R0.303 CCOCCOCCOCCCCCCCBr 34a_100000760002_100011211534 [0,2,0,0,0,0|2,0,0]=4 5121 B16R0.303 CCOCCOCCOCCCCCCCBr 7a_100000760002_100011211534 [0,2,0,0,0,0|2,0,0]=4 5122 B16R0.303 CCOCCOCCOCCCCCCCN 34a_100011996573_100011211534 [0,2,0,0,0,0|2,0,0]=4 5123 B16R0.303 CCOCCOCCOCCCCCCCO 34a_100000210240_100000760002 [0,2,0,0,0,0|2,0,0]=4 5124 B16R0.303 CCOCCOCCOCCCCCCCO 7a_100000210240_100000760002 [0,2,0,0,0,0|2,0,0]=4 5125 B16R0.303 CCOCCOCCOCCCCCCOC 34a_100000210240_100011998445 [0,2,0,0,0,0|1,0,0]=3 5126 B16R0.303 CCOCCOCCOCCCCCCOC 34a_200012092642_100011211534 [0,2,0,0,0,0|1,0,0]=3 5127 B16R0.303 CCOCCOCCOCCCCCCOC 7a_100000210240_100011998445 [0,2,0,0,0,0|1,0,0]=3 5128 B16R0.303 CCOCCOCCOCCCCCCOC 7a_200012092642_100011211534 [0,2,0,0,0,0|1,0,0]=3 5129 B16R0.303 CCOCCOCCOCCCOCCCN 34a_100011310245_100011211534 [0,2,0,0,0,0|2,0,0]=4 5130 B16R0.303 CCOCCOCCOCCCOCCOC 34a_100000210240_100011216529 [0,2,0,0,0,0|0,0,0]=2 5131 B16R0.303 CCOCCOCCOCCCOCCOC 7a_100000210240_100011216529 [0,2,0,0,0,0|0,0,0]=2 5132 B16R0.303 CCOCCOCCOCCNCCCCF 2230a_100012282185_100000729493 [0,2,0,0,0,0|2,0,0]=4 5133 B16R0.303 CCOCCOCCOCCNCCCCF 34a_100012282185_100000729493 [0,2,0,0,0,0|2,0,0]=4 5134 B16R0.303 CCOCCOCCOCCNCCCCO 2230a_100012282185_100000210776 [0,2,0,0,0,0|2,0,0]=4 5135 B16R0.303 CCOCCOCCOCCNCCCCO 34a_100012282185_100011216708 [0,2,0,0,0,0|2,0,0]=4 5136 B16R0.303 CCOCCOCCOCCNCCCOC 2230a_100012282185_100000740836 [0,2,0,0,0,0|1,0,0]=3 5137 B16R0.303 CCOCCOCCOCCNCCCOC 34a_100012282185_100000740836 [0,2,0,0,0,0|1,0,0]=3 5138 B16R0.303 CCOCCOCCOCCNCCSCC 2230a_100012282185_100000757381 [0,2,0,0,0,0|1,1,0]=4 5139 B16R0.303 CCOCCOCCOCCNCCSCC 34a_100012282185_100000757381 [0,2,0,0,0,0|1,1,0]=4 5140 B16R0.303 CCOCCOCCOCCOCC#CCO 34a_100000033264_200000047223 [0,2,0,0,0,0|1,0,1]=4 5141 B16R0.303 CCOCCOCCOCCOCC#CCO 7a_100000033264_200000047223 [0,2,0,0,0,0|1,0,1]=4 5142 B16R0.303 CCOCCOCCOCCOCCCC#N 7a_100000033264_100000687738 [0,2,0,0,0,0|1,0,1]=4 5143 B16R0.303 CCOCCOCCOCCOCCCC=O 7a_100000033264_200011292268 [0,2,0,0,0,0|1,0,1]=4 5144 B16R0.303 CCOCCOCCOCCOCCCCF 34a_100000033264_100000729493 [0,2,0,0,0,0|1,0,0]=3 5145 B16R0.303 CCOCCOCCOCCOCCCCF 7a_100000033264_100000729493 [0,2,0,0,0,0|1,0,0]=3 5146 B16R0.303 CCOCCOCCOCCOCCCCO 34a_100000033264_100011216708 [0,2,0,0,0,0|1,0,0]=3 5147 B16R0.303 CCOCCOCCOCCOCCCCO 7a_100000033264_100000210776 [0,2,0,0,0,0|1,0,0]=3 5148 B16R0.303 CCOCCOCCOCCOCCCOC 34a_100000033264_100000740836 [0,2,0,0,0,0|0,0,0]=2 5149 B16R0.303 CCOCCOCCOCCOCCCOC 7a_100000033264_100000740836 [0,2,0,0,0,0|0,0,0]=2 5150 B16R0.303 CCOCCOCCOCCOCCN=[N+]=[N-] 34a_100000210136_100010820720 [0,2,0,0,0,0|2,0,0]=4 5151 B16R0.303 CCOCCOCCOCCOCCN=[N+]=[N-] 34a_100121572206_100010820719 [0,2,0,0,0,0|2,0,0]=4 5152 B16R0.303 CCOCCOCCOCCOCCN=[N+]=[N-] 7a_100000210136_100010820720 [0,2,0,0,0,0|2,0,0]=4 5153 B16R0.303 CCOCCOCCOCCOCCN=[N+]=[N-] 7a_100010008387_100000210202 [0,2,0,0,0,0|2,0,0]=4 5154 B16R0.303 CCOCCOCCOCCOCCOCC 34a_100000033264_100000210147 [0,2,0,0,0,0|0,0,0]=2 5155 B16R0.303 CCOCCOCCOCCOCCOCC 34a_100000210240_100011211534 [0,2,0,0,0,0|0,0,0]=2 5156 B16R0.303 CCOCCOCCOCCOCCOCC 34a_100010185881_100000210202 [0,2,0,0,0,0|0,0,0]=2 5157 B16R0.303 CCOCCOCCOCCOCCOCC 7a_100000033264_100011215890 [0,2,0,0,0,0|0,0,0]=2 5158 B16R0.303 CCOCCOCCOCCOCCOCC 7a_100000210240_100011211534 [0,2,0,0,0,0|0,0,0]=2 5159 B16R0.303 CCOCCOCCOCCOCCOCC 7a_100010185881_100000210202 [0,2,0,0,0,0|0,0,0]=2 5160 B16R0.303 CCOCCOCCOCCOCCOCF 34a_100010185881_100015361967 [0,2,0,0,0,0|0,0,0]=2 5161 B16R0.303 CCOCCOCCOCCOCCOCF 7a_100010185881_100015361967 [0,2,0,0,0,0|0,0,0]=2 5162 B16R0.303 CCOCCOCCOCCOCCSCC 34a_100000033264_100000757381 [0,2,0,0,0,0|0,1,0]=3 5163 B16R0.303 CCOCCOCCOCCOCCSCC 7a_100000033264_100000757381 [0,2,0,0,0,0|0,1,0]=3 5164 B16R0.303 CCOCCOCCSCCCCCCOC 62a_100011211534_100011998445 [0,2,0,0,0,0|1,1,0]=4 5165 B16R0.303 CCOCCOCCSCCCCCCOC 62a_100011998445_100011211534 [0,2,0,0,0,0|1,1,0]=4 5166 B16R0.303 CCOCCOCCSCCCOCCOC 62a_100011211534_100011216529 [0,2,0,0,0,0|0,1,0]=3 5167 B16R0.303 CCOCCOCCSCCCOCCOC 62a_100011216529_100011211534 [0,2,0,0,0,0|0,1,0]=3 5168 B16R0.303 CCOCCOCCSCCOCCOCC 62a_100011211534_100011211534 [0,2,0,0,0,0|0,1,0]=3 5169 B16R0.303 CCSCCCOCCOCCOCCOC 34a_100011216438_100013367474 [0,2,0,0,0,0|0,1,0]=3 5170 B16R0.303 CCSCCCOCCOCCOCCOC 7a_100011216438_100013367474 [0,2,0,0,0,0|0,1,0]=3 5171 B16R0.303 CNCCCCCOCCOCCOCCO 34a_100000722520_100000032323 [0,2,0,0,0,0|2,0,0]=4 5172 B16R0.303 CNCCOCCOCCOCCCCCF 34a_200014138305_100000729378 [0,2,0,0,0,0|2,0,0]=4 5173 B16R0.303 CNCCOCCOCCOCCCCCO 34a_200014138305_100000746330 [0,2,0,0,0,0|2,0,0]=4 5174 B16R0.303 CNCCOCCOCCOCCCCOC 34a_200014138305_100000755781 [0,2,0,0,0,0|1,0,0]=3 5175 B16R0.303 CNCCOCCOCCOCCOCC=O 34a_100036875364_200009817547 [0,2,0,0,0,0|1,0,0]=3 5176 B16R0.303 CNCCOCCOCCOCCOCCF 34a_100036875364_100011217306 [0,2,0,0,0,0|1,0,0]=3 5177 B16R0.303 CNCCOCCOCCOCCOCCO 2230a_100011169512_200000210301 [0,2,0,0,0,0|1,0,0]=3 5178 B16R0.303 CNCCOCCOCCOCCOCCO 2230a_106832991635_100010134629 [0,2,0,0,0,0|1,0,0]=3 5179 B16R0.303 CNCCOCCOCCOCCOCCO 34a_100000228057_100000032323 [0,2,0,0,0,0|1,0,0]=3 5180 B16R0.303 CNCCOCCOCCOCCOCCO 34a_100011169512_200000210301 [0,2,0,0,0,0|1,0,0]=3 5181 B16R0.303 CNCCOCCOCCOCCOCCO 34a_100036875364_100000211926 [0,2,0,0,0,0|1,0,0]=3 5182 B16R0.303 CNCCOCCOCCOCCOCCO 34a_100102657272_100010134629 [0,2,0,0,0,0|1,0,0]=3 5183 B16R0.303 CNCCOCCOCCOCCOCCO 34a_200014138305_100000692535 [0,2,0,0,0,0|1,0,0]=3 5184 B16R0.303 CNCCOCCOCCOCCOCCO 7a_106832991635_100010134629 [0,2,0,0,0,0|1,0,0]=3 5185 B16R0.303 CNCCOCCOCCOCCOCSC 34a_100036875364_100011218213 [0,2,0,0,0,0|1,0,0]=3 5186 B16R0.303 COCCCCCCNCCCOCCOC 2230a_100000206027_100011998445 [0,2,0,0,0,0|2,0,0]=4 5187 B16R0.303 COCCCCCCNCCCOCCOC 34a_100000206027_100011998445 [0,2,0,0,0,0|2,0,0]=4 5188 B16R0.303 COCCCCCCOCCCCCCOC 34a_200012092642_100011998445 [0,2,0,0,0,0|2,0,0]=4 5189 B16R0.303 COCCCCCCOCCCCCCOC 7a_200012092642_100011998445 [0,2,0,0,0,0|2,0,0]=4 5190 B16R0.303 COCCCCCCOCCCOCCOC 34a_200012092642_100011216529 [0,2,0,0,0,0|1,0,0]=3 5191 B16R0.303 COCCCCCCOCCCOCCOC 7a_200012092642_100011216529 [0,2,0,0,0,0|1,0,0]=3 5192 B16R0.303 COCCCCCCSCCCOCCOC 62a_100011216529_100011998445 [0,2,0,0,0,0|1,1,0]=4 5193 B16R0.303 COCCCCCCSCCCOCCOC 62a_100011998445_100011216529 [0,2,0,0,0,0|1,1,0]=4 5194 B16R0.303 COCCCCCNCCOCCOCCO 2230a_100000747528_100000032323 [0,2,0,0,0,0|2,0,0]=4 5195 B16R0.303 COCCCCCNCCOCCOCCO 34a_100000747528_100000032323 [0,2,0,0,0,0|2,0,0]=4 5196 B16R0.303 COCCCCNCCOCCOCCOC 2230a_100012028300_100000730899 [0,2,0,0,0,0|1,0,0]=3 5197 B16R0.303 COCCCCNCCOCCOCCOC 34a_100012028300_100000755781 [0,2,0,0,0,0|1,0,0]=3 5198 B16R0.303 COCCCCOCCOCCOCCCN 34a_100011996194_100000755781 [0,2,0,0,0,0|2,0,0]=4 5199 B16R0.303 COCCCCOCCOCCOCCOC 34a_100000688194_100000755781 [0,2,0,0,0,0|0,0,0]=2 5200 B16R0.303 COCCCCOCCOCCOCCOC 34a_100000740925_100013367474 [0,2,0,0,0,0|0,0,0]=2 5201 B16R0.303 COCCCCOCCOCCOCCOC 7a_100000688194_100000730899 [0,2,0,0,0,0|0,0,0]=2 5202 B16R0.303 COCCCCSCCOCCOCCOC 62a_100000730899_100013367474 [0,2,0,0,0,0|0,1,0]=3 5203 B16R0.303 COCCCCSCCOCCOCCOC 62a_100013367474_100000730899 [0,2,0,0,0,0|0,1,0]=3 5204 B16R0.303 COCCCOCCCOCCOCCOC 34a_200011215475_100000695917 [0,2,0,0,0,0|0,0,0]=2 5205 B16R0.303 COCCCOCCCOCCOCCOC 7a_200011215475_100000695917 [0,2,0,0,0,0|0,0,0]=2 5206 B16R0.303 COCCCOCCOCCOCCN=[N+]=[N-] 34a_100000740835_100010820720 [0,2,0,0,0,0|2,0,0]=4 5207 B16R0.303 COCCNCCOCCOCCOCCO 2230a_100000209980_100010166562 [0,2,0,0,0,0|1,0,0]=3 5208 B16R0.303 COCCNCCOCCOCCOCCO 2230a_103437854208_100011201679 [0,2,0,0,0,0|1,0,0]=3 5209 B16R0.303 COCCNCCOCCOCCOCCO 34a_103437854208_100011201679 [0,2,0,0,0,0|1,0,0]=3 5210 B16R0.303 COCCOCCCNCCCOCCOC 2230a_100000206027_100011216529 [0,2,0,0,0,0|1,0,0]=3 5211 B16R0.303 COCCOCCCNCCCOCCOC 34a_100000206027_100011216529 [0,2,0,0,0,0|1,0,0]=3 5212 B16R0.303 COCCOCCCOCCCCCCCBr 34a_100000760002_100011216529 [0,2,0,0,0,0|2,0,0]=4 5213 B16R0.303 COCCOCCCOCCCCCCCBr 7a_100000760002_100011216529 [0,2,0,0,0,0|2,0,0]=4 5214 B16R0.303 COCCOCCCOCCCCCCCN 34a_100011996573_100011216529 [0,2,0,0,0,0|2,0,0]=4 5215 B16R0.303 COCCOCCCOCCCOCCCN 34a_100011310245_100011216529 [0,2,0,0,0,0|2,0,0]=4 5216 B16R0.303 COCCOCCCSCCCOCCOC 62a_100011216529_100011216529 [0,2,0,0,0,0|0,1,0]=3 5217 B16R0.303 COCCOCCNCCOCCOCCO 2230a_100000745349_100000032323 [0,2,0,0,0,0|1,0,0]=3 5218 B16R0.303 COCCOCCNCCOCCOCCO 2230a_100011998139_100000695917 [0,2,0,0,0,0|1,0,0]=3 5219 B16R0.303 COCCOCCNCCOCCOCCO 34a_100000745349_100000032323 [0,2,0,0,0,0|1,0,0]=3 5220 B16R0.303 COCCOCCNCCOCCOCCO 34a_100011998139_100000695917 [0,2,0,0,0,0|1,0,0]=3 5221 B16R0.303 COCCOCCOCCCCCCCCBr 34a_100009813846_100000695917 [0,2,0,0,0,0|2,0,0]=4 5222 B16R0.303 COCCOCCOCCCCCCCCBr 7a_100009813846_100000695917 [0,2,0,0,0,0|2,0,0]=4 5223 B16R0.303 COCCOCCOCCCCCCCCCl 34a_100000033203_100000695917 [0,2,0,0,0,0|2,0,0]=4 5224 B16R0.303 COCCOCCOCCCCCCCCCl 7a_100000033203_100000695917 [0,2,0,0,0,0|2,0,0]=4 5225 B16R0.303 COCCOCCOCCCCCCCCN 34a_102515433106_100000695917 [0,2,0,0,0,0|2,0,0]=4 5226 B16R0.303 COCCOCCOCCCCCCCCO 34a_100011215163_100000033203 [0,2,0,0,0,0|2,0,0]=4 5227 B16R0.303 COCCOCCOCCCCCCCCO 7a_100011215163_100000033203 [0,2,0,0,0,0|2,0,0]=4 5228 B16R0.303 COCCOCCOCCCCCNCCN 34a_103619048469_100000695917 [0,2,0,0,0,0|2,0,0]=4 5229 B16R0.303 COCCOCCOCCNCCCCC#N 2230a_100012028300_100000211819 [0,2,0,0,0,0|2,0,0]=4 5230 B16R0.303 COCCOCCOCCNCCCCC=O 2230a_100012028300_100000139335 [0,2,0,0,0,0|2,0,0]=4 5231 B16R0.303 COCCOCCOCCNCCCCCF 2230a_100012028300_100000729378 [0,2,0,0,0,0|2,0,0]=4 5232 B16R0.303 COCCOCCOCCNCCCCCF 34a_100012028300_100000729378 [0,2,0,0,0,0|2,0,0]=4 5233 B16R0.303 COCCOCCOCCNCCCCCO 2230a_100000762737_100013367474 [0,2,0,0,0,0|2,0,0]=4 5234 B16R0.303 COCCOCCOCCNCCCCCO 2230a_100012028300_100000746330 [0,2,0,0,0,0|2,0,0]=4 5235 B16R0.303 COCCOCCOCCNCCCCCO 34a_100000762737_100013367474 [0,2,0,0,0,0|2,0,0]=4 5236 B16R0.303 COCCOCCOCCNCCCCCO 34a_100012028300_100000746330 [0,2,0,0,0,0|2,0,0]=4 5237 B16R0.303 COCCOCCOCCNCCOCC#N 2230a_100012028300_200000047693 [0,2,0,0,0,0|1,0,0]=3 5238 B16R0.303 COCCOCCOCCNCCOCCO 2230a_100000211614_100013367474 [0,2,0,0,0,0|1,0,0]=3 5239 B16R0.303 COCCOCCOCCNCCOCCO 2230a_100012028300_100011215305 [0,2,0,0,0,0|1,0,0]=3 5240 B16R0.303 COCCOCCOCCNCCOCCO 34a_100000211614_100013367474 [0,2,0,0,0,0|1,0,0]=3 5241 B16R0.303 COCCOCCOCCNCCOCCO 34a_100012028300_100000692535 [0,2,0,0,0,0|1,0,0]=3 5242 B16R0.303 COCCOCCOCCNCCSCCO 2230a_100011219999_100013367474 [0,2,0,0,0,0|1,1,0]=4 5243 B16R0.303 COCCOCCOCCNCOCCOC 2230a_100012028300_100000231047 [0,2,0,0,0,0|0,0,0]=2 5244 B16R0.303 COCCOCCOCCOCCCCC#N 7a_100000688194_100000211819 [0,2,0,0,0,0|1,0,0]=3 5245 B16R0.303 COCCOCCOCCOCCCCC=O 7a_100000688194_100000139335 [0,2,0,0,0,0|1,0,0]=3 5246 B16R0.303 COCCOCCOCCOCCCCCBr 34a_100000746331_100013367474 [0,2,0,0,0,0|1,0,0]=3 5247 B16R0.303 COCCOCCOCCOCCCCCBr 7a_100000746331_100013367474 [0,2,0,0,0,0|1,0,0]=3 5248 B16R0.303 COCCOCCOCCOCCCCCCl 34a_100000746330_100013367474 [0,2,0,0,0,0|1,0,0]=3 5249 B16R0.303 COCCOCCOCCOCCCCCCl 7a_100000746330_100013367474 [0,2,0,0,0,0|1,0,0]=3 5250 B16R0.303 COCCOCCOCCOCCCCCF 34a_100000688194_100000729378 [0,2,0,0,0,0|1,0,0]=3 5251 B16R0.303 COCCOCCOCCOCCCCCF 7a_100000688194_100000729378 [0,2,0,0,0,0|1,0,0]=3 5252 B16R0.303 COCCOCCOCCOCCCCCI 34a_200012148887_100013367474 [0,2,0,0,0,0|1,0,0]=3 5253 B16R0.303 COCCOCCOCCOCCCCCI 7a_200012148887_100013367474 [0,2,0,0,0,0|1,0,0]=3 5254 B16R0.303 COCCOCCOCCOCCCCCN 34a_100000762737_100013367474 [0,2,0,0,0,0|1,0,0]=3 5255 B16R0.303 COCCOCCOCCOCCCCCO 34a_100000688194_100000746330 [0,2,0,0,0,0|1,0,0]=3 5256 B16R0.303 COCCOCCOCCOCCCCCO 7a_100000688194_100000746330 [0,2,0,0,0,0|1,0,0]=3 5257 B16R0.303 COCCOCCOCCOCCCCSC 34a_100011217163_100013367474 [0,2,0,0,0,0|0,1,0]=3 5258 B16R0.303 COCCOCCOCCOCCCCSC 7a_100011217163_100013367474 [0,2,0,0,0,0|0,1,0]=3 5259 B16R0.303 COCCOCCOCCOCCNCC#N 2230a_100012359593_100011215382 [0,2,0,0,0,0|1,0,0]=3 5260 B16R0.303 COCCOCCOCCOCCNCC=O 2230a_100012359593_200015260668 [0,2,0,0,0,0|1,0,0]=3 5261 B16R0.303 COCCOCCOCCOCCNCC=O 34a_100012359593_200009817547 [0,2,0,0,0,0|1,0,0]=3 5262 B16R0.303 COCCOCCOCCOCCNCCF 2230a_100012359593_100011217306 [0,2,0,0,0,0|1,0,0]=3 5263 B16R0.303 COCCOCCOCCOCCNCCF 34a_100000724931_100012349117 [0,2,0,0,0,0|1,0,0]=3 5264 B16R0.303 COCCOCCOCCOCCNCCF 34a_100012359593_100011217306 [0,2,0,0,0,0|1,0,0]=3 5265 B16R0.303 COCCOCCOCCOCCNCCO 2230a_100012359593_100000211926 [0,2,0,0,0,0|1,0,0]=3 5266 B16R0.303 COCCOCCOCCOCCNCCO 2230a_100016997473_100012349117 [0,2,0,0,0,0|1,0,0]=3 5267 B16R0.303 COCCOCCOCCOCCNCCO 34a_100012359593_100000211926 [0,2,0,0,0,0|1,0,0]=3 5268 B16R0.303 COCCOCCOCCOCCNCCO 34a_100016990907_100012349117 [0,2,0,0,0,0|1,0,0]=3 5269 B16R0.303 COCCOCCOCCOCCNCOC 2230a_100012359593_100000766300 [0,2,0,0,0,0|0,0,0]=2 5270 B16R0.303 COCCOCCOCCOCCNCSC 2230a_100012359593_100011218213 [0,2,0,0,0,0|0,1,0]=3 5271 B16R0.303 COCCOCCOCCOCCNCSC 34a_100012359593_100011218213 [0,2,0,0,0,0|0,1,0]=3 5272 B16R0.303 COCCOCCOCCOCCOCC#N 7a_100000688194_200000047693 [0,2,0,0,0,0|0,0,0]=2 5273 B16R0.303 COCCOCCOCCOCCOCC#N 7a_100011218579_100011215382 [0,2,0,0,0,0|0,0,0]=2 5274 B16R0.303 COCCOCCOCCOCCOCC=O 34a_100011218579_200009817547 [0,2,0,0,0,0|0,0,0]=2 5275 B16R0.303 COCCOCCOCCOCCOCC=O 7a_100011218579_200015260668 [0,2,0,0,0,0|0,0,0]=2 5276 B16R0.303 COCCOCCOCCOCCOCCBr 34a_100000211926_100012349117 [0,2,0,0,0,0|0,0,0]=2 5277 B16R0.303 COCCOCCOCCOCCOCCBr 34a_100000692535_100013367474 [0,2,0,0,0,0|0,0,0]=2 5278 B16R0.303 COCCOCCOCCOCCOCCBr 34a_100010132935_100011201679 [0,2,0,0,0,0|0,0,0]=2 5279 B16R0.303 COCCOCCOCCOCCOCCBr 34a_100010132937_100000695917 [0,2,0,0,0,0|0,0,0]=2 5280 B16R0.303 COCCOCCOCCOCCOCCBr 34a_100010134629_200000210301 [0,2,0,0,0,0|0,0,0]=2 5281 B16R0.303 COCCOCCOCCOCCOCCBr 7a_100000692535_100013367474 [0,2,0,0,0,0|0,0,0]=2 5282 B16R0.303 COCCOCCOCCOCCOCCBr 7a_100010132935_100000233755 [0,2,0,0,0,0|0,0,0]=2 5283 B16R0.303 COCCOCCOCCOCCOCCBr 7a_100010132937_100000695917 [0,2,0,0,0,0|0,0,0]=2 5284 B16R0.303 COCCOCCOCCOCCOCCBr 7a_100010134629_200000210301 [0,2,0,0,0,0|0,0,0]=2 5285 B16R0.303 COCCOCCOCCOCCOCCCl 34a_100000032323_100000695917 [0,2,0,0,0,0|0,0,0]=2 5286 B16R0.303 COCCOCCOCCOCCOCCCl 34a_100010166562_100011201679 [0,2,0,0,0,0|0,0,0]=2 5287 B16R0.303 COCCOCCOCCOCCOCCCl 34a_100011215305_100013367474 [0,2,0,0,0,0|0,0,0]=2 5288 B16R0.303 COCCOCCOCCOCCOCCCl 7a_100000032323_100000695917 [0,2,0,0,0,0|0,0,0]=2 5289 B16R0.303 COCCOCCOCCOCCOCCCl 7a_100010166562_100000233755 [0,2,0,0,0,0|0,0,0]=2 5290 B16R0.303 COCCOCCOCCOCCOCCCl 7a_100011215305_100013367474 [0,2,0,0,0,0|0,0,0]=2 5291 B16R0.303 COCCOCCOCCOCCOCCF 34a_100011218579_100011217306 [0,2,0,0,0,0|0,0,0]=2 5292 B16R0.303 COCCOCCOCCOCCOCCF 34a_200015357709_100013367474 [0,2,0,0,0,0|0,0,0]=2 5293 B16R0.303 COCCOCCOCCOCCOCCF 7a_100011218579_100011217306 [0,2,0,0,0,0|0,0,0]=2 5294 B16R0.303 COCCOCCOCCOCCOCCF 7a_200015357709_100013367474 [0,2,0,0,0,0|0,0,0]=2 5295 B16R0.303 COCCOCCOCCOCCOCCI 34a_100012149058_100013367474 [0,2,0,0,0,0|0,0,0]=2 5296 B16R0.303 COCCOCCOCCOCCOCCI 7a_100012149058_100013367474 [0,2,0,0,0,0|0,0,0]=2 5297 B16R0.303 COCCOCCOCCOCCOCCN 34a_100000210304_100012349117 [0,2,0,0,0,0|0,0,0]=2 5298 B16R0.303 COCCOCCOCCOCCOCCN 34a_100000211614_100013367474 [0,2,0,0,0,0|0,0,0]=2 5299 B16R0.303 COCCOCCOCCOCCOCCN 34a_100011169512_200000210301 [0,2,0,0,0,0|0,0,0]=2 5300 B16R0.303 COCCOCCOCCOCCOCCN 34a_100011998139_100000695917 [0,2,0,0,0,0|0,0,0]=2 5301 B16R0.303 COCCOCCOCCOCCOCCN 34a_103437854208_100011201679 [0,2,0,0,0,0|0,0,0]=2 5302 B16R0.303 COCCOCCOCCOCCOCCO 34a_100000210237_100010166562 [0,2,0,0,0,0|0,0,0]=2 5303 B16R0.303 COCCOCCOCCOCCOCCO 34a_100000688194_100000692535 [0,2,0,0,0,0|0,0,0]=2 5304 B16R0.303 COCCOCCOCCOCCOCCO 34a_100011215163_100000032323 [0,2,0,0,0,0|0,0,0]=2 5305 B16R0.303 COCCOCCOCCOCCOCCO 34a_100011218579_100000211926 [0,2,0,0,0,0|0,0,0]=2 5306 B16R0.303 COCCOCCOCCOCCOCCO 34a_100138415774_100010134629 [0,2,0,0,0,0|0,0,0]=2 5307 B16R0.303 COCCOCCOCCOCCOCCO 7a_100000688194_100011215305 [0,2,0,0,0,0|0,0,0]=2 5308 B16R0.303 COCCOCCOCCOCCOCCO 7a_100011215163_100000032323 [0,2,0,0,0,0|0,0,0]=2 5309 B16R0.303 COCCOCCOCCOCCOCCO 7a_100011218579_100000211926 [0,2,0,0,0,0|0,0,0]=2 5310 B16R0.303 COCCOCCOCCOCCOCSC 34a_100011218579_100011218213 [0,2,0,0,0,0|0,0,0]=2 5311 B16R0.303 COCCOCCOCCOCCSCC#N 62a_100011215382_100012349117 [0,2,0,0,0,0|0,1,0]=3 5312 B16R0.303 COCCOCCOCCOCCSCC#N 62a_100012349117_100011215382 [0,2,0,0,0,0|0,1,0]=3 5313 B16R0.303 COCCOCCOCCOCCSCC=O 62a_100012349117_200015260668 [0,2,0,0,0,0|0,1,0]=3 5314 B16R0.303 COCCOCCOCCOCCSCC=O 62a_200015260668_100012349117 [0,2,0,0,0,0|0,1,0]=3 5315 B16R0.303 COCCOCCOCCOCCSCCF 62a_100011217306_100012349117 [0,2,0,0,0,0|0,1,0]=3 5316 B16R0.303 COCCOCCOCCOCCSCCF 62a_100012349117_100011217306 [0,2,0,0,0,0|0,1,0]=3 5317 B16R0.303 COCCOCCOCCOCCSCCO 62a_100000211926_100012349117 [0,2,0,0,0,0|0,1,0]=3 5318 B16R0.303 COCCOCCOCCOCCSCCO 62a_100012349117_100000211926 [0,2,0,0,0,0|0,1,0]=3 5319 B16R0.303 COCCOCCOCCOCCSCOC 62a_100000766300_100012349117 [0,2,0,0,0,0|0,0,0]=2 5320 B16R0.303 COCCOCCOCCOCCSCOC 62a_100012349117_100000766300 [0,2,0,0,0,0|0,0,0]=2 5321 B16R0.303 COCCOCCOCCOCCSCSC 62a_100011218213_100012349117 [0,2,0,0,0,0|0,1,0]=3 5322 B16R0.303 COCCOCCOCCOCCSCSC 62a_100012349117_100011218213 [0,2,0,0,0,0|0,1,0]=3 5323 B16R0.303 COCCOCCOCCSCCCCC#N 62a_100011219923_100013367474 [0,2,0,0,0,0|1,1,0]=4 5324 B16R0.303 COCCOCCOCCSCCCCC#N 62a_100013367474_100000211819 [0,2,0,0,0,0|1,1,0]=4 5325 B16R0.303 COCCOCCOCCSCCCCC=O 62a_100000139335_100013367474 [0,2,0,0,0,0|1,1,0]=4 5326 B16R0.303 COCCOCCOCCSCCCCC=O 62a_100013367474_100000139335 [0,2,0,0,0,0|1,1,0]=4 5327 B16R0.303 COCCOCCOCCSCCCCCF 62a_100000729378_100013367474 [0,2,0,0,0,0|1,1,0]=4 5328 B16R0.303 COCCOCCOCCSCCCCCF 62a_100013367474_100000729378 [0,2,0,0,0,0|1,1,0]=4 5329 B16R0.303 COCCOCCOCCSCCCCCO 62a_100000746330_100013367474 [0,2,0,0,0,0|1,1,0]=4 5330 B16R0.303 COCCOCCOCCSCCCCCO 62a_100013367474_100000746330 [0,2,0,0,0,0|1,1,0]=4 5331 B16R0.303 COCCOCCOCCSCCOCC#N 62a_100013367474_200000047693 [0,2,0,0,0,0|0,1,0]=3 5332 B16R0.303 COCCOCCOCCSCCOCC#N 62a_200000047693_100013367474 [0,2,0,0,0,0|0,1,0]=3 5333 B16R0.303 COCCOCCOCCSCCOCCO 62a_100011215305_100013367474 [0,2,0,0,0,0|0,1,0]=3 5334 B16R0.303 COCCOCCOCCSCCOCCO 62a_100013367474_100011215305 [0,2,0,0,0,0|0,1,0]=3 5335 B16R0.303 COCCOCCOCCSCOCCOC 62a_100000231047_100013367474 [0,2,0,0,0,0|0,0,0]=2 5336 B16R0.303 COCCOCCOCCSCOCCOC 62a_100013367474_100000231047 [0,2,0,0,0,0|0,0,0]=2 5337 B16R0.303 COCCOCCSCCOCCOCCO 62a_100000032323_100000695917 [0,2,0,0,0,0|0,1,0]=3 5338 B16R0.303 COCCOCCSCCOCCOCCO 62a_100000695917_100000032323 [0,2,0,0,0,0|0,1,0]=3 5339 B16R0.303 COCCOCNCCCOCCOCCO 2230a_100011996194_100000231047 [0,2,0,0,0,0|2,0,0]=4 5340 B16R0.303 COCCSCCOCCOCCOCCO 62a_100000233755_100010166562 [0,2,0,0,0,0|0,1,0]=3 5341 B16R0.303 COCCSCCOCCOCCOCCO 62a_100010166562_100000233755 [0,2,0,0,0,0|0,1,0]=3 5342 B16R0.303 CSCCNCCOCCOCCOCCO 2230a_100020590264_100010166562 [0,2,0,0,0,0|1,1,0]=4 5343 B16R0.303 CSCCNCCOCCOCCOCCO 2230a_103437854208_100000751147 [0,2,0,0,0,0|1,1,0]=4 5344 B16R0.303 CSCCNCCOCCOCCOCCO 34a_103437854208_100000212216 [0,2,0,0,0,0|1,1,0]=4 5345 B16R0.303 CSCCOCCOCCOCCOCCBr 34a_100010132935_100000212216 [0,2,0,0,0,0|0,1,0]=3 5346 B16R0.303 CSCCOCCOCCOCCOCCBr 7a_100010132935_100000212216 [0,2,0,0,0,0|0,1,0]=3 5347 B16R0.303 CSCCOCCOCCOCCOCCCl 34a_100010166562_100000212216 [0,2,0,0,0,0|0,1,0]=3 5348 B16R0.303 CSCCOCCOCCOCCOCCCl 7a_100010166562_100000212216 [0,2,0,0,0,0|0,1,0]=3 5349 B16R0.303 CSCCOCCOCCOCCOCCN 34a_103437854208_100000212216 [0,2,0,0,0,0|0,1,0]=3 5350 B16R0.303 CSCCOCCOCCOCCOCCO 34a_100000230434_100010166562 [0,2,0,0,0,0|0,1,0]=3 5351 B16R0.303 CSCCOCCOCCOCCOCCO 62a_100010134629_200000210301 [0,2,0,0,0,0|0,1,0]=3 5352 B16R0.303 CSCCOCCOCCOCCOCCO 62a_200000210301_100010134629 [0,2,0,0,0,0|0,1,0]=3 5353 B16R0.303 CSCCOCCOCCOCCOCCO 7a_100000230434_100010166562 [0,2,0,0,0,0|0,1,0]=3 5354 B16R0.303 CSCCSCCOCCOCCOCCO 62a_100000212216_100010166562 [0,2,0,0,0,0|0,2,0]=4 5355 B16R0.303 CSCCSCCOCCOCCOCCO 62a_100010166562_100000751147 [0,2,0,0,0,0|0,2,0]=4 5356 B16R0.303 CSCOCCOCCOCCOCCON 34a_200121571635_100011218213 [0,2,0,0,0,0|1,0,0]=3 5357 B16R0.303 FCCCOCCOCCOCCOCCBr 34a_100010132935_100011934791 [0,2,0,0,0,0|2,0,0]=4 5358 B16R0.303 FCCCOCCOCCOCCOCCBr 7a_100010132935_100011934791 [0,2,0,0,0,0|2,0,0]=4 5359 B16R0.303 FCCCOCCOCCOCCOCCCl 34a_100010166562_100011934791 [0,2,0,0,0,0|2,0,0]=4 5360 B16R0.303 FCCCOCCOCCOCCOCCCl 7a_100010166562_100011934791 [0,2,0,0,0,0|2,0,0]=4 5361 B16R0.303 N#CCCOCCOCCOCCOCCBr 7a_100010132935_100000184422 [0,2,0,0,0,0|2,0,0]=4 5362 B16R0.303 N#CCCOCCOCCOCCOCCCl 7a_100010166562_100000184422 [0,2,0,0,0,0|2,0,0]=4 5363 B16R0.303 NCCCOCCOCCOCCOCCO 34a_100000182051_100010166562 [0,2,0,0,0,0|2,0,0]=4 5364 B16R0.303 NCCCOCCOCCOCCOCCO 34a_100011996194_100000692535 [0,2,0,0,0,0|2,0,0]=4 5365 B16R0.303 NCCOCCOCCOCCOCCCF 34a_103437854208_100011934791 [0,2,0,0,0,0|2,0,0]=4 5366 B16R0.303 NCCOCCOCCOCCOCCCO 34a_103437854208_100000230001 [0,2,0,0,0,0|2,0,0]=4 5367 B16R0.303 NOCCOCCOCCOCCOCC=O 34a_200121571635_200009817547 [0,2,0,0,0,0|1,0,0]=3 5368 B16R0.303 NOCCOCCOCCOCCOCCF 34a_200121571635_100011217306 [0,2,0,0,0,0|1,0,0]=3 5369 B16R0.303 NOCCOCCOCCOCCOCCO 34a_100000700252_100010166562 [0,2,0,0,0,0|1,0,0]=3 5370 B16R0.303 NOCCOCCOCCOCCOCCO 34a_200121571635_100000211926 [0,2,0,0,0,0|1,0,0]=3 5371 B16R0.303 OCCCOCCOCCOCCOCCBr 34a_100010132935_100000230001 [0,2,0,0,0,0|2,0,0]=4 5372 B16R0.303 OCCCOCCOCCOCCOCCBr 7a_100010132935_100011215043 [0,2,0,0,0,0|2,0,0]=4 5373 B16R0.303 OCCCOCCOCCOCCOCCCl 34a_100010166562_100000230001 [0,2,0,0,0,0|2,0,0]=4 5374 B16R0.303 OCCCOCCOCCOCCOCCCl 7a_100010166562_100011215043 [0,2,0,0,0,0|2,0,0]=4 5375 B16R0.303 OCCOCCOCCOCCOCCCBr 34a_100011217188_100010166562 [0,2,0,0,0,0|2,0,0]=4 5376 B16R0.303 OCCOCCOCCOCCOCCCCl 34a_100000230001_100010166562 [0,2,0,0,0,0|2,0,0]=4 5377 B16R0.303 OCCOCCOCCOCCOCCCF 34a_100000759539_100010166562 [0,2,0,0,0,0|2,0,0]=4 5378 B16R0.303 [13CH3]NCCOCCOCCOCCOCCO 2230a_100011169512_200025704644 [0,2,0,0,0,0|1,0,0]=3 5379 B16R0.303 [13CH3]NCCOCCOCCOCCOCCO 34a_100011169512_200025704644 [0,2,0,0,0,0|1,0,0]=3 5380 B16R0.303 [13CH3]OCCOCCOCCOCCOCCBr 34a_100010134629_200025704644 [0,2,0,0,0,0|0,0,0]=2 5381 B16R0.303 [13CH3]OCCOCCOCCOCCOCCBr 7a_100010134629_200025704644 [0,2,0,0,0,0|0,0,0]=2 5382 B16R0.303 [13CH3]OCCOCCOCCOCCOCCN 34a_100011169512_200025704644 [0,2,0,0,0,0|0,0,0]=2 5383 B16R0.303 [13CH3]SCCOCCOCCOCCOCCO 62a_100010134629_200025704644 [0,2,0,0,0,0|0,1,0]=3 5384 B16R0.303 [13CH3]SCCOCCOCCOCCOCCO 62a_200025704644_100010134629 [0,2,0,0,0,0|0,1,0]=3 5385 B16R0.303 [N-]=[N+]=NCCOCCOCCOCCOCF 7a_100010008387_100015361967 [0,2,0,0,0,0|2,0,0]=4 5386 B16R0.661 C=CCCC(C)OCCOCCOCCOC 34a_100000765329_100013367474 [0,2,0,0,0,0|1,0,1]=4 5387 B16R0.661 C=CCCC(C)OCCOCCOCCOC 7a_100000765329_100013367474 [0,2,0,0,0,0|1,0,1]=4 5388 B16R0.661 CCC#CC(C)OCCOCCOCCOC 34a_100000033903_100013367474 [0,2,0,0,0,0|1,0,1]=4 5389 B16R0.661 CCC#CC(C)OCCOCCOCCOC 7a_100000033903_100013367474 [0,2,0,0,0,0|1,0,1]=4 5390 B16R0.661 CCCCC(=O)NCCOCCOCCOC 1626a_100012028300_100000210183 [0,2,0,0,0,0|2,0,0]=4 5391 B16R0.661 CCCCC(=O)NCCOCCOCCOC 240690a_100012028300_100000210183 [0,2,0,0,0,0|2,0,0]=4 5392 B16R0.661 CCCCC(C)NCCOCCOCCOC 2230a_100000126638_100013367474 [0,2,0,0,0,0|2,0,0]=4 5393 B16R0.661 CCCCC(C)NCCOCCOCCOC 2230a_100012028300_200011215066 [0,2,0,0,0,0|2,0,0]=4 5394 B16R0.661 CCCCC(C)NCCOCCOCCOC 270004a_100012028300_100000210087 [0,2,0,0,0,0|2,0,0]=4 5395 B16R0.661 CCCCC(C)NCCOCCOCCOC 34a_100012028300_200011215066 [0,2,0,0,0,0|2,0,0]=4 5396 B16R0.661 CCCCC(C)OCCOCCOCCNC 34a_200014138305_200011215066 [0,2,0,0,0,0|2,0,0]=4 5397 B16R0.661 CCCCC(C)OCCOCCOCCOC 34a_100000687866_100013367474 [0,2,0,0,0,0|1,0,0]=3 5398 B16R0.661 CCCCC(C)OCCOCCOCCOC 34a_100000688194_200011215066 [0,2,0,0,0,0|1,0,0]=3 5399 B16R0.661 CCCCC(C)OCCOCCOCCOC 7a_100000687866_100013367474 [0,2,0,0,0,0|1,0,0]=3 5400 B16R0.661 CCCCC(C)OCCOCCOCCOC 7a_100000688194_200011215066 [0,2,0,0,0,0|1,0,0]=3 5401 B16R0.661 CCCCC(C)SCCOCCOCCOC 62a_100013367474_200011215066 [0,2,0,0,0,0|1,1,0]=4 5402 B16R0.661 CCCCC(C)SCCOCCOCCOC 62a_200011215066_100013367474 [0,2,0,0,0,0|1,1,0]=4 5403 B16R0.661 CCCCOCCOCCOC(C)CCCC 34a_100011215186_200011215066 [0,2,0,0,0,0|2,0,0]=4 5404 B16R0.661 CCCCOCCOCCOC(C)CCCC 7a_100011215186_200011215066 [0,2,0,0,0,0|2,0,0]=4 5405 B16R0.661 CCOCC(=O)NCCOCCOCCOC 1626a_100012028300_100000211967 [0,2,0,0,0,0|1,0,1]=4 5406 B16R0.661 CCOCC(=O)NCCOCCOCCOC 240690a_100012028300_100000211967 [0,2,0,0,0,0|1,0,1]=4 5407 B16R0.661 CCOCC(C)OCCOCCOCCOC 34a_100000718985_100013367474 [0,2,0,0,0,0|0,0,0]=2 5408 B16R0.661 CCOCC(C)OCCOCCOCCOC 7a_100000718985_100013367474 [0,2,0,0,0,0|0,0,0]=2 5409 B16R0.661 CCSCC(C)NCCOCCOCCOC 270004a_100012028300_200011216171 [0,2,0,0,0,0|1,1,0]=4 5410 B16R0.661 COCCOCCOCCNC(=O)CCOC 1626a_100012028300_100000749529 [0,2,0,0,0,0|1,0,0]=3 5411 B16R0.661 COCCOCCOCCNC(=O)CCOC 240690a_100012028300_100000749529 [0,2,0,0,0,0|1,0,0]=3 5412 B16R0.661 COCCOCCOCCNC(=O)CCSC 1626a_100012028300_100000174002 [0,2,0,0,0,0|1,1,0]=4 5413 B16R0.661 COCCOCCOCCNC(=O)CCSC 240690a_100012028300_100000174002 [0,2,0,0,0,0|1,1,0]=4 5414 B16R0.661 COCCOCCOCCNC(C)CCOC 270004a_100012028300_100000742357 [0,2,0,0,0,0|1,0,0]=3 5415 B16R0.661 COCCOCCOCCNC(C)CCSC 270004a_100012028300_100011217047 [0,2,0,0,0,0|1,1,0]=4 5416 B16R0.661 COCCOCCOCCOC(C)CCCCl 34a_200000718107_100013367474 [0,2,0,0,0,0|1,0,0]=3 5417 B16R0.661 COCCOCCOCCOC(C)CCCCl 7a_200000718107_100013367474 [0,2,0,0,0,0|1,0,0]=3 5418 B16R0.6603 CCCCCCC(=O)COCCOCCOC 1458a_100011214951_100000210757 [0,2,0,0,0,0|2,0,0]=4 5419 B16R0.6603 CCCCCCC(C)OCCCOCCOC 34a_100000210265_100011216529 [0,2,0,0,0,0|2,0,0]=4 5420 B16R0.6603 CCCCCCC(C)OCCCOCCOC 7a_100000210265_100011216529 [0,2,0,0,0,0|2,0,0]=4 5421 B16R0.6603 CCCCCCC(C)OCCOCCOCC 34a_100000210240_100011215978 [0,2,0,0,0,0|2,0,0]=4 5422 B16R0.6603 CCCCCCC(C)OCCOCCOCC 34a_100000210265_100011211534 [0,2,0,0,0,0|2,0,0]=4 5423 B16R0.6603 CCCCCCC(C)OCCOCCOCC 7a_100000210240_100011215978 [0,2,0,0,0,0|2,0,0]=4 5424 B16R0.6603 CCCCCCC(C)OCCOCCOCC 7a_100000210265_100011211534 [0,2,0,0,0,0|2,0,0]=4 5425 B16R0.6603 CCCCOCC(=O)COCCOCCOC 1458a_100011214951_100011995733 [0,2,0,0,0,0|1,0,0]=3 5426 B16R0.6603 CCCCOCC(C)OCCCCCCOC 34a_100011217071_100011998445 [0,2,0,0,0,0|2,0,0]=4 5427 B16R0.6603 CCCCOCC(C)OCCCCCCOC 7a_100011217071_100011998445 [0,2,0,0,0,0|2,0,0]=4 5428 B16R0.6603 CCCCOCC(C)OCCCOCCOC 34a_100011217071_100011216529 [0,2,0,0,0,0|1,0,0]=3 5429 B16R0.6603 CCCCOCC(C)OCCCOCCOC 7a_100011217071_100011216529 [0,2,0,0,0,0|1,0,0]=3 5430 B16R0.6603 CCCCOCC(C)OCCOCCOCC 34a_100011217071_100011211534 [0,2,0,0,0,0|1,0,0]=3 5431 B16R0.6603 CCCCOCC(C)OCCOCCOCC 7a_100011217071_100011211534 [0,2,0,0,0,0|1,0,0]=3 5432 B16R0.6603 CCCCOCCOCC(=O)CCCCOC 1458a_100011216887_100000755781 [0,2,0,0,0,0|2,0,0]=4 5433 B16R0.6603 CCCCOCCOCC(=O)COCCCC 1458a_100011216887_100011995733 [0,2,0,0,0,0|2,0,0]=4 5434 B16R0.6603 CCCCOCCOCC(=O)OCCOCC 34a_100000210238_200000101388 [0,2,0,0,0,0|1,0,1]=4 5435 B16R0.6603 CCCCOCCOCC(=O)OCCOCC 7a_100000210238_200000101388 [0,2,0,0,0,0|1,0,1]=4 5436 B16R0.6603 CCOCCCC(=O)COCCOCCOC 1458a_100011214951_100012232248 [0,2,0,0,0,0|1,0,1]=4 5437 B16R0.6603 CCOCCNC(=O)COCCOCCOC 11a_100011200944_100011214951 [0,2,0,0,0,0|1,0,1]=4 5438 B16R0.6603 CCOCCNC(=O)COCCOCCOC 1626a_102516460346_100011214951 [0,2,0,0,0,0|1,0,1]=4 5439 B16R0.6603 CCOCCNC(=O)COCCOCCOC 240690a_100011200944_100011214951 [0,2,0,0,0,0|1,0,1]=4 5440 B16R0.6603 CCOCCNC(=O)COCCOCCOC 527a_100011200944_100011214951 [0,2,0,0,0,0|1,0,1]=4 5441 B16R0.6603 CCOCCOC(=O)CNCCOCCOC 2230a_100000745349_200000101388 [0,2,0,0,0,0|1,0,1]=4 5442 B16R0.6603 CCOCCOC(=O)CNCCOCCOC 34a_100000745349_200000101388 [0,2,0,0,0,0|1,0,1]=4 5443 B16R0.6603 CCOCCOC(=O)COCCOCCNC 34a_100000228057_200000101388 [0,2,0,0,0,0|1,0,1]=4 5444 B16R0.6603 CCOCCOC(=O)COCCOCCOC 34a_100011215163_200000101388 [0,2,0,0,0,0|0,0,1]=3 5445 B16R0.6603 CCOCCOC(=O)COCCOCCOC 7a_100011215163_200000101388 [0,2,0,0,0,0|0,0,1]=3 5446 B16R0.6603 CCOCCOC(=O)CSCCOCCOC 62a_100000695917_200000101388 [0,2,0,0,0,0|0,1,1]=4 5447 B16R0.6603 CCOCCOC(=O)CSCCOCCOC 62a_200000101388_100000695917 [0,2,0,0,0,0|0,1,1]=4 5448 B16R0.6603 CCOCCOCCNC(=O)COCCOC 11a_100102712874_100000211095 [0,2,0,0,0,0|1,0,1]=4 5449 B16R0.6603 CCOCCOCCNC(=O)COCCOC 1626a_100102712874_100000211095 [0,2,0,0,0,0|1,0,1]=4 5450 B16R0.6603 CCOCCOCCNC(=O)COCCOC 240690a_100102712874_100000211095 [0,2,0,0,0,0|1,0,1]=4 5451 B16R0.6603 CCOCCOCCNC(=O)COCCOC 527a_100102712874_100000211095 [0,2,0,0,0,0|1,0,1]=4 5452 B16R0.6603 COCCCCC(=O)COCCOCCOC 1458a_100011214951_100000755781 [0,2,0,0,0,0|1,0,0]=3 5453 B16R0.6603 COCCCNC(=O)COCCOCCOC 1626a_100150723488_100011214951 [0,2,0,0,0,0|1,0,1]=4 5454 B16R0.6603 COCCCNC(=O)COCCOCCOC 240690a_100150723488_100011214951 [0,2,0,0,0,0|1,0,1]=4 5455 B16R0.6603 COCCCNC(=O)COCCOCCOC 34a_100011215163_100000183178 [0,2,0,0,0,0|1,0,1]=4 5456 B16R0.6603 COCCCNC(=O)COCCOCCOC 527a_100150723488_100011214951 [0,2,0,0,0,0|1,0,1]=4 5457 B16R0.6603 COCCCNC(=O)COCCOCCOC 7a_100011215163_100000183178 [0,2,0,0,0,0|1,0,1]=4 5458 B16R0.6603 COCCNNC(=O)COCCOCCOC 22a_100000741390_100011214951 [0,2,0,0,0,0|1,0,1]=4 5459 B16R0.6603 COCCOCCCNC(=O)COCCOC 1626a_100000206027_100000211095 [0,2,0,0,0,0|1,0,1]=4 5460 B16R0.6603 COCCOCCCNC(=O)COCCOC 240690a_100000206027_100000211095 [0,2,0,0,0,0|1,0,1]=4 5461 B16R0.70 C=C[C@@H](C)[C@@H](C)OCCOCCOCCOC 34a_100015455354_100013367474 [0,2,0,0,0,0|1,0,1]=4 5462 B16R0.70 C=C[C@@H](C)[C@@H](C)OCCOCCOCCOC 7a_100015455354_100013367474 [0,2,0,0,0,0|1,0,1]=4 5463 B16R0.70 CCC(=O)C(C)OCCOCCOCCOC 7a_100000688194_100000742827 [0,2,0,0,0,0|1,0,1]=4 5464 B16R0.70 CCC(C)C(C)NCCOCCOCCOC 269862a_100012028300_100000210599 [0,2,0,0,0,0|2,0,0]=4 5465 B16R0.70 CCC(C)C(C)NCCOCCOCCOC 270004a_100012028300_100000210599 [0,2,0,0,0,0|2,0,0]=4 5466 B16R0.70 CCC(C)C(C)OCCOCCOCCOC 7a_100011215189_100013367474 [0,2,0,0,0,0|1,0,0]=3 5467 B16R0.70 CCCCOCCOCCOC(C)C(=O)OC 34a_100011215186_100000211248 [0,2,0,0,0,0|1,0,1]=4 5468 B16R0.70 CCCCOCCOCCOC(C)C(=O)OC 7a_100011215186_100000211248 [0,2,0,0,0,0|1,0,1]=4 5469 B16R0.70 CNC(=O)C(C)OCCOCCOCCOC 34a_100000688194_100000731044 [0,2,0,0,0,0|1,0,1]=4 5470 B16R0.70 CNC(=O)C(C)OCCOCCOCCOC 7a_100000688194_100000209862 [0,2,0,0,0,0|1,0,1]=4 5471 B16R0.70 CNC(=O)C(F)OCCOCCOCCOC 34a_100000688194_100009813575 [0,2,0,0,0,0|1,0,1]=4 5472 B16R0.70 CNC(=O)C(F)OCCOCCOCCOC 7a_100000688194_100009813575 [0,2,0,0,0,0|1,0,1]=4 5473 B16R0.70 CNCCOCCOCCOC(C)C(=O)OC 34a_200014138305_100000211248 [0,2,0,0,0,0|1,0,1]=4 5474 B16R0.70 COCCOCCOCCNC(=O)C(C)OC 1626a_100012028300_100000743197 [0,2,0,0,0,0|1,0,1]=4 5475 B16R0.70 COCCOCCOCCNC(=O)C(C)OC 240690a_100012028300_100000743197 [0,2,0,0,0,0|1,0,1]=4 5476 B16R0.70 COCCOCCOCCNC(C)C(=O)OC 2230a_100012028300_100000211248 [0,2,0,0,0,0|1,0,1]=4 5477 B16R0.70 COCCOCCOCCNC(C)C(=O)OC 34a_100012028300_100000211248 [0,2,0,0,0,0|1,0,1]=4 5478 B16R0.70 COCCOCCOCCOC(C)C(=O)OC 34a_100000688194_100000211248 [0,2,0,0,0,0|0,0,1]=3 5479 B16R0.70 COCCOCCOCCOC(C)C(=O)OC 34a_100011215400_100013367474 [0,2,0,0,0,0|0,0,1]=3 5480 B16R0.70 COCCOCCOCCOC(C)C(=O)OC 7a_100000688194_100000211248 [0,2,0,0,0,0|0,0,1]=3 5481 B16R0.70 COCCOCCOCCSC(C)C(=O)OC 62a_100000211248_100013367474 [0,2,0,0,0,0|0,1,1]=4 5482 B16R0.70 COCCOCCOCCSC(C)C(=O)OC 62a_100013367474_100000211248 [0,2,0,0,0,0|0,1,1]=4 5483 B16R0.108 COCCOCCC(=O)CCOCC(=O)OC 1458a_100000745395_100000090808 [0,2,0,0,0,0|1,0,1]=4 5484 B16R0.164 CCC(C)COCCOCCOCC(=O)OC 34a_100011023656_100000748023 [0,2,0,0,0,0|1,0,1]=4 5485 B16R0.164 CCC(C)COCCOCCOCC(=O)OC 7a_100011023656_100000748023 [0,2,0,0,0,0|1,0,1]=4 5486 B16R0.164 CCC(O)COCCOCCOCC(=O)OC 34a_100011023656_100011218378 [0,2,0,0,0,0|1,0,1]=4 5487 B16R0.164 CCC(O)COCCOCCOCC(=O)OC 7a_100011023656_100011218378 [0,2,0,0,0,0|1,0,1]=4 5488 B16R0.164 CC[C@H](C)COCCOCCOCC(=O)OC 34a_100011023656_100009816398 [0,2,0,0,0,0|1,0,1]=4 5489 B16R0.164 CC[C@H](C)COCCOCCOCC(=O)OC 7a_100011023656_100009816398 [0,2,0,0,0,0|1,0,1]=4 5490 B16R0.164 COC(=O)COCCOCCOCC(=O)OC 34a_100011023656_100000747449 [0,2,0,0,0,0|0,0,2]=4 5491 B16R0.164 COC(=O)COCCOCCOCC(=O)OC 7a_100011023656_100000747449 [0,2,0,0,0,0|0,0,2]=4 5492 B16R0.165 C=C(C)CCOCCOCCOCC(=O)OC 34a_100011023656_100000730704 [0,2,0,0,0,0|1,0,1]=4 5493 B16R0.165 C=C(C)CCOCCOCCOCC(=O)OC 7a_100011023656_100000730704 [0,2,0,0,0,0|1,0,1]=4 5494 B16R0.165 COC(=O)COCCOCCOCCC(=O)C 7a_100011023656_100000053229 [0,2,0,0,0,0|1,0,1]=4 5495 B16R0.165 COC(=O)COCCOCCOCCC(C)C 34a_100011023656_100000210312 [0,2,0,0,0,0|1,0,1]=4 5496 B16R0.165 COC(=O)COCCOCCOCCC(C)C 7a_100011023656_100000210626 [0,2,0,0,0,0|1,0,1]=4 5497 B16R0.165 COC(=O)COCCOCCOCCC(C)O 34a_100011023656_100012276601 [0,2,0,0,0,0|1,0,1]=4 5498 B16R0.165 COC(=O)COCCOCCOCCC(C)O 7a_100011023656_100012276601 [0,2,0,0,0,0|1,0,1]=4 5499 B16R0.165 COC(=O)COCCOCCOCCN(C)C 7a_100011023656_100000755713 [0,2,0,0,0,0|1,0,1]=4 5500 B16R0.184 CCCCOCC(C)OCCOCC(=O)OC 34a_100011217071_100000090808 [0,2,0,0,0,0|1,0,1]=4 5501 B16R0.184 CCCCOCC(C)OCCOCC(=O)OC 7a_100011217071_100000090808 [0,2,0,0,0,0|1,0,1]=4 5502 B16R0.222 CCC(CC)CNCCOCCOCCOC 2230a_100012028300_100011215472 [0,2,0,0,0,0|2,0,0]=4 5503 B16R0.222 CCC(CC)CNCCOCCOCCOC 2230a_100102946423_100013367474 [0,2,0,0,0,0|2,0,0]=4 5504 B16R0.222 CCC(CC)CNCCOCCOCCOC 269862a_100012028300_100000211137 [0,2,0,0,0,0|2,0,0]=4 5505 B16R0.222 CCC(CC)CNCCOCCOCCOC 270004a_100012028300_100000211137 [0,2,0,0,0,0|2,0,0]=4 5506 B16R0.222 CCC(CC)CNCCOCCOCCOC 34a_100012028300_100011215472 [0,2,0,0,0,0|2,0,0]=4 5507 B16R0.222 CCC(CC)COCCOCCOCCNC 34a_200014138305_100011215472 [0,2,0,0,0,0|2,0,0]=4 5508 B16R0.222 CCC(CC)COCCOCCOCCOC 34a_100000688194_100011215472 [0,2,0,0,0,0|1,0,0]=3 5509 B16R0.222 CCC(CC)COCCOCCOCCOC 7a_100000688194_100011215472 [0,2,0,0,0,0|1,0,0]=3 5510 B16R0.222 CCC(CC)COCCOCCOCCOC 7a_100000703878_100013367474 [0,2,0,0,0,0|1,0,0]=3 5511 B16R0.222 CCC(CC)CSCCOCCOCCOC 62a_100011215472_100013367474 [0,2,0,0,0,0|1,1,0]=4 5512 B16R0.222 CCC(CC)CSCCOCCOCCOC 62a_100013367474_100011215472 [0,2,0,0,0,0|1,1,0]=4 5513 B16R0.222 CCC(COCCOCCOCCOC)OC 34a_100011934954_100013367474 [0,2,0,0,0,0|0,0,0]=2 5514 B16R0.222 CCC(COCCOCCOCCOC)OC 7a_100011934954_100013367474 [0,2,0,0,0,0|0,0,0]=2 5515 B16R0.222 CCCCOCCOCCOCC(CC)CC 34a_100011215186_100011215472 [0,2,0,0,0,0|2,0,0]=4 5516 B16R0.222 CCCCOCCOCCOCC(CC)CC 7a_100011215186_100011215472 [0,2,0,0,0,0|2,0,0]=4 5517 B16R0.222 CCCCOCCOCCOCC(OC)OC 34a_100011215186_100000211822 [0,2,0,0,0,0|1,0,0]=3 5518 B16R0.222 CCCCOCCOCCOCC(OC)OC 7a_100011215186_100000751394 [0,2,0,0,0,0|1,0,0]=3 5519 B16R0.222 CCN(CC)COCCOCCOCCOC 7a_200015374951_100013367474 [0,2,0,0,0,0|2,0,0]=4 5520 B16R0.222 CNCCOCCOCCOCC(OC)OC 34a_200014138305_100000211822 [0,2,0,0,0,0|1,0,0]=3 5521 B16R0.222 COC(COCCOCCOCCCN)OC 34a_100011996194_100000211822 [0,2,0,0,0,0|2,0,0]=4 5522 B16R0.222 COCCOCCOCCNCC(OC)OC 2230a_100012028300_100000751394 [0,2,0,0,0,0|1,0,0]=3 5523 B16R0.222 COCCOCCOCCNCC(OC)OC 270004a_100012028300_100000752162 [0,2,0,0,0,0|1,0,0]=3 5524 B16R0.222 COCCOCCOCCNCC(OC)OC 34a_100012028300_100000211822 [0,2,0,0,0,0|1,0,0]=3 5525 B16R0.222 COCCOCCOCCOCC(OC)OC 34a_100000688194_100000211822 [0,2,0,0,0,0|0,0,0]=2 5526 B16R0.222 COCCOCCOCCOCC(OC)OC 34a_100011216393_100013367474 [0,2,0,0,0,0|0,0,0]=2 5527 B16R0.222 COCCOCCOCCOCC(OC)OC 7a_100000688194_100000751394 [0,2,0,0,0,0|0,0,0]=2 5528 B16R0.222 COCCOCCOCCSCC(OC)OC 62a_100000751394_100013367474 [0,2,0,0,0,0|0,1,0]=3 5529 B16R0.222 COCCOCCOCCSCC(OC)OC 62a_100013367474_100000751394 [0,2,0,0,0,0|0,1,0]=3 5530 B16R0.224 COCCOCCOCCNCC(O)C(C)C 2230a_100000759067_100013367474 [0,2,0,0,0,0|2,0,0]=4 5531 B16R0.224 COCCOCCOCCNCC(O)C(C)C 34a_100000759067_100013367474 [0,2,0,0,0,0|2,0,0]=4 5532 B16R0.224 COCCOCCOCCOCC(=O)C(=O)C 34a_100000688194_100011261029 [0,2,0,0,0,0|1,0,1]=4 5533 B16R0.224 COCCOCCOCCOCC(=O)C(C)C 1458a_100012826494_100000210206 [0,2,0,0,0,0|1,0,1]=4 5534 B16R0.224 COCCOCCOCCOCC(=O)C(C)C 34a_100000688194_100000753385 [0,2,0,0,0,0|1,0,1]=4 5535 B16R0.224 COCCOCCOCCOCC(=O)C(C)C 7a_100000688194_100000753385 [0,2,0,0,0,0|1,0,1]=4 5536 B16R0.224 COCCOCCOCCOCC(=O)N(C)C 11a_100102631434_100012826494 [0,2,0,0,0,0|1,0,1]=4 5537 B16R0.224 COCCOCCOCCOCC(=O)N(C)C 1626a_100102631434_100012826494 [0,2,0,0,0,0|1,0,1]=4 5538 B16R0.224 COCCOCCOCCOCC(=O)N(C)C 240690a_100102631434_100012826494 [0,2,0,0,0,0|1,0,1]=4 5539 B16R0.224 COCCOCCOCCOCC(=O)N(C)C 34a_100000688194_100000692301 [0,2,0,0,0,0|1,0,1]=4 5540 B16R0.224 COCCOCCOCCOCC(=O)N(C)C 527a_100102631434_100012826494 [0,2,0,0,0,0|1,0,1]=4 5541 B16R0.224 COCCOCCOCCOCC(=O)N(C)C 7a_100000688194_100000692301 [0,2,0,0,0,0|1,0,1]=4 5542 B16R0.224 COCCOCCOCCOCC(C)C(=O)C 34a_100000032740_100013367474 [0,2,0,0,0,0|1,0,0]=3 5543 B16R0.224 COCCOCCOCCOCC(C)C(=O)C 7a_100000032740_100013367474 [0,2,0,0,0,0|1,0,0]=3 5544 B16R0.224 COCCOCCOCCOCC(C)[N+](=O)[O-] 34a_100000039676_100013367474 [0,2,0,0,0,0|2,0,0]=4 5545 B16R0.224 COCCOCCOCCOCC(C)[N+](=O)[O-] 7a_100000039676_100013367474 [0,2,0,0,0,0|2,0,0]=4 5546 B16R0.224 COCCOCCOCCOC[C@H](N)C(=O)N 34a_100000729942_100013367474 [0,2,0,0,0,0|2,0,0]=4 5547 B16R0.224 COCCOCCOCCOC[C@H](N)C(C)C 34a_100011830312_100013367474 [0,2,0,0,0,0|1,0,0]=3 5548 B16R0.806 CCCC(C)OCCOCCOCC(=O)OC 34a_100011023656_100000766640 [0,2,0,0,0,0|1,0,1]=4 5549 B16R0.806 CCCC(C)OCCOCCOCC(=O)OC 7a_100011023656_100000766640 [0,2,0,0,0,0|1,0,1]=4 5550 B16R0.806 COCC(C)OCCOCCOCC(=O)OC 34a_100011023656_100000765312 [0,2,0,0,0,0|0,0,1]=3 5551 B16R0.806 COCC(C)OCCOCCOCC(=O)OC 7a_100011023656_100000765312 [0,2,0,0,0,0|0,0,1]=3 5552 B16R0.1182 CCC(C)CC(=O)CCOCCOCCOC 1458a_100000708755_100013367474 [0,2,0,0,0,0|2,0,0]=4 5553 B16R0.1182 CCC(C)CC(=O)CCOCCOCCOC 1458a_100012278103_100000748023 [0,2,0,0,0,0|2,0,0]=4 5554 B16R0.1182 CCC(C)CN(C)CCOCCOCCOC 2230a_100000753921_100013367474 [0,2,0,0,0,0|2,0,0]=4 5555 B16R0.1182 CCC(C)CN(C)CCOCCOCCOC 2230a_200000716983_100000748023 [0,2,0,0,0,0|2,0,0]=4 5556 B16R0.1182 CCC(C)CN(C)CCOCCOCCOC 269982a_100000753921_100013367474 [0,2,0,0,0,0|2,0,0]=4 5557 B16R0.1182 CCC(C)CN(C)CCOCCOCCOC 269982a_200000716983_100000748023 [0,2,0,0,0,0|2,0,0]=4 5558 B16R0.1182 CCC(C)CN(C)CCOCCOCCOC 270004a_200000716983_100000243153 [0,2,0,0,0,0|2,0,0]=4 5559 B16R0.1182 CCC(C)CN(C)CCOCCOCCOC 34a_200000716983_100000748023 [0,2,0,0,0,0|2,0,0]=4 5560 B16R0.1182 CCC(O)CC(=O)CCOCCOCCOC 1458a_100011667805_100013367474 [0,2,0,0,0,0|2,0,0]=4 5561 B16R0.1182 CCC(O)CC(=O)CCOCCOCCOC 1458a_100012278103_100011218378 [0,2,0,0,0,0|2,0,0]=4 5562 B16R0.1182 CCC(O)CN(C)CCOCCOCCOC 2230a_200000716983_100011218378 [0,2,0,0,0,0|2,0,0]=4 5563 B16R0.1182 CCC(O)CN(C)CCOCCOCCOC 269982a_200000716983_100011218378 [0,2,0,0,0,0|2,0,0]=4 5564 B16R0.1182 CCC(O)CN(C)CCOCCOCCOC 34a_200000716983_100011218378 [0,2,0,0,0,0|2,0,0]=4 5565 B16R0.1182 CC[C@H](C)CC(=O)CCOCCOCCOC 1458a_100012278103_100009816398 [0,2,0,0,0,0|2,0,0]=4 5566 B16R0.1182 CC[C@H](C)CN(C)CCOCCOCCOC 2230a_200000716983_100009816398 [0,2,0,0,0,0|2,0,0]=4 5567 B16R0.1182 CC[C@H](C)CN(C)CCOCCOCCOC 269982a_200000716983_100009816398 [0,2,0,0,0,0|2,0,0]=4 5568 B16R0.1182 CC[C@H](C)CN(C)CCOCCOCCOC 34a_200000716983_100009816398 [0,2,0,0,0,0|2,0,0]=4 5569 B16R0.1182 COCCOCCOCCC(=O)CC(=O)OC 1458a_100000211351_100013367474 [0,2,0,0,0,0|1,0,1]=4 5570 B16R0.1182 COCCOCCOCCC(=O)CC(=O)OC 1458a_100012278103_100000747449 [0,2,0,0,0,0|1,0,1]=4 5571 B16R0.1182 COCCOCCOCCN(C)CC(=O)OC 2230a_100000198492_100013367474 [0,2,0,0,0,0|1,0,1]=4 5572 B16R0.1182 COCCOCCOCCN(C)CC(=O)OC 2230a_200000716983_100000747449 [0,2,0,0,0,0|1,0,1]=4 5573 B16R0.1182 COCCOCCOCCN(C)CC(=O)OC 269982a_200000716983_100000747449 [0,2,0,0,0,0|1,0,1]=4 5574 B16R0.1182 COCCOCCOCCN(C)CC(=O)OC 34a_200000716983_100000747449 [0,2,0,0,0,0|1,0,1]=4 5575 B16R0.3292 CCC(C)(C)COCCOCCOCCOC 7a_100000765029_100013367474 [0,2,0,0,0,0|1,0,0]=3 5576 B16R0.3292 CCCCOCCOCCOCC(C)(C)OC 34a_100011215186_100000701081 [0,2,0,0,0,0|1,0,0]=3 5577 B16R0.3292 CNCCOCCOCCOCC(C)(C)OC 34a_200014138305_100000701081 [0,2,0,0,0,0|1,0,0]=3 5578 B16R0.3292 COC(C)(C)COCCOCCOCCCN 34a_100011996194_100000701081 [0,2,0,0,0,0|2,0,0]=4 5579 B16R0.3292 COCCOCCOCCNCC(C)(C)OC 2230a_100000763424_100013367474 [0,2,0,0,0,0|1,0,0]=3 5580 B16R0.3292 COCCOCCOCCNCC(C)(C)OC 34a_100012028300_100000701081 [0,2,0,0,0,0|1,0,0]=3 5581 B16R0.3292 COCCOCCOCCNCC(C)(C)SC 270004a_100012028300_100009845794 [0,2,0,0,0,0|1,1,0]=4 5582 B16R0.3292 COCCOCCOCCOCC(C)(C)CCl 7a_100011217199_100013367474 [0,2,0,0,0,0|2,0,0]=4 5583 B16R0.3292 COCCOCCOCCOCC(C)(C)CO 34a_100000688194_100009813988 [0,2,0,0,0,0|2,0,0]=4 5584 B16R0.3292 COCCOCCOCCOCC(C)(C)CO 7a_100000688194_100009813988 [0,2,0,0,0,0|2,0,0]=4 5585 B16R0.3292 COCCOCCOCCOCC(C)(C)OC 34a_100000688194_100000701081 [0,2,0,0,0,0|0,0,0]=2 5586 B16R0.3292 COCCOCCOCCOCC(F)(F)CN 34a_100000703232_100013367474 [0,2,0,0,0,0|2,0,0]=4 5587 B16R0.3292 COCCOCCOCCSCC(C)(C)OC 62a_100000701081_100013367474 [0,2,0,0,0,0|0,1,0]=3 5588 B16R0.3292 COCCOCCOCCSCC(C)(C)OC 62a_100013367474_100000701081 [0,2,0,0,0,0|0,1,0]=3 5589 B16R0.6606 COCCOCCOCC(=O)NC[C@@H](C)OC 11a_100020591295_100011214951 [0,2,0,0,0,0|1,0,1]=4 5590 B16R0.6606 COCCOCCOCC(=O)NC[C@@H](C)OC 1626a_100020591295_100011214951 [0,2,0,0,0,0|1,0,1]=4 5591 B16R0.6606 COCCOCCOCC(=O)NC[C@@H](C)OC 240690a_100020591295_100011214951 [0,2,0,0,0,0|1,0,1]=4 5592 B16R0.6606 COCCOCCOCC(=O)NC[C@@H](C)OC 527a_100020591295_100011214951 [0,2,0,0,0,0|1,0,1]=4 5593 B16R0.789 COCCOCCC(=O)CCN(C)CCOC 1458a_200103286627_100000695917 [0,2,0,0,0,0|2,0,0]=4 5594 B16R0.5998 COCCOCCC(=O)CC(=O)OCCOC 1458a_100000745395_200000040189 [0,2,0,0,0,0|1,0,1]=4 5595 B16R0.137 CCCCCCCOC(C)COC(C)COC 34a_200011930013_100000210614 [0,2,0,0,0,0|2,0,0]=4 5596 B16R0.137 CCCCCCCOC(C)COC(C)COC 7a_200011930013_100000210614 [0,2,0,0,0,0|2,0,0]=4 5597 B16R0.137 CCCCOCCOC(C)COC(C)COC 34a_200011930013_100000743108 [0,2,0,0,0,0|1,0,0]=3 5598 B16R0.137 CCCCOCCOC(C)COC(C)COC 7a_200011930013_100000743108 [0,2,0,0,0,0|1,0,0]=3 5599 B16R0.137 COCCOCCOC(C)COC(C)COC 34a_200011930013_100000695917 [0,2,0,0,0,0|0,0,0]=2 5600 B16R0.137 COCCOCCOC(C)COC(C)COC 7a_200011930013_100000695917 [0,2,0,0,0,0|0,0,0]=2 5601 B16R0.1095 CCCCOCC(C)OCC(=O)OCCOC 34a_100011217071_200000040189 [0,2,0,0,0,0|1,0,1]=4 5602 B16R0.1095 CCCCOCC(C)OCC(=O)OCCOC 7a_100011217071_200000040189 [0,2,0,0,0,0|1,0,1]=4 5603 B16R0.1095 CCCCOCC(C)OCC(C)OCCCC 34a_200000033020_100000210210 [0,2,0,0,0,0|2,0,0]=4 5604 B16R0.1095 CCCCOCC(C)OCC(C)OCCCC 7a_200000033020_100000210211 [0,2,0,0,0,0|2,0,0]=4 5605 B16R0.1095 CCCCOCC(C)OCC(C)OCCOC 34a_200000033020_100011201679 [0,2,0,0,0,0|1,0,0]=3 5606 B16R0.1095 CCCCOCC(C)OCC(C)OCCOC 7a_200000033020_100000233755 [0,2,0,0,0,0|1,0,0]=3 5607 B16R0.1095 CCCCOCC(C)OCC(C)OCCSC 34a_200000033020_100000212216 [0,2,0,0,0,0|1,1,0]=4 5608 B16R0.1095 CCCCOCC(C)OCC(C)OCCSC 7a_200000033020_100000212216 [0,2,0,0,0,0|1,1,0]=4 5609 B16R0.1714 CCCCCCC(C)(C)OCCOCCOC 7a_200011995690_100000695917 [0,2,0,0,0,0|2,0,0]=4 5610 B16R0.1714 CCCCCCCOC(C)(C)COCCOC 7a_100000067319_100000210614 [0,2,0,0,0,0|2,0,0]=4 5611 B16R0.1714 CCCCOCCOC(C)(C)COCCOC 7a_100000067319_100000743108 [0,2,0,0,0,0|1,0,0]=3 5612 B16R0.1714 COCCOCCOC(C)(C)COCCOC 7a_100000067319_100000695917 [0,2,0,0,0,0|0,0,0]=2 5613 B16R0.4696 CCCCOC(=O)C(C)OCCOCCOC 34a_100000038973_100000695917 [0,2,0,0,0,0|1,0,1]=4 5614 B16R0.4696 CCCCOC(=O)C(C)OCCOCCOC 34a_100011215163_100000759602 [0,2,0,0,0,0|1,0,1]=4 5615 B16R0.4696 CCCCOC(=O)C(C)OCCOCCOC 7a_100000038973_100000695917 [0,2,0,0,0,0|1,0,1]=4 5616 B16R0.4696 CCCCOC(=O)C(C)OCCOCCOC 7a_100011215163_100000759602 [0,2,0,0,0,0|1,0,1]=4 5617 B16R0.4696 COCCNC(=O)C(C)OCCOCCOC 7a_100011215163_100000230274 [0,2,0,0,0,0|1,0,1]=4 5618 B16R0.6401 C=CC(CCCCCC)OCCOCCOC 34a_200011215977_100000695917 [0,2,0,0,0,0|2,0,0]=4 5619 B16R0.6401 C=CC(CCCCCC)OCCOCCOC 7a_200011215977_100000695917 [0,2,0,0,0,0|2,0,0]=4 5620 B16R0.6401 CCCCCCC(CC)OCCOCCOC 34a_100011215785_100000695917 [0,2,0,0,0,0|2,0,0]=4 5621 B16R0.6401 CCCCCCC(CC)OCCOCCOC 7a_100011215785_100000695917 [0,2,0,0,0,0|2,0,0]=4 5622 B16R0.302 CCCCOCCOCCOC(C)CC(C)C 34a_100011215186_100000731052 [0,2,0,0,0,0|2,0,0]=4 5623 B16R0.302 CCCCOCCOCCOC(C)CC(C)C 7a_100011215186_100000731052 [0,2,0,0,0,0|2,0,0]=4 5624 B16R0.302 CNCCOCCOCCOC(C)CC(C)C 34a_200014138305_100000731052 [0,2,0,0,0,0|2,0,0]=4 5625 B16R0.302 COCCOCCOCCNC(C)CC(C)C 2230a_100000692259_100013367474 [0,2,0,0,0,0|2,0,0]=4 5626 B16R0.302 COCCOCCOCCNC(C)CC(C)C 2230a_100012028300_100000731052 [0,2,0,0,0,0|2,0,0]=4 5627 B16R0.302 COCCOCCOCCNC(C)CC(C)C 34a_100012028300_100000731052 [0,2,0,0,0,0|2,0,0]=4 5628 B16R0.302 COCCOCCOCCOC(=O)CC(=O)C 34a_100011215163_100000102702 [0,2,0,0,0,0|1,0,1]=4 5629 B16R0.302 COCCOCCOCCOC(C)C=C(C)C 34a_100000717055_100013367474 [0,2,0,0,0,0|1,0,1]=4 5630 B16R0.302 COCCOCCOCCOC(C)CC(C)C 34a_100000211805_100013367474 [0,2,0,0,0,0|1,0,0]=3 5631 B16R0.302 COCCOCCOCCOC(C)CC(C)C 34a_100000688194_100000731052 [0,2,0,0,0,0|1,0,0]=3 5632 B16R0.302 COCCOCCOCCOC(C)CC(C)C 7a_100000211805_100013367474 [0,2,0,0,0,0|1,0,0]=3 5633 B16R0.302 COCCOCCOCCOC(C)CC(C)C 7a_100000688194_100000731052 [0,2,0,0,0,0|1,0,0]=3 5634 B16R0.302 COCCOCCOCCSC(C)CC(C)C 62a_100000731052_100013367474 [0,2,0,0,0,0|1,1,0]=4 5635 B16R0.302 COCCOCCOCCSC(C)CC(C)C 62a_100013367474_100000731052 [0,2,0,0,0,0|1,1,0]=4 5636 B16R0.302 COCCOCCOCCSC(C)CN(C)C 62a_100013367474_100020606517 [0,2,0,0,0,0|1,1,0]=4 5637 B16R0.302 COCCOCCOCCSC(C)CN(C)C 62a_100020606517_100013367474 [0,2,0,0,0,0|1,1,0]=4 5638 B16R0.1188 CCCCOCCOCCOCCC(C)(C)C 34a_100011215186_100000755188 [0,2,0,0,0,0|2,0,0]=4 5639 B16R0.1188 CCCCOCCOCCOCCC(C)(C)C 7a_100011215186_100000755188 [0,2,0,0,0,0|2,0,0]=4 5640 B16R0.1188 CCCCOCCOCCOCCC(C)(C)O 34a_100011215186_100000702414 [0,2,0,0,0,0|2,0,0]=4 5641 B16R0.1188 CCCCOCCOCCOCCC(C)(C)O 7a_100011215186_100000702414 [0,2,0,0,0,0|2,0,0]=4 5642 B16R0.1188 CCCCOCCOCCOCCS(=O)(=O)C 34a_100011215186_100000731031 [0,2,0,0,0,0|1,1,0]=4 5643 B16R0.1188 CCCCOCCOCCOCCS(=O)(=O)C 7a_100011215186_100000230027 [0,2,0,0,0,0|1,1,0]=4 5644 B16R0.1188 CCCCOCCOCCOCC[N+](C)(C)C 34a_100011215186_100000085578 [0,2,0,0,0,0|2,0,0]=4 5645 B16R0.1188 CCCCOCCOCCOCC[N+](C)(C)C 7a_100011215186_100000085578 [0,2,0,0,0,0|2,0,0]=4 5646 B16R0.1188 CCCCOCCOCCOCC[Si](C)(C)C 34a_100011215186_200000733723 [0,2,0,0,0,0|2,0,0]=4 5647 B16R0.1188 CCCCOCCOCCOCC[Si](C)(C)C 7a_100011215186_200000733723 [0,2,0,0,0,0|2,0,0]=4 5648 B16R0.1188 CNCCOCCOCCOCCC(C)(C)C 34a_200014138305_100000755188 [0,2,0,0,0,0|2,0,0]=4 5649 B16R0.1188 CNCCOCCOCCOCCC(C)(C)O 34a_200014138305_100000702414 [0,2,0,0,0,0|2,0,0]=4 5650 B16R0.1188 CNCCOCCOCCOCCS(=O)(=O)C 34a_200014138305_100000731031 [0,2,0,0,0,0|1,1,0]=4 5651 B16R0.1188 CNCCOCCOCCOCC[N+](C)(C)C 34a_200014138305_100000085578 [0,2,0,0,0,0|2,0,0]=4 5652 B16R0.1188 CNCCOCCOCCOCC[Si](C)(C)C 34a_200014138305_200000733723 [0,2,0,0,0,0|2,0,0]=4 5653 B16R0.1188 COCCOCCOCCCCCC(C)(C)O 34a_100011215163_100010402123 [0,2,0,0,0,0|2,0,0]=4 5654 B16R0.1188 COCCOCCOCCCCCC(C)(C)O 7a_100011215163_100010402123 [0,2,0,0,0,0|2,0,0]=4 5655 B16R0.1188 COCCOCCOCCCCC[N+](C)(C)C 34a_100011215163_100009813293 [0,2,0,0,0,0|2,0,0]=4 5656 B16R0.1188 COCCOCCOCCCCC[N+](C)(C)C 7a_100011215163_100009813293 [0,2,0,0,0,0|2,0,0]=4 5657 B16R0.1188 COCCOCCOCCNCCC(C)(C)C 2230a_100000738805_100013367474 [0,2,0,0,0,0|2,0,0]=4 5658 B16R0.1188 COCCOCCOCCNCCC(C)(C)C 2230a_100012028300_100000755188 [0,2,0,0,0,0|2,0,0]=4 5659 B16R0.1188 COCCOCCOCCNCCC(C)(C)C 34a_100012028300_100000755188 [0,2,0,0,0,0|2,0,0]=4 5660 B16R0.1188 COCCOCCOCCNCCC(C)(C)F 2230a_100016253952_100013367474 [0,2,0,0,0,0|2,0,0]=4 5661 B16R0.1188 COCCOCCOCCNCCC(C)(C)O 2230a_100012028300_100000702414 [0,2,0,0,0,0|2,0,0]=4 5662 B16R0.1188 COCCOCCOCCNCCC(C)(C)O 34a_100012028300_100000702414 [0,2,0,0,0,0|2,0,0]=4 5663 B16R0.1188 COCCOCCOCCNCCS(=O)(=O)C 2230a_100000740961_100013367474 [0,2,0,0,0,0|1,1,0]=4 5664 B16R0.1188 COCCOCCOCCNCCS(=O)(=O)C 2230a_100012028300_100000731031 [0,2,0,0,0,0|1,1,0]=4 5665 B16R0.1188 COCCOCCOCCNCCS(=O)(=O)C 34a_100000740961_100013367474 [0,2,0,0,0,0|1,1,0]=4 5666 B16R0.1188 COCCOCCOCCNCCS(=O)(=O)C 34a_100012028300_100000731031 [0,2,0,0,0,0|1,1,0]=4 5667 B16R0.1188 COCCOCCOCCNCC[N+](C)(C)C 34a_100012028300_100000085578 [0,2,0,0,0,0|2,0,0]=4 5668 B16R0.1188 COCCOCCOCCNCC[Si](C)(C)C 2230a_100012028300_200000733723 [0,2,0,0,0,0|2,0,0]=4 5669 B16R0.1188 COCCOCCOCCNCC[Si](C)(C)C 34a_100012028300_200000733723 [0,2,0,0,0,0|2,0,0]=4 5670 B16R0.1188 COCCOCCOCCOCCC(C)(C)C 34a_100000688194_100000755188 [0,2,0,0,0,0|1,0,0]=3 5671 B16R0.1188 COCCOCCOCCOCCC(C)(C)C 7a_100000688194_100000755188 [0,2,0,0,0,0|1,0,0]=3 5672 B16R0.1188 COCCOCCOCCOCCC(C)(C)C 7a_100000765024_100013367474 [0,2,0,0,0,0|1,0,0]=3 5673 B16R0.1188 COCCOCCOCCOCCC(C)(C)O 34a_100000688194_100000702414 [0,2,0,0,0,0|1,0,0]=3 5674 B16R0.1188 COCCOCCOCCOCCC(C)(C)O 7a_100000688194_100000702414 [0,2,0,0,0,0|1,0,0]=3 5675 B16R0.1188 COCCOCCOCCOCCC(F)(F)F 34a_100000688194_100011219754 [0,2,0,0,0,0|2,0,0]=4 5676 B16R0.1188 COCCOCCOCCOCCC(F)(F)F 34a_100000752437_100013367474 [0,2,0,0,0,0|2,0,0]=4 5677 B16R0.1188 COCCOCCOCCOCCC(F)(F)F 7a_100000688194_100011219754 [0,2,0,0,0,0|2,0,0]=4 5678 B16R0.1188 COCCOCCOCCOCCS(=O)(=O)C 34a_100000211924_100013367474 [0,2,0,0,0,0|0,1,0]=3 5679 B16R0.1188 COCCOCCOCCOCCS(=O)(=O)C 34a_100000688194_100000731031 [0,2,0,0,0,0|0,1,0]=3 5680 B16R0.1188 COCCOCCOCCOCCS(=O)(=O)C 7a_100000211924_100013367474 [0,2,0,0,0,0|0,1,0]=3 5681 B16R0.1188 COCCOCCOCCOCCS(=O)(=O)C 7a_100000688194_100000230027 [0,2,0,0,0,0|0,1,0]=3 5682 B16R0.1188 COCCOCCOCCOCCS(=O)(=O)N 34a_100012334274_100013367474 [0,2,0,0,0,0|1,1,0]=4 5683 B16R0.1188 COCCOCCOCCOCCS(=O)(=O)[O-] 34a_100000688194_100000762736 [0,2,0,0,0,0|1,1,0]=4 5684 B16R0.1188 COCCOCCOCCOCC[N+](C)(C)C 34a_100000688194_100000085578 [0,2,0,0,0,0|1,0,0]=3 5685 B16R0.1188 COCCOCCOCCOCC[N+](C)(C)C 7a_100000688194_100000085578 [0,2,0,0,0,0|1,0,0]=3 5686 B16R0.1188 COCCOCCOCCOCC[N+](C)(C)C 7a_200020618287_100013367474 [0,2,0,0,0,0|1,0,0]=3 5687 B16R0.1188 COCCOCCOCCOCC[Si](C)(C)C 34a_100000688194_200000733723 [0,2,0,0,0,0|1,0,0]=3 5688 B16R0.1188 COCCOCCOCCOCC[Si](C)(C)C 7a_100000039746_100013367474 [0,2,0,0,0,0|1,0,0]=3 5689 B16R0.1188 COCCOCCOCCOCC[Si](C)(C)C 7a_100000688194_200000733723 [0,2,0,0,0,0|1,0,0]=3 5690 B16R0.1188 COCCOCCOCCSCCC(C)(C)C 62a_100000755188_100013367474 [0,2,0,0,0,0|1,1,0]=4 5691 B16R0.1188 COCCOCCOCCSCCC(C)(C)C 62a_100013367474_100000755188 [0,2,0,0,0,0|1,1,0]=4 5692 B16R0.1188 COCCOCCOCCSCCC(C)(C)O 62a_100000702414_100013367474 [0,2,0,0,0,0|1,1,0]=4 5693 B16R0.1188 COCCOCCOCCSCCC(C)(C)O 62a_100013367474_100000702414 [0,2,0,0,0,0|1,1,0]=4 5694 B16R0.1188 COCCOCCOCCSCCS(=O)(=O)C 62a_100000731031_100013367474 [0,2,0,0,0,0|0,2,0]=4 5695 B16R0.1188 COCCOCCOCCSCCS(=O)(=O)C 62a_100013367474_100000230027 [0,2,0,0,0,0|0,2,0]=4 5696 B16R0.1188 COCCOCCOCCSCC[N+](C)(C)C 62a_100000085578_100013367474 [0,2,0,0,0,0|1,1,0]=4 5697 B16R0.1188 COCCOCCOCCSCC[N+](C)(C)C 62a_100013367474_100000085578 [0,2,0,0,0,0|1,1,0]=4 5698 B16R0.1188 COCCOCCOCCSCC[Si](C)(C)C 62a_100013367474_200000733723 [0,2,0,0,0,0|1,1,0]=4 5699 B16R0.1188 COCCOCCOCCSCC[Si](C)(C)C 62a_200000733723_100013367474 [0,2,0,0,0,0|1,1,0]=4 5700 B16R0.3183 C=C(C)CCC(=O)CCOCCOCCOC 1458a_100012278103_100000730704 [0,2,0,0,0,0|2,0,0]=4 5701 B16R0.3183 C=C(C)CCC(=O)CCOCCOCCOC 1458a_200000688413_100013367474 [0,2,0,0,0,0|2,0,0]=4 5702 B16R0.3183 C=C(C)CCN(C)CCOCCOCCOC 2230a_200000716983_100000730704 [0,2,0,0,0,0|2,0,0]=4 5703 B16R0.3183 C=C(C)CCN(C)CCOCCOCCOC 269982a_200000716983_100000730704 [0,2,0,0,0,0|2,0,0]=4 5704 B16R0.3183 C=C(C)CCN(C)CCOCCOCCOC 34a_200000716983_100000730704 [0,2,0,0,0,0|2,0,0]=4 5705 B16R0.3183 COCCOCCOCCC(=O)CCC(C)C 1458a_100000181311_100013367474 [0,2,0,0,0,0|2,0,0]=4 5706 B16R0.3183 COCCOCCOCCC(=O)CCC(C)C 1458a_100012278103_100000210312 [0,2,0,0,0,0|2,0,0]=4 5707 B16R0.3183 COCCOCCOCCC(=O)CCC(C)O 1458a_100012278103_100012276601 [0,2,0,0,0,0|2,0,0]=4 5708 B16R0.3183 COCCOCCOCCC(=O)CC[S+](C)C 1458a_100009452791_100013367474 [0,2,0,0,0,0|1,1,0]=4 5709 B16R0.3183 COCCOCCOCCN(C)CCC(=O)C 269982a_200000716983_100000053229 [0,2,0,0,0,0|2,0,0]=4 5710 B16R0.3183 COCCOCCOCCN(C)CCC(C)C 2230a_100000742789_100013367474 [0,2,0,0,0,0|2,0,0]=4 5711 B16R0.3183 COCCOCCOCCN(C)CCC(C)C 2230a_200000716983_100000210312 [0,2,0,0,0,0|2,0,0]=4 5712 B16R0.3183 COCCOCCOCCN(C)CCC(C)C 269982a_100000742789_100013367474 [0,2,0,0,0,0|2,0,0]=4 5713 B16R0.3183 COCCOCCOCCN(C)CCC(C)C 269982a_200000716983_100000210312 [0,2,0,0,0,0|2,0,0]=4 5714 B16R0.3183 COCCOCCOCCN(C)CCC(C)C 34a_200000716983_100000210312 [0,2,0,0,0,0|2,0,0]=4 5715 B16R0.3183 COCCOCCOCCN(C)CCC(C)O 2230a_200000716983_100012276601 [0,2,0,0,0,0|2,0,0]=4 5716 B16R0.3183 COCCOCCOCCN(C)CCC(C)O 269982a_200000716983_100012276601 [0,2,0,0,0,0|2,0,0]=4 5717 B16R0.3183 COCCOCCOCCN(C)CCC(C)O 34a_200000716983_100012276601 [0,2,0,0,0,0|2,0,0]=4 5718 B16R0.3183 COCCOCCOCCN(C)CCN(C)C 269982a_100000225618_100013367474 [0,2,0,0,0,0|2,0,0]=4 5719 B16R0.3183 COCCOCCOCCN(C)CCN(C)C 269982a_200000716983_100000755713 [0,2,0,0,0,0|2,0,0]=4 5720 B16R0.154 CCOC(C)O[C@H](C)COCCOCCOC 34a_200015424329_100000695917 [0,2,0,0,0,0|2,0,0]=4 5721 B16R0.154 CCOC(C)O[C@H](C)COCCOCCOC 7a_200015424329_100000695917 [0,2,0,0,0,0|2,0,0]=4 5722 B16R0.154 COCCOCCOCC(=O)N[C@H](C)COC 11a_100000764878_100011214951 [0,2,0,0,0,0|1,0,1]=4 5723 B16R0.154 COCCOCCOCC(=O)N[C@H](C)COC 1626a_100000764878_100011214951 [0,2,0,0,0,0|1,0,1]=4 5724 B16R0.154 COCCOCCOCC(=O)N[C@H](C)COC 240690a_100000764878_100011214951 [0,2,0,0,0,0|1,0,1]=4 5725 B16R0.154 COCCOCCOCC(=O)N[C@H](C)COC 527a_100000764878_100011214951 [0,2,0,0,0,0|1,0,1]=4 5726 B16R0.6607 COCCOCCOCC(=O)N(C)CCOC 11a_100000743101_100011214951 [0,2,0,0,0,0|1,0,1]=4 5727 B16R0.6607 COCCOCCOCC(=O)N(C)CCOC 1626a_100000743101_100011214951 [0,2,0,0,0,0|1,0,1]=4 5728 B16R0.6607 COCCOCCOCC(=O)N(C)CCOC 240690a_100000743101_100011214951 [0,2,0,0,0,0|1,0,1]=4 5729 B16R0.6607 COCCOCCOCC(=O)N(C)CCOC 527a_100000743101_100011214951 [0,2,0,0,0,0|1,0,1]=4 5730 B16R0.220 C#CC(CCC)OCCOCCOCCOC 34a_200011217317_100013367474 [0,2,0,0,0,0|1,0,0]=3 5731 B16R0.220 C#CC(CCC)OCCOCCOCCOC 7a_200011217317_100013367474 [0,2,0,0,0,0|1,0,0]=3 5732 B16R0.220 C#CCC(CC)OCCOCCOCCOC 34a_200011217983_100013367474 [0,2,0,0,0,0|1,0,1]=4 5733 B16R0.220 C#CCC(CC)OCCOCCOCCOC 7a_200011217983_100013367474 [0,2,0,0,0,0|1,0,1]=4 5734 B16R0.220 C=CC(CCC)OCCOCCOCCOC 34a_100011216692_100013367474 [0,2,0,0,0,0|1,0,0]=3 5735 B16R0.220 C=CC(CCC)OCCOCCOCCOC 7a_100011216692_100013367474 [0,2,0,0,0,0|1,0,0]=3 5736 B16R0.220 C=CCC(C=C)OCCOCCOCCOC 34a_100000038011_100013367474 [0,2,0,0,0,0|1,0,1]=4 5737 B16R0.220 C=CCC(C=C)OCCOCCOCCOC 7a_100000038011_100013367474 [0,2,0,0,0,0|1,0,1]=4 5738 B16R0.220 CC#CC(CC)OCCOCCOCCOC 34a_200011219922_100013367474 [0,2,0,0,0,0|1,0,1]=4 5739 B16R0.220 CC#CC(CC)OCCOCCOCCOC 7a_200011219922_100013367474 [0,2,0,0,0,0|1,0,1]=4 5740 B16R0.220 CCC(COC)NCCOCCOCCOC 2230a_100000757820_100013367474 [0,2,0,0,0,0|1,0,0]=3 5741 B16R0.220 CCC(COC)NCCOCCOCCOC 270004a_100012028300_100000757811 [0,2,0,0,0,0|1,0,0]=3 5742 B16R0.220 CCC(COC)OCCOCCOCCOC 7a_200011214946_100013367474 [0,2,0,0,0,0|0,0,0]=2 5743 B16R0.220 CCCC(C#N)OCCOCCOCCOC 34a_100000686963_100013367474 [0,2,0,0,0,0|1,0,0]=3 5744 B16R0.220 CCCC(C#N)OCCOCCOCCOC 7a_100000686963_100013367474 [0,2,0,0,0,0|1,0,0]=3 5745 B16R0.220 CCCC(CC)NCCOCCOCCOC 2230a_100000747048_100013367474 [0,2,0,0,0,0|2,0,0]=4 5746 B16R0.220 CCCC(CC)NCCOCCOCCOC 270004a_100012028300_100000687865 [0,2,0,0,0,0|2,0,0]=4 5747 B16R0.220 CCCC(CC)OCCOCCOCCOC 34a_100000687864_100013367474 [0,2,0,0,0,0|1,0,0]=3 5748 B16R0.220 CCCC(CC)OCCOCCOCCOC 7a_100000687864_100013367474 [0,2,0,0,0,0|1,0,0]=3 5749 B16R0.220 CCCC(CC)OCCOCCOCCOC 7a_100000688194_100011219200 [0,2,0,0,0,0|1,0,0]=3 5750 B16R0.220 CCCC(CC)SCCOCCOCCOC 62a_100011219200_100013367474 [0,2,0,0,0,0|1,1,0]=4 5751 B16R0.220 CCCC(CC)SCCOCCOCCOC 62a_100013367474_100011219200 [0,2,0,0,0,0|1,1,0]=4 5752 B16R0.220 CCCCOCCOCCOC(CC)CCC 7a_100011215186_100011219200 [0,2,0,0,0,0|2,0,0]=4 5753 B16R0.220 CCC[C@@H](CO)NCCOCCOCCOC 2230a_100000732646_100013367474 [0,2,0,0,0,0|2,0,0]=4 5754 B16R0.220 CCC[C@@H](CO)NCCOCCOCCOC 34a_100000732646_100013367474 [0,2,0,0,0,0|2,0,0]=4 5755 B16R0.220 COCCOCCOCCNC(CO)COC 2230a_100000724102_100013367474 [0,2,0,0,0,0|1,0,0]=3 5756 B16R0.220 COCCOCCOCCNC(CO)COC 34a_100000724102_100013367474 [0,2,0,0,0,0|1,0,0]=3 5757 B16R0.220 COCCOCCOCCOC(CCl)COC 34a_100011215053_100013367474 [0,2,0,0,0,0|0,0,0]=2 5758 B16R0.220 COCCOCCOCCOC(CN)COC 34a_100000756049_100013367474 [0,2,0,0,0,0|0,0,0]=2 5759 B16R0.1183 CCCC(C)C(=O)CCOCCOCCOC 1458a_100000210906_100013367474 [0,2,0,0,0,0|2,0,0]=4 5760 B16R0.1183 CCCC(C)C(=O)CCOCCOCCOC 1458a_100012278103_100000766640 [0,2,0,0,0,0|2,0,0]=4 5761 B16R0.1183 CCCC(C)N(C)CCOCCOCCOC 2230a_200000716983_100000766640 [0,2,0,0,0,0|2,0,0]=4 5762 B16R0.1183 CCCC(C)N(C)CCOCCOCCOC 269982a_200000716983_100000766640 [0,2,0,0,0,0|2,0,0]=4 5763 B16R0.1183 CCCC(C)N(C)CCOCCOCCOC 270004a_200000716983_100000211909 [0,2,0,0,0,0|2,0,0]=4 5764 B16R0.1183 CCCC(C)N(C)CCOCCOCCOC 34a_200000716983_100000766640 [0,2,0,0,0,0|2,0,0]=4 5765 B16R0.1183 CCC[C@H](O)C(=O)CCOCCOCCOC 1458a_100009822183_100013367474 [0,2,0,0,0,0|2,0,0]=4 5766 B16R0.1183 COCCOCCOCCC(=O)C(C)COC 1458a_100000751857_100013367474 [0,2,0,0,0,0|1,0,0]=3 5767 B16R0.1183 COCCOCCOCCC(=O)C(C)COC 1458a_100012278103_100000765312 [0,2,0,0,0,0|1,0,0]=3 5768 B16R0.1183 COCCOCCOCCC(=O)C(C)CSC 1458a_100000753918_100013367474 [0,2,0,0,0,0|1,1,0]=4 5769 B16R0.1183 COCCOCCOCCN(C)C(=O)COC 11a_200000716983_100000210968 [0,2,0,0,0,0|1,0,1]=4 5770 B16R0.1183 COCCOCCOCCN(C)C(=O)COC 1626a_200000716983_100000210968 [0,2,0,0,0,0|1,0,1]=4 5771 B16R0.1183 COCCOCCOCCN(C)C(=O)COC 240690a_200000716983_100000210968 [0,2,0,0,0,0|1,0,1]=4 5772 B16R0.1183 COCCOCCOCCN(C)C(=O)COC 527a_200000716983_100000210968 [0,2,0,0,0,0|1,0,1]=4 5773 B16R0.1183 COCCOCCOCCN(C)C(C)COC 2230a_200000716983_100000765312 [0,2,0,0,0,0|1,0,0]=3 5774 B16R0.1183 COCCOCCOCCN(C)C(C)COC 269982a_200000716983_100000765312 [0,2,0,0,0,0|1,0,0]=3 5775 B16R0.1183 COCCOCCOCCN(C)C(C)COC 270004a_200000716983_100000749346 [0,2,0,0,0,0|1,0,0]=3 5776 B16R0.1183 COCCOCCOCCN(C)C(C)COC 34a_200000716983_100000765312 [0,2,0,0,0,0|1,0,0]=3 5777 B16R0.1183 COCCOCCOCCN(C)C(C)CSC 270004a_200000716983_100011216314 [0,2,0,0,0,0|1,1,0]=4 5778 B16R0.5308 C=CCC(C)(C)OCCOCCOCCOC 7a_100011995686_100013367474 [0,2,0,0,0,0|1,0,1]=4 5779 B16R0.5308 CCCC(C)(C)OCCOCCOCCOC 7a_100000748436_100013367474 [0,2,0,0,0,0|1,0,0]=3 5780 B16R0.5308 COCCOCCOCCNC(C)(C)COC 2230a_100000752728_100013367474 [0,2,0,0,0,0|1,0,0]=3 5781 B16R0.5308 COCCOCCOCCNC(C)(C)CSC 2230a_100000759623_100013367474 [0,2,0,0,0,0|1,1,0]=4 5782 B16R0.5308 COCCOCCOCCNC(C)(C)CSC 7a_100000759623_100013367474 [0,2,0,0,0,0|1,1,0]=4 5783 B16R0.5308 COCCOCCOCCOC(C)(C)CCBr 7a_100000702414_100013367474 [0,2,0,0,0,0|2,0,0]=4 5784 B16R0.1180 CCCCN(CC)CCOCCOCCOC 2230a_100000207695_100013367474 [0,2,0,0,0,0|2,0,0]=4 5785 B16R0.1180 CCCCN(CC)CCOCCOCCOC 269982a_100000207695_100013367474 [0,2,0,0,0,0|2,0,0]=4 5786 B16R0.1180 CCN(CCOC)CCOCCOCCOC 2230a_100000731262_100013367474 [0,2,0,0,0,0|1,0,0]=3 5787 B16R0.1180 CCN(CCOC)CCOCCOCCOC 269982a_100000731262_100013367474 [0,2,0,0,0,0|1,0,0]=3 5788 B14R1.40 CCCCCCCOCC1CCCO1 34a_100000210270_100000210614 [1,0,0,1,0,0|2,0,0]=4 5789 B14R1.40 CCCCCCCOCC1CCCO1 7a_100000210270_100000210614 [1,0,0,1,0,0|2,0,0]=4 5790 B14R1.40 CCCCCCCOCC1CCCO1 7a_100000210272_100000203698 [1,0,0,1,0,0|2,0,0]=4 5791 B14R1.40 CCCCCCCOCC1CCOC1 34a_100000210272_100011261433 [1,0,0,1,0,0|2,0,0]=4 5792 B14R1.40 CCCCCCCOCC1CCOC1 34a_100000740260_100000210614 [1,0,0,1,0,0|2,0,0]=4 5793 B14R1.40 CCCCCCCOCC1CCOC1 7a_100000210272_100000702531 [1,0,0,1,0,0|2,0,0]=4 5794 B14R1.40 CCCCCCCOCC1COCO1 34a_100011216627_100000210614 [1,0,0,1,0,0|2,0,0]=4 5795 B14R1.40 CCCCCCCOCC1OCCO1 34a_100000087154_100000210614 [1,0,0,1,0,0|2,0,0]=4 5796 B14R1.40 CCCCCCCOCC1OCCO1 34a_100000210272_100000755774 [1,0,0,1,0,0|2,0,0]=4 5797 B14R1.40 CCCCCCCOCC1OCCO1 7a_100000210272_100000755774 [1,0,0,1,0,0|2,0,0]=4 5798 B14R1.40 CCCCCCOCCC1CCOC1 34a_100011879284_100000210314 [1,0,0,1,0,0|2,0,0]=4 5799 B14R1.40 CCCCOCCCCC1OCCO1 34a_100000210227_200009813554 [1,0,0,1,0,0|2,0,0]=4 5800 B14R1.40 CCCCOCCCCC1OCCO1 7a_100000210227_100000034956 [1,0,0,1,0,0|2,0,0]=4 5801 B14R1.40 CCCCOCCNCC1CCOC1 2230a_100000737293_100000743108 [1,0,0,1,0,0|2,0,0]=4 5802 B14R1.40 CCCCOCCNCC1CCOC1 34a_100000737293_100000743108 [1,0,0,1,0,0|2,0,0]=4 5803 B14R1.40 CCCCOCCNCC1OCCO1 2230a_100000036311_100000743108 [1,0,0,1,0,0|2,0,0]=4 5804 B14R1.40 CCCCOCCNCC1OCCO1 34a_100000036311_100000743108 [1,0,0,1,0,0|2,0,0]=4 5805 B14R1.40 CCCCOCCNC[C@@H]1CCCO1 2230a_100020590478_100000743108 [1,0,0,1,0,0|2,0,0]=4 5806 B14R1.40 CCCCOCCNC[C@@H]1CCCO1 34a_100020590478_100000743108 [1,0,0,1,0,0|2,0,0]=4 5807 B14R1.40 CCCCOCCOCC1CCCC1 34a_100000210238_100000740388 [1,0,0,1,0,0|2,0,0]=4 5808 B14R1.40 CCCCOCCOCC1CCCC1 34a_100000742336_100000743108 [1,0,0,1,0,0|2,0,0]=4 5809 B14R1.40 CCCCOCCOCC1CCCC1 7a_100000210238_100000740388 [1,0,0,1,0,0|2,0,0]=4 5810 B14R1.40 CCCCOCCOCC1CCCC1 7a_100000742336_100000743108 [1,0,0,1,0,0|2,0,0]=4 5811 B14R1.40 CCCCOCCOCC1CCCO1 34a_100000210270_100000743108 [1,0,0,1,0,0|1,0,0]=3 5812 B14R1.40 CCCCOCCOCC1CCCO1 7a_100000210238_100000203698 [1,0,0,1,0,0|1,0,0]=3 5813 B14R1.40 CCCCOCCOCC1CCCO1 7a_100000210270_100000743108 [1,0,0,1,0,0|1,0,0]=3 5814 B14R1.40 CCCCOCCOCC1CCNC1 34a_100000748654_100000743108 [1,0,0,1,0,0|2,0,0]=4 5815 B14R1.40 CCCCOCCOCC1CCOC1 34a_100000210238_100011261433 [1,0,0,1,0,0|1,0,0]=3 5816 B14R1.40 CCCCOCCOCC1CCOC1 34a_100000740260_100000743108 [1,0,0,1,0,0|1,0,0]=3 5817 B14R1.40 CCCCOCCOCC1CCOC1 7a_100000210238_100000702531 [1,0,0,1,0,0|1,0,0]=3 5818 B14R1.40 CCCCOCCOCC1COCO1 34a_100011216627_100000743108 [1,0,0,1,0,0|1,0,0]=3 5819 B14R1.40 CCCCOCCOCC1OCCO1 34a_100000087154_100000743108 [1,0,0,1,0,0|1,0,0]=3 5820 B14R1.40 CCCCOCCOCC1OCCO1 34a_100000210238_100000755774 [1,0,0,1,0,0|1,0,0]=3 5821 B14R1.40 CCCCOCCOCC1OCCO1 7a_100000210238_100000755774 [1,0,0,1,0,0|1,0,0]=3 5822 B14R1.40 CCCCOCCOC[C@H]1CCCN1 34a_100000745186_100000743108 [1,0,0,1,0,0|2,0,0]=4 5823 B14R1.40 CCCCOCCSCC1CCCO1 62a_100000203698_100000743108 [1,0,0,1,0,0|1,1,0]=4 5824 B14R1.40 CCCCOCCSCC1CCCO1 62a_100000743108_100000203698 [1,0,0,1,0,0|1,1,0]=4 5825 B14R1.40 CCCCOCCSCC1CCOC1 62a_100000702531_100000743108 [1,0,0,1,0,0|1,1,0]=4 5826 B14R1.40 CCCCOCCSCC1CCOC1 62a_100000743108_100000702531 [1,0,0,1,0,0|1,1,0]=4 5827 B14R1.40 CCCCOCCSCC1OCCO1 62a_100000743108_100000755774 [1,0,0,1,0,0|1,1,0]=4 5828 B14R1.40 CCCCOCCSCC1OCCO1 62a_100000755774_100000743108 [1,0,0,1,0,0|1,1,0]=4 5829 B14R1.40 CCCCOCOCCC1CCOC1 34a_100011879284_100011995733 [1,0,0,1,0,0|2,0,0]=4 5830 B14R1.40 CCCCSCCOCC1CCCO1 7a_200000230436_100000203698 [1,0,0,1,0,0|1,1,0]=4 5831 B14R1.40 CCCCSCCOCC1CCOC1 34a_200000230436_100011261433 [1,0,0,1,0,0|1,1,0]=4 5832 B14R1.40 CCCCSCCOCC1CCOC1 7a_200000230436_100000702531 [1,0,0,1,0,0|1,1,0]=4 5833 B14R1.40 CCCCSCCOCC1OCCO1 34a_200000230436_100000755774 [1,0,0,1,0,0|1,1,0]=4 5834 B14R1.40 CCCCSCCOCC1OCCO1 7a_200000230436_100000755774 [1,0,0,1,0,0|1,1,0]=4 5835 B14R1.40 CCCOCCOCCC1CCCC1 34a_100000749090_100011215938 [1,0,0,1,0,0|2,0,0]=4 5836 B14R1.40 CCCOCCOCCC1CCCC1 34a_100000752267_100000760354 [1,0,0,1,0,0|2,0,0]=4 5837 B14R1.40 CCCOCCOCCC1CCCC1 7a_100000749090_100011215938 [1,0,0,1,0,0|2,0,0]=4 5838 B14R1.40 CCCOCCOCCC1CCCC1 7a_100000752267_100000760354 [1,0,0,1,0,0|2,0,0]=4 5839 B14R1.40 CCCOCCOCCC1CCNC1 34a_100016987287_100011215938 [1,0,0,1,0,0|2,0,0]=4 5840 B14R1.40 CCCOCCOCCC1CCOC1 34a_100011879284_100011215938 [1,0,0,1,0,0|1,0,0]=3 5841 B14R1.40 CCCOCCOCCN1CCCC1 7a_100000752267_100000004467 [1,0,0,1,0,0|2,0,0]=4 5842 B14R1.40 CNCCCCCOCC1CCOC1 34a_100000722520_100011261433 [1,0,0,1,0,0|2,0,0]=4 5843 B14R1.40 CNCCCCCOCC1OCCO1 34a_100000722520_100000755774 [1,0,0,1,0,0|2,0,0]=4 5844 B14R1.40 CNCCOCCOCC1CCCC1 34a_100000228057_100000740388 [1,0,0,1,0,0|2,0,0]=4 5845 B14R1.40 CNCCOCCOCC1CCOC1 34a_100000228057_100011261433 [1,0,0,1,0,0|1,0,0]=3 5846 B14R1.40 CNCCOCCOCC1OCCO1 34a_100000228057_100000755774 [1,0,0,1,0,0|1,0,0]=3 5847 B14R1.40 COCCCCCNCC1CCCO1 2230a_100000747528_100000203698 [1,0,0,1,0,0|2,0,0]=4 5848 B14R1.40 COCCCCCNCC1CCOC1 2230a_100000747528_100000702531 [1,0,0,1,0,0|2,0,0]=4 5849 B14R1.40 COCCCCCNCC1CCOC1 34a_100000747528_100011261433 [1,0,0,1,0,0|2,0,0]=4 5850 B14R1.40 COCCCCCNCC1OCCO1 2230a_100000747528_100000755774 [1,0,0,1,0,0|2,0,0]=4 5851 B14R1.40 COCCCCCNCC1OCCO1 34a_100000747528_100000755774 [1,0,0,1,0,0|2,0,0]=4 5852 B14R1.40 COCCCCOCCC1CCCC1 34a_100000740925_100000760354 [1,0,0,1,0,0|2,0,0]=4 5853 B14R1.40 COCCCCOCCC1CCCC1 34a_100000749090_100000755781 [1,0,0,1,0,0|2,0,0]=4 5854 B14R1.40 COCCCCOCCC1CCCC1 7a_100000749090_100000730899 [1,0,0,1,0,0|2,0,0]=4 5855 B14R1.40 COCCCCOCCC1CCNC1 34a_100016987287_100000755781 [1,0,0,1,0,0|2,0,0]=4 5856 B14R1.40 COCCCCOCCC1CCOC1 34a_100011879284_100000755781 [1,0,0,1,0,0|1,0,0]=3 5857 B14R1.40 COCCNCCCCC1OCCO1 2230a_100000209980_100000034956 [1,0,0,1,0,0|2,0,0]=4 5858 B14R1.40 COCCOCCCCC1OCCO1 34a_100000210237_200009813554 [1,0,0,1,0,0|1,0,0]=3 5859 B14R1.40 COCCOCCCNC1CCOC1 2230a_100000206027_100000731011 [1,0,0,1,0,0|2,0,0]=4 5860 B14R1.40 COCCOCCCNC1CCOC1 270004a_100000206027_100000752484 [1,0,0,1,0,0|2,0,0]=4 5861 B14R1.40 COCCOCCCNC1CCOC1 34a_100000206027_100000690089 [1,0,0,1,0,0|2,0,0]=4 5862 B14R1.40 COCCOCCCN[C@@H]1CCOC1 2230a_200015188469_100011216529 [1,0,0,1,0,0|2,0,0]=4 5863 B14R1.40 COCCOCCCN[C@H]1CCOC1 2230a_100015188467_100011216529 [1,0,0,1,0,0|2,0,0]=4 5864 B14R1.40 COCCOCCCN[C@H]1CCOC1 34a_100015188467_100011216529 [1,0,0,1,0,0|2,0,0]=4 5865 B14R1.40 COCCOCCCOC1CCCO1 34a_100000085407_100011216529 [1,0,0,1,0,0|2,0,0]=4 5866 B14R1.40 COCCOCCCO[C@H]1CCOC1 34a_100000717292_100011216529 [1,0,0,1,0,0|2,0,0]=4 5867 B14R1.40 COCCOCCCSC1CCOC1 62a_100011216529_100000690089 [1,0,0,1,0,0|2,0,0]=4 5868 B14R1.40 COCCOCCNCC1CCCC1 2230a_100000737975_100000695917 [1,0,0,1,0,0|2,0,0]=4 5869 B14R1.40 COCCOCCNCC1CCCC1 2230a_100000745349_100000740388 [1,0,0,1,0,0|2,0,0]=4 5870 B14R1.40 COCCOCCNCC1CCCC1 269862a_100000745349_100000746403 [1,0,0,1,0,0|2,0,0]=4 5871 B14R1.40 COCCOCCNCC1CCCC1 34a_100000737975_100000695917 [1,0,0,1,0,0|2,0,0]=4 5872 B14R1.40 COCCOCCNCC1CCCC1 34a_100000745349_100000740388 [1,0,0,1,0,0|2,0,0]=4 5873 B14R1.40 COCCOCCNCC1CCCO1 2230a_100000745349_100000203698 [1,0,0,1,0,0|1,0,0]=3 5874 B14R1.40 COCCOCCNCC1CCOC1 2230a_100000737293_100000695917 [1,0,0,1,0,0|1,0,0]=3 5875 B14R1.40 COCCOCCNCC1CCOC1 2230a_100000745349_100000702531 [1,0,0,1,0,0|1,0,0]=3 5876 B14R1.40 COCCOCCNCC1CCOC1 34a_100000737293_100000695917 [1,0,0,1,0,0|1,0,0]=3 5877 B14R1.40 COCCOCCNCC1CCOC1 34a_100000745349_100011261433 [1,0,0,1,0,0|1,0,0]=3 5878 B14R1.40 COCCOCCNCC1OCCO1 2230a_100000036311_100000695917 [1,0,0,1,0,0|1,0,0]=3 5879 B14R1.40 COCCOCCNCC1OCCO1 2230a_100000745349_100000755774 [1,0,0,1,0,0|1,0,0]=3 5880 B14R1.40 COCCOCCNCC1OCCO1 34a_100000036311_100000695917 [1,0,0,1,0,0|1,0,0]=3 5881 B14R1.40 COCCOCCNCC1OCCO1 34a_100000745349_100000755774 [1,0,0,1,0,0|1,0,0]=3 5882 B14R1.40 COCCOCCNC[C@@H]1CCCO1 2230a_100020590478_100000695917 [1,0,0,1,0,0|1,0,0]=3 5883 B14R1.40 COCCOCCNC[C@@H]1CCCO1 34a_100020590478_100000695917 [1,0,0,1,0,0|1,0,0]=3 5884 B14R1.40 COCCOCCOCC1CC=CC1 34a_100000688395_100000695917 [1,0,0,1,0,0|1,0,1]=4 5885 B14R1.40 COCCOCCOCC1CCCC1 34a_100000742336_100000695917 [1,0,0,1,0,0|1,0,0]=3 5886 B14R1.40 COCCOCCOCC1CCCC1 34a_100011215163_100000740388 [1,0,0,1,0,0|1,0,0]=3 5887 B14R1.40 COCCOCCOCC1CCCC1 7a_100000742336_100000695917 [1,0,0,1,0,0|1,0,0]=3 5888 B14R1.40 COCCOCCOCC1CCCC1 7a_100011215163_100000740388 [1,0,0,1,0,0|1,0,0]=3 5889 B14R1.40 COCCOCCOCC1CCCO1 34a_100000210270_100000695917 [1,0,0,1,0,0|0,0,0]=2 5890 B14R1.40 COCCOCCOCC1CCCO1 34a_200000723522_200000210301 [1,0,0,1,0,0|0,0,0]=2 5891 B14R1.40 COCCOCCOCC1CCCO1 7a_100000210270_100000695917 [1,0,0,1,0,0|0,0,0]=2 5892 B14R1.40 COCCOCCOCC1CCCO1 7a_100011215163_100000203698 [1,0,0,1,0,0|0,0,0]=2 5893 B14R1.40 COCCOCCOCC1CCCO1 7a_200000723522_200000210301 [1,0,0,1,0,0|0,0,0]=2 5894 B14R1.40 COCCOCCOCC1CCNC1 34a_100000748654_100000695917 [1,0,0,1,0,0|1,0,0]=3 5895 B14R1.40 COCCOCCOCC1CCOC1 34a_100000740260_100000695917 [1,0,0,1,0,0|0,0,0]=2 5896 B14R1.40 COCCOCCOCC1CCOC1 34a_100011215163_100011261433 [1,0,0,1,0,0|0,0,0]=2 5897 B14R1.40 COCCOCCOCC1CCOC1 7a_100011215163_100000702531 [1,0,0,1,0,0|0,0,0]=2 5898 B14R1.40 COCCOCCOCC1COCO1 34a_100011216627_100000695917 [1,0,0,1,0,0|0,0,0]=2 5899 B14R1.40 COCCOCCOCC1OCCO1 34a_100000087154_100000695917 [1,0,0,1,0,0|0,0,0]=2 5900 B14R1.40 COCCOCCOCC1OCCO1 34a_100011215163_100000755774 [1,0,0,1,0,0|0,0,0]=2 5901 B14R1.40 COCCOCCOCC1OCCO1 7a_100011215163_100000755774 [1,0,0,1,0,0|0,0,0]=2 5902 B14R1.40 COCCOCCOC[C@H]1CCCN1 34a_100000745186_100000695917 [1,0,0,1,0,0|1,0,0]=3 5903 B14R1.40 COCCOCCSCC1CCCC1 62a_100000695917_100000740388 [1,0,0,1,0,0|1,1,0]=4 5904 B14R1.40 COCCOCCSCC1CCCC1 62a_100000740388_100000695917 [1,0,0,1,0,0|1,1,0]=4 5905 B14R1.40 COCCOCCSCC1CCCO1 62a_100000203698_100000695917 [1,0,0,1,0,0|0,1,0]=3 5906 B14R1.40 COCCOCCSCC1CCCO1 62a_100000695917_100000203698 [1,0,0,1,0,0|0,1,0]=3 5907 B14R1.40 COCCOCCSCC1CCOC1 62a_100000695917_100000702531 [1,0,0,1,0,0|0,1,0]=3 5908 B14R1.40 COCCOCCSCC1CCOC1 62a_100000702531_100000695917 [1,0,0,1,0,0|0,1,0]=3 5909 B14R1.40 COCCOCCSCC1OCCO1 62a_100000695917_100000755774 [1,0,0,1,0,0|0,1,0]=3 5910 B14R1.40 COCCOCCSCC1OCCO1 62a_100000755774_100000695917 [1,0,0,1,0,0|0,1,0]=3 5911 B14R1.40 COCCOCNCCC1OCCO1 2230a_100000034215_100000231047 [1,0,0,1,0,0|2,0,0]=4 5912 B14R1.40 COCCOCSCCC1OCCO1 62a_100000231047_100000740749 [1,0,0,1,0,0|2,0,0]=4 5913 B14R1.40 COCCSCCCCC1OCCO1 62a_100000233755_100000034956 [1,0,0,1,0,0|1,1,0]=4 5914 B14R1.40 CSCCOCCCCC1OCCO1 34a_100000230434_200009813554 [1,0,0,1,0,0|1,1,0]=4 5915 B14R1.40 CSCCOCCCCC1OCCO1 7a_100000230434_100000034956 [1,0,0,1,0,0|1,1,0]=4 5916 B14R1.40 NOCCOCCCCC1OCCO1 34a_100000700252_200009813554 [1,0,0,1,0,0|2,0,0]=4 5917 B14R1.40 OCCCCCOCCC1CCOC1 34a_100011879284_100000746330 [1,0,0,1,0,0|2,0,0]=4 5918 B14R1.40 OCCOCCOCCC1CCCC1 34a_100000749090_100000692535 [1,0,0,1,0,0|2,0,0]=4 5919 B14R1.40 OCCOCCOCCC1CCCC1 7a_100000749090_100011215305 [1,0,0,1,0,0|2,0,0]=4 5920 B14R1.40 OCCOCCOCCC1CCNC1 34a_100016987287_100000692535 [1,0,0,1,0,0|2,0,0]=4 5921 B14R1.40 OCCOCCOCCC1CCOC1 34a_100011879284_100000692535 [1,0,0,1,0,0|1,0,0]=3 5922 B14R1.40 OCCOCCOCCN1CCCC1 2230a_100000188435_100000032323 [1,0,0,1,0,0|2,0,0]=4 5923 B14R1.40 OCCOCCOCCN1CCCC1 269982a_100000188435_100000032323 [1,0,0,1,0,0|2,0,0]=4 5924 B14R1.40 OCCOCCOCCN1CCSC1 2230a_100011215254_100000032323 [1,0,0,1,0,0|1,1,0]=4 5925 B14R1.40 OCCOCCOCCN1CCSC1 269982a_100011215254_100000032323 [1,0,0,1,0,0|1,1,0]=4 5926 B14R1.40 [13CH3]OCCOCCOCC1CCCO1 34a_200000723522_200025704644 [1,0,0,1,0,0|0,0,0]=2 5927 B14R1.40 [13CH3]OCCOCCOCC1CCCO1 7a_200000723522_200025704644 [1,0,0,1,0,0|0,0,0]=2 5928 B14R1.62 CCC1CCCN1CCOCCOC 2230a_100000754278_100000695917 [1,0,0,1,0,0|2,0,0]=4 5929 B14R1.62 CCC1CCCN1CCOCCOC 269982a_100000754278_100000695917 [1,0,0,1,0,0|2,0,0]=4 5930 B14R1.62 CCC1CCCN1CCOCCOC 34a_100000754278_100000695917 [1,0,0,1,0,0|2,0,0]=4 5931 B14R1.62 COCCOCCN1CCC[C@@H]1CO 2230a_100000745186_100000695917 [1,0,0,1,0,0|2,0,0]=4 5932 B14R1.62 COCCOCCN1CCC[C@@H]1CO 269982a_100000745186_100000695917 [1,0,0,1,0,0|2,0,0]=4 5933 B14R1.62 COCCOCCN1CCC[C@@H]1CO 34a_100000745186_100000695917 [1,0,0,1,0,0|2,0,0]=4 5934 B14R1.123 BrCCOCCOCC1CCCCO1 34a_100000692535_100000211543 [1,0,0,1,0,0|2,0,0]=4 5935 B14R1.123 BrCCOCCOCC1CCCCO1 7a_100000692535_100000211543 [1,0,0,1,0,0|2,0,0]=4 5936 B14R1.123 BrCCOCCOCC1CCCOC1 34a_100000692535_100000741521 [1,0,0,1,0,0|2,0,0]=4 5937 B14R1.123 BrCCOCCOCC1CCCOC1 7a_100000692535_100000741521 [1,0,0,1,0,0|2,0,0]=4 5938 B14R1.123 C#CCCCCOC[C@H]1COCCO1 34a_100009875890_100010269958 [1,0,0,1,0,0|1,0,1]=4 5939 B14R1.123 C#CCOCCOC[C@H]1COCCO1 34a_100009875890_100010402529 [1,0,0,1,0,0|0,0,2]=4 5940 B14R1.123 C=CCCCCOC[C@H]1COCCO1 34a_100009875890_100011215482 [1,0,0,1,0,0|1,0,1]=4 5941 B14R1.123 CC/C=C\CCOC[C@H]1COCCO1 34a_100009875890_100015370543 [1,0,0,1,0,0|1,0,1]=4 5942 B14R1.123 CCCCCCCOC1CCCOC1 34a_100000210272_100000693364 [1,0,0,1,0,0|2,0,0]=4 5943 B14R1.123 CCCCCCCOC1CCCOC1 34a_100000754041_100000210614 [1,0,0,1,0,0|2,0,0]=4 5944 B14R1.123 CCCCCCCOC1CCCOC1 7a_100000210272_100000693364 [1,0,0,1,0,0|2,0,0]=4 5945 B14R1.123 CCCCCCNC[C@H]1COCCO1 2230a_100010981119_100000210314 [1,0,0,1,0,0|2,0,0]=4 5946 B14R1.123 CCCCCCNC[C@H]1COCCO1 34a_100010981119_100000210314 [1,0,0,1,0,0|2,0,0]=4 5947 B14R1.123 CCCCCCOCC1CCCCO1 34a_100000210259_100000211543 [1,0,0,1,0,0|2,0,0]=4 5948 B14R1.123 CCCCCCOCC1CCCCO1 34a_100000211370_100000210314 [1,0,0,1,0,0|2,0,0]=4 5949 B14R1.123 CCCCCCOCC1CCCCO1 7a_100000210259_100000211543 [1,0,0,1,0,0|2,0,0]=4 5950 B14R1.123 CCCCCCOCC1CCCCO1 7a_100000211370_100000210314 [1,0,0,1,0,0|2,0,0]=4 5951 B14R1.123 CCCCCCOCC1CCCOC1 34a_100000210259_100000741521 [1,0,0,1,0,0|2,0,0]=4 5952 B14R1.123 CCCCCCOCC1CCCOC1 34a_100000741520_100000210314 [1,0,0,1,0,0|2,0,0]=4 5953 B14R1.123 CCCCCCOCC1CCCOC1 7a_100000210259_100000741521 [1,0,0,1,0,0|2,0,0]=4 5954 B14R1.123 CCCCCCOC[C@@H]1CNCCO1 34a_100015189573_100000210314 [1,0,0,1,0,0|2,0,0]=4 5955 B14R1.123 CCCCCCOC[C@@H]1COCCN1 34a_100000717676_100000210314 [1,0,0,1,0,0|2,0,0]=4 5956 B14R1.123 CCCCCCOC[C@H]1COCCO1 34a_100009875890_100000210314 [1,0,0,1,0,0|1,0,0]=3 5957 B14R1.123 CCCCOCCNC1CCCOC1 2230a_100000719290_100000743108 [1,0,0,1,0,0|2,0,0]=4 5958 B14R1.123 CCCCOCCNC1CCCOC1 34a_100000719290_100000743108 [1,0,0,1,0,0|2,0,0]=4 5959 B14R1.123 CCCCOCCOC1CCCCC1 34a_100000210227_100011211530 [1,0,0,1,0,0|2,0,0]=4 5960 B14R1.123 CCCCOCCOC1CCCCC1 34a_100000210231_100000743108 [1,0,0,1,0,0|2,0,0]=4 5961 B14R1.123 CCCCOCCOC1CCCCC1 34a_100000210238_100000210327 [1,0,0,1,0,0|2,0,0]=4 5962 B14R1.123 CCCCOCCOC1CCCCC1 34a_100011249652_100000210210 [1,0,0,1,0,0|2,0,0]=4 5963 B14R1.123 CCCCOCCOC1CCCCC1 7a_100000210227_100011211530 [1,0,0,1,0,0|2,0,0]=4 5964 B14R1.123 CCCCOCCOC1CCCCC1 7a_100000210231_100000743108 [1,0,0,1,0,0|2,0,0]=4 5965 B14R1.123 CCCCOCCOC1CCCCC1 7a_100000210238_100000210327 [1,0,0,1,0,0|2,0,0]=4 5966 B14R1.123 CCCCOCCOC1CCCCC1 7a_100011249652_100000210211 [1,0,0,1,0,0|2,0,0]=4 5967 B14R1.123 CCCCOCCOC1CCCCO1 34a_100000033831_100000743108 [1,0,0,1,0,0|2,0,0]=4 5968 B14R1.123 CCCCOCCOC1CCCCO1 34a_100000034223_100000210210 [1,0,0,1,0,0|2,0,0]=4 5969 B14R1.123 CCCCOCCOC1CCCCO1 34a_100000210227_100000744793 [1,0,0,1,0,0|2,0,0]=4 5970 B14R1.123 CCCCOCCOC1CCCCO1 7a_100000034223_100000210211 [1,0,0,1,0,0|2,0,0]=4 5971 B14R1.123 CCCCOCCOC1CCCCO1 7a_100000210227_100000744793 [1,0,0,1,0,0|2,0,0]=4 5972 B14R1.123 CCCCOCCOC1CCCOC1 34a_100000210238_100000693364 [1,0,0,1,0,0|1,0,0]=3 5973 B14R1.123 CCCCOCCOC1CCCOC1 34a_100000754041_100000743108 [1,0,0,1,0,0|1,0,0]=3 5974 B14R1.123 CCCCOCCOC1CCCOC1 7a_100000210238_100000693364 [1,0,0,1,0,0|1,0,0]=3 5975 B14R1.123 CCCCOCCOC1CCCSC1 7a_100015962668_100000743108 [1,0,0,1,0,0|1,1,0]=4 5976 B14R1.123 CCCCOCCSC1CCCOC1 62a_100000743108_100000693364 [1,0,0,1,0,0|1,1,0]=4 5977 B14R1.123 CCCCOCNC[C@H]1COCCO1 2230a_100010981119_100011995733 [1,0,0,1,0,0|2,0,0]=4 5978 B14R1.123 CCCCOCNC[C@H]1COCCO1 34a_100010981119_100011995733 [1,0,0,1,0,0|2,0,0]=4 5979 B14R1.123 CCCCOCOCC1CCCCO1 34a_100000211370_100011995733 [1,0,0,1,0,0|2,0,0]=4 5980 B14R1.123 CCCCOCOCC1CCCOC1 34a_100000741520_100011995733 [1,0,0,1,0,0|2,0,0]=4 5981 B14R1.123 CCCCOCOC[C@@H]1CNCCO1 34a_100015189573_100011995733 [1,0,0,1,0,0|2,0,0]=4 5982 B14R1.123 CCCCOCOC[C@@H]1COCCN1 34a_100000717676_100011995733 [1,0,0,1,0,0|2,0,0]=4 5983 B14R1.123 CCCCOCOC[C@H]1COCCO1 34a_100009875890_100011995733 [1,0,0,1,0,0|1,0,0]=3 5984 B14R1.123 CCCCSCCOC1CCCOC1 34a_200000230436_100000693364 [1,0,0,1,0,0|1,1,0]=4 5985 B14R1.123 CCCCSCCOC1CCCOC1 7a_200000230436_100000693364 [1,0,0,1,0,0|1,1,0]=4 5986 B14R1.123 CCCOCCNCC1CCCCO1 2230a_100000174945_100011215938 [1,0,0,1,0,0|2,0,0]=4 5987 B14R1.123 CCCOCCNCC1CCCCO1 2230a_100161115042_100000211543 [1,0,0,1,0,0|2,0,0]=4 5988 B14R1.123 CCCOCCNCC1CCCCO1 34a_100000174945_100011215938 [1,0,0,1,0,0|2,0,0]=4 5989 B14R1.123 CCCOCCNCC1CCCCO1 34a_100161115042_100000211543 [1,0,0,1,0,0|2,0,0]=4 5990 B14R1.123 CCCOCCNCC1CCCOC1 2230a_100000720124_100011215938 [1,0,0,1,0,0|2,0,0]=4 5991 B14R1.123 CCCOCCNCC1CCCOC1 2230a_100161115042_100000741521 [1,0,0,1,0,0|2,0,0]=4 5992 B14R1.123 CCCOCCNCC1CCCOC1 34a_100000720124_100011215938 [1,0,0,1,0,0|2,0,0]=4 5993 B14R1.123 CCCOCCNCC1CCCOC1 34a_100161115042_100000741521 [1,0,0,1,0,0|2,0,0]=4 5994 B14R1.123 CCCOCCNC[C@H]1COCCO1 2230a_100010981119_100011215938 [1,0,0,1,0,0|1,0,0]=3 5995 B14R1.123 CCCOCCNC[C@H]1COCCO1 34a_100010981119_100011215938 [1,0,0,1,0,0|1,0,0]=3 5996 B14R1.123 CCCOCCOCC1CCCCC1 34a_100000212181_100011215938 [1,0,0,1,0,0|2,0,0]=4 5997 B14R1.123 CCCOCCOCC1CCCCC1 34a_100000752267_100000211423 [1,0,0,1,0,0|2,0,0]=4 5998 B14R1.123 CCCOCCOCC1CCCCC1 7a_100000212181_100011215938 [1,0,0,1,0,0|2,0,0]=4 5999 B14R1.123 CCCOCCOCC1CCCCC1 7a_100000752267_100000211423 [1,0,0,1,0,0|2,0,0]=4 6000 B14R1.123 CCCOCCOCC1CCCCN1 34a_100000210821_100011215938 [1,0,0,1,0,0|2,0,0]=4 6001 B14R1.123 CCCOCCOCC1CCCCO1 34a_100000211370_100011215938 [1,0,0,1,0,0|1,0,0]=3 6002 B14R1.123 CCCOCCOCC1CCCCO1 34a_100000752267_100000211543 [1,0,0,1,0,0|1,0,0]=3 6003 B14R1.123 CCCOCCOCC1CCCCO1 7a_100000211370_100011215938 [1,0,0,1,0,0|1,0,0]=3 6004 B14R1.123 CCCOCCOCC1CCCCO1 7a_100000752267_100000211543 [1,0,0,1,0,0|1,0,0]=3 6005 B14R1.123 CCCOCCOCC1CCCNC1 34a_100000211344_100011215938 [1,0,0,1,0,0|2,0,0]=4 6006 B14R1.123 CCCOCCOCC1CCCOC1 34a_100000741520_100011215938 [1,0,0,1,0,0|1,0,0]=3 6007 B14R1.123 CCCOCCOCC1CCCOC1 34a_100000752267_100000741521 [1,0,0,1,0,0|1,0,0]=3 6008 B14R1.123 CCCOCCOCC1CCCOC1 7a_100000752267_100000741521 [1,0,0,1,0,0|1,0,0]=3 6009 B14R1.123 CCCOCCOC[C@@H]1CNCCO1 34a_100015189573_100011215938 [1,0,0,1,0,0|1,0,0]=3 6010 B14R1.123 CCCOCCOC[C@@H]1COCCN1 34a_100000717676_100011215938 [1,0,0,1,0,0|1,0,0]=3 6011 B14R1.123 CCCOCCOC[C@H]1COCCO1 34a_100009875890_100011215938 [1,0,0,1,0,0|0,0,0]=2 6012 B14R1.123 CCCOCCSCC1CCCCO1 62a_100000211543_100011215938 [1,0,0,1,0,0|1,1,0]=4 6013 B14R1.123 CCCOCCSCC1CCCCO1 62a_100011215938_100000211543 [1,0,0,1,0,0|1,1,0]=4 6014 B14R1.123 CCCOCCSCC1CCCOC1 62a_100000741521_100011215938 [1,0,0,1,0,0|1,1,0]=4 6015 B14R1.123 CCCOCCSCC1CCCOC1 62a_100011215938_100000741521 [1,0,0,1,0,0|1,1,0]=4 6016 B14R1.123 CCCSCCOCC1CCCCO1 34a_200000230433_100000211543 [1,0,0,1,0,0|1,1,0]=4 6017 B14R1.123 CCCSCCOCC1CCCCO1 7a_200000230433_100000211543 [1,0,0,1,0,0|1,1,0]=4 6018 B14R1.123 CCCSCCOCC1CCCOC1 34a_200000230433_100000741521 [1,0,0,1,0,0|1,1,0]=4 6019 B14R1.123 CCCSCCOCC1CCCOC1 7a_200000230433_100000741521 [1,0,0,1,0,0|1,1,0]=4 6020 B14R1.123 CCOCCCOC[C@H]1COCCO1 34a_100009875890_100012232248 [1,0,0,1,0,0|2,0,0]=4 6021 B14R1.123 CNCCCCCOC1CCCOC1 34a_100000722520_100000693364 [1,0,0,1,0,0|2,0,0]=4 6022 B14R1.123 CNCCOCCOC1CCCCC1 34a_100000228057_100000210327 [1,0,0,1,0,0|2,0,0]=4 6023 B14R1.123 CNCCOCCOC1CCCOC1 34a_100000228057_100000693364 [1,0,0,1,0,0|1,0,0]=3 6024 B14R1.123 COCCCCCNC1CCCOC1 270004a_100000747528_100000753404 [1,0,0,1,0,0|2,0,0]=4 6025 B14R1.123 COCCCCCNC1CCCOC1 34a_100000747528_100000693364 [1,0,0,1,0,0|2,0,0]=4 6026 B14R1.123 COCCCCNCC1CCCCO1 2230a_100000174945_100000730899 [1,0,0,1,0,0|2,0,0]=4 6027 B14R1.123 COCCCCNCC1CCCCO1 34a_100000174945_100000755781 [1,0,0,1,0,0|2,0,0]=4 6028 B14R1.123 COCCCCNCC1CCCOC1 2230a_100000720124_100000730899 [1,0,0,1,0,0|2,0,0]=4 6029 B14R1.123 COCCCCNCC1CCCOC1 34a_100000720124_100000755781 [1,0,0,1,0,0|2,0,0]=4 6030 B14R1.123 COCCCCNC[C@H]1COCCO1 2230a_100010981119_100000730899 [1,0,0,1,0,0|1,0,0]=3 6031 B14R1.123 COCCCCNC[C@H]1COCCO1 34a_100010981119_100000755781 [1,0,0,1,0,0|1,0,0]=3 6032 B14R1.123 COCCCCOCC1CCCCC1 34a_100000212181_100000755781 [1,0,0,1,0,0|2,0,0]=4 6033 B14R1.123 COCCCCOCC1CCCCC1 34a_100000740925_100000211423 [1,0,0,1,0,0|2,0,0]=4 6034 B14R1.123 COCCCCOCC1CCCCC1 7a_100000212181_100000730899 [1,0,0,1,0,0|2,0,0]=4 6035 B14R1.123 COCCCCOCC1CCCCN1 34a_100000210821_100000755781 [1,0,0,1,0,0|2,0,0]=4 6036 B14R1.123 COCCCCOCC1CCCCO1 34a_100000211370_100000755781 [1,0,0,1,0,0|1,0,0]=3 6037 B14R1.123 COCCCCOCC1CCCCO1 34a_100000740925_100000211543 [1,0,0,1,0,0|1,0,0]=3 6038 B14R1.123 COCCCCOCC1CCCCO1 7a_100000211370_100000730899 [1,0,0,1,0,0|1,0,0]=3 6039 B14R1.123 COCCCCOCC1CCCNC1 34a_100000211344_100000755781 [1,0,0,1,0,0|2,0,0]=4 6040 B14R1.123 COCCCCOCC1CCCOC1 34a_100000740925_100000741521 [1,0,0,1,0,0|1,0,0]=3 6041 B14R1.123 COCCCCOCC1CCCOC1 34a_100000741520_100000755781 [1,0,0,1,0,0|1,0,0]=3 6042 B14R1.123 COCCCCOC[C@@H]1CNCCO1 34a_100015189573_100000755781 [1,0,0,1,0,0|1,0,0]=3 6043 B14R1.123 COCCCCOC[C@@H]1COCCN1 34a_100000717676_100000755781 [1,0,0,1,0,0|1,0,0]=3 6044 B14R1.123 COCCCCOC[C@H]1COCCO1 34a_100009875890_100000755781 [1,0,0,1,0,0|0,0,0]=2 6045 B14R1.123 COCCCCSCC1CCCCO1 62a_100000211543_100000730899 [1,0,0,1,0,0|1,1,0]=4 6046 B14R1.123 COCCCCSCC1CCCCO1 62a_100000730899_100000211543 [1,0,0,1,0,0|1,1,0]=4 6047 B14R1.123 COCCCCSCC1CCCOC1 62a_100000730899_100000741521 [1,0,0,1,0,0|1,1,0]=4 6048 B14R1.123 COCCCCSCC1CCCOC1 62a_100000741521_100000730899 [1,0,0,1,0,0|1,1,0]=4 6049 B14R1.123 COCCNCCOC1CCCCC1 2230a_100000209980_100011211530 [1,0,0,1,0,0|2,0,0]=4 6050 B14R1.123 COCCNCCOC1CCCCC1 34a_100015206981_100011201679 [1,0,0,1,0,0|2,0,0]=4 6051 B14R1.123 COCCNCCOC1CCCCO1 2230a_100000209980_100000744793 [1,0,0,1,0,0|2,0,0]=4 6052 B14R1.123 COCCOCCCC1CCCCC1 34a_100000198086_100011201679 [1,0,0,1,0,0|2,0,0]=4 6053 B14R1.123 COCCOCCCC1CCCCC1 34a_100000210237_100011713725 [1,0,0,1,0,0|2,0,0]=4 6054 B14R1.123 COCCOCCCC1CCCCC1 7a_100000198086_100000233755 [1,0,0,1,0,0|2,0,0]=4 6055 B14R1.123 COCCOCCCC1CCCCN1 34a_100011934581_100011201679 [1,0,0,1,0,0|2,0,0]=4 6056 B14R1.123 COCCOCCCC1CCCNC1 34a_100150707839_100011201679 [1,0,0,1,0,0|2,0,0]=4 6057 B14R1.123 COCCOCCCN1CCCOC1 2230a_100000131196_100011216529 [1,0,0,1,0,0|2,0,0]=4 6058 B14R1.123 COCCOCCCN1CCCOC1 269982a_100000131196_100011216529 [1,0,0,1,0,0|2,0,0]=4 6059 B14R1.123 COCCOCCCN1CCCOC1 34a_100000131196_100011216529 [1,0,0,1,0,0|2,0,0]=4 6060 B14R1.123 COCCOCCNC1CCCCC1 2230a_100000182618_100000695917 [1,0,0,1,0,0|2,0,0]=4 6061 B14R1.123 COCCOCCNC1CCCCC1 270004a_100000745349_100000210434 [1,0,0,1,0,0|2,0,0]=4 6062 B14R1.123 COCCOCCNC1CCCCC1 34a_100000182618_100000695917 [1,0,0,1,0,0|2,0,0]=4 6063 B14R1.123 COCCOCCNC1CCCCC1 34a_100000200466_100011201679 [1,0,0,1,0,0|2,0,0]=4 6064 B14R1.123 COCCOCCNC1CCCCC1 34a_100000745349_100000210327 [1,0,0,1,0,0|2,0,0]=4 6065 B14R1.123 COCCOCCNC1CCCOC1 2230a_100000719290_100000695917 [1,0,0,1,0,0|1,0,0]=3 6066 B14R1.123 COCCOCCNC1CCCOC1 270004a_100000745349_100000753404 [1,0,0,1,0,0|1,0,0]=3 6067 B14R1.123 COCCOCCNC1CCCOC1 34a_100000719290_100000695917 [1,0,0,1,0,0|1,0,0]=3 6068 B14R1.123 COCCOCCNC1CCCOC1 34a_100000745349_100000693364 [1,0,0,1,0,0|1,0,0]=3 6069 B14R1.123 COCCOCCNC1CCCSC1 270004a_100000745349_100000057913 [1,0,0,1,0,0|1,1,0]=4 6070 B14R1.123 COCCOCCOC1C=CCCC1 34a_100011215024_100000695917 [1,0,0,1,0,0|1,0,1]=4 6071 B14R1.123 COCCOCCOC1C=CCCC1 7a_100011215163_100000751183 [1,0,0,1,0,0|1,0,1]=4 6072 B14R1.123 COCCOCCOC1CC=CCC1 34a_100000073881_100000695917 [1,0,0,1,0,0|1,0,1]=4 6073 B14R1.123 COCCOCCOC1CCCCC1 34a_100000210231_100000695917 [1,0,0,1,0,0|1,0,0]=3 6074 B14R1.123 COCCOCCOC1CCCCC1 34a_100000210237_100011211530 [1,0,0,1,0,0|1,0,0]=3 6075 B14R1.123 COCCOCCOC1CCCCC1 34a_100011215163_100000210327 [1,0,0,1,0,0|1,0,0]=3 6076 B14R1.123 COCCOCCOC1CCCCC1 34a_100011249652_100011201679 [1,0,0,1,0,0|1,0,0]=3 6077 B14R1.123 COCCOCCOC1CCCCC1 7a_100000210231_100000695917 [1,0,0,1,0,0|1,0,0]=3 6078 B14R1.123 COCCOCCOC1CCCCC1 7a_100011215163_100000210327 [1,0,0,1,0,0|1,0,0]=3 6079 B14R1.123 COCCOCCOC1CCCCC1 7a_100011249652_100000233755 [1,0,0,1,0,0|1,0,0]=3 6080 B14R1.123 COCCOCCOC1CCCCO1 34a_100000033831_100000695917 [1,0,0,1,0,0|1,0,0]=3 6081 B14R1.123 COCCOCCOC1CCCCO1 34a_100000034223_100011201679 [1,0,0,1,0,0|1,0,0]=3 6082 B14R1.123 COCCOCCOC1CCCCO1 34a_100000080444_200000210301 [1,0,0,1,0,0|1,0,0]=3 6083 B14R1.123 COCCOCCOC1CCCCO1 34a_100000210237_100000744793 [1,0,0,1,0,0|1,0,0]=3 6084 B14R1.123 COCCOCCOC1CCCCO1 7a_100000034223_100000233755 [1,0,0,1,0,0|1,0,0]=3 6085 B14R1.123 COCCOCCOC1CCCCO1 7a_100000080444_200000210301 [1,0,0,1,0,0|1,0,0]=3 6086 B14R1.123 COCCOCCOC1CCCOC1 34a_100000754041_100000695917 [1,0,0,1,0,0|0,0,0]=2 6087 B14R1.123 COCCOCCOC1CCCOC1 34a_100011215163_100000693364 [1,0,0,1,0,0|0,0,0]=2 6088 B14R1.123 COCCOCCOC1CCCOC1 7a_100011215163_100000693364 [1,0,0,1,0,0|0,0,0]=2 6089 B14R1.123 COCCOCCOC1CCCSC1 7a_100015962668_100000695917 [1,0,0,1,0,0|0,1,0]=3 6090 B14R1.123 COCCOCCOC1CCOCC1 34a_100000744328_100000695917 [1,0,0,1,0,0|2,0,0]=4 6091 B14R1.123 COCCOCCOC1CCOCC1 7a_100011215163_100000686592 [1,0,0,1,0,0|2,0,0]=4 6092 B14R1.123 COCCOCCOC1CCSCC1 34a_100000731022_100000695917 [1,0,0,1,0,0|2,0,0]=4 6093 B14R1.123 COCCOCCOC1CCSCC1 34a_100011215163_100000069128 [1,0,0,1,0,0|2,0,0]=4 6094 B14R1.123 COCCOCCOC1CCSCC1 7a_100000731022_100000695917 [1,0,0,1,0,0|2,0,0]=4 6095 B14R1.123 COCCOCCOC1CCSCC1 7a_100011215163_100011500858 [1,0,0,1,0,0|2,0,0]=4 6096 B14R1.123 COCCOCCSC1CCCCC1 62a_100000210327_100000695917 [1,0,0,1,0,0|1,1,0]=4 6097 B14R1.123 COCCOCCSC1CCCCC1 62a_100000695917_100000210327 [1,0,0,1,0,0|1,1,0]=4 6098 B14R1.123 COCCOCCSC1CCCOC1 62a_100000695917_100000693364 [1,0,0,1,0,0|0,1,0]=3 6099 B14R1.123 COCCOCNCC1CCCCO1 2230a_100000174945_100000231047 [1,0,0,1,0,0|2,0,0]=4 6100 B14R1.123 COCCOCNCC1CCCOC1 2230a_100000720124_100000231047 [1,0,0,1,0,0|2,0,0]=4 6101 B14R1.123 COCCOCNC[C@H]1COCCO1 2230a_100010981119_100000231047 [1,0,0,1,0,0|1,0,0]=3 6102 B14R1.123 COCCOCSCC1CCCCO1 62a_100000211543_100000231047 [1,0,0,1,0,0|1,1,0]=4 6103 B14R1.123 COCCOCSCC1CCCCO1 62a_100000231047_100000211543 [1,0,0,1,0,0|1,1,0]=4 6104 B14R1.123 COCCOCSCC1CCCOC1 62a_100000231047_100000741521 [1,0,0,1,0,0|1,1,0]=4 6105 B14R1.123 COCCOCSCC1CCCOC1 62a_100000741521_100000231047 [1,0,0,1,0,0|1,1,0]=4 6106 B14R1.123 COCCSCCOC1CCCCC1 62a_100000233755_100011211530 [1,0,0,1,0,0|1,1,0]=4 6107 B14R1.123 COCCSCCOC1CCCCC1 62a_100011211530_100000233755 [1,0,0,1,0,0|1,1,0]=4 6108 B14R1.123 COCCSCCOC1CCCCO1 62a_100000233755_100000744793 [1,0,0,1,0,0|1,1,0]=4 6109 B14R1.123 COCCSCCOC1CCCCO1 62a_100000744793_100000233755 [1,0,0,1,0,0|1,1,0]=4 6110 B14R1.123 CSCCCCOCC1CCCCO1 34a_100011217163_100000211543 [1,0,0,1,0,0|1,1,0]=4 6111 B14R1.123 CSCCCCOCC1CCCCO1 7a_100011217163_100000211543 [1,0,0,1,0,0|1,1,0]=4 6112 B14R1.123 CSCCCCOCC1CCCOC1 34a_100011217163_100000741521 [1,0,0,1,0,0|1,1,0]=4 6113 B14R1.123 CSCCCCOCC1CCCOC1 7a_100011217163_100000741521 [1,0,0,1,0,0|1,1,0]=4 6114 B14R1.123 CSCCOCCOC1CCCCC1 34a_100000230434_100011211530 [1,0,0,1,0,0|1,1,0]=4 6115 B14R1.123 CSCCOCCOC1CCCCC1 34a_100011249652_100000212216 [1,0,0,1,0,0|1,1,0]=4 6116 B14R1.123 CSCCOCCOC1CCCCC1 7a_100000230434_100011211530 [1,0,0,1,0,0|1,1,0]=4 6117 B14R1.123 CSCCOCCOC1CCCCC1 7a_100011249652_100000212216 [1,0,0,1,0,0|1,1,0]=4 6118 B14R1.123 CSCCOCCOC1CCCCO1 34a_100000034223_100000212216 [1,0,0,1,0,0|1,1,0]=4 6119 B14R1.123 CSCCOCCOC1CCCCO1 34a_100000230434_100000744793 [1,0,0,1,0,0|1,1,0]=4 6120 B14R1.123 CSCCOCCOC1CCCCO1 7a_100000034223_100000212216 [1,0,0,1,0,0|1,1,0]=4 6121 B14R1.123 CSCCOCCOC1CCCCO1 7a_100000230434_100000744793 [1,0,0,1,0,0|1,1,0]=4 6122 B14R1.123 ClCCOCCOCC1CCCCO1 34a_100011215305_100000211543 [1,0,0,1,0,0|2,0,0]=4 6123 B14R1.123 ClCCOCCOCC1CCCCO1 7a_100011215305_100000211543 [1,0,0,1,0,0|2,0,0]=4 6124 B14R1.123 ClCCOCCOCC1CCCOC1 34a_100011215305_100000741521 [1,0,0,1,0,0|2,0,0]=4 6125 B14R1.123 ClCCOCCOCC1CCCOC1 7a_100011215305_100000741521 [1,0,0,1,0,0|2,0,0]=4 6126 B14R1.123 FCCCCCOC[C@H]1COCCO1 34a_100009875890_100000729378 [1,0,0,1,0,0|2,0,0]=4 6127 B14R1.123 FCCOCCOCC1CCCCO1 34a_200015357709_100000211543 [1,0,0,1,0,0|2,0,0]=4 6128 B14R1.123 FCCOCCOCC1CCCCO1 7a_200015357709_100000211543 [1,0,0,1,0,0|2,0,0]=4 6129 B14R1.123 FCCOCCOCC1CCCOC1 34a_200015357709_100000741521 [1,0,0,1,0,0|2,0,0]=4 6130 B14R1.123 FCCOCCOCC1CCCOC1 7a_200015357709_100000741521 [1,0,0,1,0,0|2,0,0]=4 6131 B14R1.123 ICCOCCOCC1CCCCO1 34a_100012149058_100000211543 [1,0,0,1,0,0|2,0,0]=4 6132 B14R1.123 ICCOCCOCC1CCCCO1 7a_100012149058_100000211543 [1,0,0,1,0,0|2,0,0]=4 6133 B14R1.123 ICCOCCOCC1CCCOC1 34a_100012149058_100000741521 [1,0,0,1,0,0|2,0,0]=4 6134 B14R1.123 ICCOCCOCC1CCCOC1 7a_100012149058_100000741521 [1,0,0,1,0,0|2,0,0]=4 6135 B14R1.123 NCCOCCOCC1CCCCO1 34a_100000211614_100000211543 [1,0,0,1,0,0|2,0,0]=4 6136 B14R1.123 NCCOCCOCC1CCCOC1 34a_100000211614_100000741521 [1,0,0,1,0,0|2,0,0]=4 6137 B14R1.123 NOCCOCCOC1CCCCC1 34a_100000700252_100011211530 [1,0,0,1,0,0|2,0,0]=4 6138 B14R1.123 NOCCOCCOC1CCCCO1 34a_100000700252_100000744793 [1,0,0,1,0,0|2,0,0]=4 6139 B14R1.123 OCCCCCNC[C@H]1COCCO1 2230a_100010981119_100000746330 [1,0,0,1,0,0|2,0,0]=4 6140 B14R1.123 OCCCCCNC[C@H]1COCCO1 34a_100010981119_100000746330 [1,0,0,1,0,0|2,0,0]=4 6141 B14R1.123 OCCCCCOCC1CCCCO1 34a_100000211370_100000746330 [1,0,0,1,0,0|2,0,0]=4 6142 B14R1.123 OCCCCCOCC1CCCCO1 7a_100000211370_100000746330 [1,0,0,1,0,0|2,0,0]=4 6143 B14R1.123 OCCCCCOCC1CCCOC1 34a_100000741520_100000746330 [1,0,0,1,0,0|2,0,0]=4 6144 B14R1.123 OCCCCCOC[C@@H]1CNCCO1 34a_100015189573_100000746330 [1,0,0,1,0,0|2,0,0]=4 6145 B14R1.123 OCCCCCOC[C@@H]1COCCN1 34a_100000717676_100000746330 [1,0,0,1,0,0|2,0,0]=4 6146 B14R1.123 OCCCCCOC[C@H]1COCCO1 34a_100009875890_100000746330 [1,0,0,1,0,0|1,0,0]=3 6147 B14R1.123 OCCOCCNCC1CCCCO1 2230a_100000174945_100011215305 [1,0,0,1,0,0|2,0,0]=4 6148 B14R1.123 OCCOCCNCC1CCCCO1 2230a_100000211614_100000211543 [1,0,0,1,0,0|2,0,0]=4 6149 B14R1.123 OCCOCCNCC1CCCCO1 34a_100000174945_100000692535 [1,0,0,1,0,0|2,0,0]=4 6150 B14R1.123 OCCOCCNCC1CCCCO1 34a_100000211614_100000211543 [1,0,0,1,0,0|2,0,0]=4 6151 B14R1.123 OCCOCCNCC1CCCOC1 2230a_100000211614_100000741521 [1,0,0,1,0,0|2,0,0]=4 6152 B14R1.123 OCCOCCNCC1CCCOC1 2230a_100000720124_100011215305 [1,0,0,1,0,0|2,0,0]=4 6153 B14R1.123 OCCOCCNCC1CCCOC1 34a_100000211614_100000741521 [1,0,0,1,0,0|2,0,0]=4 6154 B14R1.123 OCCOCCNCC1CCCOC1 34a_100000720124_100000692535 [1,0,0,1,0,0|2,0,0]=4 6155 B14R1.123 OCCOCCNC[C@H]1COCCO1 2230a_100010981119_100011215305 [1,0,0,1,0,0|1,0,0]=3 6156 B14R1.123 OCCOCCNC[C@H]1COCCO1 34a_100010981119_100000692535 [1,0,0,1,0,0|1,0,0]=3 6157 B14R1.123 OCCOCCOCC1CCCCC1 34a_100000212181_100000692535 [1,0,0,1,0,0|2,0,0]=4 6158 B14R1.123 OCCOCCOCC1CCCCC1 7a_100000212181_100011215305 [1,0,0,1,0,0|2,0,0]=4 6159 B14R1.123 OCCOCCOCC1CCCCN1 34a_100000210821_100000692535 [1,0,0,1,0,0|2,0,0]=4 6160 B14R1.123 OCCOCCOCC1CCCCO1 34a_100000211370_100000692535 [1,0,0,1,0,0|1,0,0]=3 6161 B14R1.123 OCCOCCOCC1CCCCO1 7a_100000211370_100011215305 [1,0,0,1,0,0|1,0,0]=3 6162 B14R1.123 OCCOCCOCC1CCCNC1 34a_100000211344_100000692535 [1,0,0,1,0,0|2,0,0]=4 6163 B14R1.123 OCCOCCOCC1CCCOC1 34a_100000741520_100000692535 [1,0,0,1,0,0|1,0,0]=3 6164 B14R1.123 OCCOCCOC[C@@H]1CNCCO1 34a_100015189573_100000692535 [1,0,0,1,0,0|1,0,0]=3 6165 B14R1.123 OCCOCCOC[C@@H]1COCCN1 34a_100000717676_100000692535 [1,0,0,1,0,0|1,0,0]=3 6166 B14R1.123 OCCOCCOC[C@H]1COCCO1 34a_100009875890_100000692535 [1,0,0,1,0,0|0,0,0]=2 6167 B14R1.123 OCCOCCSCC1CCCCO1 62a_100000211543_100011215305 [1,0,0,1,0,0|1,1,0]=4 6168 B14R1.123 OCCOCCSCC1CCCCO1 62a_100011215305_100000211543 [1,0,0,1,0,0|1,1,0]=4 6169 B14R1.123 OCCOCCSCC1CCCOC1 62a_100000741521_100011215305 [1,0,0,1,0,0|1,1,0]=4 6170 B14R1.123 OCCOCCSCC1CCCOC1 62a_100011215305_100000741521 [1,0,0,1,0,0|1,1,0]=4 6171 B14R1.123 [13CH3]OCCOCCOC1CCCCO1 34a_100000080444_200025704644 [1,0,0,1,0,0|1,0,0]=3 6172 B14R1.123 [13CH3]OCCOCCOC1CCCCO1 7a_100000080444_200025704644 [1,0,0,1,0,0|1,0,0]=3 6173 B14R1.216 CCCCCCCOC1COCC1O 34a_100000210272_200000725654 [1,0,0,1,0,0|2,0,0]=4 6174 B14R1.216 CCCCCCCOC1COCC1O 7a_100000210272_200000725654 [1,0,0,1,0,0|2,0,0]=4 6175 B14R1.216 CCCCOCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000743108 [1,0,0,1,0,0|2,0,0]=4 6176 B14R1.216 CCCCOCCOC1CCCC1C 34a_100011216460_100000743108 [1,0,0,1,0,0|2,0,0]=4 6177 B14R1.216 CCCCOCCOC1CCCC1C 7a_100011216460_100000743108 [1,0,0,1,0,0|2,0,0]=4 6178 B14R1.216 CCCCOCCOC1COCC1O 34a_100000210238_200000725654 [1,0,0,1,0,0|1,0,0]=3 6179 B14R1.216 CCCCOCCOC1COCC1O 7a_100000210238_200000725654 [1,0,0,1,0,0|1,0,0]=3 6180 B14R1.216 CCCCOCCO[C@H]1CNC[C@H]1C 34a_200015306588_100000743108 [1,0,0,1,0,0|2,0,0]=4 6181 B14R1.216 CCCCOCCO[C@H]1COC[C@@H]1N 34a_100015191717_100000743108 [1,0,0,1,0,0|2,0,0]=4 6182 B14R1.216 CCCCOCCSC1COCC1O 62a_100000743108_200000725654 [1,0,0,1,0,0|1,1,0]=4 6183 B14R1.216 CCCCOCCSC1COCC1O 62a_200000725654_100000743108 [1,0,0,1,0,0|1,1,0]=4 6184 B14R1.216 CCCCSCCOC1COCC1O 34a_200000230436_200000725654 [1,0,0,1,0,0|1,1,0]=4 6185 B14R1.216 CCCCSCCOC1COCC1O 7a_200000230436_200000725654 [1,0,0,1,0,0|1,1,0]=4 6186 B14R1.216 CCCOCCOCC1CCCN1C 34a_100000743107_100011215938 [1,0,0,1,0,0|2,0,0]=4 6187 B14R1.216 CN1CCCC1COCCOCCO 34a_100000743107_100000692535 [1,0,0,1,0,0|2,0,0]=4 6188 B14R1.216 CNCCCCCOC1COCC1O 34a_100000722520_200000725654 [1,0,0,1,0,0|2,0,0]=4 6189 B14R1.216 CNCCOCCOC1COCC1O 34a_100000228057_200000725654 [1,0,0,1,0,0|1,0,0]=3 6190 B14R1.216 COCCCCCNC1COCC1O 34a_100000747528_200000725654 [1,0,0,1,0,0|2,0,0]=4 6191 B14R1.216 COCCCCOCC1CCCN1C 34a_100000743107_100000755781 [1,0,0,1,0,0|2,0,0]=4 6192 B14R1.216 COCCOCCNC1CCCC1C 269862a_100000745349_100000752053 [1,0,0,1,0,0|2,0,0]=4 6193 B14R1.216 COCCOCCNC1COCC1O 34a_100000745349_200000725654 [1,0,0,1,0,0|1,0,0]=3 6194 B14R1.216 COCCOCCN[C@H]1COC[C@@H]1O 2230a_100015191717_100000695917 [1,0,0,1,0,0|1,0,0]=3 6195 B14R1.216 COCCOCCOC1CCCC1=O 34a_100011215163_100000709159 [1,0,0,1,0,0|2,0,0]=4 6196 B14R1.216 COCCOCCOC1CCCC1=O 34a_200000719330_100000695917 [1,0,0,1,0,0|2,0,0]=4 6197 B14R1.216 COCCOCCOC1CCCC1=O 7a_100011215163_100000211823 [1,0,0,1,0,0|2,0,0]=4 6198 B14R1.216 COCCOCCOC1CCCC1C 34a_100011216460_100000695917 [1,0,0,1,0,0|1,0,0]=3 6199 B14R1.216 COCCOCCOC1CCCC1C 7a_100011216460_100000695917 [1,0,0,1,0,0|1,0,0]=3 6200 B14R1.216 COCCOCCOC1COCC1O 34a_100011215163_200000725654 [1,0,0,1,0,0|0,0,0]=2 6201 B14R1.216 COCCOCCOC1COCC1O 7a_100011215163_200000725654 [1,0,0,1,0,0|0,0,0]=2 6202 B14R1.216 COCCOCCO[C@@H]1CCC[C@H]1Cl 34a_200016002552_100000695917 [1,0,0,1,0,0|2,0,0]=4 6203 B14R1.216 COCCOCCO[C@H]1CCC[C@@H]1N 34a_100000748460_100000695917 [1,0,0,1,0,0|2,0,0]=4 6204 B14R1.216 COCCOCCO[C@H]1CNC[C@H]1C 34a_200015306588_100000695917 [1,0,0,1,0,0|1,0,0]=3 6205 B14R1.216 COCCOCCO[C@H]1COC[C@@H]1N 34a_100015191717_100000695917 [1,0,0,1,0,0|1,0,0]=3 6206 B14R1.216 COCCOCCSC1COCC1O 62a_100000695917_200000725654 [1,0,0,1,0,0|0,1,0]=3 6207 B14R1.216 COCCOCCSC1COCC1O 62a_200000725654_100000695917 [1,0,0,1,0,0|0,1,0]=3 6208 B14R1.216 COCCOCCS[C@@H]1CCC[C@H]1O 62a_100000695917_200016002552 [1,0,0,1,0,0|1,1,0]=4 6209 B14R1.216 COCCOCCS[C@@H]1CCC[C@H]1O 62a_200016002552_100000695917 [1,0,0,1,0,0|1,1,0]=4 6210 B14R1.221 BrCCOCCOCCOCC1CC1 34a_100010132937_100000742324 [1,0,0,1,0,0|2,0,0]=4 6211 B14R1.221 BrCCOCCOCCOCC1CC1 7a_100010132937_100000742324 [1,0,0,1,0,0|2,0,0]=4 6212 B14R1.221 BrCCOCCOCCOCC1CO1 34a_100010132937_102125554688 [1,0,0,1,0,0|1,0,0]=3 6213 B14R1.221 BrCCOCCOCCOCC1CO1 7a_100010132937_102125554688 [1,0,0,1,0,0|1,0,0]=3 6214 B14R1.221 BrCCOCCOCCOCC1CS1 7a_100010132937_100000031435 [1,0,0,1,0,0|1,1,0]=4 6215 B14R1.221 BrCCOCCOCCOC[C@@H]1CO1 7a_100010132937_100000745022 [1,0,0,1,0,0|1,0,0]=3 6216 B14R1.221 C#CCCOCCCCOCC1CO1 34a_100010889290_100000688953 [1,0,0,1,0,0|1,0,1]=4 6217 B14R1.221 C#CCCOCCCCOCC1CO1 7a_100010889290_100000688953 [1,0,0,1,0,0|1,0,1]=4 6218 B14R1.221 C#CCOCCOCCOCC1CO1 34a_100000041007_102125554688 [1,0,0,1,0,0|0,0,2]=4 6219 B14R1.221 C#CCOCCOCCOCC1CO1 7a_100000041007_102125554688 [1,0,0,1,0,0|0,0,2]=4 6220 B14R1.221 C#CCOCCOCCOC[C@@H]1CO1 34a_100000757423_100010408581 [1,0,0,1,0,0|0,0,2]=4 6221 B14R1.221 C#CCOCCOCCOC[C@@H]1CO1 7a_100000041007_100000745022 [1,0,0,1,0,0|0,0,2]=4 6222 B14R1.221 C/C=C/COCCCCOCC1CO1 34a_100010889290_100102629194 [1,0,0,1,0,0|1,0,1]=4 6223 B14R1.221 C/C=C/COCCCCOCC1CO1 7a_100010889290_100102629194 [1,0,0,1,0,0|1,0,1]=4 6224 B14R1.221 C=CCCOCCCCOCC1CO1 34a_100010889290_100000754431 [1,0,0,1,0,0|1,0,1]=4 6225 B14R1.221 C=CCCOCCCCOCC1CO1 7a_100010889290_100000754431 [1,0,0,1,0,0|1,0,1]=4 6226 B14R1.221 C=CCOCCOCCOCC1CO1 34a_100000065479_102125554688 [1,0,0,1,0,0|0,0,2]=4 6227 B14R1.221 C=CCOCCOCCOCC1CO1 7a_100000065479_102125554688 [1,0,0,1,0,0|0,0,2]=4 6228 B14R1.221 C=CCOCCOCCOC[C@@H]1CO1 7a_100000065479_100000745022 [1,0,0,1,0,0|0,0,2]=4 6229 B14R1.221 CC#CCOCCCCOCC1CO1 34a_100010889290_100000748600 [1,0,0,1,0,0|1,0,1]=4 6230 B14R1.221 CC#CCOCCCCOCC1CO1 7a_100010889290_100000748600 [1,0,0,1,0,0|1,0,1]=4 6231 B14R1.221 CC=CCOCCCCOCC1CO1 34a_100010889290_100000070051 [1,0,0,1,0,0|1,0,1]=4 6232 B14R1.221 CC=CCOCCCCOCC1CO1 7a_100010889290_100000070051 [1,0,0,1,0,0|1,0,1]=4 6233 B14R1.221 CCCCCCCCCOCC1CO1 34a_100000210712_102125554688 [1,0,0,1,0,0|2,0,0]=4 6234 B14R1.221 CCCCCCCCCOCC1CO1 7a_100000210712_102125554688 [1,0,0,1,0,0|2,0,0]=4 6235 B14R1.221 CCCCCCCCCOC[C@@H]1CO1 34a_100000757423_100011214924 [1,0,0,1,0,0|2,0,0]=4 6236 B14R1.221 CCCCCCCCCOC[C@@H]1CO1 7a_100000210712_100000745022 [1,0,0,1,0,0|2,0,0]=4 6237 B14R1.221 CCCCCCCOCCCC1CO1 34a_100000210272_100000733510 [1,0,0,1,0,0|2,0,0]=4 6238 B14R1.221 CCCCCCCOCCCC1CO1 7a_100000210272_100000733510 [1,0,0,1,0,0|2,0,0]=4 6239 B14R1.221 CCCCCCOCCOCC1CC1 34a_100000691444_100000742324 [1,0,0,1,0,0|2,0,0]=4 6240 B14R1.221 CCCCCCOCCOCC1CC1 7a_100000691444_100000742324 [1,0,0,1,0,0|2,0,0]=4 6241 B14R1.221 CCCCCCOCCOCC1CO1 34a_100000691444_102125554688 [1,0,0,1,0,0|1,0,0]=3 6242 B14R1.221 CCCCCCOCCOCC1CO1 7a_100000691444_102125554688 [1,0,0,1,0,0|1,0,0]=3 6243 B14R1.221 CCCCCCOCCOCC1CS1 7a_100000691444_100000031435 [1,0,0,1,0,0|1,1,0]=4 6244 B14R1.221 CCCCCCOCCOC[C@@H]1CO1 7a_100000691444_100000745022 [1,0,0,1,0,0|1,0,0]=3 6245 B14R1.221 CCCCNCCCCOCC1CO1 34a_200011216965_102125554688 [1,0,0,1,0,0|2,0,0]=4 6246 B14R1.221 CCCCOCCCCOCC1CC1 34a_200000760531_100000742324 [1,0,0,1,0,0|2,0,0]=4 6247 B14R1.221 CCCCOCCCCOCC1CC1 7a_200000760531_100000742324 [1,0,0,1,0,0|2,0,0]=4 6248 B14R1.221 CCCCOCCCCOCC1CO1 34a_100010889290_100000210210 [1,0,0,1,0,0|1,0,0]=3 6249 B14R1.221 CCCCOCCCCOCC1CO1 34a_200000760531_102125554688 [1,0,0,1,0,0|1,0,0]=3 6250 B14R1.221 CCCCOCCCCOCC1CO1 7a_100010889290_100000210211 [1,0,0,1,0,0|1,0,0]=3 6251 B14R1.221 CCCCOCCCCOCC1CO1 7a_200000760531_102125554688 [1,0,0,1,0,0|1,0,0]=3 6252 B14R1.221 CCCCOCCCCOCC1CS1 7a_200000760531_100000031435 [1,0,0,1,0,0|1,1,0]=4 6253 B14R1.221 CCCCOCCCCOC[C@@H]1CO1 7a_200000760531_100000745022 [1,0,0,1,0,0|1,0,0]=3 6254 B14R1.221 CCCCOCCOCCCC1CO1 34a_100000210238_100000733510 [1,0,0,1,0,0|1,0,0]=3 6255 B14R1.221 CCCCOCCOCCCC1CO1 7a_100000210238_100000733510 [1,0,0,1,0,0|1,0,0]=3 6256 B14R1.221 CCCCOCCOCCNC1CC1 34a_100000738766_100000743108 [1,0,0,1,0,0|2,0,0]=4 6257 B14R1.221 CCCCOCCOCCOC1CC1 34a_100011215186_100000211595 [1,0,0,1,0,0|1,0,0]=3 6258 B14R1.221 CCCCOCCSCCCC1CO1 62a_100000733510_100000743108 [1,0,0,1,0,0|1,1,0]=4 6259 B14R1.221 CCCCOCCSCCCC1CO1 62a_100000743108_100000733510 [1,0,0,1,0,0|1,1,0]=4 6260 B14R1.221 CCCCSCCOCCCC1CO1 34a_200000230436_100000733510 [1,0,0,1,0,0|1,1,0]=4 6261 B14R1.221 CCCCSCCOCCCC1CO1 7a_200000230436_100000733510 [1,0,0,1,0,0|1,1,0]=4 6262 B14R1.221 CCCOCCOCCNCC1CC1 2230a_200011904461_100000742324 [1,0,0,1,0,0|2,0,0]=4 6263 B14R1.221 CCCOCCOCCNCC1CC1 269862a_200011904461_100000741477 [1,0,0,1,0,0|2,0,0]=4 6264 B14R1.221 CCCOCCOCCNCC1CC1 34a_200011904461_100000742324 [1,0,0,1,0,0|2,0,0]=4 6265 B14R1.221 CCCOCCOCCNCC1CO1 2230a_200011904461_100011216344 [1,0,0,1,0,0|1,0,0]=3 6266 B14R1.221 CCCOCCOCCNCC1CO1 34a_200011904461_102125554688 [1,0,0,1,0,0|1,0,0]=3 6267 B14R1.221 CNCCCCCOCCCC1CO1 34a_100000722520_100000733510 [1,0,0,1,0,0|2,0,0]=4 6268 B14R1.221 CNCCOCCOCCCC1CO1 34a_100000228057_100000733510 [1,0,0,1,0,0|1,0,0]=3 6269 B14R1.221 CNCCOCCOCCOC1CC1 34a_200014138305_100000211595 [1,0,0,1,0,0|1,0,0]=3 6270 B14R1.221 COCCCCCNCCCC1CO1 2230a_100000747528_100000733510 [1,0,0,1,0,0|2,0,0]=4 6271 B14R1.221 COCCCCCNCCCC1CO1 34a_100000747528_100000733510 [1,0,0,1,0,0|2,0,0]=4 6272 B14R1.221 COCCCOCCCOCC1CO1 34a_200011215475_102125554688 [1,0,0,1,0,0|2,0,0]=4 6273 B14R1.221 COCCCOCCCOCC1CO1 7a_200011215475_102125554688 [1,0,0,1,0,0|2,0,0]=4 6274 B14R1.221 COCCCOCCCOC[C@@H]1CO1 7a_200011215475_100000745022 [1,0,0,1,0,0|2,0,0]=4 6275 B14R1.221 COCCOCCCCOCC1CO1 34a_100010889290_100011201679 [1,0,0,1,0,0|0,0,0]=2 6276 B14R1.221 COCCOCCCCOCC1CO1 7a_100010889290_100000233755 [1,0,0,1,0,0|0,0,0]=2 6277 B14R1.221 COCCOCCCNCCC1CO1 2230a_100000206027_100000732470 [1,0,0,1,0,0|2,0,0]=4 6278 B14R1.221 COCCOCCCNCCC1CO1 34a_100000206027_100000732470 [1,0,0,1,0,0|2,0,0]=4 6279 B14R1.221 COCCOCCCOCC[C@@H]1CO1 34a_100009820653_100011216529 [1,0,0,1,0,0|2,0,0]=4 6280 B14R1.221 COCCOCCCSCCC1CO1 62a_100000732470_100011216529 [1,0,0,1,0,0|2,0,0]=4 6281 B14R1.221 COCCOCCCSCCC1CO1 62a_100011216529_100000732470 [1,0,0,1,0,0|2,0,0]=4 6282 B14R1.221 COCCOCCNCCCC1CO1 2230a_100000745349_100000733510 [1,0,0,1,0,0|1,0,0]=3 6283 B14R1.221 COCCOCCNCCCC1CO1 34a_100000745349_100000733510 [1,0,0,1,0,0|1,0,0]=3 6284 B14R1.221 COCCOCCOCC#CC1CC1 34a_100000083941_100000695917 [1,0,0,1,0,0|1,0,1]=4 6285 B14R1.221 COCCOCCOCC#CC1CC1 34a_100011215163_100009895102 [1,0,0,1,0,0|1,0,1]=4 6286 B14R1.221 COCCOCCOCC#CC1CC1 7a_100000083941_100000695917 [1,0,0,1,0,0|1,0,1]=4 6287 B14R1.221 COCCOCCOCC#CC1CC1 7a_100011215163_100009895102 [1,0,0,1,0,0|1,0,1]=4 6288 B14R1.221 COCCOCCOCCCC1CO1 34a_100011215163_100000733510 [1,0,0,1,0,0|0,0,0]=2 6289 B14R1.221 COCCOCCOCCCC1CO1 7a_100011215163_100000733510 [1,0,0,1,0,0|0,0,0]=2 6290 B14R1.221 COCCOCCOCCNC1CC1 34a_100000212008_100013367474 [1,0,0,1,0,0|1,0,0]=3 6291 B14R1.221 COCCOCCOCCNC1CC1 34a_100000738766_100000695917 [1,0,0,1,0,0|1,0,0]=3 6292 B14R1.221 COCCOCCOCCNC1CC1 34a_100012028300_100000211595 [1,0,0,1,0,0|1,0,0]=3 6293 B14R1.221 COCCOCCOCCOC1CC1 34a_100000688194_100000211595 [1,0,0,1,0,0|0,0,0]=2 6294 B14R1.221 COCCOCCOCCSC1CC1 62a_100013367474_100000211595 [1,0,0,1,0,0|0,1,0]=3 6295 B14R1.221 COCCOCCSCCCC1CO1 62a_100000695917_100000733510 [1,0,0,1,0,0|0,1,0]=3 6296 B14R1.221 COCCOCCSCCCC1CO1 62a_100000733510_100000695917 [1,0,0,1,0,0|0,1,0]=3 6297 B14R1.221 CSCCOCCCCOCC1CO1 34a_100010889290_100000212216 [1,0,0,1,0,0|0,1,0]=3 6298 B14R1.221 CSCCOCCCCOCC1CO1 7a_100010889290_100000212216 [1,0,0,1,0,0|0,1,0]=3 6299 B14R1.221 ClCCOCCOCCOCC1CC1 34a_100000032323_100000742324 [1,0,0,1,0,0|2,0,0]=4 6300 B14R1.221 ClCCOCCOCCOCC1CC1 7a_100000032323_100000742324 [1,0,0,1,0,0|2,0,0]=4 6301 B14R1.221 ClCCOCCOCCOCC1CO1 34a_100000032323_102125554688 [1,0,0,1,0,0|1,0,0]=3 6302 B14R1.221 ClCCOCCOCCOCC1CO1 7a_100000032323_102125554688 [1,0,0,1,0,0|1,0,0]=3 6303 B14R1.221 ClCCOCCOCCOCC1CS1 7a_100000032323_100000031435 [1,0,0,1,0,0|1,1,0]=4 6304 B14R1.221 ClCCOCCOCCOC[C@@H]1CO1 7a_100000032323_100000745022 [1,0,0,1,0,0|1,0,0]=3 6305 B14R1.221 FCCCOCCCCOCC1CO1 34a_100010889290_100011934791 [1,0,0,1,0,0|2,0,0]=4 6306 B14R1.221 FCCCOCCCCOCC1CO1 7a_100010889290_100011934791 [1,0,0,1,0,0|2,0,0]=4 6307 B14R1.221 N#CCCOCCCCOCC1CO1 7a_100010889290_100000184422 [1,0,0,1,0,0|2,0,0]=4 6308 B14R1.221 NCCCOCCOCCOC1CC1 34a_100011996194_100000211595 [1,0,0,1,0,0|2,0,0]=4 6309 B14R1.221 NCCOCCOCCOCC1CC1 34a_100011998139_100000742324 [1,0,0,1,0,0|2,0,0]=4 6310 B14R1.221 NCCOCCOCCOCC1CO1 34a_100011998139_102125554688 [1,0,0,1,0,0|1,0,0]=3 6311 B14R1.221 OCCCCCCCCOC[C@@H]1CO1 34a_100000757423_100000033203 [1,0,0,1,0,0|2,0,0]=4 6312 B14R1.221 OCCCOCCCCOCC1CO1 34a_100010889290_100000230001 [1,0,0,1,0,0|2,0,0]=4 6313 B14R1.221 OCCCOCCCCOCC1CO1 7a_100010889290_100011215043 [1,0,0,1,0,0|2,0,0]=4 6314 B14R1.221 OCCOCCOCCNCC1CC1 2230a_100000735609_100000032323 [1,0,0,1,0,0|2,0,0]=4 6315 B14R1.221 OCCOCCOCCNCC1CC1 2230a_100011998139_100000742324 [1,0,0,1,0,0|2,0,0]=4 6316 B14R1.221 OCCOCCOCCNCC1CC1 269862a_100011998139_100000741477 [1,0,0,1,0,0|2,0,0]=4 6317 B14R1.221 OCCOCCOCCNCC1CC1 34a_100000735609_100000032323 [1,0,0,1,0,0|2,0,0]=4 6318 B14R1.221 OCCOCCOCCNCC1CC1 34a_100011998139_100000742324 [1,0,0,1,0,0|2,0,0]=4 6319 B14R1.221 OCCOCCOCCNCC1CO1 2230a_100011998139_100011216344 [1,0,0,1,0,0|1,0,0]=3 6320 B14R1.221 OCCOCCOCCNCC1CO1 34a_100011998139_102125554688 [1,0,0,1,0,0|1,0,0]=3 6321 B14R1.221 OCCOCCOCCOCC1CC1 34a_100000211283_100000032323 [1,0,0,1,0,0|1,0,0]=3 6322 B14R1.221 OCCOCCOCCOC[C@@H]1CO1 34a_100000757423_100000032323 [1,0,0,1,0,0|0,0,0]=2 6323 B14R1.221 OCCOCCOCCSCC1CC1 62a_100000032323_100000742324 [1,0,0,1,0,0|1,1,0]=4 6324 B14R1.221 OCCOCCOCCSCC1CC1 62a_100000756562_100000032323 [1,0,0,1,0,0|1,1,0]=4 6325 B14R1.221 OCCOCCOCCSCC1CO1 62a_100000032323_102125554688 [1,0,0,1,0,0|0,1,0]=3 6326 B14R1.221 OCCOCCOCCSCC1CO1 62a_102125554688_100000032323 [1,0,0,1,0,0|0,1,0]=3 6327 B14R1.221 OCCOCCOCCSCC1CS1 62a_100000031435_100000032323 [1,0,0,1,0,0|0,2,0]=4 6328 B14R1.221 OCCOCCOCCSCC1CS1 62a_100000032323_100000031435 [1,0,0,1,0,0|0,2,0]=4 6329 B14R1.221 OCCOCCOCCSC[C@@H]1CO1 62a_100000032323_100000745022 [1,0,0,1,0,0|0,1,0]=3 6330 B14R1.221 OCCOCCOCCSC[C@@H]1CO1 62a_100000745022_100000032323 [1,0,0,1,0,0|0,1,0]=3 6331 B14R1.229 CC1CCN1CCOCCOCCO 269982a_100000755817_100000032323 [1,0,0,1,0,0|2,0,0]=4 6332 B14R1.229 CC1CCN1CCOCCOCCO 34a_100000755817_100000032323 [1,0,0,1,0,0|2,0,0]=4 6333 B14R1.234 CCCN1CCCC1COCCOC 34a_200000694710_100011201679 [1,0,0,1,0,0|2,0,0]=4 6334 B14R1.234 CCCN1CCCC1COCCOC 7a_200000694710_100000233755 [1,0,0,1,0,0|2,0,0]=4 6335 B14R1.234 CCCOCCN1CCC[C@H]1COC 2230a_100020646714_100011215938 [1,0,0,1,0,0|2,0,0]=4 6336 B14R1.234 CCCOCCN1CCC[C@H]1COC 269982a_100020646714_100011215938 [1,0,0,1,0,0|2,0,0]=4 6337 B14R1.234 CCCOCCN1CCC[C@H]1COC 34a_100020646714_100011215938 [1,0,0,1,0,0|2,0,0]=4 6338 B14R1.234 COCCCCN1CCC[C@H]1COC 2230a_100020646714_100000730899 [1,0,0,1,0,0|2,0,0]=4 6339 B14R1.234 COCCCCN1CCC[C@H]1COC 269982a_100020646714_100000730899 [1,0,0,1,0,0|2,0,0]=4 6340 B14R1.234 COCCCCN1CCC[C@H]1COC 34a_100020646714_100000755781 [1,0,0,1,0,0|2,0,0]=4 6341 B14R1.234 COCCOCN1CCC[C@H]1COC 2230a_100020646714_100000231047 [1,0,0,1,0,0|2,0,0]=4 6342 B14R1.234 COCCOCN1CCC[C@H]1COC 269982a_100020646714_100000231047 [1,0,0,1,0,0|2,0,0]=4 6343 B14R1.234 COC[C@@H]1CCCN1CCOCCO 2230a_100020646714_100011215305 [1,0,0,1,0,0|2,0,0]=4 6344 B14R1.234 COC[C@@H]1CCCN1CCOCCO 269982a_100020646714_100011215305 [1,0,0,1,0,0|2,0,0]=4 6345 B14R1.234 COC[C@@H]1CCCN1CCOCCO 34a_100020646714_100000692535 [1,0,0,1,0,0|2,0,0]=4 6346 B14R1.476 CCCOCCN1CCOC[C@@H]1CC 2230a_100016988097_100011215938 [1,0,0,1,0,0|2,0,0]=4 6347 B14R1.476 CCCOCCN1CCOC[C@@H]1CC 269982a_100016988097_100011215938 [1,0,0,1,0,0|2,0,0]=4 6348 B14R1.476 CCCOCCN1CCOC[C@@H]1CC 34a_100016988097_100011215938 [1,0,0,1,0,0|2,0,0]=4 6349 B14R1.476 CC[C@H]1COCCN1CCCCOC 2230a_100016988097_100000730899 [1,0,0,1,0,0|2,0,0]=4 6350 B14R1.476 CC[C@H]1COCCN1CCCCOC 269982a_100016988097_100000730899 [1,0,0,1,0,0|2,0,0]=4 6351 B14R1.476 CC[C@H]1COCCN1CCCCOC 34a_100016988097_100000755781 [1,0,0,1,0,0|2,0,0]=4 6352 B14R1.476 CC[C@H]1COCCN1CCOCCO 2230a_100016988097_100011215305 [1,0,0,1,0,0|2,0,0]=4 6353 B14R1.476 CC[C@H]1COCCN1CCOCCO 269982a_100016988097_100011215305 [1,0,0,1,0,0|2,0,0]=4 6354 B14R1.476 CC[C@H]1COCCN1CCOCCO 34a_100016988097_100000692535 [1,0,0,1,0,0|2,0,0]=4 6355 B14R1.476 CC[C@H]1COCCN1COCCOC 2230a_100016988097_100000231047 [1,0,0,1,0,0|2,0,0]=4 6356 B14R1.476 CC[C@H]1COCCN1COCCOC 269982a_100016988097_100000231047 [1,0,0,1,0,0|2,0,0]=4 6357 B14R1.476 COCCCNC1CCOCC1OC 270004a_100150723488_100000095984 [1,0,0,1,0,0|2,0,0]=4 6358 B14R1.787 COCCC1CCCCN1CCOC 2230a_100015186528_100011201679 [1,0,0,1,0,0|2,0,0]=4 6359 B14R1.787 COCCC1CCCCN1CCOC 269982a_100015186528_100000233755 [1,0,0,1,0,0|2,0,0]=4 6360 B14R1.787 COCCC1CCCCN1CCOC 34a_100015186528_100011201679 [1,0,0,1,0,0|2,0,0]=4 6361 B14R1.882 CC1CCCCC1OCCOCCO 34a_100000211207_100000692535 [1,0,0,1,0,0|2,0,0]=4 6362 B14R1.882 CC1CCCCC1OCCOCCO 7a_100000211207_100011215305 [1,0,0,1,0,0|2,0,0]=4 6363 B14R1.882 CC1CCNCC1OCCOCCO 34a_100000696640_100000692535 [1,0,0,1,0,0|2,0,0]=4 6364 B14R1.882 CCCCOCCN1CCOC[C@@H]1C 2230a_100009815349_100000743108 [1,0,0,1,0,0|2,0,0]=4 6365 B14R1.882 CCCCOCCN1CCOC[C@@H]1C 269982a_100009815349_100000743108 [1,0,0,1,0,0|2,0,0]=4 6366 B14R1.882 CCCCOCCN1CCOC[C@@H]1C 34a_100009815349_100000743108 [1,0,0,1,0,0|2,0,0]=4 6367 B14R1.882 CCCOCCOC1CCCCC1C 34a_100000211207_100011215938 [1,0,0,1,0,0|2,0,0]=4 6368 B14R1.882 CCCOCCOC1CCCCC1C 7a_100000211207_100011215938 [1,0,0,1,0,0|2,0,0]=4 6369 B14R1.882 CCCOCCOC1CNCCC1C 34a_100000696640_100011215938 [1,0,0,1,0,0|2,0,0]=4 6370 B14R1.882 CCCOCCOC1COCCC1=O 34a_100000752267_100012180262 [1,0,0,1,0,0|2,0,0]=4 6371 B14R1.882 CCCOCCOC1COCCC1=O 7a_100000752267_100012180262 [1,0,0,1,0,0|2,0,0]=4 6372 B14R1.882 CCCOCCO[C@H]1COCC[C@H]1N 34a_100016994285_100011215938 [1,0,0,1,0,0|2,0,0]=4 6373 B14R1.882 COCCCCOC1CCCCC1C 34a_100000211207_100000755781 [1,0,0,1,0,0|2,0,0]=4 6374 B14R1.882 COCCCCOC1CCCCC1C 7a_100000211207_100000730899 [1,0,0,1,0,0|2,0,0]=4 6375 B14R1.882 COCCCCOC1CNCCC1C 34a_100000696640_100000755781 [1,0,0,1,0,0|2,0,0]=4 6376 B14R1.882 COCCCCOC1COCCC1=O 34a_100000740925_100012180262 [1,0,0,1,0,0|2,0,0]=4 6377 B14R1.882 COCCCCO[C@H]1COCC[C@H]1N 34a_100016994285_100000755781 [1,0,0,1,0,0|2,0,0]=4 6378 B14R1.882 COCCOCCC1CCCCN1C 34a_100000210237_100000211948 [1,0,0,1,0,0|2,0,0]=4 6379 B14R1.882 COCCOCCN1CCCCC1C 2230a_100000211376_100000695917 [1,0,0,1,0,0|2,0,0]=4 6380 B14R1.882 COCCOCCN1CCCCC1C 269982a_100000211376_100000695917 [1,0,0,1,0,0|2,0,0]=4 6381 B14R1.882 COCCOCCN1CCCCC1C 34a_100000211376_100000695917 [1,0,0,1,0,0|2,0,0]=4 6382 B14R1.882 COCCOCCN1CCCCC1C 34a_100011305533_100011201679 [1,0,0,1,0,0|2,0,0]=4 6383 B14R1.882 COCCOCCN1CCOC[C@@H]1C 2230a_100009815349_100000695917 [1,0,0,1,0,0|1,0,0]=3 6384 B14R1.882 COCCOCCN1CCOC[C@@H]1C 269982a_100009815349_100000695917 [1,0,0,1,0,0|1,0,0]=3 6385 B14R1.882 COCCOCCN1CCOC[C@@H]1C 34a_100009815349_100000695917 [1,0,0,1,0,0|1,0,0]=3 6386 B14R1.882 COCCOCN[C@@H]1CCOC[C@@H]1O 2230a_100016994285_100000231047 [1,0,0,1,0,0|2,0,0]=4 6387 B14R1.882 N[C@@H]1CCOC[C@@H]1OCCOCCO 34a_100016994285_100000692535 [1,0,0,1,0,0|2,0,0]=4 6388 B14R1.891 BrCCOCCOCCOC1CCC1 34a_100010132937_100000749161 [1,0,0,1,0,0|2,0,0]=4 6389 B14R1.891 BrCCOCCOCCOC1COC1 34a_100010132937_100009818527 [1,0,0,1,0,0|1,0,0]=3 6390 B14R1.891 BrCCOCCOCCOC1COC1 7a_100010132937_100009818527 [1,0,0,1,0,0|1,0,0]=3 6391 B14R1.891 C#CCOCCOCCOC1COC1 34a_100000041007_100009818527 [1,0,0,1,0,0|0,0,2]=4 6392 B14R1.891 C#CCOCCOCCOC1COC1 7a_100000041007_100009818527 [1,0,0,1,0,0|0,0,2]=4 6393 B14R1.891 C=CCOCCOCCOC1COC1 34a_100000065479_100009818527 [1,0,0,1,0,0|0,0,2]=4 6394 B14R1.891 C=CCOCCOCCOC1COC1 7a_100000065479_100009818527 [1,0,0,1,0,0|0,0,2]=4 6395 B14R1.891 CCCCCCCCCOC1COC1 34a_100000210712_100009818527 [1,0,0,1,0,0|2,0,0]=4 6396 B14R1.891 CCCCCCCCCOC1COC1 7a_100000210712_100009818527 [1,0,0,1,0,0|2,0,0]=4 6397 B14R1.891 CCCCCCCOCCC1COC1 34a_100009855314_100000210614 [1,0,0,1,0,0|2,0,0]=4 6398 B14R1.891 CCCCCCOCCOC1CCC1 34a_100000691444_100000749161 [1,0,0,1,0,0|2,0,0]=4 6399 B14R1.891 CCCCCCOCCOC1COC1 34a_100000691444_100009818527 [1,0,0,1,0,0|1,0,0]=3 6400 B14R1.891 CCCCCCOCCOC1COC1 7a_100000691444_100009818527 [1,0,0,1,0,0|1,0,0]=3 6401 B14R1.891 CCCCNCCCCOC1COC1 34a_200011216965_100009818527 [1,0,0,1,0,0|2,0,0]=4 6402 B14R1.891 CCCCOCCCCOC1CCC1 34a_200000760531_100000749161 [1,0,0,1,0,0|2,0,0]=4 6403 B14R1.891 CCCCOCCCCOC1COC1 34a_200000760531_100009818527 [1,0,0,1,0,0|1,0,0]=3 6404 B14R1.891 CCCCOCCCCOC1COC1 7a_200000760531_100009818527 [1,0,0,1,0,0|1,0,0]=3 6405 B14R1.891 CCCCOCCOCCC1COC1 34a_100009855314_100000743108 [1,0,0,1,0,0|1,0,0]=3 6406 B14R1.891 CCCOCCOCCNC1CCC1 270004a_200011904461_100000241760 [1,0,0,1,0,0|2,0,0]=4 6407 B14R1.891 CCCOCCOCCNC1CCC1 34a_200011904461_100000749161 [1,0,0,1,0,0|2,0,0]=4 6408 B14R1.891 CCCOCCOCCNC1COC1 34a_200011904461_100009818527 [1,0,0,1,0,0|1,0,0]=3 6409 B14R1.891 COCCCOCCCOC1COC1 34a_200011215475_100009818527 [1,0,0,1,0,0|2,0,0]=4 6410 B14R1.891 COCCCOCCCOC1COC1 7a_200011215475_100009818527 [1,0,0,1,0,0|2,0,0]=4 6411 B14R1.891 COCCOCCCNCC1COC1 2230a_100000206027_100010264016 [1,0,0,1,0,0|2,0,0]=4 6412 B14R1.891 COCCOCCCNCC1COC1 2230a_100015281925_100011216529 [1,0,0,1,0,0|2,0,0]=4 6413 B14R1.891 COCCOCCCNCC1COC1 34a_100000206027_100010264016 [1,0,0,1,0,0|2,0,0]=4 6414 B14R1.891 COCCOCCCNCC1COC1 34a_100015281925_100011216529 [1,0,0,1,0,0|2,0,0]=4 6415 B14R1.891 COCCOCCCOCC1COC1 34a_100000060846_100011216529 [1,0,0,1,0,0|2,0,0]=4 6416 B14R1.891 COCCOCCCSCC1COC1 62a_100010264016_100011216529 [1,0,0,1,0,0|2,0,0]=4 6417 B14R1.891 COCCOCCCSCC1COC1 62a_100011216529_100010264016 [1,0,0,1,0,0|2,0,0]=4 6418 B14R1.891 COCCOCCOCCC1COC1 34a_100009855314_100000695917 [1,0,0,1,0,0|0,0,0]=2 6419 B14R1.891 COCCOCCOCCN1CCC1 269982a_100000754969_100013367474 [1,0,0,1,0,0|1,0,0]=3 6420 B14R1.891 ClCCOCCOCCOC1CCC1 34a_100000032323_100000749161 [1,0,0,1,0,0|2,0,0]=4 6421 B14R1.891 ClCCOCCOCCOC1COC1 34a_100000032323_100009818527 [1,0,0,1,0,0|1,0,0]=3 6422 B14R1.891 ClCCOCCOCCOC1COC1 7a_100000032323_100009818527 [1,0,0,1,0,0|1,0,0]=3 6423 B14R1.891 NCCOCCOCCOC1CCC1 34a_100011998139_100000749161 [1,0,0,1,0,0|2,0,0]=4 6424 B14R1.891 NCCOCCOCCOC1COC1 34a_100011998139_100009818527 [1,0,0,1,0,0|1,0,0]=3 6425 B14R1.891 OCCOCCOCCNC1CCC1 2230a_100000749019_100000032323 [1,0,0,1,0,0|2,0,0]=4 6426 B14R1.891 OCCOCCOCCNC1CCC1 270004a_100011998139_100000241760 [1,0,0,1,0,0|2,0,0]=4 6427 B14R1.891 OCCOCCOCCNC1CCC1 34a_100000749019_100000032323 [1,0,0,1,0,0|2,0,0]=4 6428 B14R1.891 OCCOCCOCCNC1CCC1 34a_100011998139_100000749161 [1,0,0,1,0,0|2,0,0]=4 6429 B14R1.891 OCCOCCOCCNC1COC1 2230a_100016991112_100000032323 [1,0,0,1,0,0|1,0,0]=3 6430 B14R1.891 OCCOCCOCCNC1COC1 34a_100011998139_100009818527 [1,0,0,1,0,0|1,0,0]=3 6431 B14R1.891 OCCOCCOCCOC1CCC1 34a_100000748187_100000032323 [1,0,0,1,0,0|1,0,0]=3 6432 B14R1.891 OCCOCCOCCOC1CSC1 7a_100000072292_100000032323 [1,0,0,1,0,0|0,1,0]=3 6433 B14R1.891 OCCOCCOCCSC1CCC1 62a_100000032323_100000749161 [1,0,0,1,0,0|1,1,0]=4 6434 B14R1.891 OCCOCCOCCSC1COC1 62a_100000032323_100009818527 [1,0,0,1,0,0|0,1,0]=3 6435 B14R1.904 CCCC1CCCCC1OCCOC 34a_100011217265_100011201679 [1,0,0,1,0,0|2,0,0]=4 6436 B14R1.904 CCCC1CCCCC1OCCOC 7a_100011217265_100000233755 [1,0,0,1,0,0|2,0,0]=4 6437 B14R1.1254 COCCOCC1CCCCCCC1 34a_100011216312_100011201679 [1,0,0,1,0,0|2,0,0]=4 6438 B14R1.1254 COCCOCC1CCCCCCC1 7a_100011216312_100000233755 [1,0,0,1,0,0|2,0,0]=4 6439 B14R1.2352 CCCCOCCN1CCCOCC1 2230a_100000685342_100000743108 [1,0,0,1,0,0|2,0,0]=4 6440 B14R1.2352 CCCCOCCN1CCCOCC1 269982a_100000685342_100000743108 [1,0,0,1,0,0|2,0,0]=4 6441 B14R1.2352 CCCCOCCN1CCCOCC1 34a_100000685342_100000743108 [1,0,0,1,0,0|2,0,0]=4 6442 B14R1.2352 CCCOCCOC1CCCCCC1 34a_100000210887_100011215938 [1,0,0,1,0,0|2,0,0]=4 6443 B14R1.2352 CCCOCCOC1CCCCCC1 34a_100000752267_100011217769 [1,0,0,1,0,0|2,0,0]=4 6444 B14R1.2352 CCCOCCOC1CCCCCC1 7a_100000210887_100011215938 [1,0,0,1,0,0|2,0,0]=4 6445 B14R1.2352 COCCCCOC1CCCCCC1 34a_100000210887_100000755781 [1,0,0,1,0,0|2,0,0]=4 6446 B14R1.2352 COCCCCOC1CCCCCC1 34a_100000740925_100011217769 [1,0,0,1,0,0|2,0,0]=4 6447 B14R1.2352 COCCCCOC1CCCCCC1 7a_100000210887_100000730899 [1,0,0,1,0,0|2,0,0]=4 6448 B14R1.2352 COCCOCCN1CCCCCC1 2230a_100000185865_100000695917 [1,0,0,1,0,0|2,0,0]=4 6449 B14R1.2352 COCCOCCN1CCCCCC1 269982a_100000185865_100000695917 [1,0,0,1,0,0|2,0,0]=4 6450 B14R1.2352 COCCOCCN1CCCCCC1 34a_100000185865_100000695917 [1,0,0,1,0,0|2,0,0]=4 6451 B14R1.2352 COCCOCCN1CCCCCC1 34a_100000238007_100011201679 [1,0,0,1,0,0|2,0,0]=4 6452 B14R1.2352 COCCOCCN1CCCOCC1 2230a_100000685342_100000695917 [1,0,0,1,0,0|1,0,0]=3 6453 B14R1.2352 COCCOCCN1CCCOCC1 269982a_100000685342_100000695917 [1,0,0,1,0,0|1,0,0]=3 6454 B14R1.2352 COCCOCCN1CCCOCC1 34a_100000685342_100000695917 [1,0,0,1,0,0|1,0,0]=3 6455 B14R1.2352 OCCOCCOC1CCCCCC1 34a_100000210887_100000692535 [1,0,0,1,0,0|2,0,0]=4 6456 B14R1.2352 OCCOCCOC1CCCCCC1 7a_100000210887_100011215305 [1,0,0,1,0,0|2,0,0]=4 6457 B14R1.3128 CCCCOCCN1CCC1COC 2230a_100015195929_100000743108 [1,0,0,1,0,0|2,0,0]=4 6458 B14R1.3128 CCCCOCCN1CCC1COC 269982a_100015195929_100000743108 [1,0,0,1,0,0|2,0,0]=4 6459 B14R1.3128 CCCCOCCN1CCC1COC 34a_100015195929_100000743108 [1,0,0,1,0,0|2,0,0]=4 6460 B14R1.3128 COCCOCCN1CCC1COC 2230a_100015195929_100000695917 [1,0,0,1,0,0|1,0,0]=3 6461 B14R1.3128 COCCOCCN1CCC1COC 269982a_100015195929_100000695917 [1,0,0,1,0,0|1,0,0]=3 6462 B14R1.3128 COCCOCCN1CCC1COC 34a_100015195929_100000695917 [1,0,0,1,0,0|1,0,0]=3 6463 B16R1.271 COCCOCN1CCCCC1CCOC 2230a_100015186528_100000231047 [0,1,0,1,0,0|2,0,0]=4 6464 B16R1.271 COCCOCN1CCCCC1CCOC 269982a_100015186528_100000231047 [0,1,0,1,0,0|2,0,0]=4 6465 B16R1.643 C=COCCOCCOCC1CCCCO1 34a_100000039918_100000211543 [0,1,0,1,0,0|1,0,1]=4 6466 B16R1.643 C=COCCOCCOCC1CCCCO1 7a_100000039918_100000211543 [0,1,0,1,0,0|1,0,1]=4 6467 B16R1.643 C=COCCOCCOCC1CCCOC1 34a_100000039918_100000741521 [0,1,0,1,0,0|1,0,1]=4 6468 B16R1.643 C=COCCOCCOCC1CCCOC1 7a_100000039918_100000741521 [0,1,0,1,0,0|1,0,1]=4 6469 B16R1.643 CCCCCCCCOC[C@H]1COCCO1 34a_100009875890_100000210759 [0,1,0,1,0,0|2,0,0]=4 6470 B16R1.643 CCCCCOCCOCC1CCCCO1 34a_100011215259_100000211543 [0,1,0,1,0,0|2,0,0]=4 6471 B16R1.643 CCCCCOCCOCC1CCCCO1 7a_100011215259_100000211543 [0,1,0,1,0,0|2,0,0]=4 6472 B16R1.643 CCCCCOCCOCC1CCCOC1 34a_100011215259_100000741521 [0,1,0,1,0,0|2,0,0]=4 6473 B16R1.643 CCCCCOCCOCC1CCCOC1 7a_100011215259_100000741521 [0,1,0,1,0,0|2,0,0]=4 6474 B16R1.643 CCCCOCCCOCC1CCCCO1 34a_200011215613_100000211543 [0,1,0,1,0,0|2,0,0]=4 6475 B16R1.643 CCCCOCCCOCC1CCCCO1 7a_200011215613_100000211543 [0,1,0,1,0,0|2,0,0]=4 6476 B16R1.643 CCCCOCCCOCC1CCCOC1 34a_200011215613_100000741521 [0,1,0,1,0,0|2,0,0]=4 6477 B16R1.643 CCCCOCCCOCC1CCCOC1 7a_200011215613_100000741521 [0,1,0,1,0,0|2,0,0]=4 6478 B16R1.643 CCCCOCCOCCC1CCOCC1 34a_100000210238_100011934994 [0,1,0,1,0,0|2,0,0]=4 6479 B16R1.643 CCCCOCCOCCC1CCOCC1 34a_100011933979_100000743108 [0,1,0,1,0,0|2,0,0]=4 6480 B16R1.643 CCCCOCCOCCC1CCOCC1 7a_100000210238_100011934994 [0,1,0,1,0,0|2,0,0]=4 6481 B16R1.643 CCCCOCCOCCC1CCOCC1 7a_100011933979_100000743108 [0,1,0,1,0,0|2,0,0]=4 6482 B16R1.643 CCCCOCCOCCN1CCOCC1 34a_100011409812_100000210210 [0,1,0,1,0,0|2,0,0]=4 6483 B16R1.643 CCCCOCCOCCN1CCOCC1 7a_100000210238_100000211760 [0,1,0,1,0,0|2,0,0]=4 6484 B16R1.643 CCOCCOCCNCC1CCCCO1 2230a_100000174945_100011211534 [0,1,0,1,0,0|2,0,0]=4 6485 B16R1.643 CCOCCOCCNCC1CCCCO1 2230a_100102712874_100000211543 [0,1,0,1,0,0|2,0,0]=4 6486 B16R1.643 CCOCCOCCNCC1CCCCO1 34a_100000174945_100011211534 [0,1,0,1,0,0|2,0,0]=4 6487 B16R1.643 CCOCCOCCNCC1CCCCO1 34a_100102712874_100000211543 [0,1,0,1,0,0|2,0,0]=4 6488 B16R1.643 CCOCCOCCNCC1CCCOC1 2230a_100000720124_100011211534 [0,1,0,1,0,0|2,0,0]=4 6489 B16R1.643 CCOCCOCCNCC1CCCOC1 2230a_100102712874_100000741521 [0,1,0,1,0,0|2,0,0]=4 6490 B16R1.643 CCOCCOCCNCC1CCCOC1 34a_100000720124_100011211534 [0,1,0,1,0,0|2,0,0]=4 6491 B16R1.643 CCOCCOCCNCC1CCCOC1 34a_100102712874_100000741521 [0,1,0,1,0,0|2,0,0]=4 6492 B16R1.643 CCOCCOCCNC[C@H]1COCCO1 2230a_100010981119_100011211534 [0,1,0,1,0,0|1,0,0]=3 6493 B16R1.643 CCOCCOCCNC[C@H]1COCCO1 34a_100010981119_100011211534 [0,1,0,1,0,0|1,0,0]=3 6494 B16R1.643 CCOCCOCCOCC1CCCCC1 34a_100000210240_100000211423 [0,1,0,1,0,0|2,0,0]=4 6495 B16R1.643 CCOCCOCCOCC1CCCCC1 34a_100000212181_100011211534 [0,1,0,1,0,0|2,0,0]=4 6496 B16R1.643 CCOCCOCCOCC1CCCCC1 7a_100000210240_100000211423 [0,1,0,1,0,0|2,0,0]=4 6497 B16R1.643 CCOCCOCCOCC1CCCCC1 7a_100000212181_100011211534 [0,1,0,1,0,0|2,0,0]=4 6498 B16R1.643 CCOCCOCCOCC1CCCCN1 34a_100000210821_100011211534 [0,1,0,1,0,0|2,0,0]=4 6499 B16R1.643 CCOCCOCCOCC1CCCCO1 34a_100000210240_100000211543 [0,1,0,1,0,0|1,0,0]=3 6500 B16R1.643 CCOCCOCCOCC1CCCCO1 34a_100000211370_100011211534 [0,1,0,1,0,0|1,0,0]=3 6501 B16R1.643 CCOCCOCCOCC1CCCCO1 7a_100000210240_100000211543 [0,1,0,1,0,0|1,0,0]=3 6502 B16R1.643 CCOCCOCCOCC1CCCCO1 7a_100000211370_100011211534 [0,1,0,1,0,0|1,0,0]=3 6503 B16R1.643 CCOCCOCCOCC1CCCNC1 34a_100000211344_100011211534 [0,1,0,1,0,0|2,0,0]=4 6504 B16R1.643 CCOCCOCCOCC1CCCOC1 34a_100000210240_100000741521 [0,1,0,1,0,0|1,0,0]=3 6505 B16R1.643 CCOCCOCCOCC1CCCOC1 34a_100000741520_100011211534 [0,1,0,1,0,0|1,0,0]=3 6506 B16R1.643 CCOCCOCCOCC1CCCOC1 7a_100000210240_100000741521 [0,1,0,1,0,0|1,0,0]=3 6507 B16R1.643 CCOCCOCCOC[C@@H]1CNCCO1 34a_100015189573_100011211534 [0,1,0,1,0,0|1,0,0]=3 6508 B16R1.643 CCOCCOCCOC[C@@H]1COCCN1 34a_100000717676_100011211534 [0,1,0,1,0,0|1,0,0]=3 6509 B16R1.643 CCOCCOCCOC[C@H]1COCCO1 34a_100009875890_100011211534 [0,1,0,1,0,0|0,0,0]=2 6510 B16R1.643 CCOCCOCCSCC1CCCCO1 62a_100000211543_100011211534 [0,1,0,1,0,0|1,1,0]=4 6511 B16R1.643 CCOCCOCCSCC1CCCCO1 62a_100011211534_100000211543 [0,1,0,1,0,0|1,1,0]=4 6512 B16R1.643 CCOCCOCCSCC1CCCOC1 62a_100000741521_100011211534 [0,1,0,1,0,0|1,1,0]=4 6513 B16R1.643 CCOCCOCCSCC1CCCOC1 62a_100011211534_100000741521 [0,1,0,1,0,0|1,1,0]=4 6514 B16R1.643 CNCCOCCOCCC1CCOCC1 34a_100000228057_100011934994 [0,1,0,1,0,0|2,0,0]=4 6515 B16R1.643 COCCCCCCNC[C@H]1COCCO1 2230a_100010981119_100011998445 [0,1,0,1,0,0|2,0,0]=4 6516 B16R1.643 COCCCCCCNC[C@H]1COCCO1 34a_100010981119_100011998445 [0,1,0,1,0,0|2,0,0]=4 6517 B16R1.643 COCCCCCCOCC1CCCCO1 34a_100000211370_100011998445 [0,1,0,1,0,0|2,0,0]=4 6518 B16R1.643 COCCCCCCOCC1CCCCO1 34a_200012092642_100000211543 [0,1,0,1,0,0|2,0,0]=4 6519 B16R1.643 COCCCCCCOCC1CCCCO1 7a_100000211370_100011998445 [0,1,0,1,0,0|2,0,0]=4 6520 B16R1.643 COCCCCCCOCC1CCCCO1 7a_200012092642_100000211543 [0,1,0,1,0,0|2,0,0]=4 6521 B16R1.643 COCCCCCCOCC1CCCOC1 34a_100000741520_100011998445 [0,1,0,1,0,0|2,0,0]=4 6522 B16R1.643 COCCCCCCOCC1CCCOC1 34a_200012092642_100000741521 [0,1,0,1,0,0|2,0,0]=4 6523 B16R1.643 COCCCCCCOCC1CCCOC1 7a_200012092642_100000741521 [0,1,0,1,0,0|2,0,0]=4 6524 B16R1.643 COCCCCCCOC[C@@H]1CNCCO1 34a_100015189573_100011998445 [0,1,0,1,0,0|2,0,0]=4 6525 B16R1.643 COCCCCCCOC[C@@H]1COCCN1 34a_100000717676_100011998445 [0,1,0,1,0,0|2,0,0]=4 6526 B16R1.643 COCCCCCCOC[C@H]1COCCO1 34a_100009875890_100011998445 [0,1,0,1,0,0|1,0,0]=3 6527 B16R1.643 COCCNCCOCCN1CCOCC1 2230a_100011651319_100011201679 [0,1,0,1,0,0|2,0,0]=4 6528 B16R1.643 COCCOCCCCOC1CCCCO1 34a_100000210237_100000031530 [0,1,0,1,0,0|2,0,0]=4 6529 B16R1.643 COCCOCCCNCC1CCCCO1 2230a_100000174945_100011216529 [0,1,0,1,0,0|2,0,0]=4 6530 B16R1.643 COCCOCCCNCC1CCCCO1 2230a_100000206027_100000211543 [0,1,0,1,0,0|2,0,0]=4 6531 B16R1.643 COCCOCCCNCC1CCCCO1 34a_100000174945_100011216529 [0,1,0,1,0,0|2,0,0]=4 6532 B16R1.643 COCCOCCCNCC1CCCCO1 34a_100000206027_100000211543 [0,1,0,1,0,0|2,0,0]=4 6533 B16R1.643 COCCOCCCNCC1CCCOC1 2230a_100000206027_100000741521 [0,1,0,1,0,0|2,0,0]=4 6534 B16R1.643 COCCOCCCNCC1CCCOC1 2230a_100000720124_100011216529 [0,1,0,1,0,0|2,0,0]=4 6535 B16R1.643 COCCOCCCNCC1CCCOC1 34a_100000206027_100000741521 [0,1,0,1,0,0|2,0,0]=4 6536 B16R1.643 COCCOCCCNCC1CCCOC1 34a_100000720124_100011216529 [0,1,0,1,0,0|2,0,0]=4 6537 B16R1.643 COCCOCCCNC[C@H]1COCCO1 2230a_100010981119_100011216529 [0,1,0,1,0,0|1,0,0]=3 6538 B16R1.643 COCCOCCCNC[C@H]1COCCO1 34a_100010981119_100011216529 [0,1,0,1,0,0|1,0,0]=3 6539 B16R1.643 COCCOCCCOCC1CCCCC1 34a_100000212181_100011216529 [0,1,0,1,0,0|2,0,0]=4 6540 B16R1.643 COCCOCCCOCC1CCCCC1 7a_100000212181_100011216529 [0,1,0,1,0,0|2,0,0]=4 6541 B16R1.643 COCCOCCCOCC1CCCCN1 34a_100000210821_100011216529 [0,1,0,1,0,0|2,0,0]=4 6542 B16R1.643 COCCOCCCOCC1CCCCO1 34a_100000211370_100011216529 [0,1,0,1,0,0|1,0,0]=3 6543 B16R1.643 COCCOCCCOCC1CCCCO1 7a_100000211370_100011216529 [0,1,0,1,0,0|1,0,0]=3 6544 B16R1.643 COCCOCCCOCC1CCCNC1 34a_100000211344_100011216529 [0,1,0,1,0,0|2,0,0]=4 6545 B16R1.643 COCCOCCCOCC1CCCOC1 34a_100000741520_100011216529 [0,1,0,1,0,0|1,0,0]=3 6546 B16R1.643 COCCOCCCOC[C@@H]1CNCCO1 34a_100015189573_100011216529 [0,1,0,1,0,0|1,0,0]=3 6547 B16R1.643 COCCOCCCOC[C@@H]1COCCN1 34a_100000717676_100011216529 [0,1,0,1,0,0|1,0,0]=3 6548 B16R1.643 COCCOCCCOC[C@H]1COCCO1 34a_100009875890_100011216529 [0,1,0,1,0,0|0,0,0]=2 6549 B16R1.643 COCCOCCCSCC1CCCCO1 62a_100000211543_100011216529 [0,1,0,1,0,0|1,1,0]=4 6550 B16R1.643 COCCOCCCSCC1CCCCO1 62a_100011216529_100000211543 [0,1,0,1,0,0|1,1,0]=4 6551 B16R1.643 COCCOCCCSCC1CCCOC1 62a_100000741521_100011216529 [0,1,0,1,0,0|1,1,0]=4 6552 B16R1.643 COCCOCCCSCC1CCCOC1 62a_100011216529_100000741521 [0,1,0,1,0,0|1,1,0]=4 6553 B16R1.643 COCCOCCNCCC1CCCCO1 2230a_100015183643_100000695917 [0,1,0,1,0,0|2,0,0]=4 6554 B16R1.643 COCCOCCNCCC1CCCCO1 34a_100015183643_100000695917 [0,1,0,1,0,0|2,0,0]=4 6555 B16R1.643 COCCOCCNCCC1CCOCC1 2230a_100000745349_100011934994 [0,1,0,1,0,0|2,0,0]=4 6556 B16R1.643 COCCOCCNCCC1CCOCC1 2230a_100000755988_100000695917 [0,1,0,1,0,0|2,0,0]=4 6557 B16R1.643 COCCOCCNCCC1CCOCC1 34a_100000745349_100011934994 [0,1,0,1,0,0|2,0,0]=4 6558 B16R1.643 COCCOCCNCCC1CCOCC1 34a_100000755988_100000695917 [0,1,0,1,0,0|2,0,0]=4 6559 B16R1.643 COCCOCCNCCN1CCOCC1 2230a_100000745349_100025781966 [0,1,0,1,0,0|2,0,0]=4 6560 B16R1.643 COCCOCCOCCC1CCCCC1 34a_100011215163_100011209188 [0,1,0,1,0,0|2,0,0]=4 6561 B16R1.643 COCCOCCOCCC1CCCCC1 34a_100011217863_100000695917 [0,1,0,1,0,0|2,0,0]=4 6562 B16R1.643 COCCOCCOCCC1CCCCC1 7a_100011215163_100011273959 [0,1,0,1,0,0|2,0,0]=4 6563 B16R1.643 COCCOCCOCCC1CCCCC1 7a_100011217863_100000695917 [0,1,0,1,0,0|2,0,0]=4 6564 B16R1.643 COCCOCCOCCC1CCCCN1 34a_100000211664_100000695917 [0,1,0,1,0,0|2,0,0]=4 6565 B16R1.643 COCCOCCOCCC1CCCNC1 34a_100000752241_100000695917 [0,1,0,1,0,0|2,0,0]=4 6566 B16R1.643 COCCOCCOCCC1CCNCC1 34a_100015190746_100000695917 [0,1,0,1,0,0|2,0,0]=4 6567 B16R1.643 COCCOCCOCCC1CCOCC1 34a_100011215163_100011934994 [0,1,0,1,0,0|1,0,0]=3 6568 B16R1.643 COCCOCCOCCC1CCOCC1 34a_100011933979_100000695917 [0,1,0,1,0,0|1,0,0]=3 6569 B16R1.643 COCCOCCOCCC1CCOCC1 7a_100011215163_100011934994 [0,1,0,1,0,0|1,0,0]=3 6570 B16R1.643 COCCOCCOCCC1CCOCC1 7a_100011933979_100000695917 [0,1,0,1,0,0|1,0,0]=3 6571 B16R1.643 COCCOCCOCCC1OCCCO1 34a_100011215163_100000764188 [0,1,0,1,0,0|2,0,0]=4 6572 B16R1.643 COCCOCCOCCC1OCCCO1 7a_100011215163_100000764188 [0,1,0,1,0,0|2,0,0]=4 6573 B16R1.643 COCCOCCOCCN1CC=CCC1 2230a_100000698166_100013367474 [0,1,0,1,0,0|2,0,0]=4 6574 B16R1.643 COCCOCCOCCN1CC=CCC1 269982a_100000698166_100013367474 [0,1,0,1,0,0|2,0,0]=4 6575 B16R1.643 COCCOCCOCCN1CC=CCC1 34a_100000698166_100013367474 [0,1,0,1,0,0|2,0,0]=4 6576 B16R1.643 COCCOCCOCCN1CCCCC1 34a_100011215163_100000739454 [0,1,0,1,0,0|2,0,0]=4 6577 B16R1.643 COCCOCCOCCN1CCCCC1 34a_200011409831_100011201679 [0,1,0,1,0,0|2,0,0]=4 6578 B16R1.643 COCCOCCOCCN1CCCCC1 7a_100011215163_100000739454 [0,1,0,1,0,0|2,0,0]=4 6579 B16R1.643 COCCOCCOCCN1CCCCC1 7a_200011409831_100000233755 [0,1,0,1,0,0|2,0,0]=4 6580 B16R1.643 COCCOCCOCCN1CCCOC1 2230a_100000131196_100013367474 [0,1,0,1,0,0|1,0,0]=3 6581 B16R1.643 COCCOCCOCCN1CCCOC1 269982a_100000131196_100013367474 [0,1,0,1,0,0|1,0,0]=3 6582 B16R1.643 COCCOCCOCCN1CCCOC1 34a_100000131196_100013367474 [0,1,0,1,0,0|1,0,0]=3 6583 B16R1.643 COCCOCCOCCN1CCOCC1 2230a_100015191051_100013367474 [0,1,0,1,0,0|1,0,0]=3 6584 B16R1.643 COCCOCCOCCN1CCOCC1 269982a_100015191051_100013367474 [0,1,0,1,0,0|1,0,0]=3 6585 B16R1.643 COCCOCCOCCN1CCOCC1 34a_100011409812_100011201679 [0,1,0,1,0,0|1,0,0]=3 6586 B16R1.643 COCCOCCOCCN1CCOCC1 34a_100015191051_100013367474 [0,1,0,1,0,0|1,0,0]=3 6587 B16R1.643 COCCOCCOCCN1CCOCC1 7a_100011215163_100000211760 [0,1,0,1,0,0|1,0,0]=3 6588 B16R1.643 COCCOCCOCCN1CCSCC1 2230a_100000737611_100013367474 [0,1,0,1,0,0|1,1,0]=4 6589 B16R1.643 COCCOCCOCCN1CCSCC1 269982a_100000737611_100013367474 [0,1,0,1,0,0|1,1,0]=4 6590 B16R1.643 COCCOCCOCCN1CCSCC1 7a_100000686052_100000695917 [0,1,0,1,0,0|1,1,0]=4 6591 B16R1.643 COCCOCCOCC[C@@H]1CNCCN1 34a_100016989929_100000695917 [0,1,0,1,0,0|2,0,0]=4 6592 B16R1.643 COCCOCCOCOC1CCCCC1 34a_100011215163_100011935260 [0,1,0,1,0,0|2,0,0]=4 6593 B16R1.643 COCCOCCOCOC1CCCCC1 7a_100011215163_100011935260 [0,1,0,1,0,0|2,0,0]=4 6594 B16R1.643 COCCOCCSCCC1CCOCC1 62a_100000695917_100011934994 [0,1,0,1,0,0|1,1,0]=4 6595 B16R1.643 COCCOCCSCCC1CCOCC1 62a_100011934994_100000695917 [0,1,0,1,0,0|1,1,0]=4 6596 B16R1.643 COCCOCCSCCN1CCOCC1 62a_100000695917_100000211760 [0,1,0,1,0,0|1,1,0]=4 6597 B16R1.643 CSCCOCCOCCN1CCOCC1 34a_100011409812_100000212216 [0,1,0,1,0,0|1,1,0]=4 6598 B16R1.643 OCCCCCCCOC[C@H]1COCCO1 34a_100009875890_100000760002 [0,1,0,1,0,0|2,0,0]=4 6599 B16R1.1193 CCCCOCCOCCOC1CCCC1 34a_100000738311_100000743108 [0,1,0,1,0,0|2,0,0]=4 6600 B16R1.1193 CCCCOCCOCCOC1CCCC1 34a_100011215186_100000179811 [0,1,0,1,0,0|2,0,0]=4 6601 B16R1.1193 CCCCOCCOCCOC1CCCC1 7a_100000738311_100000743108 [0,1,0,1,0,0|2,0,0]=4 6602 B16R1.1193 CCCCOCCOCCOC1CCCC1 7a_100011215186_100000179811 [0,1,0,1,0,0|2,0,0]=4 6603 B16R1.1193 CCCCOCCOCCOC1CCOC1 34a_100011215186_100000690089 [0,1,0,1,0,0|1,0,0]=3 6604 B16R1.1193 CCCCOCCOCCOC1CCOC1 7a_100011215186_100000731011 [0,1,0,1,0,0|1,0,0]=3 6605 B16R1.1193 CCOCCOCCOCCC1CCCC1 34a_100000210240_100000760354 [0,1,0,1,0,0|2,0,0]=4 6606 B16R1.1193 CCOCCOCCOCCC1CCCC1 34a_100000749090_100011211534 [0,1,0,1,0,0|2,0,0]=4 6607 B16R1.1193 CCOCCOCCOCCC1CCCC1 7a_100000210240_100000760354 [0,1,0,1,0,0|2,0,0]=4 6608 B16R1.1193 CCOCCOCCOCCC1CCCC1 7a_100000749090_100011211534 [0,1,0,1,0,0|2,0,0]=4 6609 B16R1.1193 CCOCCOCCOCCC1CCNC1 34a_100016987287_100011211534 [0,1,0,1,0,0|2,0,0]=4 6610 B16R1.1193 CCOCCOCCOCCC1CCOC1 34a_100011879284_100011211534 [0,1,0,1,0,0|1,0,0]=3 6611 B16R1.1193 CCOCCOCCOCCN1CCCC1 7a_100000210240_100000004467 [0,1,0,1,0,0|2,0,0]=4 6612 B16R1.1193 CNCCOCCOCCOC1CCCC1 34a_200014138305_100000179811 [0,1,0,1,0,0|2,0,0]=4 6613 B16R1.1193 CNCCOCCOCCOC1CCOC1 34a_200014138305_100000690089 [0,1,0,1,0,0|1,0,0]=3 6614 B16R1.1193 COCCCCCCOCCC1CCOC1 34a_100011879284_100011998445 [0,1,0,1,0,0|2,0,0]=4 6615 B16R1.1193 COCCOCCCOCCC1CCCC1 34a_100000749090_100011216529 [0,1,0,1,0,0|2,0,0]=4 6616 B16R1.1193 COCCOCCCOCCC1CCCC1 7a_100000749090_100011216529 [0,1,0,1,0,0|2,0,0]=4 6617 B16R1.1193 COCCOCCCOCCC1CCNC1 34a_100016987287_100011216529 [0,1,0,1,0,0|2,0,0]=4 6618 B16R1.1193 COCCOCCCOCCC1CCOC1 34a_100011879284_100011216529 [0,1,0,1,0,0|1,0,0]=3 6619 B16R1.1193 COCCOCCNCCOC1CCCC1 34a_100000741755_100000695917 [0,1,0,1,0,0|2,0,0]=4 6620 B16R1.1193 COCCOCCOCCCC1CCCC1 34a_100011215163_100011713738 [0,1,0,1,0,0|2,0,0]=4 6621 B16R1.1193 COCCOCCOCCCC1CCCC1 34a_100011215328_100000695917 [0,1,0,1,0,0|2,0,0]=4 6622 B16R1.1193 COCCOCCOCCCC1CCCC1 7a_100011215163_100011713738 [0,1,0,1,0,0|2,0,0]=4 6623 B16R1.1193 COCCOCCOCCCC1CCCC1 7a_100011215328_100000695917 [0,1,0,1,0,0|2,0,0]=4 6624 B16R1.1193 COCCOCCOCCCN1CCCC1 34a_100011215163_100016991639 [0,1,0,1,0,0|2,0,0]=4 6625 B16R1.1193 COCCOCCOCCCN1CCCC1 7a_100011215163_100011445909 [0,1,0,1,0,0|2,0,0]=4 6626 B16R1.1193 COCCOCCOCCNC1CC=CC1 2230a_100015188752_100013367474 [0,1,0,1,0,0|2,0,0]=4 6627 B16R1.1193 COCCOCCOCCNC1CCCC1 2230a_100000211070_100013367474 [0,1,0,1,0,0|2,0,0]=4 6628 B16R1.1193 COCCOCCOCCNC1CCCC1 2230a_100012028300_100000179811 [0,1,0,1,0,0|2,0,0]=4 6629 B16R1.1193 COCCOCCOCCNC1CCCC1 270004a_100012028300_100000210133 [0,1,0,1,0,0|2,0,0]=4 6630 B16R1.1193 COCCOCCOCCNC1CCCC1 34a_100000211070_100013367474 [0,1,0,1,0,0|2,0,0]=4 6631 B16R1.1193 COCCOCCOCCNC1CCCC1 34a_100012028300_100000179811 [0,1,0,1,0,0|2,0,0]=4 6632 B16R1.1193 COCCOCCOCCNC1CCCC1 34a_200000200444_100000695917 [0,1,0,1,0,0|2,0,0]=4 6633 B16R1.1193 COCCOCCOCCNC1CCOC1 2230a_100012028300_100000731011 [0,1,0,1,0,0|1,0,0]=3 6634 B16R1.1193 COCCOCCOCCNC1CCOC1 270004a_100012028300_100000752484 [0,1,0,1,0,0|1,0,0]=3 6635 B16R1.1193 COCCOCCOCCNC1CCOC1 34a_100012028300_100000690089 [0,1,0,1,0,0|1,0,0]=3 6636 B16R1.1193 COCCOCCOCCNC1CCSC1 270004a_100012028300_100000212027 [0,1,0,1,0,0|1,1,0]=4 6637 B16R1.1193 COCCOCCOCCN[C@@H]1CCOC1 2230a_200015188469_100013367474 [0,1,0,1,0,0|1,0,0]=3 6638 B16R1.1193 COCCOCCOCCN[C@H]1CCOC1 2230a_100015188467_100013367474 [0,1,0,1,0,0|1,0,0]=3 6639 B16R1.1193 COCCOCCOCCN[C@H]1CCOC1 34a_100015188467_100013367474 [0,1,0,1,0,0|1,0,0]=3 6640 B16R1.1193 COCCOCCOCCOC1CCCC1 34a_100000210269_100013367474 [0,1,0,1,0,0|1,0,0]=3 6641 B16R1.1193 COCCOCCOCCOC1CCCC1 34a_100000688194_100000179811 [0,1,0,1,0,0|1,0,0]=3 6642 B16R1.1193 COCCOCCOCCOC1CCCC1 34a_100000738311_100000695917 [0,1,0,1,0,0|1,0,0]=3 6643 B16R1.1193 COCCOCCOCCOC1CCCC1 7a_100000210269_100013367474 [0,1,0,1,0,0|1,0,0]=3 6644 B16R1.1193 COCCOCCOCCOC1CCCC1 7a_100000688194_100000179811 [0,1,0,1,0,0|1,0,0]=3 6645 B16R1.1193 COCCOCCOCCOC1CCCC1 7a_100000738311_100000695917 [0,1,0,1,0,0|1,0,0]=3 6646 B16R1.1193 COCCOCCOCCOC1CCCO1 34a_100000085407_100013367474 [0,1,0,1,0,0|1,0,0]=3 6647 B16R1.1193 COCCOCCOCCOC1CCOC1 34a_100000688194_100000690089 [0,1,0,1,0,0|0,0,0]=2 6648 B16R1.1193 COCCOCCOCCOC1CCOC1 7a_100000688194_100000731011 [0,1,0,1,0,0|0,0,0]=2 6649 B16R1.1193 COCCOCCOCCOC1CCSC1 7a_100011232664_100013367474 [0,1,0,1,0,0|0,1,0]=3 6650 B16R1.1193 COCCOCCOCCO[C@H]1CCOC1 34a_100000717292_100013367474 [0,1,0,1,0,0|0,0,0]=2 6651 B16R1.1193 COCCOCCOCCSC1CCCC1 62a_100011217020_100013367474 [0,1,0,1,0,0|1,1,0]=4 6652 B16R1.1193 COCCOCCOCCSC1CCCC1 62a_100013367474_100000179811 [0,1,0,1,0,0|1,1,0]=4 6653 B16R1.1193 COCCOCCOCCSC1CCOC1 62a_100013367474_100000690089 [0,1,0,1,0,0|0,1,0]=3 6654 B16R1.1193 NCCCOCCOCCOC1CCOC1 34a_100011996194_100000690089 [0,1,0,1,0,0|2,0,0]=4 6655 B16R1.1218 CCCCOCCOCC1COCCC1N 34a_214813039666_100000743108 [0,1,0,1,0,0|2,0,0]=4 6656 B16R1.1218 CCCCOCCOCC1COCCN1C 34a_100013547906_100000743108 [0,1,0,1,0,0|2,0,0]=4 6657 B16R1.1218 CCOCCOCCOC1CCCCC1C 34a_100000211207_100011211534 [0,1,0,1,0,0|2,0,0]=4 6658 B16R1.1218 CCOCCOCCOC1CCCCC1C 7a_100000211207_100011211534 [0,1,0,1,0,0|2,0,0]=4 6659 B16R1.1218 CCOCCOCCOC1CNCCC1C 34a_100000696640_100011211534 [0,1,0,1,0,0|2,0,0]=4 6660 B16R1.1218 CCOCCOCCOC1COCCC1=O 34a_100000210240_100012180262 [0,1,0,1,0,0|2,0,0]=4 6661 B16R1.1218 CCOCCOCCOC1COCCC1=O 7a_100000210240_100012180262 [0,1,0,1,0,0|2,0,0]=4 6662 B16R1.1218 CCOCCOCCO[C@H]1COCC[C@H]1N 34a_100016994285_100011211534 [0,1,0,1,0,0|2,0,0]=4 6663 B16R1.1218 COCCOCCCOC1CCCCC1C 34a_100000211207_100011216529 [0,1,0,1,0,0|2,0,0]=4 6664 B16R1.1218 COCCOCCCOC1CCCCC1C 7a_100000211207_100011216529 [0,1,0,1,0,0|2,0,0]=4 6665 B16R1.1218 COCCOCCCOC1CNCCC1C 34a_100000696640_100011216529 [0,1,0,1,0,0|2,0,0]=4 6666 B16R1.1218 COCCOCCCO[C@H]1COCC[C@H]1N 34a_100016994285_100011216529 [0,1,0,1,0,0|2,0,0]=4 6667 B16R1.1218 COCCOCCOCC1CCCCC1=O 34a_100009861125_100000695917 [0,1,0,1,0,0|2,0,0]=4 6668 B16R1.1218 COCCOCCOCC1CCCCC1=O 7a_100009861125_100000695917 [0,1,0,1,0,0|2,0,0]=4 6669 B16R1.1218 COCCOCCOCC1CCCCN1C 34a_100000225079_100000695917 [0,1,0,1,0,0|2,0,0]=4 6670 B16R1.1218 COCCOCCOCC1CCCCN1C 34a_100011215163_100015186950 [0,1,0,1,0,0|2,0,0]=4 6671 B16R1.1218 COCCOCCOCC1CCCCN1C 7a_100011215163_100015185383 [0,1,0,1,0,0|2,0,0]=4 6672 B16R1.1218 COCCOCCOCC1COCCC1N 34a_214813039666_100000695917 [0,1,0,1,0,0|1,0,0]=3 6673 B16R1.1218 COCCOCCOCC1COCCN1C 34a_100013547906_100000695917 [0,1,0,1,0,0|1,0,0]=3 6674 B16R1.1219 CCN1CCC[C@@H]1COCCOCCOC 34a_100011739246_100000695917 [0,1,0,1,0,0|2,0,0]=4 6675 B16R1.1219 CCN1CCC[C@@H]1COCCOCCOC 7a_100011739246_100000695917 [0,1,0,1,0,0|2,0,0]=4 6676 B16R1.1418 CCC1CCCCC1OCCOCCOC 34a_100000210738_100000695917 [0,1,0,1,0,0|2,0,0]=4 6677 B16R1.1418 CCC1CCCCC1OCCOCCOC 7a_100000210738_100000695917 [0,1,0,1,0,0|2,0,0]=4 6678 B16R1.1418 CCCCOCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000743108 [0,1,0,1,0,0|2,0,0]=4 6679 B16R1.1418 CCCCOCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000743108 [0,1,0,1,0,0|2,0,0]=4 6680 B16R1.1418 CCOCCOCCN1CCOC[C@@H]1CC 2230a_100016988097_100011211534 [0,1,0,1,0,0|2,0,0]=4 6681 B16R1.1418 CCOCCOCCN1CCOC[C@@H]1CC 269982a_100016988097_100011211534 [0,1,0,1,0,0|2,0,0]=4 6682 B16R1.1418 CCOCCOCCN1CCOC[C@@H]1CC 34a_100016988097_100011211534 [0,1,0,1,0,0|2,0,0]=4 6683 B16R1.1418 CC[C@H]1COCCN1CCCOCCOC 2230a_100016988097_100011216529 [0,1,0,1,0,0|2,0,0]=4 6684 B16R1.1418 CC[C@H]1COCCN1CCCOCCOC 269982a_100016988097_100011216529 [0,1,0,1,0,0|2,0,0]=4 6685 B16R1.1418 CC[C@H]1COCCN1CCCOCCOC 34a_100016988097_100011216529 [0,1,0,1,0,0|2,0,0]=4 6686 B16R1.1418 CN[C@@H]1CCCC[C@H]1OCCOCCOC 34a_100000708425_100000695917 [0,1,0,1,0,0|2,0,0]=4 6687 B16R1.1418 COCCCCCNC1CCOCC1OC 270004a_100000747528_100000095984 [0,1,0,1,0,0|2,0,0]=4 6688 B16R1.1418 COCCOCCNC1CCCCC1OC 270004a_100000745349_100000740605 [0,1,0,1,0,0|2,0,0]=4 6689 B16R1.1418 COCCOCCNC1CCCCC1OC 34a_100011208099_100000695917 [0,1,0,1,0,0|2,0,0]=4 6690 B16R1.1418 COCCOCCNC1CCOCC1OC 270004a_100000745349_100000095984 [0,1,0,1,0,0|1,0,0]=3 6691 B16R1.1418 COCCOCCOC1CCCCC1CN 34a_100011216029_100000695917 [0,1,0,1,0,0|2,0,0]=4 6692 B16R1.1418 COCCOCCO[C@H]1CCCC[C@@H]1OC 34a_200009815850_100000695917 [0,1,0,1,0,0|1,0,0]=3 6693 B16R1.1418 COCCOCCO[C@H]1CCCC[C@@H]1OC 7a_200009815850_100000695917 [0,1,0,1,0,0|1,0,0]=3 6694 B16R1.3890 COCCOCCOCCOCC1CC1C 34a_100000744939_100013367474 [0,1,0,1,0,0|1,0,0]=3 6695 B16R1.3890 COCCOCCOCCOCC1CC1C 7a_100000744939_100013367474 [0,1,0,1,0,0|1,0,0]=3 6696 B16R1.3891 CCCCOCCOCCOCC1CCC1 34a_100011215186_100000763275 [0,1,0,1,0,0|2,0,0]=4 6697 B16R1.3891 CCCCOCCOCCOCC1CCC1 7a_100011215186_100000763275 [0,1,0,1,0,0|2,0,0]=4 6698 B16R1.3891 CCCCOCCOCCOCC1CCO1 34a_100011215186_100000103362 [0,1,0,1,0,0|1,0,0]=3 6699 B16R1.3891 CCCCOCCOCCOCC1CCO1 7a_100011215186_100000103362 [0,1,0,1,0,0|1,0,0]=3 6700 B16R1.3891 CCCCOCCOCCOCC1COC1 34a_100011215186_100010264016 [0,1,0,1,0,0|1,0,0]=3 6701 B16R1.3891 CCCCOCCOCCOCC1COC1 7a_100011215186_100010264016 [0,1,0,1,0,0|1,0,0]=3 6702 B16R1.3891 CCOCCOCCOCCNC1CCC1 270004a_100012282185_100000241760 [0,1,0,1,0,0|2,0,0]=4 6703 B16R1.3891 CCOCCOCCOCCNC1CCC1 34a_100012282185_100000749161 [0,1,0,1,0,0|2,0,0]=4 6704 B16R1.3891 CCOCCOCCOCCNC1COC1 34a_100012282185_100009818527 [0,1,0,1,0,0|1,0,0]=3 6705 B16R1.3891 CCOCCOCCOCCOC1CCC1 34a_100000033264_100000749161 [0,1,0,1,0,0|1,0,0]=3 6706 B16R1.3891 CCOCCOCCOCCOC1COC1 34a_100000033264_100009818527 [0,1,0,1,0,0|0,0,0]=2 6707 B16R1.3891 CCOCCOCCOCCOC1COC1 7a_100000033264_100009818527 [0,1,0,1,0,0|0,0,0]=2 6708 B16R1.3891 CNCCOCCOCCOCC1CCC1 34a_200014138305_100000763275 [0,1,0,1,0,0|2,0,0]=4 6709 B16R1.3891 CNCCOCCOCCOCC1CCO1 34a_200014138305_100000103362 [0,1,0,1,0,0|1,0,0]=3 6710 B16R1.3891 CNCCOCCOCCOCC1COC1 34a_200014138305_100010264016 [0,1,0,1,0,0|1,0,0]=3 6711 B16R1.3891 COCCOCCOCCNCC1CCC1 2230a_100000738700_100013367474 [0,1,0,1,0,0|2,0,0]=4 6712 B16R1.3891 COCCOCCOCCNCC1CCC1 2230a_100012028300_100000763275 [0,1,0,1,0,0|2,0,0]=4 6713 B16R1.3891 COCCOCCOCCNCC1CCC1 269862a_100012028300_100000753134 [0,1,0,1,0,0|2,0,0]=4 6714 B16R1.3891 COCCOCCOCCNCC1CCC1 34a_100000738700_100013367474 [0,1,0,1,0,0|2,0,0]=4 6715 B16R1.3891 COCCOCCOCCNCC1CCC1 34a_100012028300_100000763275 [0,1,0,1,0,0|2,0,0]=4 6716 B16R1.3891 COCCOCCOCCNCC1CCO1 2230a_100012028300_100000103362 [0,1,0,1,0,0|1,0,0]=3 6717 B16R1.3891 COCCOCCOCCNCC1CCO1 34a_100012028300_100000103362 [0,1,0,1,0,0|1,0,0]=3 6718 B16R1.3891 COCCOCCOCCNCC1COC1 2230a_100012028300_100010264016 [0,1,0,1,0,0|1,0,0]=3 6719 B16R1.3891 COCCOCCOCCNCC1COC1 2230a_100015281925_100013367474 [0,1,0,1,0,0|1,0,0]=3 6720 B16R1.3891 COCCOCCOCCNCC1COC1 34a_100012028300_100010264016 [0,1,0,1,0,0|1,0,0]=3 6721 B16R1.3891 COCCOCCOCCNCC1COC1 34a_100015281925_100013367474 [0,1,0,1,0,0|1,0,0]=3 6722 B16R1.3891 COCCOCCOCCNC[C@@H]1CCO1 2230a_100020831831_100013367474 [0,1,0,1,0,0|1,0,0]=3 6723 B16R1.3891 COCCOCCOCCNC[C@@H]1CCO1 34a_100020831831_100013367474 [0,1,0,1,0,0|1,0,0]=3 6724 B16R1.3891 COCCOCCOCCOCC1CCC1 34a_100000688194_100000763275 [0,1,0,1,0,0|1,0,0]=3 6725 B16R1.3891 COCCOCCOCCOCC1CCC1 34a_100000760304_100013367474 [0,1,0,1,0,0|1,0,0]=3 6726 B16R1.3891 COCCOCCOCCOCC1CCC1 7a_100000688194_100000763275 [0,1,0,1,0,0|1,0,0]=3 6727 B16R1.3891 COCCOCCOCCOCC1CCO1 34a_100000039022_100013367474 [0,1,0,1,0,0|0,0,0]=2 6728 B16R1.3891 COCCOCCOCCOCC1CCO1 34a_100000688194_100000103362 [0,1,0,1,0,0|0,0,0]=2 6729 B16R1.3891 COCCOCCOCCOCC1CCO1 7a_100000688194_100000103362 [0,1,0,1,0,0|0,0,0]=2 6730 B16R1.3891 COCCOCCOCCOCC1CNC1 34a_100016987283_100013367474 [0,1,0,1,0,0|1,0,0]=3 6731 B16R1.3891 COCCOCCOCCOCC1COC1 34a_100000060846_100013367474 [0,1,0,1,0,0|0,0,0]=2 6732 B16R1.3891 COCCOCCOCCOCC1COC1 34a_100000688194_100010264016 [0,1,0,1,0,0|0,0,0]=2 6733 B16R1.3891 COCCOCCOCCOCC1COC1 7a_100000688194_100010264016 [0,1,0,1,0,0|0,0,0]=2 6734 B16R1.3891 COCCOCCOCCSCC1CCC1 62a_100000763275_100013367474 [0,1,0,1,0,0|1,1,0]=4 6735 B16R1.3891 COCCOCCOCCSCC1CCC1 62a_100013367474_100000763275 [0,1,0,1,0,0|1,1,0]=4 6736 B16R1.3891 COCCOCCOCCSCC1CCO1 62a_100000103362_100013367474 [0,1,0,1,0,0|0,1,0]=3 6737 B16R1.3891 COCCOCCOCCSCC1CCO1 62a_100013367474_100000103362 [0,1,0,1,0,0|0,1,0]=3 6738 B16R1.3891 COCCOCCOCCSCC1COC1 62a_100010264016_100013367474 [0,1,0,1,0,0|0,1,0]=3 6739 B16R1.3891 COCCOCCOCCSCC1COC1 62a_100013367474_100010264016 [0,1,0,1,0,0|0,1,0]=3 6740 B16R1.3891 NCCCOCCOCCOCC1CCO1 34a_100011996194_100000103362 [0,1,0,1,0,0|2,0,0]=4 6741 B16R1.3891 NCCCOCCOCCOCC1COC1 34a_100011996194_100010264016 [0,1,0,1,0,0|2,0,0]=4 6742 B16R1.6680 CCOCCOCCOCC1CCCN1C 34a_100000743107_100011211534 [0,1,0,1,0,0|2,0,0]=4 6743 B16R1.6680 COCCOCCCOCC1CCCN1C 34a_100000743107_100011216529 [0,1,0,1,0,0|2,0,0]=4 6744 B16R1.6680 COCCOCCOCCC1CCCN1C 34a_100011215163_100000005710 [0,1,0,1,0,0|2,0,0]=4 6745 B16R1.6680 COCCOCCOCCC1CCCN1C 34a_100011215177_100000695917 [0,1,0,1,0,0|2,0,0]=4 6746 B16R1.6680 COCCOCCOCCC1CCCN1C 7a_100011215163_100000005710 [0,1,0,1,0,0|2,0,0]=4 6747 B16R1.6680 COCCOCCOCCC1CCCN1C 7a_100011215177_100000695917 [0,1,0,1,0,0|2,0,0]=4 6748 B16R1.6680 COCCOCCOCCN1CCC[C@@H]1C 2230a_100020605311_100013367474 [0,1,0,1,0,0|2,0,0]=4 6749 B16R1.6680 COCCOCCOCCN1CCC[C@@H]1C 269982a_100020605311_100013367474 [0,1,0,1,0,0|2,0,0]=4 6750 B16R1.6680 COCCOCCOCCN1CCC[C@H]1C 2230a_100015189458_100013367474 [0,1,0,1,0,0|2,0,0]=4 6751 B16R1.6680 COCCOCCOCCN1CCC[C@H]1C 269982a_100015189458_100013367474 [0,1,0,1,0,0|2,0,0]=4 6752 B16R1.6680 COCCOCCOCCN1CCC[C@H]1C 34a_100015189458_100013367474 [0,1,0,1,0,0|2,0,0]=4 6753 B16R1.6680 COCCOCCOCCN1CCSC1C 2230a_200011216479_100013367474 [0,1,0,1,0,0|1,1,0]=4 6754 B16R1.6680 COCCOCCOCCN1CCSC1C 269982a_200011216479_100013367474 [0,1,0,1,0,0|1,1,0]=4 6755 B16R1.6680 COCCOCCOCCN1CCSC1C 34a_200011216479_100013367474 [0,1,0,1,0,0|1,1,0]=4 6756 B16R1.6688 COCCOCCOCCOC1CCC1=O 34a_100000688194_100009892977 [0,1,0,1,0,0|1,0,1]=4 6757 B16R1.6688 COCCOCCOCCOC1CCC1=O 7a_100000688194_100009892977 [0,1,0,1,0,0|1,0,1]=4 6758 B16R1.7352 CCCCN1CCOCCOCCOCC1 2230a_100000032966_100000210211 [0,1,0,1,0,0|2,0,0]=4 6759 B16R1.7352 CCCCN1CCOCCOCCOCC1 269982a_100000032966_100000210211 [0,1,0,1,0,0|2,0,0]=4 6760 B16R1.7352 CCCCN1CCOCCOCCOCC1 34a_100000032966_100000210210 [0,1,0,1,0,0|2,0,0]=4 6761 B16R1.7352 COCCN1CCOCCOCCOCC1 2230a_100000032966_100011201679 [0,1,0,1,0,0|1,0,0]=3 6762 B16R1.7352 COCCN1CCOCCOCCOCC1 269982a_100000032966_100000233755 [0,1,0,1,0,0|1,0,0]=3 6763 B16R1.7352 COCCN1CCOCCOCCOCC1 34a_100000032966_100011201679 [0,1,0,1,0,0|1,0,0]=3 6764 B16R1.7352 CSCCN1CCOCCOCCOCC1 2230a_100000032966_100000751147 [0,1,0,1,0,0|1,1,0]=4 6765 B16R1.7352 CSCCN1CCOCCOCCOCC1 269982a_100000032966_100000212216 [0,1,0,1,0,0|1,1,0]=4 6766 B16R1.7352 CSCCN1CCOCCOCCOCC1 34a_100000032966_100000212216 [0,1,0,1,0,0|1,1,0]=4 6767 B16R1.8376 CCOCCOCCN1CCC[C@H]1COC 2230a_100020646714_100011211534 [0,1,0,1,0,0|2,0,0]=4 6768 B16R1.8376 CCOCCOCCN1CCC[C@H]1COC 269982a_100020646714_100011211534 [0,1,0,1,0,0|2,0,0]=4 6769 B16R1.8376 CCOCCOCCN1CCC[C@H]1COC 34a_100020646714_100011211534 [0,1,0,1,0,0|2,0,0]=4 6770 B16R1.8376 COCCOCCCN1CCC[C@H]1COC 2230a_100020646714_100011216529 [0,1,0,1,0,0|2,0,0]=4 6771 B16R1.8376 COCCOCCCN1CCC[C@H]1COC 269982a_100020646714_100011216529 [0,1,0,1,0,0|2,0,0]=4 6772 B16R1.8376 COCCOCCCN1CCC[C@H]1COC 34a_100020646714_100011216529 [0,1,0,1,0,0|2,0,0]=4 6773 B16R1.8379 COCCOCCOC1CCCCCCC1 34a_100000210054_100000695917 [0,1,0,1,0,0|2,0,0]=4 6774 B16R1.8379 COCCOCCOC1CCCCCCC1 7a_100000210054_100000695917 [0,1,0,1,0,0|2,0,0]=4 6775 B16R1.8816 CN1CCOCCOCCOCCOCC1 2230a_100000037297_200000210301 [0,1,0,1,0,0|1,0,0]=3 6776 B16R1.8816 CN1CCOCCOCCOCCOCC1 269982a_100000037297_200000210301 [0,1,0,1,0,0|1,0,0]=3 6777 B16R1.8816 CN1CCOCCOCCOCCOCC1 34a_100000037297_200000210301 [0,1,0,1,0,0|1,0,0]=3 6778 B16R1.8816 [13CH3]N1CCOCCOCCOCCOCC1 2230a_100000037297_200025704644 [0,1,0,1,0,0|1,0,0]=3 6779 B16R1.8816 [13CH3]N1CCOCCOCCOCCOCC1 269982a_100000037297_200025704644 [0,1,0,1,0,0|1,0,0]=3 6780 B16R1.8816 [13CH3]N1CCOCCOCCOCCOCC1 34a_100000037297_200025704644 [0,1,0,1,0,0|1,0,0]=3 6781 B16R1.17455 CCCCOCCOCCOCCC1CC1 34a_100011215186_100000694398 [0,1,0,1,0,0|2,0,0]=4 6782 B16R1.17455 CCCCOCCOCCOCCC1CC1 7a_100011215186_100000764125 [0,1,0,1,0,0|2,0,0]=4 6783 B16R1.17455 CCCCOCCOCCOCCC1CO1 34a_100011215186_100000732470 [0,1,0,1,0,0|1,0,0]=3 6784 B16R1.17455 CCCCOCCOCCOCCC1CO1 7a_100011215186_100000732470 [0,1,0,1,0,0|1,0,0]=3 6785 B16R1.17455 CCCCOCOCCCCOCC1CO1 34a_100010889290_100011995733 [0,1,0,1,0,0|2,0,0]=4 6786 B16R1.17455 CCOCCOCCOCCNCC1CC1 2230a_100012282185_100000742324 [0,1,0,1,0,0|2,0,0]=4 6787 B16R1.17455 CCOCCOCCOCCNCC1CC1 269862a_100012282185_100000741477 [0,1,0,1,0,0|2,0,0]=4 6788 B16R1.17455 CCOCCOCCOCCNCC1CC1 34a_100012282185_100000742324 [0,1,0,1,0,0|2,0,0]=4 6789 B16R1.17455 CCOCCOCCOCCNCC1CO1 2230a_100012282185_100011216344 [0,1,0,1,0,0|1,0,0]=3 6790 B16R1.17455 CCOCCOCCOCCNCC1CO1 34a_100012282185_102125554688 [0,1,0,1,0,0|1,0,0]=3 6791 B16R1.17455 CCOCCOCCOCCOCC1CC1 34a_100000033264_100000742324 [0,1,0,1,0,0|1,0,0]=3 6792 B16R1.17455 CCOCCOCCOCCOCC1CC1 7a_100000033264_100000742324 [0,1,0,1,0,0|1,0,0]=3 6793 B16R1.17455 CCOCCOCCOCCOCC1CO1 34a_100000033264_102125554688 [0,1,0,1,0,0|0,0,0]=2 6794 B16R1.17455 CCOCCOCCOCCOCC1CO1 7a_100000033264_102125554688 [0,1,0,1,0,0|0,0,0]=2 6795 B16R1.17455 CCOCCOCCOCCOCC1CS1 7a_100000033264_100000031435 [0,1,0,1,0,0|0,1,0]=3 6796 B16R1.17455 CCOCCOCCOCCOC[C@@H]1CO1 7a_100000033264_100000745022 [0,1,0,1,0,0|0,0,0]=2 6797 B16R1.17455 CNCCOCCOCCOCCC1CC1 34a_200014138305_100000694398 [0,1,0,1,0,0|2,0,0]=4 6798 B16R1.17455 CNCCOCCOCCOCCC1CO1 34a_200014138305_100000732470 [0,1,0,1,0,0|1,0,0]=3 6799 B16R1.17455 COCCCCOCCCCOCC1CO1 34a_100010889290_100000755781 [0,1,0,1,0,0|2,0,0]=4 6800 B16R1.17455 COCCCCOCCCCOCC1CO1 7a_100010889290_100000730899 [0,1,0,1,0,0|2,0,0]=4 6801 B16R1.17455 COCCOCCOCCNCCC1CC1 2230a_100012028300_100000694398 [0,1,0,1,0,0|2,0,0]=4 6802 B16R1.17455 COCCOCCOCCNCCC1CC1 34a_100000764129_100013367474 [0,1,0,1,0,0|2,0,0]=4 6803 B16R1.17455 COCCOCCOCCNCCC1CC1 34a_100012028300_100000694398 [0,1,0,1,0,0|2,0,0]=4 6804 B16R1.17455 COCCOCCOCCNCCC1CO1 2230a_100012028300_100000732470 [0,1,0,1,0,0|1,0,0]=3 6805 B16R1.17455 COCCOCCOCCNCCC1CO1 34a_100012028300_100000732470 [0,1,0,1,0,0|1,0,0]=3 6806 B16R1.17455 COCCOCCOCCOCCC1CC1 34a_100000688194_100000694398 [0,1,0,1,0,0|1,0,0]=3 6807 B16R1.17455 COCCOCCOCCOCCC1CC1 34a_100000754188_100013367474 [0,1,0,1,0,0|1,0,0]=3 6808 B16R1.17455 COCCOCCOCCOCCC1CC1 7a_100000688194_100000764125 [0,1,0,1,0,0|1,0,0]=3 6809 B16R1.17455 COCCOCCOCCOCCC1CC1 7a_100000754188_100013367474 [0,1,0,1,0,0|1,0,0]=3 6810 B16R1.17455 COCCOCCOCCOCCC1CO1 34a_100000688194_100000732470 [0,1,0,1,0,0|0,0,0]=2 6811 B16R1.17455 COCCOCCOCCOCCC1CO1 7a_100000688194_100000732470 [0,1,0,1,0,0|0,0,0]=2 6812 B16R1.17455 COCCOCCOCCOCC[C@@H]1CO1 34a_100009820653_100013367474 [0,1,0,1,0,0|0,0,0]=2 6813 B16R1.17455 COCCOCCOCCSCCC1CC1 62a_100000764125_100013367474 [0,1,0,1,0,0|1,1,0]=4 6814 B16R1.17455 COCCOCCOCCSCCC1CC1 62a_100013367474_100000764125 [0,1,0,1,0,0|1,1,0]=4 6815 B16R1.17455 COCCOCCOCCSCCC1CO1 62a_100000732470_100013367474 [0,1,0,1,0,0|0,1,0]=3 6816 B16R1.17455 COCCOCCOCCSCCC1CO1 62a_100013367474_100000732470 [0,1,0,1,0,0|0,1,0]=3 6817 B16R1.17455 NCCCOCCOCCOCCC1CO1 34a_100011996194_100000732470 [0,1,0,1,0,0|2,0,0]=4 6818 B16R1.17455 [N-]=[N+]=NCCOCCOCCOC[C@@H]1CO1 34a_100000757423_100010820720 [0,1,0,1,0,0|2,0,0]=4 6819 B16R1.17539 CCCCOCCOCC1CNCCOC1 34a_100103147999_100000743108 [0,1,0,1,0,0|2,0,0]=4 6820 B16R1.17539 CCOCCOCCOC1CCCCCC1 34a_100000210240_100011217769 [0,1,0,1,0,0|2,0,0]=4 6821 B16R1.17539 CCOCCOCCOC1CCCCCC1 34a_100000210887_100011211534 [0,1,0,1,0,0|2,0,0]=4 6822 B16R1.17539 CCOCCOCCOC1CCCCCC1 7a_100000210887_100011211534 [0,1,0,1,0,0|2,0,0]=4 6823 B16R1.17539 COCCOCCCOC1CCCCCC1 34a_100000210887_100011216529 [0,1,0,1,0,0|2,0,0]=4 6824 B16R1.17539 COCCOCCCOC1CCCCCC1 7a_100000210887_100011216529 [0,1,0,1,0,0|2,0,0]=4 6825 B16R1.17539 COCCOCCOCC1CCCCCC1 34a_100000699130_100000695917 [0,1,0,1,0,0|2,0,0]=4 6826 B16R1.17539 COCCOCCOCC1CCCCCC1 34a_100011215163_200000696569 [0,1,0,1,0,0|2,0,0]=4 6827 B16R1.17539 COCCOCCOCC1CCCCCC1 7a_100000699130_100000695917 [0,1,0,1,0,0|2,0,0]=4 6828 B16R1.17539 COCCOCCOCC1CCCCCC1 7a_100011215163_200000696569 [0,1,0,1,0,0|2,0,0]=4 6829 B16R1.17539 COCCOCCOCC1CNCCOC1 34a_100103147999_100000695917 [0,1,0,1,0,0|1,0,0]=3 6830 B16R1.20288 CCCC1COCCN1CCOCCOC 2230a_102495339903_100000695917 [0,1,0,1,0,0|2,0,0]=4 6831 B16R1.20288 CCCC1COCCN1CCOCCOC 269982a_102495339903_100000695917 [0,1,0,1,0,0|2,0,0]=4 6832 B16R1.20288 CCCC1COCCN1CCOCCOC 34a_102495339903_100000695917 [0,1,0,1,0,0|2,0,0]=4 6833 B16R1.20288 CCCCOCCN1CCOC[C@@H]1COC 2230a_100016989928_100000743108 [0,1,0,1,0,0|2,0,0]=4 6834 B16R1.20288 CCCCOCCN1CCOC[C@@H]1COC 269982a_100016989928_100000743108 [0,1,0,1,0,0|2,0,0]=4 6835 B16R1.20288 CCCCOCCN1CCOC[C@@H]1COC 34a_100016989928_100000743108 [0,1,0,1,0,0|2,0,0]=4 6836 B16R1.20288 COCCOCCN1CCCCC1COC 2230a_100015184032_100000695917 [0,1,0,1,0,0|2,0,0]=4 6837 B16R1.20288 COCCOCCN1CCCCC1COC 269982a_100015184032_100000695917 [0,1,0,1,0,0|2,0,0]=4 6838 B16R1.20288 COCCOCCN1CCCCC1COC 34a_100015184032_100000695917 [0,1,0,1,0,0|2,0,0]=4 6839 B16R1.20288 COCCOCCN1CCOC[C@@H]1COC 2230a_100016989928_100000695917 [0,1,0,1,0,0|1,0,0]=3 6840 B16R1.20288 COCCOCCN1CCOC[C@@H]1COC 269982a_100016989928_100000695917 [0,1,0,1,0,0|1,0,0]=3 6841 B16R1.20288 COCCOCCN1CCOC[C@@H]1COC 34a_100016989928_100000695917 [0,1,0,1,0,0|1,0,0]=3 6842 B16R1.6 COCCOCCOCC1CCC(CC1)C 34a_100000701341_100000695917 [0,1,0,1,0,0|2,0,0]=4 6843 B16R1.6 COCCOCCOC[C@@H]1CN[C@H](CN1)C 34a_100160570299_100000695917 [0,1,0,1,0,0|2,0,0]=4 6844 B16R1.6 COCCOCCOC[C@H]1CC[C@@H](CC1)N 34a_100009821084_100000695917 [0,1,0,1,0,0|2,0,0]=4 6845 B16R1.75 COCCOCCOC1CCCC(C1C)C 34a_100011217532_100000695917 [0,1,0,1,0,0|2,0,0]=4 6846 B16R1.75 COCCOCCOC1CCCC(C1C)C 7a_100011217532_100000695917 [0,1,0,1,0,0|2,0,0]=4 6847 B16R1.642 COCCOCCOCCN1CCC(C1)O 2230a_100011215560_100013367474 [0,1,0,1,0,0|2,0,0]=4 6848 B16R1.642 COCCOCCOCCN1CCC(C1)O 269982a_100011215560_100013367474 [0,1,0,1,0,0|2,0,0]=4 6849 B16R1.642 COCCOCCOCCN1CC[C@@H](C1)F 2230a_100015203821_100013367474 [0,1,0,1,0,0|2,0,0]=4 6850 B16R1.642 COCCOCCOCCN1CC[C@@H](C1)F 269982a_100015203821_100013367474 [0,1,0,1,0,0|2,0,0]=4 6851 B16R1.642 COCCOCCOCCN1CC[C@@H](C1)F 34a_100015203821_100013367474 [0,1,0,1,0,0|2,0,0]=4 6852 B16R1.642 COCCOCCOCCN1CC[C@H](C1)C 2230a_100016987628_100013367474 [0,1,0,1,0,0|2,0,0]=4 6853 B16R1.642 COCCOCCOCCN1CC[C@H](C1)C 269982a_100016987628_100013367474 [0,1,0,1,0,0|2,0,0]=4 6854 B16R1.642 COCCOCCOCCN1CC[C@H](C1)C 34a_100016987628_100013367474 [0,1,0,1,0,0|2,0,0]=4 6855 B16R1.1095 COC(=O)COCCOCCC1CCOC1 34a_100011879284_100000090808 [0,1,0,1,0,0|1,0,1]=4 6856 B16R1.1166 COC(=O)CCCCOC[C@H]1COCCO1 34a_100009875890_100000204269 [0,1,0,1,0,0|1,0,1]=4 6857 B16R1.1166 COC(=O)COCCNC[C@H]1COCCO1 2230a_100010981119_100000090808 [0,1,0,1,0,0|1,0,1]=4 6858 B16R1.1166 COC(=O)COCCNC[C@H]1COCCO1 34a_100010981119_100000090808 [0,1,0,1,0,0|1,0,1]=4 6859 B16R1.1166 COC(=O)COCCOCC1CCCCO1 34a_100000211370_100000090808 [0,1,0,1,0,0|1,0,1]=4 6860 B16R1.1166 COC(=O)COCCOCC1CCCCO1 7a_100000211370_100000090808 [0,1,0,1,0,0|1,0,1]=4 6861 B16R1.1166 COC(=O)COCCOCC1CCCOC1 34a_100000741520_100000090808 [0,1,0,1,0,0|1,0,1]=4 6862 B16R1.1166 COC(=O)COCCOC[C@@H]1CNCCO1 34a_100015189573_100000090808 [0,1,0,1,0,0|1,0,1]=4 6863 B16R1.1166 COC(=O)COCCOC[C@@H]1COCCN1 34a_100000717676_100000090808 [0,1,0,1,0,0|1,0,1]=4 6864 B16R1.1166 COC(=O)COCCOC[C@H]1COCCO1 34a_100009875890_100000090808 [0,1,0,1,0,0|0,0,1]=3 6865 B16R1.3258 COC(=O)COCCOCCOC1CCC1 34a_100011023656_100000749161 [0,1,0,1,0,0|1,0,1]=4 6866 B16R1.3258 COC(=O)COCCOCCOC1COC1 34a_100011023656_100009818527 [0,1,0,1,0,0|0,0,1]=3 6867 B16R1.3258 COC(=O)COCCOCCOC1COC1 7a_100011023656_100009818527 [0,1,0,1,0,0|0,0,1]=3 6868 B16R1.16747 COC(=O)COCCOCCOCC1CC1 34a_100011023656_100000742324 [0,1,0,1,0,0|1,0,1]=4 6869 B16R1.16747 COC(=O)COCCOCCOCC1CC1 7a_100011023656_100000742324 [0,1,0,1,0,0|1,0,1]=4 6870 B16R1.16747 COC(=O)COCCOCCOCC1CO1 34a_100011023656_102125554688 [0,1,0,1,0,0|0,0,1]=3 6871 B16R1.16747 COC(=O)COCCOCCOCC1CO1 7a_100011023656_102125554688 [0,1,0,1,0,0|0,0,1]=3 6872 B16R1.16747 COC(=O)COCCOCCOCC1CS1 7a_100011023656_100000031435 [0,1,0,1,0,0|0,1,1]=4 6873 B16R1.16747 COC(=O)COCCOCCOC[C@@H]1CO1 7a_100011023656_100000745022 [0,1,0,1,0,0|0,0,1]=3 6874 B16R1.20277 CC1(CO1)COCCOCCOCCCN 34a_100011996194_100000760498 [0,1,0,1,0,0|2,0,0]=4 6875 B16R1.20277 CCCCOCCOCCOCC1(CO1)C 34a_100011215186_100000760498 [0,1,0,1,0,0|1,0,0]=3 6876 B16R1.20277 CNCCOCCOCCOCC1(CO1)C 34a_200014138305_100000760498 [0,1,0,1,0,0|1,0,0]=3 6877 B16R1.20277 COCCOCCOCCNCC1(CC1)C 2230a_100000766693_100013367474 [0,1,0,1,0,0|2,0,0]=4 6878 B16R1.20277 COCCOCCOCCNCC1(CC1)O 2230a_100011936951_100013367474 [0,1,0,1,0,0|2,0,0]=4 6879 B16R1.20277 COCCOCCOCCNCC1(CO1)C 34a_100012028300_100000760498 [0,1,0,1,0,0|1,0,0]=3 6880 B16R1.20277 COCCOCCOCCOCC1(CC1)C 7a_100000698024_100013367474 [0,1,0,1,0,0|1,0,0]=3 6881 B16R1.20277 COCCOCCOCCOCC1(CC1)F 34a_200000703853_100013367474 [0,1,0,1,0,0|1,0,0]=3 6882 B16R1.20277 COCCOCCOCCOCC1(CC1)F 7a_200000703853_100013367474 [0,1,0,1,0,0|1,0,0]=3 6883 B16R1.20277 COCCOCCOCCOCC1(CO1)C 34a_100000688194_100000760498 [0,1,0,1,0,0|0,0,0]=2 6884 B16R1.20277 COCCOCCOCCSCC1(CO1)C 62a_100000760498_100013367474 [0,1,0,1,0,0|0,1,0]=3 6885 B16R1.20277 COCCOCCOCCSCC1(CO1)C 62a_100013367474_100000760498 [0,1,0,1,0,0|0,1,0]=3 6886 B16R1.20336 CCC1CN(C1)CCOCCOCCOC 2230a_100015205115_100013367474 [0,1,0,1,0,0|2,0,0]=4 6887 B16R1.20336 CCC1CN(C1)CCOCCOCCOC 269982a_100015205115_100013367474 [0,1,0,1,0,0|2,0,0]=4 6888 B16R1.20336 COCCOCCOCCN1CC(C1)OC 269982a_100000755009_100013367474 [0,1,0,1,0,0|1,0,0]=3 6889 B16R1.20336 COCCOCCOCCN1CC(C1)SC 269982a_100016990038_100013367474 [0,1,0,1,0,0|1,1,0]=4 6890 B16R1.20496 CCC1CCCC(C1)OCCOCCOC 7a_100011985506_100000695917 [0,1,0,1,0,0|2,0,0]=4 6891 B16R1.36993 COCCOCCOCCN1C[C@@H]([C@@H]1C)O 2230a_206633788156_100013367474 [0,1,0,1,0,0|2,0,0]=4 6892 B16R1.36993 COCCOCCOCCN1C[C@@H]([C@@H]1C)O 269982a_206633788156_100013367474 [0,1,0,1,0,0|2,0,0]=4 6893 B16R1.693 CCCCOCCN(C)CC1COCCO1 2230a_100011398995_100000743108 [0,1,0,1,0,0|2,0,0]=4 6894 B16R1.693 CCCCOCCN(C)CC1COCCO1 269982a_100011398995_100000743108 [0,1,0,1,0,0|2,0,0]=4 6895 B16R1.693 CCCCOCCN(C)CC1COCCO1 34a_100011398995_100000743108 [0,1,0,1,0,0|2,0,0]=4 6896 B16R1.693 COCCOCCC(=O)CC1CCCCO1 1458a_100000238585_100000695917 [0,1,0,1,0,0|2,0,0]=4 6897 B16R1.693 COCCOCCC(=O)CC1CCCCO1 1458a_100000745395_100000211543 [0,1,0,1,0,0|2,0,0]=4 6898 B16R1.693 COCCOCCC(=O)CC1CCCOC1 1458a_100000741523_100000695917 [0,1,0,1,0,0|2,0,0]=4 6899 B16R1.693 COCCOCCC(=O)CC1CCCOC1 1458a_100000745395_100000741521 [0,1,0,1,0,0|2,0,0]=4 6900 B16R1.693 COCCOCCN(C)CC1CCCCO1 2230a_100000225654_100000695917 [0,1,0,1,0,0|2,0,0]=4 6901 B16R1.693 COCCOCCN(C)CC1CCCCO1 269982a_100000225654_100000695917 [0,1,0,1,0,0|2,0,0]=4 6902 B16R1.693 COCCOCCN(C)CC1CCCCO1 34a_100000225654_100000695917 [0,1,0,1,0,0|2,0,0]=4 6903 B16R1.693 COCCOCCN(C)CC1COCCO1 2230a_100011398995_100000695917 [0,1,0,1,0,0|1,0,0]=3 6904 B16R1.693 COCCOCCN(C)CC1COCCO1 269982a_100011398995_100000695917 [0,1,0,1,0,0|1,0,0]=3 6905 B16R1.693 COCCOCCN(C)CC1COCCO1 34a_100011398995_100000695917 [0,1,0,1,0,0|1,0,0]=3 6906 B16R1.17796 CCCCOCCN1CCOC(C1)COC 2230a_100000760289_100000743108 [0,1,0,1,0,0|2,0,0]=4 6907 B16R1.17796 CCCCOCCN1CCOC(C1)COC 269982a_100000760289_100000743108 [0,1,0,1,0,0|2,0,0]=4 6908 B16R1.17796 CCCCOCCN1CCOC(C1)COC 34a_100000760289_100000743108 [0,1,0,1,0,0|2,0,0]=4 6909 B16R1.17796 COCCOCCN1CCCC(C1)COC 2230a_100000755410_100000695917 [0,1,0,1,0,0|2,0,0]=4 6910 B16R1.17796 COCCOCCN1CCCC(C1)COC 269982a_100000755410_100000695917 [0,1,0,1,0,0|2,0,0]=4 6911 B16R1.17796 COCCOCCN1CCCC(C1)COC 34a_100000755410_100000695917 [0,1,0,1,0,0|2,0,0]=4 6912 B16R1.17796 COCCOCCN1CCOC(C1)COC 2230a_100000760289_100000695917 [0,1,0,1,0,0|1,0,0]=3 6913 B16R1.17796 COCCOCCN1CCOC(C1)COC 269982a_100000760289_100000695917 [0,1,0,1,0,0|1,0,0]=3 6914 B16R1.17796 COCCOCCN1CCOC(C1)COC 34a_100000760289_100000695917 [0,1,0,1,0,0|1,0,0]=3 6915 B16R1.64 COCCOCCCC(=O)C1COCCO1 1458a_100000045528_100011216529 [0,1,0,1,0,0|1,0,1]=4 6916 B16R1.64 COCCOCCNC(=O)C1COCCO1 11a_100000745349_100000045528 [0,1,0,1,0,0|1,0,1]=4 6917 B16R1.64 COCCOCCNC(=O)C1COCCO1 1626a_100000745349_100000045528 [0,1,0,1,0,0|1,0,1]=4 6918 B16R1.64 COCCOCCNC(=O)C1COCCO1 240690a_100000745349_100000045528 [0,1,0,1,0,0|1,0,1]=4 6919 B16R1.64 COCCOCCNC(=O)C1COCCO1 527a_100000745349_100000045528 [0,1,0,1,0,0|1,0,1]=4 6920 B16R1.64 COCCOCCOC(C)C1CCCCC1 34a_100011216961_100000695917 [0,1,0,1,0,0|2,0,0]=4 6921 B16R1.64 COCCOCCOC(C)C1CCCCC1 7a_100011216961_100000695917 [0,1,0,1,0,0|2,0,0]=4 6922 B16R1.64 COCCOCCOC(C)C1CCCNC1 34a_100000740858_100000695917 [0,1,0,1,0,0|2,0,0]=4 6923 B16R1.688 CCCCCCC(C)OC[C@H]1COCCO1 34a_100009875890_100011215978 [0,1,0,1,0,0|2,0,0]=4 6924 B16R1.688 CCCCOCC(C)OCC1CCCCO1 34a_100011217071_100000211543 [0,1,0,1,0,0|2,0,0]=4 6925 B16R1.688 CCCCOCC(C)OCC1CCCCO1 7a_100011217071_100000211543 [0,1,0,1,0,0|2,0,0]=4 6926 B16R1.688 CCCCOCC(C)OCC1CCCOC1 34a_100011217071_100000741521 [0,1,0,1,0,0|2,0,0]=4 6927 B16R1.688 CCCCOCC(C)OCC1CCCOC1 7a_100011217071_100000741521 [0,1,0,1,0,0|2,0,0]=4 6928 B16R1.688 COCCOCC(=O)NC[C@H]1COCCO1 11a_100010981119_100000211095 [0,1,0,1,0,0|1,0,1]=4 6929 B16R1.688 COCCOCC(=O)NC[C@H]1COCCO1 1626a_100010981119_100000211095 [0,1,0,1,0,0|1,0,1]=4 6930 B16R1.688 COCCOCC(=O)NC[C@H]1COCCO1 240690a_100010981119_100000211095 [0,1,0,1,0,0|1,0,1]=4 6931 B16R1.688 COCCOCC(=O)NC[C@H]1COCCO1 527a_100010981119_100000211095 [0,1,0,1,0,0|1,0,1]=4 6932 B16R1.5833 COCCOCCO[C@@H](C)[C@@H]1CCCN1C 34a_100160487421_100000695917 [0,1,0,1,0,0|2,0,0]=4 6933 B16R1.43498 COCCOCCOC1(CCCCCC1)C 34a_100000708895_100000695917 [0,1,0,1,0,0|2,0,0]=4 6934 B16R1.43498 COCCOCCOC1(CCCCCC1)C 7a_100000708895_100000695917 [0,1,0,1,0,0|2,0,0]=4 6935 B16R1.27 COCCOCCOCC1CCCN(C1)C 34a_100011215163_100015183302 [0,1,0,1,0,0|2,0,0]=4 6936 B16R1.27 COCCOCCOCC1CCCN(C1)C 7a_100011215163_100000752043 [0,1,0,1,0,0|2,0,0]=4 6937 B16R1.27 COCCOCCOCC1CNCC(C1)C 34a_200012821172_100000695917 [0,1,0,1,0,0|2,0,0]=4 6938 B16R1.27 COCCOCCOCC1COCC(=O)N1 34a_200000101122_100000695917 [0,1,0,1,0,0|1,0,1]=4 6939 B16R1.250 C=C1CC(C1)NCCOCCOCCOC 2230a_100132301982_100013367474 [0,1,0,1,0,0|2,0,0]=4 6940 B16R1.250 COCCOCCOCCNC1CC(C1)F 2230a_100016993743_100013367474 [0,1,0,1,0,0|2,0,0]=4 6941 B16R1.250 COCCOCCOCCN[C@H]1C[C@@H](C1)O 2230a_100020629032_100013367474 [0,1,0,1,0,0|2,0,0]=4 6942 B16R1.250 COCCOCCOCCSC1CC(=O)C1 62a_100009894365_100013367474 [0,1,0,1,0,0|1,1,0]=4 6943 B16R1.596 CC(C)CCCCCOC[C@H]1COCCO1 34a_100009875890_100000210682 [0,1,0,1,0,0|2,0,0]=4 6944 B16R1.3900 COCCOCCN1CCOC[C@@H]1C(C)C 2230a_100025712635_100000695917 [0,1,0,1,0,0|2,0,0]=4 6945 B16R1.3900 COCCOCCN1CCOC[C@@H]1C(C)C 269982a_100025712635_100000695917 [0,1,0,1,0,0|2,0,0]=4 6946 B16R1.3900 COCCOCCN1CCOC[C@@H]1C(C)C 34a_100025712635_100000695917 [0,1,0,1,0,0|2,0,0]=4 6947 B16R1.709 COCCOCCOCC(=O)C1CCOC1 1458a_100011214951_100000690089 [0,1,0,1,0,0|1,0,1]=4 6948 B16R1.709 COCCOCCOCC(C)N1CCCC1 7a_100011215163_200015187269 [0,1,0,1,0,0|2,0,0]=4 6949 B16R1.1694 CCCCOC(=O)COC[C@H]1COCCO1 34a_100009875890_100000211628 [0,1,0,1,0,0|1,0,1]=4 6950 B16R1.1694 COCCNC(=O)COC[C@H]1COCCO1 34a_100009875890_100000183275 [0,1,0,1,0,0|1,0,1]=4 6951 B16R1.1694 COCCOC(=O)CNC[C@H]1COCCO1 2230a_100010981119_200000040189 [0,1,0,1,0,0|1,0,1]=4 6952 B16R1.1694 COCCOC(=O)CNC[C@H]1COCCO1 34a_100010981119_200000040189 [0,1,0,1,0,0|1,0,1]=4 6953 B16R1.1694 COCCOC(=O)COCC1CCCCO1 34a_100000211370_200000040189 [0,1,0,1,0,0|1,0,1]=4 6954 B16R1.1694 COCCOC(=O)COCC1CCCCO1 7a_100000211370_200000040189 [0,1,0,1,0,0|1,0,1]=4 6955 B16R1.1694 COCCOC(=O)COCC1CCCOC1 34a_100000741520_200000040189 [0,1,0,1,0,0|1,0,1]=4 6956 B16R1.1694 COCCOC(=O)COC[C@@H]1CNCCO1 34a_100015189573_200000040189 [0,1,0,1,0,0|1,0,1]=4 6957 B16R1.1694 COCCOC(=O)COC[C@@H]1COCCN1 34a_100000717676_200000040189 [0,1,0,1,0,0|1,0,1]=4 6958 B16R1.1694 COCCOC(=O)COC[C@H]1COCCO1 34a_100009875890_200000040189 [0,1,0,1,0,0|0,0,1]=3 6959 B16R1.1711 COCCOC(=O)COCCC1CCOC1 34a_100011879284_200000040189 [0,1,0,1,0,0|1,0,1]=4 6960 B16R1.13658 COCCOCCOCC(=O)CC1COC1 1458a_100011214951_100010264016 [0,1,0,1,0,0|1,0,1]=4 6961 B16R1.13658 COCCOCCOCC(=O)NC1COC1 11a_100016991112_100011214951 [0,1,0,1,0,0|1,0,1]=4 6962 B16R1.13658 COCCOCCOCC(=O)NC1COC1 1626a_100016991112_100011214951 [0,1,0,1,0,0|1,0,1]=4 6963 B16R1.13658 COCCOCCOCC(=O)NC1COC1 240690a_100016991112_100011214951 [0,1,0,1,0,0|1,0,1]=4 6964 B16R1.13658 COCCOCCOCC(=O)NC1COC1 527a_100016991112_100011214951 [0,1,0,1,0,0|1,0,1]=4 6965 B16R1.13659 COCCOCCOCC(=O)CCC1CO1 1458a_100011214951_100000732470 [0,1,0,1,0,0|1,0,1]=4 6966 B16R1.27197 COCCOCCOCC1(CCCCC1)C 34a_100000688186_100000695917 [0,1,0,1,0,0|2,0,0]=4 6967 B16R1.27197 COCCOCCOCC1(CCCCC1)C 7a_100000688186_100000695917 [0,1,0,1,0,0|2,0,0]=4 6968 B16R1.27197 COCCOCCOCC1(CCCCC1)F 34a_100000090305_100000695917 [0,1,0,1,0,0|2,0,0]=4 6969 B16R1.27197 COCCOCCOCC1(CCCCC1)F 7a_100000090305_100000695917 [0,1,0,1,0,0|2,0,0]=4 6970 B16R1.27197 COCCOCCOCC1(CCCCC1)N 34a_100000740034_100000695917 [0,1,0,1,0,0|2,0,0]=4 6971 B16R1.43510 COCCOCCOC1C(CCCC1C)C 34a_100011218088_100000695917 [0,1,0,1,0,0|2,0,0]=4 6972 B16R1.43510 COCCOCCOC1C(CCCC1C)C 7a_100011218088_100000695917 [0,1,0,1,0,0|2,0,0]=4 6973 B16R1.258 COCCOCCOC1CCC(CC1C)C 34a_100011539931_100000695917 [0,1,0,1,0,0|2,0,0]=4 6974 B16R1.258 COCCOCCOC1CCC(CC1C)C 7a_100011539931_100000695917 [0,1,0,1,0,0|2,0,0]=4 6975 B16R1.20656 COCCOCCOCCNC(=O)C1CO1 1626a_100012028300_100000701028 [0,1,0,1,0,0|1,0,1]=4 6976 B16R1.20656 COCCOCCOCCNC(=O)C1CO1 240690a_100012028300_100000701028 [0,1,0,1,0,0|1,0,1]=4 6977 B16R1.20656 COCCOCCOCCNC(C)C1CC1 2230a_100000700016_100013367474 [0,1,0,1,0,0|2,0,0]=4 6978 B16R1.20656 COCCOCCOCCNC(C)C1CC1 269862a_100012028300_100000210639 [0,1,0,1,0,0|2,0,0]=4 6979 B16R1.20656 COCCOCCOCCNC(C)C1CC1 34a_100000700016_100013367474 [0,1,0,1,0,0|2,0,0]=4 6980 B16R1.20656 COCCOCCOCCNC(C)C1CO1 270004a_100012028300_100000031964 [0,1,0,1,0,0|1,0,0]=3 6981 B16R1.20656 COCCOCCOCCOC(C)C1CC1 34a_100000744524_100013367474 [0,1,0,1,0,0|1,0,0]=3 6982 B16R1.20656 COCCOCCOCCOC(C)C1CC1 7a_100000744524_100013367474 [0,1,0,1,0,0|1,0,0]=3 6983 B16R1.27196 COCCOCCOCCNC1(CCC1)C 2230a_100000692455_100013367474 [0,1,0,1,0,0|2,0,0]=4 6984 B16R1.27196 COCCOCCOCCNC1(CCC1)C 34a_100000692455_100013367474 [0,1,0,1,0,0|2,0,0]=4 6985 B16R1.27196 COCCOCCOCCNC1(COC1)C 2230a_100000732644_100013367474 [0,1,0,1,0,0|1,0,0]=3 6986 B16R1.27196 COCCOCCOCCOC1(CCC1)C 34a_100000759064_100013367474 [0,1,0,1,0,0|1,0,0]=3 6987 B16R1.27196 COCCOCCOCCOC1(CCC1)C 7a_100000759064_100013367474 [0,1,0,1,0,0|1,0,0]=3 6988 B16R1.27196 COCCOCCOCCOC1(CSC1)C 7a_100016018533_100013367474 [0,1,0,1,0,0|0,1,0]=3 6989 B16R1.6681 COCCOCCOC1CC(CCC1C)C 34a_100011217446_100000695917 [0,1,0,1,0,0|2,0,0]=4 6990 B16R1.6681 COCCOCCOC1CC(CCC1C)C 7a_100011217446_100000695917 [0,1,0,1,0,0|2,0,0]=4 6991 B16R1.18042 COCCOCCOCCC(=O)C1CCC1 1458a_100000209988_100013367474 [0,1,0,1,0,0|2,0,0]=4 6992 B16R1.18042 COCCOCCOCCC(=O)C1CCC1 1458a_100012278103_100000749161 [0,1,0,1,0,0|2,0,0]=4 6993 B16R1.18042 COCCOCCOCCC(=O)C1COC1 1458a_100000758290_100013367474 [0,1,0,1,0,0|1,0,0]=3 6994 B16R1.18042 COCCOCCOCCC(=O)C1COC1 1458a_100012278103_100000687716 [0,1,0,1,0,0|1,0,0]=3 6995 B16R1.18042 COCCOCCOCCN(C)C1CCC1 2230a_100000758072_100013367474 [0,1,0,1,0,0|2,0,0]=4 6996 B16R1.18042 COCCOCCOCCN(C)C1CCC1 269982a_100000758072_100013367474 [0,1,0,1,0,0|2,0,0]=4 6997 B16R1.18042 COCCOCCOCCN(C)C1CCC1 269982a_200000716983_100000749161 [0,1,0,1,0,0|2,0,0]=4 6998 B16R1.18042 COCCOCCOCCN(C)C1CCC1 270004a_200000716983_100000241760 [0,1,0,1,0,0|2,0,0]=4 6999 B16R1.18042 COCCOCCOCCN(C)C1CCC1 34a_100000758072_100013367474 [0,1,0,1,0,0|2,0,0]=4 7000 B16R1.18042 COCCOCCOCCN(C)C1CCC1 34a_200000716983_100000749161 [0,1,0,1,0,0|2,0,0]=4 7001 B16R1.18042 COCCOCCOCCN(C)C1COC1 2230a_100102693430_100013367474 [0,1,0,1,0,0|1,0,0]=3 7002 B16R1.18042 COCCOCCOCCN(C)C1COC1 269982a_100102693430_100013367474 [0,1,0,1,0,0|1,0,0]=3 7003 B16R1.18042 COCCOCCOCCN(C)C1COC1 269982a_200000716983_100000687716 [0,1,0,1,0,0|1,0,0]=3 7004 B16R1.18042 COCCOCCOCCN(C)C1COC1 34a_200000716983_100009818527 [0,1,0,1,0,0|1,0,0]=3 7005 B16R1.18044 COCCOCCOCCC(=O)CC1CC1 1458a_100000738066_100013367474 [0,1,0,1,0,0|2,0,0]=4 7006 B16R1.18044 COCCOCCOCCC(=O)CC1CC1 1458a_100012278103_100000742324 [0,1,0,1,0,0|2,0,0]=4 7007 B16R1.18044 COCCOCCOCCC(=O)CC1CO1 1458a_100012278103_100011216344 [0,1,0,1,0,0|1,0,0]=3 7008 B16R1.18044 COCCOCCOCCC(=O)CC1CS1 1458a_100012278103_100000031435 [0,1,0,1,0,0|1,1,0]=4 7009 B16R1.18044 COCCOCCOCCC(=O)C[C@@H]1CO1 1458a_100012278103_100000745022 [0,1,0,1,0,0|1,0,0]=3 7010 B16R1.18044 COCCOCCOCCN(C)CC1CC1 2230a_100000741881_100013367474 [0,1,0,1,0,0|2,0,0]=4 7011 B16R1.18044 COCCOCCOCCN(C)CC1CC1 2230a_200000716983_100000742324 [0,1,0,1,0,0|2,0,0]=4 7012 B16R1.18044 COCCOCCOCCN(C)CC1CC1 269982a_100000741881_100013367474 [0,1,0,1,0,0|2,0,0]=4 7013 B16R1.18044 COCCOCCOCCN(C)CC1CC1 269982a_200000716983_100000756562 [0,1,0,1,0,0|2,0,0]=4 7014 B16R1.18044 COCCOCCOCCN(C)CC1CC1 34a_200000716983_100000742324 [0,1,0,1,0,0|2,0,0]=4 7015 B16R1.18044 COCCOCCOCCN(C)CC1CO1 2230a_200000716983_100011216344 [0,1,0,1,0,0|1,0,0]=3 7016 B16R1.18044 COCCOCCOCCN(C)CC1CO1 269982a_200000716983_102125554688 [0,1,0,1,0,0|1,0,0]=3 7017 B16R1.18044 COCCOCCOCCN(C)CC1CO1 34a_200000716983_102125554688 [0,1,0,1,0,0|1,0,0]=3 7018 B16R1.18044 COCCOCCOCCN(C)CC1CS1 269982a_200000716983_100000031435 [0,1,0,1,0,0|1,1,0]=4 7019 B16R1.18044 COCCOCCOCCN(C)C[C@@H]1CO1 269982a_200000716983_100000745022 [0,1,0,1,0,0|1,0,0]=3 7020 B16R1.88231 COCCOCCOCCC(=O)C1CC1C 1458a_100000211227_100013367474 [0,1,0,1,0,0|2,0,0]=4 7021 B16R2.71 O=C1CCOCC1OC[C@H]2COCCO2 34a_100009875890_100012180262 [0,0,0,2,0,0|2,0,0]=4 7022 B16R2.2256 C1CCC(CC1)COC[C@H]2COCCO2 34a_100009875890_100000211423 [0,0,0,2,0,0|2,0,0]=4 7023 B16R2.2256 C1CCC(OC1)CNC[C@H]2COCCO2 2230a_100010981119_100000211543 [0,0,0,2,0,0|2,0,0]=4 7024 B16R2.2256 C1CCC(OC1)CNC[C@H]2COCCO2 34a_100010981119_100000211543 [0,0,0,2,0,0|2,0,0]=4 7025 B16R2.2256 C1CCC(OC1)COCC2CCCCO2 34a_100000211370_100000211543 [0,0,0,2,0,0|2,0,0]=4 7026 B16R2.2256 C1CCC(OC1)COCC2CCCCO2 7a_100000211370_100000211543 [0,0,0,2,0,0|2,0,0]=4 7027 B16R2.2256 C1CCC(OC1)COCC2CCCOC2 34a_100000211370_100000741521 [0,0,0,2,0,0|2,0,0]=4 7028 B16R2.2256 C1CCC(OC1)COCC2CCCOC2 34a_100000741520_100000211543 [0,0,0,2,0,0|2,0,0]=4 7029 B16R2.2256 C1CCC(OC1)COCC2CCCOC2 7a_100000211370_100000741521 [0,0,0,2,0,0|2,0,0]=4 7030 B16R2.2256 C1CCC(OC1)COC[C@@H]2CNCCO2 34a_100015189573_100000211543 [0,0,0,2,0,0|2,0,0]=4 7031 B16R2.2256 C1CCC(OC1)COC[C@@H]2COCCN2 34a_100000717676_100000211543 [0,0,0,2,0,0|2,0,0]=4 7032 B16R2.2256 C1CCC(OC1)COC[C@H]2COCCO2 34a_100009875890_100000211543 [0,0,0,2,0,0|1,0,0]=3 7033 B16R2.2256 C1COCC(C1)CNC[C@H]2COCCO2 2230a_100010981119_100000741521 [0,0,0,2,0,0|2,0,0]=4 7034 B16R2.2256 C1COCC(C1)CNC[C@H]2COCCO2 34a_100010981119_100000741521 [0,0,0,2,0,0|2,0,0]=4 7035 B16R2.2256 C1COCC(C1)COCC2CCCOC2 34a_100000741520_100000741521 [0,0,0,2,0,0|2,0,0]=4 7036 B16R2.2256 C1COCC(C1)COC[C@@H]2CNCCO2 34a_100015189573_100000741521 [0,0,0,2,0,0|2,0,0]=4 7037 B16R2.2256 C1COCC(C1)COC[C@@H]2COCCN2 34a_100000717676_100000741521 [0,0,0,2,0,0|2,0,0]=4 7038 B16R2.2256 C1COCC(C1)COC[C@H]2COCCO2 34a_100009875890_100000741521 [0,0,0,2,0,0|1,0,0]=3 7039 B16R2.2257 C1CCC(C1)CCOC[C@H]2COCCO2 34a_100009875890_100000760354 [0,0,0,2,0,0|2,0,0]=4 7040 B16R2.2257 C1CCC(OC1)COCCC2CCOC2 34a_100011879284_100000211543 [0,0,0,2,0,0|2,0,0]=4 7041 B16R2.2257 C1COCC(C1)COCCC2CCOC2 34a_100011879284_100000741521 [0,0,0,2,0,0|2,0,0]=4 7042 B16R2.5334 C1CCCC(CC1)OC[C@H]2COCCO2 34a_100009875890_100011217769 [0,0,0,2,0,0|2,0,0]=4 7043 B16R2.27999 COCCOCCOC1C2CCC1CC2 34a_100011215163_100009813300 [0,0,0,2,0,0|2,0,0]=4 7044 B16R2.45827 COCCOCCOCC1C2C1CNC2 34a_100000045132_100000695917 [0,0,0,2,0,0|2,0,0]=4 7045 B16R2.4335 COCCOCCOC1CC2CCC1C2 34a_100000211339_100000695917 [0,0,0,2,0,0|2,0,0]=4 7046 B16R2.4335 COCCOCCOC1CC2CCC1C2 34a_100011215163_100000727232 [0,0,0,2,0,0|2,0,0]=4 7047 B16R2.4246 COCCOCCN1C2CCC1COC2 2230a_100015205251_100000695917 [0,0,0,2,0,0|2,0,0]=4 7048 B16R2.4246 COCCOCCN1C2CCC1COC2 269982a_100015205251_100000695917 [0,0,0,2,0,0|2,0,0]=4 7049 B16R2.4246 COCCOCCN1C2CCC1COC2 34a_100015205251_100000695917 [0,0,0,2,0,0|2,0,0]=4